data_19806 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19806 _Entry.PDB_ID 2ML5 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 19806 _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 SER N N 3 114.847 114.847 115.233 -0.386 19806 2 1 1 . 1 1 3 3 SER HA H 3 4.463 4.463 4.193 0.270 19806 3 1 1 . 1 1 3 3 SER CA C 3 58.340 58.340 59.499 -1.159 19806 4 1 1 . 1 1 3 3 SER CB C 3 63.457 63.457 63.825 -0.368 19806 5 1 1 . 1 1 4 4 GLU N N 4 121.498 121.498 119.570 1.928 19806 6 1 1 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.527 -0.195 19806 7 1 1 . 1 1 4 4 GLU CA C 4 56.443 56.443 55.989 0.455 19806 8 1 1 . 1 1 4 4 GLU CB C 4 29.966 29.966 30.932 -0.966 19806 9 1 1 . 1 1 5 5 LEU N N 5 121.589 121.589 123.722 -2.133 19806 10 1 1 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.845 -0.408 19806 11 1 1 . 1 1 5 5 LEU CA C 5 55.019 55.019 55.330 -0.311 19806 12 1 1 . 1 1 5 5 LEU CB C 5 42.243 42.243 44.069 -1.826 19806 13 1 1 . 1 1 6 6 THR N N 6 113.708 113.708 114.277 -0.569 19806 14 1 1 . 1 1 6 6 THR HA H 6 4.470 4.470 4.493 -0.023 19806 15 1 1 . 1 1 6 6 THR CA C 6 61.409 61.409 61.473 -0.064 19806 16 1 1 . 1 1 6 6 THR CB C 6 69.544 69.544 69.804 -0.260 19806 17 1 1 . 1 1 7 7 THR N N 7 114.945 114.945 117.063 -2.118 19806 18 1 1 . 1 1 7 7 THR HA H 7 4.415 4.415 4.028 0.387 19806 19 1 1 . 1 1 7 7 THR CA C 7 61.435 61.435 64.020 -2.585 19806 20 1 1 . 1 1 7 7 THR CB C 7 69.506 69.506 69.055 0.451 19806 21 1 1 . 1 1 8 8 GLN N N 8 121.368 121.368 119.698 1.670 19806 22 1 1 . 1 1 8 8 GLN CA C 8 55.684 55.684 56.006 -0.322 19806 23 1 1 . 1 1 9 9 ASP N N 9 120.595 120.595 120.730 -0.135 19806 24 1 1 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.722 -0.075 19806 25 1 1 . 1 1 9 9 ASP CA C 9 54.115 54.115 54.020 0.095 19806 26 1 1 . 1 1 9 9 ASP CB C 9 41.328 41.328 41.722 -0.395 19806 27 1 1 . 1 1 10 10 GLY N N 10 106.984 106.984 106.709 0.275 19806 28 1 1 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.675 -0.180 19806 29 1 1 . 1 1 11 11 GLU N N 11 120.879 120.879 121.313 -0.434 19806 30 1 1 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.243 -0.054 19806 31 1 1 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.434 0.076 19806 32 1 1 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.382 1.687 19806 33 1 1 . 1 1 12 12 ASP N N 12 126.686 126.686 122.648 4.038 19806 34 1 1 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.672 0.078 19806 35 1 1 . 1 1 12 12 ASP CA C 12 54.347 54.347 54.851 -0.504 19806 36 1 1 . 1 1 12 12 ASP CB C 12 42.771 42.771 41.778 0.993 19806 37 1 1 . 1 1 13 13 PHE N N 13 128.055 128.055 124.813 3.242 19806 38 1 1 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.810 -0.398 19806 39 1 1 . 1 1 13 13 PHE CA C 13 62.551 62.551 61.839 0.712 19806 40 1 1 . 1 1 13 13 PHE CB C 13 38.833 38.833 39.342 -0.508 19806 41 1 1 . 1 1 14 14 LYS N N 14 117.498 117.498 119.026 -1.528 19806 42 1 1 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.989 -0.408 19806 43 1 1 . 1 1 14 14 LYS CA C 14 59.461 59.461 59.251 0.210 19806 44 1 1 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.708 -0.364 19806 45 1 1 . 1 1 15 15 SER N N 15 113.775 113.775 114.233 -0.458 19806 46 1 1 . 1 1 15 15 SER HA H 15 4.167 4.167 4.226 -0.059 19806 47 1 1 . 1 1 15 15 SER CA C 15 61.099 61.099 61.510 -0.411 19806 48 1 1 . 1 1 15 15 SER CB C 15 62.428 62.428 62.739 -0.311 19806 49 1 1 . 1 1 16 16 PHE N N 16 122.292 122.292 120.441 1.851 19806 50 1 1 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.409 -0.119 19806 51 1 1 . 1 1 16 16 PHE CA C 16 59.773 59.773 59.566 0.207 19806 52 1 1 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.580 -1.405 19806 53 1 1 . 1 1 17 17 LEU N N 17 122.472 122.472 120.978 1.494 19806 54 1 1 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.137 -0.287 19806 55 1 1 . 1 1 17 17 LEU CA C 17 56.619 56.619 56.483 0.137 19806 56 1 1 . 1 1 17 17 LEU CB C 17 40.462 40.462 39.906 0.556 19806 57 1 1 . 1 1 18 18 ASP N N 18 117.331 117.331 119.709 -2.378 19806 58 1 1 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.205 -0.090 19806 59 1 1 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.956 -1.561 19806 60 1 1 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.778 -0.424 19806 61 1 1 . 1 1 19 19 LYS N N 19 120.032 120.032 118.183 1.849 19806 62 1 1 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.990 -0.313 19806 63 1 1 . 1 1 19 19 LYS CA C 19 59.067 59.067 58.134 0.933 19806 64 1 1 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.347 -0.411 19806 65 1 1 . 1 1 20 20 PHE N N 20 119.607 119.607 120.463 -0.856 19806 66 1 1 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.159 -0.050 19806 67 1 1 . 1 1 20 20 PHE CA C 20 62.090 62.090 61.154 0.936 19806 68 1 1 . 1 1 20 20 PHE CB C 20 40.469 40.469 38.989 1.480 19806 69 1 1 . 1 1 21 21 THR N N 21 101.473 101.473 110.993 -9.520 19806 70 1 1 . 1 1 21 21 THR HA H 21 4.259 4.259 3.952 0.307 19806 71 1 1 . 1 1 21 21 THR CA C 21 61.774 61.774 65.126 -3.352 19806 72 1 1 . 1 1 22 22 SER N N 22 111.453 111.453 115.390 -3.937 19806 73 1 1 . 1 1 22 22 SER HA H 22 4.165 4.165 4.517 -0.352 19806 74 1 1 . 1 1 22 22 SER CA C 22 58.215 58.215 57.902 0.313 19806 75 1 1 . 1 1 22 22 SER CB C 22 64.570 64.570 64.277 0.293 19806 76 1 1 . 1 1 23 23 SER N N 23 114.184 114.184 116.208 -2.024 19806 77 1 1 . 1 1 23 23 SER HA H 23 4.764 4.764 4.817 -0.053 19806 78 1 1 . 1 1 23 23 SER CA C 23 55.669 55.669 57.489 -1.820 19806 79 1 1 . 1 1 23 23 SER CB C 23 64.011 64.011 64.743 -0.732 19806 80 1 1 . 1 1 24 24 ALA N N 24 133.370 133.370 131.653 1.717 19806 81 1 1 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.070 -0.114 19806 82 1 1 . 1 1 24 24 ALA CA C 24 55.106 55.106 55.579 -0.473 19806 83 1 1 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.224 0.611 19806 84 1 1 . 1 1 25 25 ALA N N 25 117.430 117.430 121.004 -3.574 19806 85 1 1 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.372 -0.055 19806 86 1 1 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.770 0.431 19806 87 1 1 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.466 -0.117 19806 88 1 1 . 1 1 26 26 PHE N N 26 116.042 116.042 117.583 -1.541 19806 89 1 1 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.518 -0.208 19806 90 1 1 . 1 1 26 26 PHE CA C 26 60.759 60.759 60.728 0.031 19806 91 1 1 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.346 -0.036 19806 92 1 1 . 1 1 27 27 GLN N N 27 121.820 121.820 120.769 1.051 19806 93 1 1 . 1 1 27 27 GLN HA H 27 3.391 3.391 3.973 -0.582 19806 94 1 1 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.659 0.435 19806 95 1 1 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.383 -0.926 19806 96 1 1 . 1 1 28 28 TYR N N 28 111.517 111.517 116.082 -4.565 19806 97 1 1 . 1 1 28 28 TYR HA H 28 4.130 4.130 4.024 0.106 19806 98 1 1 . 1 1 28 28 TYR CA C 28 62.357 62.357 59.628 2.729 19806 99 1 1 . 1 1 28 28 TYR CB C 28 38.568 38.568 37.704 0.864 19806 100 1 1 . 1 1 29 29 THR N N 29 106.324 106.324 109.177 -2.853 19806 101 1 1 . 1 1 29 29 THR HA H 29 4.489 4.489 4.427 0.062 19806 102 1 1 . 1 1 29 29 THR CA C 29 63.765 63.765 62.597 1.168 19806 103 1 1 . 1 1 29 29 THR CB C 29 69.568 69.568 69.220 0.348 19806 104 1 1 . 1 1 30 30 ARG N N 30 117.696 117.696 119.240 -1.544 19806 105 1 1 . 1 1 30 30 ARG HA H 30 4.701 4.701 3.602 1.099 19806 106 1 1 . 1 1 30 30 ARG CA C 30 52.760 52.760 54.696 -1.936 19806 107 1 1 . 1 1 30 30 ARG CB C 30 35.047 35.047 30.720 4.327 19806 108 1 1 . 1 1 31 31 VAL N N 31 119.395 119.395 119.768 -0.373 19806 109 1 1 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.469 -0.239 19806 110 1 1 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.291 0.900 19806 111 1 1 . 1 1 31 31 VAL CB C 31 32.173 32.173 35.174 -3.001 19806 112 1 1 . 1 1 32 32 LYS N N 32 126.124 126.124 124.427 1.697 19806 113 1 1 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.528 -0.344 19806 114 1 1 . 1 1 32 32 LYS CA C 32 53.958 53.958 54.583 -0.625 19806 115 1 1 . 1 1 32 32 LYS CB C 32 31.112 31.112 33.613 -2.501 19806 116 1 1 . 1 1 33 33 PHE N N 33 119.303 119.303 119.353 -0.050 19806 117 1 1 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.958 -0.445 19806 118 1 1 . 1 1 33 33 PHE CA C 33 56.272 56.272 56.080 0.192 19806 119 1 1 . 1 1 33 33 PHE CB C 33 40.378 40.378 40.658 -0.281 19806 120 1 1 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.853 0.115 19806 121 1 1 . 1 1 34 34 PRO CA C 34 61.633 61.633 63.437 -1.804 19806 122 1 1 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.581 1.151 19806 123 1 1 . 1 1 35 35 LEU N N 35 120.016 120.016 114.767 5.249 19806 124 1 1 . 1 1 35 35 LEU HA H 35 4.222 4.222 3.836 0.386 19806 125 1 1 . 1 1 35 35 LEU CA C 35 54.840 54.840 55.720 -0.880 19806 126 1 1 . 1 1 35 35 LEU CB C 35 41.244 41.244 41.162 0.082 19806 127 1 1 . 1 1 36 36 LYS N N 36 117.066 117.066 119.429 -2.363 19806 128 1 1 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.209 -0.234 19806 129 1 1 . 1 1 36 36 LYS CA C 36 60.247 60.247 58.043 2.204 19806 130 1 1 . 1 1 36 36 LYS CB C 36 32.832 32.832 32.739 0.093 19806 131 1 1 . 1 1 37 37 THR N N 37 117.574 117.574 114.170 3.404 19806 132 1 1 . 1 1 37 37 THR HA H 37 4.797 4.797 4.836 -0.039 19806 133 1 1 . 1 1 37 37 THR CA C 37 60.396 60.396 59.034 1.362 19806 134 1 1 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.864 0.155 19806 135 1 1 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.310 -0.387 19806 136 1 1 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.806 -0.175 19806 137 1 1 . 1 1 39 39 ILE N N 39 119.949 119.949 119.544 0.405 19806 138 1 1 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.255 -0.016 19806 139 1 1 . 1 1 39 39 ILE CA C 39 62.133 62.133 61.971 0.162 19806 140 1 1 . 1 1 40 40 THR N N 40 123.962 123.962 123.280 0.682 19806 141 1 1 . 1 1 40 40 THR HA H 40 5.057 5.057 4.883 0.174 19806 142 1 1 . 1 1 40 40 THR CA C 40 62.262 62.262 61.590 0.672 19806 143 1 1 . 1 1 40 40 THR CB C 40 69.891 69.891 69.418 0.473 19806 144 1 1 . 1 1 41 41 LEU N N 41 125.633 125.633 128.136 -2.503 19806 145 1 1 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.815 0.287 19806 146 1 1 . 1 1 41 41 LEU CA C 41 52.638 52.638 53.495 -0.857 19806 147 1 1 . 1 1 41 41 LEU CB C 41 45.180 45.180 44.199 0.981 19806 148 1 1 . 1 1 42 42 LEU N N 42 120.788 120.788 126.236 -5.448 19806 149 1 1 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.523 0.225 19806 150 1 1 . 1 1 42 42 LEU CA C 42 53.724 53.724 55.294 -1.570 19806 151 1 1 . 1 1 42 42 LEU CB C 42 44.384 44.384 42.411 1.973 19806 152 1 1 . 1 1 43 43 ALA N N 43 123.073 123.073 130.471 -7.398 19806 153 1 1 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.334 0.096 19806 154 1 1 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.624 -1.336 19806 155 1 1 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.446 0.568 19806 156 1 1 . 1 1 44 44 ASP N N 44 118.196 118.196 117.356 0.840 19806 157 1 1 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.432 -0.006 19806 158 1 1 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.376 -0.348 19806 159 1 1 . 1 1 44 44 ASP CB C 44 40.210 40.210 39.934 0.276 19806 160 1 1 . 1 1 45 45 ASP N N 45 115.018 115.018 119.575 -4.557 19806 161 1 1 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.609 -0.140 19806 162 1 1 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.245 -0.451 19806 163 1 1 . 1 1 45 45 ASP CB C 45 39.864 39.864 40.464 -0.600 19806 164 1 1 . 1 1 46 46 GLY N N 46 107.499 107.499 107.737 -0.238 19806 165 1 1 . 1 1 46 46 GLY CA C 46 45.914 45.914 46.170 -0.256 19806 166 1 1 . 1 1 47 47 GLU N N 47 117.331 117.331 117.370 -0.039 19806 167 1 1 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.436 0.095 19806 168 1 1 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.506 0.432 19806 169 1 1 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.969 2.164 19806 170 1 1 . 1 1 48 48 THR N N 48 118.462 118.462 119.355 -0.893 19806 171 1 1 . 1 1 48 48 THR HA H 48 4.243 4.243 4.344 -0.101 19806 172 1 1 . 1 1 48 48 THR CA C 48 62.834 62.834 62.399 0.435 19806 173 1 1 . 1 1 48 48 THR CB C 48 68.649 68.649 68.987 -0.338 19806 174 1 1 . 1 1 49 49 GLU N N 49 123.834 123.834 128.340 -4.506 19806 175 1 1 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.289 0.656 19806 176 1 1 . 1 1 49 49 GLU CA C 49 55.358 55.358 57.376 -2.018 19806 177 1 1 . 1 1 49 49 GLU CB C 49 31.395 31.395 30.029 1.366 19806 178 1 1 . 1 1 50 50 LYS N N 50 122.868 122.868 127.586 -4.718 19806 179 1 1 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.690 -0.049 19806 180 1 1 . 1 1 50 50 LYS CA C 50 54.111 54.111 54.861 -0.750 19806 181 1 1 . 1 1 50 50 LYS CB C 50 35.312 35.312 34.969 0.343 19806 182 1 1 . 1 1 51 51 THR N N 51 111.386 111.386 115.282 -3.896 19806 183 1 1 . 1 1 51 51 THR HA H 51 5.619 5.619 5.139 0.480 19806 184 1 1 . 1 1 51 51 THR CA C 51 58.980 58.980 61.518 -2.538 19806 185 1 1 . 1 1 51 51 THR CB C 51 71.277 71.277 69.699 1.578 19806 186 1 1 . 1 1 52 52 PHE N N 52 120.631 120.631 119.115 1.516 19806 187 1 1 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.853 0.110 19806 188 1 1 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.529 -1.400 19806 189 1 1 . 1 1 52 52 PHE CB C 52 41.049 41.049 41.552 -0.503 19806 190 1 1 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.453 -0.005 19806 191 1 1 . 1 1 53 53 PRO CA C 53 62.489 62.489 63.147 -0.658 19806 192 1 1 . 1 1 53 53 PRO CB C 53 32.240 32.240 31.915 0.325 19806 193 1 1 . 1 1 54 54 PHE N N 54 128.034 128.034 125.592 2.442 19806 194 1 1 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.626 0.202 19806 195 1 1 . 1 1 54 54 PHE CA C 54 55.509 55.509 58.141 -2.632 19806 196 1 1 . 1 1 54 54 PHE CB C 54 37.028 37.028 40.582 -3.554 19806 197 1 1 . 1 1 55 55 THR N N 55 111.757 111.757 119.055 -7.298 19806 198 1 1 . 1 1 55 55 THR HA H 55 4.413 4.413 3.671 0.742 19806 199 1 1 . 1 1 55 55 THR CA C 55 60.578 60.578 59.965 0.613 19806 200 1 1 . 1 1 55 55 THR CB C 55 69.447 69.447 70.796 -1.349 19806 201 1 1 . 1 1 56 56 LYS N N 56 118.734 118.734 120.469 -1.735 19806 202 1 1 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.170 -1.688 19806 203 1 1 . 1 1 56 56 LYS CA C 56 59.381 59.381 59.760 -0.379 19806 204 1 1 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.955 1.295 19806 205 1 1 . 1 1 57 57 GLU N N 57 119.675 119.675 119.687 -0.012 19806 206 1 1 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.096 0.173 19806 207 1 1 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.908 -1.756 19806 208 1 1 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.416 -2.466 19806 209 1 1 . 1 1 58 58 LYS N N 58 114.700 114.700 116.829 -2.129 19806 210 1 1 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.544 -0.232 19806 211 1 1 . 1 1 58 58 LYS CA C 58 55.595 55.595 55.318 0.277 19806 212 1 1 . 1 1 58 58 LYS CB C 58 32.011 32.011 32.276 -0.265 19806 213 1 1 . 1 1 59 59 TRP N N 59 118.204 118.204 124.692 -6.488 19806 214 1 1 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.373 -0.274 19806 215 1 1 . 1 1 59 59 TRP CA C 59 55.577 55.577 55.205 0.372 19806 216 1 1 . 1 1 59 59 TRP CB C 59 32.037 32.037 31.226 0.811 19806 217 1 1 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.564 -0.301 19806 218 1 1 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.414 -2.693 19806 219 1 1 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.183 -2.334 19806 220 1 1 . 1 1 61 61 LEU N N 61 123.758 123.758 125.866 -2.108 19806 221 1 1 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.214 -0.575 19806 222 1 1 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.088 0.787 19806 223 1 1 . 1 1 61 61 LEU CB C 61 40.815 40.815 41.022 -0.207 19806 224 1 1 . 1 1 62 62 LEU N N 62 124.052 124.052 124.117 -0.065 19806 225 1 1 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.372 -0.017 19806 226 1 1 . 1 1 62 62 LEU CA C 62 53.992 53.992 54.313 -0.321 19806 227 1 1 . 1 1 62 62 LEU CB C 62 44.686 44.686 42.832 1.854 19806 228 1 1 . 1 1 63 63 ASP N N 63 117.271 117.271 117.916 -0.645 19806 229 1 1 . 1 1 63 63 ASP HA H 63 5.033 5.033 5.126 -0.093 19806 230 1 1 . 1 1 63 63 ASP CA C 63 51.101 51.101 52.299 -1.198 19806 231 1 1 . 1 1 63 63 ASP CB C 63 43.345 43.345 42.715 0.630 19806 232 1 1 . 1 1 64 64 SER N N 64 112.856 112.856 113.812 -0.956 19806 233 1 1 . 1 1 64 64 SER HA H 64 3.865 3.865 4.314 -0.449 19806 234 1 1 . 1 1 64 64 SER CA C 64 60.910 60.910 60.392 0.518 19806 235 1 1 . 1 1 64 64 SER CB C 64 62.378 62.378 63.171 -0.793 19806 236 1 1 . 1 1 65 65 GLU N N 65 120.070 120.070 118.537 1.533 19806 237 1 1 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.292 -0.274 19806 238 1 1 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.265 0.078 19806 239 1 1 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.400 -0.513 19806 240 1 1 . 1 1 66 66 THR N N 66 115.852 115.852 115.019 0.833 19806 241 1 1 . 1 1 66 66 THR HA H 66 3.991 3.991 4.223 -0.232 19806 242 1 1 . 1 1 66 66 THR CA C 66 65.804 65.804 64.326 1.478 19806 243 1 1 . 1 1 66 66 THR CB C 66 68.451 68.451 69.045 -0.594 19806 244 1 1 . 1 1 67 67 MET N N 67 113.585 113.585 121.643 -8.058 19806 245 1 1 . 1 1 67 67 MET HA H 67 4.267 4.267 4.670 -0.403 19806 246 1 1 . 1 1 67 67 MET CA C 67 52.135 52.135 54.284 -2.149 19806 247 1 1 . 1 1 67 67 MET CB C 67 28.963 28.963 30.452 -1.489 19806 248 1 1 . 1 1 68 68 LYS N N 68 118.462 118.462 121.635 -3.173 19806 249 1 1 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.753 -0.383 19806 250 1 1 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.310 0.172 19806 251 1 1 . 1 1 68 68 LYS CB C 68 34.179 34.179 35.982 -1.803 19806 252 1 1 . 1 1 69 69 GLU N N 69 121.700 121.700 123.096 -1.396 19806 253 1 1 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.976 -0.452 19806 254 1 1 . 1 1 69 69 GLU CA C 69 55.942 55.942 55.565 0.377 19806 255 1 1 . 1 1 69 69 GLU CB C 69 30.424 30.424 30.920 -0.496 19806 256 1 1 . 1 1 70 70 GLU N N 70 123.445 123.445 125.023 -1.578 19806 257 1 1 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.690 0.007 19806 258 1 1 . 1 1 70 70 GLU CA C 70 55.473 55.473 54.720 0.753 19806 259 1 1 . 1 1 70 70 GLU CB C 70 33.162 33.162 33.090 0.072 19806 260 1 1 . 1 1 71 71 ARG N N 71 122.150 122.150 121.586 0.564 19806 261 1 1 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.720 0.431 19806 262 1 1 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.743 -0.295 19806 263 1 1 . 1 1 71 71 ARG CB C 71 31.703 31.703 30.905 0.798 19806 264 1 1 . 1 1 72 72 ILE N N 72 125.686 125.686 123.795 1.891 19806 265 1 1 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.102 0.494 19806 266 1 1 . 1 1 72 72 ILE CA C 72 59.512 59.512 62.089 -2.577 19806 267 1 1 . 1 1 72 72 ILE CB C 72 41.095 41.095 39.264 1.831 19806 268 1 1 . 1 1 73 73 THR N N 73 121.600 121.600 122.867 -1.267 19806 269 1 1 . 1 1 73 73 THR HA H 73 4.603 4.603 4.614 -0.011 19806 270 1 1 . 1 1 73 73 THR CA C 73 61.937 61.937 61.152 0.785 19806 271 1 1 . 1 1 73 73 THR CB C 73 68.669 68.669 68.116 0.553 19806 272 1 1 . 1 1 74 74 GLN N N 74 124.607 124.607 126.576 -1.969 19806 273 1 1 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.523 0.058 19806 274 1 1 . 1 1 74 74 GLN CA C 74 54.689 54.689 55.117 -0.429 19806 275 1 1 . 1 1 74 74 GLN CB C 74 29.490 29.490 29.943 -0.453 19806 276 1 1 . 1 1 75 75 GLU N N 75 122.962 122.962 119.390 3.572 19806 277 1 1 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.497 -0.438 19806 278 1 1 . 1 1 75 75 GLU CA C 75 58.845 58.845 56.772 2.073 19806 279 1 1 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.462 -0.889 19806 280 1 1 . 1 1 76 76 GLU N N 76 115.466 115.466 119.702 -4.236 19806 281 1 1 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.512 -0.204 19806 282 1 1 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.687 0.090 19806 283 1 1 . 1 1 76 76 GLU CB C 76 29.072 29.072 29.798 -0.726 19806 284 1 1 . 1 1 77 77 GLY N N 77 106.771 106.771 108.601 -1.830 19806 285 1 1 . 1 1 77 77 GLY CA C 77 45.014 45.014 45.281 -0.266 19806 286 1 1 . 1 1 78 78 GLY N N 78 108.535 108.535 107.472 1.063 19806 287 1 1 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.636 0.071 19806 288 1 1 . 1 1 79 79 ILE N N 79 121.066 121.066 121.309 -0.243 19806 289 1 1 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.829 -0.022 19806 290 1 1 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.139 -0.796 19806 291 1 1 . 1 1 79 79 ILE CB C 79 39.220 39.220 38.587 0.633 19806 292 1 1 . 1 1 80 80 TYR N N 80 130.709 130.709 130.400 0.309 19806 293 1 1 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.342 -0.078 19806 294 1 1 . 1 1 80 80 TYR CA C 80 58.161 58.161 57.470 0.691 19806 295 1 1 . 1 1 80 80 TYR CB C 80 40.621 40.621 38.733 1.888 19806 296 1 1 . 1 1 81 81 VAL N N 81 126.965 126.965 127.553 -0.588 19806 297 1 1 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.568 0.286 19806 298 1 1 . 1 1 81 81 VAL CA C 81 60.457 60.457 60.322 0.135 19806 299 1 1 . 1 1 81 81 VAL CB C 81 35.004 35.004 35.255 -0.251 19806 300 1 1 . 1 1 82 82 SER N N 82 120.914 120.914 121.782 -0.868 19806 301 1 1 . 1 1 82 82 SER HA H 82 5.185 5.185 4.728 0.457 19806 302 1 1 . 1 1 82 82 SER CA C 82 55.260 55.260 56.911 -1.651 19806 303 1 1 . 1 1 82 82 SER CB C 82 64.785 64.785 63.156 1.629 19806 304 1 1 . 1 1 83 83 LYS N N 83 119.415 119.415 124.910 -5.495 19806 305 1 1 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.092 0.686 19806 306 1 1 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.836 -0.077 19806 307 1 1 . 1 1 83 83 LYS CB C 83 35.514 35.514 36.449 -0.935 19806 308 1 1 . 1 1 84 84 PHE N N 84 119.220 119.220 120.172 -0.952 19806 309 1 1 . 1 1 84 84 PHE HA H 84 5.441 5.441 4.628 0.813 19806 310 1 1 . 1 1 84 84 PHE CA C 84 58.414 58.414 58.573 -0.159 19806 311 1 1 . 1 1 84 84 PHE CB C 84 37.523 37.523 39.397 -1.874 19806 312 1 1 . 1 1 85 85 THR N N 85 119.257 119.257 113.039 6.218 19806 313 1 1 . 1 1 85 85 THR HA H 85 4.057 4.057 4.392 -0.335 19806 314 1 1 . 1 1 85 85 THR CA C 85 62.660 62.660 62.288 0.372 19806 315 1 1 . 1 1 85 85 THR CB C 85 67.698 67.698 69.888 -2.190 19806 316 1 1 . 1 1 86 86 LEU N N 86 121.612 121.612 122.658 -1.046 19806 317 1 1 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.718 -0.120 19806 318 1 1 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.954 0.291 19806 319 1 1 . 1 1 86 86 LEU CB C 86 44.657 44.657 45.068 -0.411 19806 320 1 1 . 1 1 87 87 ASN N N 87 127.684 127.684 122.119 5.565 19806 321 1 1 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.936 0.075 19806 322 1 1 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.843 -1.544 19806 323 1 1 . 1 1 87 87 ASN CB C 87 38.595 38.595 39.628 -1.033 19806 324 1 1 . 1 1 88 88 GLU N N 88 120.509 120.509 122.683 -2.174 19806 325 1 1 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.903 -0.046 19806 326 1 1 . 1 1 88 88 GLU CA C 88 54.382 54.382 53.285 1.097 19806 327 1 1 . 1 1 88 88 GLU CB C 88 29.808 29.808 31.605 -1.797 19806 328 1 1 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.609 -0.228 19806 329 1 1 . 1 1 89 89 PRO CA C 89 65.898 65.898 64.933 0.965 19806 330 1 1 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.270 0.081 19806 331 1 1 . 1 1 90 90 LYS N N 90 107.288 107.288 115.528 -8.240 19806 332 1 1 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.375 0.309 19806 333 1 1 . 1 1 90 90 LYS CA C 90 54.979 54.979 56.041 -1.062 19806 334 1 1 . 1 1 90 90 LYS CB C 90 32.994 32.994 33.019 -0.025 19806 335 1 1 . 1 1 91 91 HIS N N 91 119.523 119.523 117.883 1.640 19806 336 1 1 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.710 0.067 19806 337 1 1 . 1 1 91 91 HIS CA C 91 53.705 53.705 55.237 -1.532 19806 338 1 1 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.823 -0.629 19806 339 1 1 . 1 1 92 92 LYS N N 92 122.527 122.527 126.583 -4.056 19806 340 1 1 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.716 0.413 19806 341 1 1 . 1 1 92 92 LYS CA C 92 54.291 54.291 54.984 -0.694 19806 342 1 1 . 1 1 92 92 LYS CB C 92 37.479 37.479 35.148 2.332 19806 343 1 1 . 1 1 93 93 ILE N N 93 121.564 121.564 123.136 -1.572 19806 344 1 1 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.359 0.951 19806 345 1 1 . 1 1 93 93 ILE CA C 93 61.137 61.137 59.148 1.989 19806 346 1 1 . 1 1 93 93 ILE CB C 93 41.088 41.088 38.742 2.345 19806 347 1 1 . 1 1 94 94 PHE N N 94 128.955 128.955 125.772 3.183 19806 348 1 1 . 1 1 94 94 PHE HA H 94 4.900 4.900 4.917 -0.017 19806 349 1 1 . 1 1 94 94 PHE CA C 94 55.843 55.843 56.773 -0.930 19806 350 1 1 . 1 1 95 95 GLU N N 95 124.809 124.809 127.274 -2.465 19806 351 1 1 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.016 0.402 19806 352 1 1 . 1 1 95 95 GLU CA C 95 54.481 54.481 54.550 -0.069 19806 353 1 1 . 1 1 95 95 GLU CB C 95 35.160 35.160 32.921 2.239 19806 354 1 1 . 1 1 96 96 ALA N N 96 123.759 123.759 125.465 -1.706 19806 355 1 1 . 1 1 96 96 ALA HA H 96 5.379 5.379 5.220 0.159 19806 356 1 1 . 1 1 96 96 ALA CA C 96 49.541 49.541 49.871 -0.330 19806 357 1 1 . 1 1 96 96 ALA CB C 96 23.830 23.830 22.239 1.591 19806 358 1 1 . 1 1 97 97 GLY N N 97 106.592 106.592 109.172 -2.580 19806 359 1 1 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.659 -0.224 19806 360 1 1 . 1 1 98 98 TYR N N 98 119.250 119.250 119.413 -0.163 19806 361 1 1 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.833 -0.015 19806 362 1 1 . 1 1 98 98 TYR CA C 98 59.387 59.387 59.146 0.241 19806 363 1 1 . 1 1 98 98 TYR CB C 98 38.122 38.122 39.452 -1.330 19806 364 1 1 . 1 1 99 99 GLU N N 99 123.080 123.080 122.295 0.785 19806 365 1 1 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.039 -0.030 19806 366 1 1 . 1 1 99 99 GLU CA C 99 58.409 58.409 59.393 -0.984 19806 367 1 1 . 1 1 99 99 GLU CB C 99 30.254 30.254 30.039 0.215 19806 368 1 1 . 1 1 100 100 GLU N N 100 116.459 116.459 118.266 -1.807 19806 369 1 1 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.578 -0.542 19806 370 1 1 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.328 1.077 19806 371 1 1 . 1 1 100 100 GLU CB C 100 27.576 27.576 29.291 -1.715 19806 372 1 1 . 1 1 101 101 SER N N 101 113.069 113.069 115.832 -2.763 19806 373 1 1 . 1 1 101 101 SER HA H 101 4.839 4.839 4.635 0.204 19806 374 1 1 . 1 1 101 101 SER CA C 101 56.024 56.024 57.261 -1.237 19806 375 1 1 . 1 1 101 101 SER CB C 101 64.806 64.806 64.603 0.203 19806 376 1 1 . 1 1 102 102 GLU N N 102 120.439 120.439 120.824 -0.385 19806 377 1 1 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.499 -0.110 19806 378 1 1 . 1 1 102 102 GLU CA C 102 55.804 55.804 55.919 -0.115 19806 379 1 1 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.388 -0.403 19806 380 1 1 . 1 1 103 103 VAL N N 103 118.899 118.899 115.801 3.098 19806 381 1 1 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.378 -0.292 19806 382 1 1 . 1 1 103 103 VAL CA C 103 62.699 62.699 60.356 2.343 19806 383 1 1 . 1 1 103 103 VAL CB C 103 32.261 32.261 33.329 -1.068 19806 384 1 1 . 1 1 104 104 ASP N N 104 120.965 120.965 123.564 -2.599 19806 385 1 1 . 1 1 104 104 ASP HA H 104 5.003 5.003 4.793 0.210 19806 386 1 1 . 1 1 104 104 ASP CA C 104 54.914 54.914 57.291 -2.377 19806 387 1 1 . 1 1 104 104 ASP CB C 104 42.791 42.791 42.223 0.568 19806 388 1 1 . 1 1 105 105 LEU N N 105 120.365 120.365 116.605 3.760 19806 389 1 1 . 1 1 105 105 LEU HA H 105 5.295 5.295 5.061 0.234 19806 390 1 1 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.186 0.245 19806 391 1 1 . 1 1 105 105 LEU CB C 105 46.001 46.001 44.494 1.507 19806 392 1 1 . 1 1 106 106 ARG N N 106 126.289 126.289 126.278 0.011 19806 393 1 1 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.081 0.744 19806 394 1 1 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.701 -0.029 19806 395 1 1 . 1 1 106 106 ARG CB C 106 33.920 33.920 33.927 -0.007 19806 396 1 1 . 1 1 107 107 VAL N N 107 126.145 126.145 122.988 3.157 19806 397 1 1 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.411 0.268 19806 398 1 1 . 1 1 107 107 VAL CA C 107 61.671 61.671 60.326 1.345 19806 399 1 1 . 1 1 107 107 VAL CB C 107 35.350 35.350 34.493 0.857 19806 400 1 1 . 1 1 108 108 GLU N N 108 127.093 127.093 124.372 2.721 19806 401 1 1 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.855 0.412 19806 402 1 1 . 1 1 108 108 GLU CA C 108 54.761 54.761 54.280 0.481 19806 403 1 1 . 1 1 108 108 GLU CB C 108 32.567 32.567 34.262 -1.695 19806 404 1 1 . 1 1 109 109 PHE N N 109 124.592 124.592 121.154 3.438 19806 405 1 1 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.449 0.579 19806 406 1 1 . 1 1 109 109 PHE CA C 109 55.945 55.945 56.142 -0.197 19806 407 1 1 . 1 1 109 109 PHE CB C 109 43.099 43.099 42.436 0.663 19806 408 1 1 . 1 1 110 110 GLU N N 110 122.143 122.143 122.234 -0.091 19806 409 1 1 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.419 -0.226 19806 410 1 1 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.610 0.833 19806 411 1 1 . 1 1 110 110 GLU CB C 110 35.816 35.816 33.734 2.082 19806 412 1 1 . 1 1 111 111 LEU N N 111 129.616 129.616 125.927 3.689 19806 413 1 1 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.511 0.297 19806 414 1 1 . 1 1 111 111 LEU CA C 111 53.470 53.470 54.400 -0.930 19806 415 1 1 . 1 1 111 111 LEU CB C 111 40.400 40.400 41.245 -0.845 19806 416 1 1 . 1 1 112 112 GLN N N 112 124.742 124.742 126.336 -1.594 19806 417 1 1 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.420 0.019 19806 418 1 1 . 1 1 112 112 GLN CA C 112 55.802 55.802 53.886 1.915 19806 419 1 1 . 1 1 112 112 GLN CB C 112 28.753 28.753 30.031 -1.278 19806 420 1 1 . 1 1 113 113 ALA N N 113 121.195 121.195 123.567 -2.372 19806 421 1 1 . 1 1 113 113 ALA HA H 113 4.048 4.048 4.012 0.036 19806 422 1 1 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.445 0.073 19806 423 1 1 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.398 -0.199 19806 424 1 1 . 1 1 114 114 ASP N N 114 114.525 114.525 116.864 -2.339 19806 425 1 1 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.420 -0.021 19806 426 1 1 . 1 1 114 114 ASP CA C 114 52.908 52.908 55.080 -2.172 19806 427 1 1 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.644 -1.585 19806 428 1 1 . 1 1 115 115 GLY N N 115 107.526 107.526 106.765 0.761 19806 429 1 1 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.752 0.032 19806 430 1 1 . 1 1 116 116 LYS N N 116 118.818 118.818 120.279 -1.461 19806 431 1 1 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.535 -0.085 19806 432 1 1 . 1 1 116 116 LYS CA C 116 54.171 54.171 55.336 -1.165 19806 433 1 1 . 1 1 116 116 LYS CB C 116 35.039 35.039 33.199 1.840 19806 434 1 1 . 1 1 117 117 TRP N N 117 118.939 118.939 122.754 -3.815 19806 435 1 1 . 1 1 117 117 TRP CA C 117 56.956 56.956 58.062 -1.106 19806 436 1 1 . 1 1 118 118 TYR N N 118 112.644 112.644 118.547 -5.903 19806 437 1 1 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.942 0.335 19806 438 1 1 . 1 1 118 118 TYR CA C 118 56.219 56.219 56.874 -0.655 19806 439 1 1 . 1 1 118 118 TYR CB C 118 43.282 43.282 42.079 1.203 19806 440 1 1 . 1 1 119 119 VAL N N 119 119.842 119.842 123.730 -3.888 19806 441 1 1 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.571 -0.056 19806 442 1 1 . 1 1 119 119 VAL CA C 119 62.442 62.442 64.512 -2.070 19806 443 1 1 . 1 1 120 120 VAL N N 120 114.552 114.552 115.623 -1.071 19806 444 1 1 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.518 0.220 19806 445 1 1 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.500 -0.905 19806 446 1 1 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.269 -0.417 19806 447 1 1 . 1 1 121 121 ASP N N 121 118.234 118.234 120.265 -2.031 19806 448 1 1 . 1 1 121 121 ASP HA H 121 5.263 5.263 5.145 0.118 19806 449 1 1 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.813 -0.150 19806 450 1 1 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.385 -0.498 19806 451 1 1 . 1 1 122 122 CYS N N 122 121.036 121.036 125.001 -3.965 19806 452 1 1 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.717 0.854 19806 453 1 1 . 1 1 122 122 CYS CA C 122 57.052 57.052 57.237 -0.185 19806 454 1 1 . 1 1 122 122 CYS CB C 122 30.834 30.834 27.647 3.187 19806 455 1 1 . 1 1 123 123 TYR N N 123 127.672 127.672 122.584 5.088 19806 456 1 1 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.650 0.360 19806 457 1 1 . 1 1 123 123 TYR CA C 123 57.169 57.169 59.997 -2.828 19806 458 1 1 . 1 1 123 123 TYR CB C 123 41.408 41.408 39.885 1.523 19806 459 1 1 . 1 1 124 124 THR N N 124 120.833 120.833 121.362 -0.529 19806 460 1 1 . 1 1 124 124 THR HA H 124 4.987 4.987 4.525 0.462 19806 461 1 1 . 1 1 124 124 THR CA C 124 57.153 57.153 61.772 -4.619 19806 462 1 1 . 1 1 124 124 THR CB C 124 68.607 68.607 69.035 -0.428 19806 463 1 1 . 1 1 125 125 GLY N N 125 114.347 114.347 109.984 4.363 19806 464 1 1 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.344 -0.017 19806 465 1 1 . 1 1 126 126 TRP N N 126 119.918 119.918 121.953 -2.035 19806 466 1 1 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.005 0.065 19806 467 1 1 . 1 1 126 126 TRP CA C 126 60.564 60.564 58.632 1.932 19806 468 1 1 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.209 0.430 19806 469 1 1 . 1 1 127 127 TYR N N 127 113.911 113.911 113.720 0.191 19806 470 1 1 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.681 0.313 19806 471 1 1 . 1 1 127 127 TYR CA C 127 53.384 53.384 56.203 -2.819 19806 472 1 1 . 1 1 127 127 TYR CB C 127 38.584 38.584 37.491 1.093 19806 473 1 1 . 1 1 128 128 GLY N N 128 105.181 105.181 108.229 -3.048 19806 474 1 1 . 1 1 128 128 GLY CA C 128 45.189 45.189 44.505 0.684 19806 475 1 1 . 1 1 129 129 TYR N N 129 116.588 116.588 117.395 -0.807 19806 476 1 1 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.728 -0.064 19806 477 1 1 . 1 1 129 129 TYR CA C 129 59.565 59.565 58.699 0.866 19806 478 1 1 . 1 1 129 129 TYR CB C 129 38.853 38.853 38.116 0.737 19806 479 1 1 . 1 1 130 130 ASP N N 130 115.195 115.195 118.436 -3.241 19806 480 1 1 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.818 -0.433 19806 481 1 1 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.448 -1.318 19806 482 1 1 . 1 1 130 130 ASP CB C 130 38.685 38.685 41.455 -2.770 19806 483 1 1 . 1 1 131 131 LEU N N 131 124.887 124.887 121.913 2.974 19806 484 1 1 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.849 -0.368 19806 485 1 1 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.035 1.570 19806 486 1 1 . 1 1 131 131 LEU CB C 131 42.441 42.441 44.878 -2.437 19806 487 1 1 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.717 -0.034 19806 488 1 1 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.691 65.374 19806 489 1 1 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.073 -0.746 19806 490 1 1 . 1 1 133 133 ILE N N 133 123.765 123.765 120.545 3.220 19806 491 1 1 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.687 0.042 19806 492 1 1 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.155 1.705 19806 493 1 1 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.216 -0.153 19806 494 1 1 . 1 1 134 134 GLY N N 134 107.030 107.030 106.060 0.970 19806 495 1 1 . 1 1 134 134 GLY CA C 134 45.976 45.976 45.729 0.247 19806 496 1 1 . 1 1 135 135 GLU N N 135 116.566 116.566 120.947 -4.381 19806 497 1 1 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.334 0.330 19806 498 1 1 . 1 1 135 135 GLU CA C 135 55.414 55.414 56.127 -0.713 19806 499 1 1 . 1 1 135 135 GLU CB C 135 30.195 30.195 29.063 1.132 19806 500 1 1 . 1 1 136 136 LEU N N 136 124.239 124.239 123.002 1.237 19806 501 1 1 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.820 0.224 19806 502 1 1 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.590 0.526 19806 503 1 1 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.483 -0.476 19806 504 1 1 . 1 1 137 137 LYS N N 137 117.225 117.225 117.744 -0.519 19806 505 1 1 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.776 0.087 19806 506 1 1 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.417 1.038 19806 507 1 1 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.784 -0.581 19806 508 1 1 . 1 1 138 138 GLN N N 138 118.718 118.718 118.854 -0.136 19806 509 1 1 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.001 0.051 19806 510 1 1 . 1 1 138 138 GLN CA C 138 57.875 57.875 59.099 -1.224 19806 511 1 1 . 1 1 138 138 GLN CB C 138 28.235 28.235 27.669 0.566 19806 512 1 1 . 1 1 139 139 THR N N 139 117.970 117.970 117.285 0.685 19806 513 1 1 . 1 1 139 139 THR HA H 139 4.532 4.532 3.879 0.653 19806 514 1 1 . 1 1 139 139 THR CA C 139 68.145 68.145 67.132 1.013 19806 515 1 1 . 1 1 139 139 THR CB C 139 68.103 68.103 68.137 -0.034 19806 516 1 1 . 1 1 140 140 ILE N N 140 120.391 120.391 121.306 -0.915 19806 517 1 1 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.554 0.173 19806 518 1 1 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.712 0.544 19806 519 1 1 . 1 1 140 140 ILE CB C 140 38.113 38.113 36.996 1.117 19806 520 1 1 . 1 1 141 141 GLN N N 141 118.917 118.917 119.247 -0.330 19806 521 1 1 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.952 0.063 19806 522 1 1 . 1 1 141 141 GLN CA C 141 58.371 58.371 58.889 -0.518 19806 523 1 1 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.241 -0.894 19806 524 1 1 . 1 1 142 142 ASN N N 142 119.936 119.936 118.418 1.518 19806 525 1 1 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.506 0.009 19806 526 1 1 . 1 1 142 142 ASN CA C 142 55.799 55.799 55.370 0.429 19806 527 1 1 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.002 -0.372 19806 528 1 1 . 1 1 143 143 VAL N N 143 123.195 123.195 120.891 2.304 19806 529 1 1 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.302 -0.586 19806 530 1 1 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.598 -0.101 19806 531 1 1 . 1 1 143 143 VAL CB C 143 30.989 30.989 30.978 0.011 19806 532 1 1 . 1 1 144 144 LYS N N 144 120.348 120.348 117.287 3.061 19806 533 1 1 . 1 1 144 144 LYS HA H 144 3.881 3.881 3.979 -0.098 19806 534 1 1 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.502 0.621 19806 535 1 1 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.258 -0.376 19806 536 1 1 . 1 1 145 145 GLU N N 145 119.220 119.220 118.673 0.547 19806 537 1 1 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.126 0.057 19806 538 1 1 . 1 1 145 145 GLU CA C 145 59.178 59.178 58.847 0.331 19806 539 1 1 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.497 -0.426 19806 540 1 1 . 1 1 146 146 GLU N N 146 121.420 121.420 120.285 1.135 19806 541 1 1 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.100 0.177 19806 542 1 1 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.339 -0.221 19806 543 1 1 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.685 -1.343 19806 544 1 1 . 1 1 147 147 ASN N N 147 119.197 119.197 116.705 2.492 19806 545 1 1 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.616 -0.048 19806 546 1 1 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.437 -1.286 19806 547 1 1 . 1 1 147 147 ASN CB C 147 37.373 37.373 38.130 -0.757 19806 548 1 1 . 1 1 148 148 ALA N N 148 123.672 123.672 122.538 1.134 19806 549 1 1 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.324 -0.201 19806 550 1 1 . 1 1 148 148 ALA CA C 148 55.133 55.133 54.930 0.203 19806 551 1 1 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.369 -0.762 19806 552 1 1 . 1 1 149 149 ALA N N 149 119.979 119.979 122.568 -2.589 19806 553 1 1 . 1 1 149 149 ALA HA H 149 4.261 4.261 3.955 0.306 19806 554 1 1 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.877 -0.232 19806 555 1 1 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.145 -0.407 19806 556 1 1 . 1 1 150 150 PHE N N 150 119.592 119.592 118.668 0.924 19806 557 1 1 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.027 0.197 19806 558 1 1 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.595 -0.587 19806 559 1 1 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.417 -0.355 19806 560 1 1 . 1 1 151 151 LYS N N 151 116.869 116.869 118.342 -1.473 19806 561 1 1 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.272 -0.366 19806 562 1 1 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.722 0.048 19806 563 1 1 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.299 0.442 19806 564 1 1 . 1 1 152 152 GLU N N 152 115.868 115.868 119.161 -3.293 19806 565 1 1 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.198 -0.145 19806 566 1 1 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.472 0.184 19806 567 1 1 . 1 1 152 152 GLU CB C 152 29.753 29.753 30.330 -0.577 19806 568 1 1 . 1 1 153 153 ILE N N 153 110.437 110.437 119.117 -8.680 19806 569 1 1 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.829 0.347 19806 570 1 1 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.891 -1.857 19806 571 1 1 . 1 1 153 153 ILE CB C 153 39.272 39.272 39.323 -0.051 19806 572 1 1 . 1 1 154 154 HIS N N 154 117.779 117.779 113.603 4.176 19806 573 1 1 . 1 1 154 154 HIS HA H 154 5.174 5.174 4.942 0.232 19806 574 1 1 . 1 1 154 154 HIS CA C 154 51.616 51.616 51.944 -0.328 19806 575 1 1 . 1 1 154 154 HIS CB C 154 28.547 28.547 28.152 0.395 19806 576 1 2 . 1 1 3 3 SER N N 3 114.847 114.847 113.627 1.220 19806 577 1 2 . 1 1 3 3 SER HA H 3 4.463 4.463 5.059 -0.596 19806 578 1 2 . 1 1 3 3 SER CA C 3 58.340 58.340 57.321 1.019 19806 579 1 2 . 1 1 3 3 SER CB C 3 63.457 63.457 65.950 -2.493 19806 580 1 2 . 1 1 4 4 GLU N N 4 121.498 121.498 120.907 0.591 19806 581 1 2 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.532 -0.200 19806 582 1 2 . 1 1 4 4 GLU CA C 4 56.443 56.443 56.268 0.175 19806 583 1 2 . 1 1 4 4 GLU CB C 4 29.966 29.966 31.157 -1.191 19806 584 1 2 . 1 1 5 5 LEU N N 5 121.589 121.589 122.423 -0.834 19806 585 1 2 . 1 1 5 5 LEU HA H 5 4.437 4.437 5.220 -0.783 19806 586 1 2 . 1 1 5 5 LEU CA C 5 55.019 55.019 54.111 0.908 19806 587 1 2 . 1 1 5 5 LEU CB C 5 42.243 42.243 44.353 -2.110 19806 588 1 2 . 1 1 6 6 THR N N 6 113.708 113.708 113.165 0.543 19806 589 1 2 . 1 1 6 6 THR HA H 6 4.470 4.470 4.821 -0.351 19806 590 1 2 . 1 1 6 6 THR CA C 6 61.409 61.409 62.072 -0.663 19806 591 1 2 . 1 1 6 6 THR CB C 6 69.544 69.544 70.332 -0.788 19806 592 1 2 . 1 1 7 7 THR N N 7 114.945 114.945 116.496 -1.551 19806 593 1 2 . 1 1 7 7 THR HA H 7 4.415 4.415 4.509 -0.094 19806 594 1 2 . 1 1 7 7 THR CA C 7 61.435 61.435 62.079 -0.644 19806 595 1 2 . 1 1 7 7 THR CB C 7 69.506 69.506 70.051 -0.545 19806 596 1 2 . 1 1 8 8 GLN N N 8 121.368 121.368 122.965 -1.597 19806 597 1 2 . 1 1 8 8 GLN CA C 8 55.684 55.684 56.234 -0.550 19806 598 1 2 . 1 1 9 9 ASP N N 9 120.595 120.595 120.503 0.092 19806 599 1 2 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.655 -0.008 19806 600 1 2 . 1 1 9 9 ASP CA C 9 54.115 54.115 54.111 0.004 19806 601 1 2 . 1 1 9 9 ASP CB C 9 41.328 41.328 41.699 -0.371 19806 602 1 2 . 1 1 10 10 GLY N N 10 106.984 106.984 107.460 -0.476 19806 603 1 2 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.533 -0.038 19806 604 1 2 . 1 1 11 11 GLU N N 11 120.879 120.879 120.975 -0.096 19806 605 1 2 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.265 -0.076 19806 606 1 2 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.873 -0.363 19806 607 1 2 . 1 1 11 11 GLU CB C 11 33.069 33.069 30.913 2.156 19806 608 1 2 . 1 1 12 12 ASP N N 12 126.686 126.686 121.171 5.515 19806 609 1 2 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.723 0.027 19806 610 1 2 . 1 1 12 12 ASP CA C 12 54.347 54.347 53.401 0.946 19806 611 1 2 . 1 1 12 12 ASP CB C 12 42.771 42.771 42.306 0.465 19806 612 1 2 . 1 1 13 13 PHE N N 13 128.055 128.055 120.028 8.027 19806 613 1 2 . 1 1 13 13 PHE HA H 13 3.412 3.412 4.014 -0.602 19806 614 1 2 . 1 1 13 13 PHE CA C 13 62.551 62.551 59.732 2.819 19806 615 1 2 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.263 0.570 19806 616 1 2 . 1 1 14 14 LYS N N 14 117.498 117.498 116.395 1.103 19806 617 1 2 . 1 1 14 14 LYS HA H 14 3.581 3.581 4.285 -0.704 19806 618 1 2 . 1 1 14 14 LYS CA C 14 59.461 59.461 56.154 3.307 19806 619 1 2 . 1 1 14 14 LYS CB C 14 31.344 31.344 32.339 -0.995 19806 620 1 2 . 1 1 15 15 SER N N 15 113.775 113.775 116.094 -2.319 19806 621 1 2 . 1 1 15 15 SER HA H 15 4.167 4.167 4.287 -0.120 19806 622 1 2 . 1 1 15 15 SER CA C 15 61.099 61.099 60.774 0.325 19806 623 1 2 . 1 1 15 15 SER CB C 15 62.428 62.428 63.490 -1.062 19806 624 1 2 . 1 1 16 16 PHE N N 16 122.292 122.292 118.253 4.039 19806 625 1 2 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.720 -0.430 19806 626 1 2 . 1 1 16 16 PHE CA C 16 59.773 59.773 57.976 1.797 19806 627 1 2 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.669 -1.494 19806 628 1 2 . 1 1 17 17 LEU N N 17 122.472 122.472 123.211 -0.739 19806 629 1 2 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.625 -0.775 19806 630 1 2 . 1 1 17 17 LEU CA C 17 56.619 56.619 57.835 -1.216 19806 631 1 2 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.920 -0.458 19806 632 1 2 . 1 1 18 18 ASP N N 18 117.331 117.331 116.846 0.485 19806 633 1 2 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.147 -0.032 19806 634 1 2 . 1 1 18 18 ASP CA C 18 56.395 56.395 56.858 -0.463 19806 635 1 2 . 1 1 18 18 ASP CB C 18 40.353 40.353 39.898 0.455 19806 636 1 2 . 1 1 19 19 LYS N N 19 120.032 120.032 119.194 0.838 19806 637 1 2 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.867 -0.190 19806 638 1 2 . 1 1 19 19 LYS CA C 19 59.067 59.067 59.129 -0.062 19806 639 1 2 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.382 -0.446 19806 640 1 2 . 1 1 20 20 PHE N N 20 119.607 119.607 116.866 2.741 19806 641 1 2 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.510 -0.401 19806 642 1 2 . 1 1 20 20 PHE CA C 20 62.090 62.090 60.145 1.944 19806 643 1 2 . 1 1 20 20 PHE CB C 20 40.469 40.469 38.920 1.549 19806 644 1 2 . 1 1 21 21 THR N N 21 101.473 101.473 112.221 -10.748 19806 645 1 2 . 1 1 21 21 THR HA H 21 4.259 4.259 3.620 0.639 19806 646 1 2 . 1 1 21 21 THR CA C 21 61.774 61.774 65.354 -3.580 19806 647 1 2 . 1 1 22 22 SER N N 22 111.453 111.453 116.221 -4.768 19806 648 1 2 . 1 1 22 22 SER HA H 22 4.165 4.165 4.296 -0.131 19806 649 1 2 . 1 1 22 22 SER CA C 22 58.215 58.215 57.579 0.636 19806 650 1 2 . 1 1 22 22 SER CB C 22 64.570 64.570 63.041 1.529 19806 651 1 2 . 1 1 23 23 SER N N 23 114.184 114.184 115.400 -1.216 19806 652 1 2 . 1 1 23 23 SER HA H 23 4.764 4.764 4.701 0.063 19806 653 1 2 . 1 1 23 23 SER CA C 23 55.669 55.669 57.810 -2.142 19806 654 1 2 . 1 1 23 23 SER CB C 23 64.011 64.011 66.307 -2.296 19806 655 1 2 . 1 1 24 24 ALA N N 24 133.370 133.370 125.070 8.300 19806 656 1 2 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.900 -0.944 19806 657 1 2 . 1 1 24 24 ALA CA C 24 55.106 55.106 53.535 1.571 19806 658 1 2 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.508 0.327 19806 659 1 2 . 1 1 25 25 ALA N N 25 117.430 117.430 120.231 -2.801 19806 660 1 2 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.915 -0.598 19806 661 1 2 . 1 1 25 25 ALA CA C 25 55.201 55.201 53.888 1.313 19806 662 1 2 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.480 -0.130 19806 663 1 2 . 1 1 26 26 PHE N N 26 116.042 116.042 117.068 -1.026 19806 664 1 2 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.613 -0.303 19806 665 1 2 . 1 1 26 26 PHE CA C 26 60.759 60.759 58.698 2.061 19806 666 1 2 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.436 -0.126 19806 667 1 2 . 1 1 27 27 GLN N N 27 121.820 121.820 117.933 3.887 19806 668 1 2 . 1 1 27 27 GLN HA H 27 3.391 3.391 4.161 -0.770 19806 669 1 2 . 1 1 27 27 GLN CA C 27 60.094 60.094 58.677 1.417 19806 670 1 2 . 1 1 27 27 GLN CB C 27 27.457 27.457 29.217 -1.760 19806 671 1 2 . 1 1 28 28 TYR N N 28 111.517 111.517 116.302 -4.785 19806 672 1 2 . 1 1 28 28 TYR HA H 28 4.130 4.130 4.081 0.049 19806 673 1 2 . 1 1 28 28 TYR CA C 28 62.357 62.357 59.466 2.891 19806 674 1 2 . 1 1 28 28 TYR CB C 28 38.568 38.568 38.529 0.039 19806 675 1 2 . 1 1 29 29 THR N N 29 106.324 106.324 113.948 -7.624 19806 676 1 2 . 1 1 29 29 THR HA H 29 4.489 4.489 4.449 0.040 19806 677 1 2 . 1 1 29 29 THR CA C 29 63.765 63.765 60.989 2.776 19806 678 1 2 . 1 1 29 29 THR CB C 29 69.568 69.568 66.684 2.884 19806 679 1 2 . 1 1 30 30 ARG N N 30 117.696 117.696 119.740 -2.044 19806 680 1 2 . 1 1 30 30 ARG HA H 30 4.701 4.701 4.147 0.554 19806 681 1 2 . 1 1 30 30 ARG CA C 30 52.760 52.760 55.614 -2.853 19806 682 1 2 . 1 1 30 30 ARG CB C 30 35.047 35.047 29.938 5.109 19806 683 1 2 . 1 1 31 31 VAL N N 31 119.395 119.395 119.503 -0.108 19806 684 1 2 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.745 -0.515 19806 685 1 2 . 1 1 31 31 VAL CA C 31 61.191 61.191 61.029 0.162 19806 686 1 2 . 1 1 31 31 VAL CB C 31 32.173 32.173 36.157 -3.984 19806 687 1 2 . 1 1 32 32 LYS N N 32 126.124 126.124 124.403 1.721 19806 688 1 2 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.725 -0.541 19806 689 1 2 . 1 1 32 32 LYS CA C 32 53.958 53.958 54.696 -0.738 19806 690 1 2 . 1 1 32 32 LYS CB C 32 31.112 31.112 33.189 -2.077 19806 691 1 2 . 1 1 33 33 PHE N N 33 119.303 119.303 123.354 -4.051 19806 692 1 2 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.785 -0.271 19806 693 1 2 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.287 0.985 19806 694 1 2 . 1 1 33 33 PHE CB C 33 40.378 40.378 38.500 1.878 19806 695 1 2 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.649 0.319 19806 696 1 2 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.484 -0.851 19806 697 1 2 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.795 0.937 19806 698 1 2 . 1 1 35 35 LEU N N 35 120.016 120.016 117.203 2.813 19806 699 1 2 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.121 0.101 19806 700 1 2 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.728 1.112 19806 701 1 2 . 1 1 35 35 LEU CB C 35 41.244 41.244 42.897 -1.653 19806 702 1 2 . 1 1 36 36 LYS N N 36 117.066 117.066 118.010 -0.944 19806 703 1 2 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.389 -0.414 19806 704 1 2 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.421 2.826 19806 705 1 2 . 1 1 36 36 LYS CB C 36 32.832 32.832 33.491 -0.659 19806 706 1 2 . 1 1 37 37 THR N N 37 117.574 117.574 117.712 -0.138 19806 707 1 2 . 1 1 37 37 THR HA H 37 4.797 4.797 4.777 0.020 19806 708 1 2 . 1 1 37 37 THR CA C 37 60.396 60.396 58.172 2.224 19806 709 1 2 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.935 0.084 19806 710 1 2 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.688 -0.765 19806 711 1 2 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.748 -0.117 19806 712 1 2 . 1 1 39 39 ILE N N 39 119.949 119.949 117.832 2.117 19806 713 1 2 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.322 -0.083 19806 714 1 2 . 1 1 39 39 ILE CA C 39 62.133 62.133 60.865 1.268 19806 715 1 2 . 1 1 40 40 THR N N 40 123.962 123.962 119.057 4.905 19806 716 1 2 . 1 1 40 40 THR HA H 40 5.057 5.057 4.857 0.200 19806 717 1 2 . 1 1 40 40 THR CA C 40 62.262 62.262 62.239 0.023 19806 718 1 2 . 1 1 40 40 THR CB C 40 69.891 69.891 69.487 0.404 19806 719 1 2 . 1 1 41 41 LEU N N 41 125.633 125.633 123.222 2.411 19806 720 1 2 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.740 0.362 19806 721 1 2 . 1 1 41 41 LEU CA C 41 52.638 52.638 52.590 0.048 19806 722 1 2 . 1 1 41 41 LEU CB C 41 45.180 45.180 43.364 1.816 19806 723 1 2 . 1 1 42 42 LEU N N 42 120.788 120.788 122.489 -1.701 19806 724 1 2 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.239 0.509 19806 725 1 2 . 1 1 42 42 LEU CA C 42 53.724 53.724 54.947 -1.224 19806 726 1 2 . 1 1 42 42 LEU CB C 42 44.384 44.384 42.238 2.146 19806 727 1 2 . 1 1 43 43 ALA N N 43 123.073 123.073 127.828 -4.755 19806 728 1 2 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.245 0.185 19806 729 1 2 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.296 -1.008 19806 730 1 2 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.758 0.256 19806 731 1 2 . 1 1 44 44 ASP N N 44 118.196 118.196 118.383 -0.187 19806 732 1 2 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.427 -0.001 19806 733 1 2 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.588 -0.560 19806 734 1 2 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.585 -0.375 19806 735 1 2 . 1 1 45 45 ASP N N 45 115.018 115.018 119.178 -4.160 19806 736 1 2 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.519 -0.050 19806 737 1 2 . 1 1 45 45 ASP CA C 45 53.794 53.794 55.614 -1.820 19806 738 1 2 . 1 1 45 45 ASP CB C 45 39.864 39.864 41.230 -1.366 19806 739 1 2 . 1 1 46 46 GLY N N 46 107.499 107.499 106.346 1.153 19806 740 1 2 . 1 1 46 46 GLY CA C 46 45.914 45.914 44.998 0.916 19806 741 1 2 . 1 1 47 47 GLU N N 47 117.331 117.331 118.451 -1.120 19806 742 1 2 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.475 0.056 19806 743 1 2 . 1 1 47 47 GLU CA C 47 56.938 56.938 55.591 1.347 19806 744 1 2 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.604 2.529 19806 745 1 2 . 1 1 48 48 THR N N 48 118.462 118.462 118.386 0.076 19806 746 1 2 . 1 1 48 48 THR HA H 48 4.243 4.243 4.503 -0.260 19806 747 1 2 . 1 1 48 48 THR CA C 48 62.834 62.834 61.566 1.268 19806 748 1 2 . 1 1 48 48 THR CB C 48 68.649 68.649 69.468 -0.818 19806 749 1 2 . 1 1 49 49 GLU N N 49 123.834 123.834 128.354 -4.520 19806 750 1 2 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.470 0.475 19806 751 1 2 . 1 1 49 49 GLU CA C 49 55.358 55.358 57.128 -1.770 19806 752 1 2 . 1 1 49 49 GLU CB C 49 31.395 31.395 29.611 1.784 19806 753 1 2 . 1 1 50 50 LYS N N 50 122.868 122.868 127.989 -5.121 19806 754 1 2 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.705 -0.064 19806 755 1 2 . 1 1 50 50 LYS CA C 50 54.111 54.111 55.260 -1.149 19806 756 1 2 . 1 1 50 50 LYS CB C 50 35.312 35.312 34.523 0.789 19806 757 1 2 . 1 1 51 51 THR N N 51 111.386 111.386 114.845 -3.459 19806 758 1 2 . 1 1 51 51 THR HA H 51 5.619 5.619 4.896 0.723 19806 759 1 2 . 1 1 51 51 THR CA C 51 58.980 58.980 60.825 -1.845 19806 760 1 2 . 1 1 51 51 THR CB C 51 71.277 71.277 69.943 1.334 19806 761 1 2 . 1 1 52 52 PHE N N 52 120.631 120.631 120.077 0.554 19806 762 1 2 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.831 0.132 19806 763 1 2 . 1 1 52 52 PHE CA C 52 54.129 54.129 54.909 -0.780 19806 764 1 2 . 1 1 52 52 PHE CB C 52 41.049 41.049 41.230 -0.181 19806 765 1 2 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.147 0.301 19806 766 1 2 . 1 1 53 53 PRO CA C 53 62.489 62.489 62.660 -0.171 19806 767 1 2 . 1 1 53 53 PRO CB C 53 32.240 32.240 31.241 1.000 19806 768 1 2 . 1 1 54 54 PHE N N 54 128.034 128.034 123.164 4.870 19806 769 1 2 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.639 0.189 19806 770 1 2 . 1 1 54 54 PHE CA C 54 55.509 55.509 54.980 0.529 19806 771 1 2 . 1 1 54 54 PHE CB C 54 37.028 37.028 36.750 0.278 19806 772 1 2 . 1 1 55 55 THR N N 55 111.757 111.757 114.159 -2.402 19806 773 1 2 . 1 1 55 55 THR HA H 55 4.413 4.413 4.363 0.050 19806 774 1 2 . 1 1 55 55 THR CA C 55 60.578 60.578 60.888 -0.310 19806 775 1 2 . 1 1 55 55 THR CB C 55 69.447 69.447 70.383 -0.936 19806 776 1 2 . 1 1 56 56 LYS N N 56 118.734 118.734 120.763 -2.029 19806 777 1 2 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.006 -1.524 19806 778 1 2 . 1 1 56 56 LYS CA C 56 59.381 59.381 59.455 -0.074 19806 779 1 2 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.887 1.363 19806 780 1 2 . 1 1 57 57 GLU N N 57 119.675 119.675 119.315 0.360 19806 781 1 2 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.164 0.105 19806 782 1 2 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.913 -1.761 19806 783 1 2 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.316 -2.366 19806 784 1 2 . 1 1 58 58 LYS N N 58 114.700 114.700 119.084 -4.384 19806 785 1 2 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.331 -0.019 19806 786 1 2 . 1 1 58 58 LYS CA C 58 55.595 55.595 55.905 -0.310 19806 787 1 2 . 1 1 58 58 LYS CB C 58 32.011 32.011 31.675 0.336 19806 788 1 2 . 1 1 59 59 TRP N N 59 118.204 118.204 123.256 -5.052 19806 789 1 2 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.232 -0.133 19806 790 1 2 . 1 1 59 59 TRP CA C 59 55.577 55.577 54.444 1.133 19806 791 1 2 . 1 1 59 59 TRP CB C 59 32.037 32.037 31.995 0.042 19806 792 1 2 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.409 -0.146 19806 793 1 2 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.197 -2.476 19806 794 1 2 . 1 1 60 60 PRO CB C 60 29.849 29.849 31.342 -1.493 19806 795 1 2 . 1 1 61 61 LEU N N 61 123.758 123.758 124.758 -1.000 19806 796 1 2 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.144 -0.505 19806 797 1 2 . 1 1 61 61 LEU CA C 61 54.875 54.875 55.691 -0.817 19806 798 1 2 . 1 1 61 61 LEU CB C 61 40.815 40.815 41.708 -0.893 19806 799 1 2 . 1 1 62 62 LEU N N 62 124.052 124.052 126.272 -2.220 19806 800 1 2 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.414 -0.059 19806 801 1 2 . 1 1 62 62 LEU CA C 62 53.992 53.992 53.373 0.619 19806 802 1 2 . 1 1 62 62 LEU CB C 62 44.686 44.686 42.448 2.238 19806 803 1 2 . 1 1 63 63 ASP N N 63 117.271 117.271 116.084 1.187 19806 804 1 2 . 1 1 63 63 ASP HA H 63 5.033 5.033 5.041 -0.008 19806 805 1 2 . 1 1 63 63 ASP CA C 63 51.101 51.101 53.429 -2.328 19806 806 1 2 . 1 1 63 63 ASP CB C 63 43.345 43.345 43.772 -0.427 19806 807 1 2 . 1 1 64 64 SER N N 64 112.856 112.856 115.431 -2.575 19806 808 1 2 . 1 1 64 64 SER HA H 64 3.865 3.865 4.233 -0.368 19806 809 1 2 . 1 1 64 64 SER CA C 64 60.910 60.910 60.993 -0.083 19806 810 1 2 . 1 1 64 64 SER CB C 64 62.378 62.378 62.950 -0.572 19806 811 1 2 . 1 1 65 65 GLU N N 65 120.070 120.070 120.287 -0.217 19806 812 1 2 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.196 -0.178 19806 813 1 2 . 1 1 65 65 GLU CA C 65 58.343 58.343 59.077 -0.734 19806 814 1 2 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.028 -0.141 19806 815 1 2 . 1 1 66 66 THR N N 66 115.852 115.852 113.442 2.410 19806 816 1 2 . 1 1 66 66 THR HA H 66 3.991 3.991 4.260 -0.269 19806 817 1 2 . 1 1 66 66 THR CA C 66 65.804 65.804 64.230 1.574 19806 818 1 2 . 1 1 66 66 THR CB C 66 68.451 68.451 68.506 -0.055 19806 819 1 2 . 1 1 67 67 MET N N 67 113.585 113.585 122.643 -9.058 19806 820 1 2 . 1 1 67 67 MET HA H 67 4.267 4.267 4.684 -0.417 19806 821 1 2 . 1 1 67 67 MET CA C 67 52.135 52.135 53.880 -1.745 19806 822 1 2 . 1 1 67 67 MET CB C 67 28.963 28.963 32.001 -3.038 19806 823 1 2 . 1 1 68 68 LYS N N 68 118.462 118.462 120.997 -2.535 19806 824 1 2 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.551 -0.181 19806 825 1 2 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.449 0.033 19806 826 1 2 . 1 1 68 68 LYS CB C 68 34.179 34.179 34.215 -0.036 19806 827 1 2 . 1 1 69 69 GLU N N 69 121.700 121.700 124.929 -3.229 19806 828 1 2 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.776 -0.252 19806 829 1 2 . 1 1 69 69 GLU CA C 69 55.942 55.942 56.518 -0.576 19806 830 1 2 . 1 1 69 69 GLU CB C 69 30.424 30.424 30.474 -0.050 19806 831 1 2 . 1 1 70 70 GLU N N 70 123.445 123.445 123.800 -0.355 19806 832 1 2 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.410 0.287 19806 833 1 2 . 1 1 70 70 GLU CA C 70 55.473 55.473 55.621 -0.148 19806 834 1 2 . 1 1 70 70 GLU CB C 70 33.162 33.162 31.868 1.294 19806 835 1 2 . 1 1 71 71 ARG N N 71 122.150 122.150 121.994 0.156 19806 836 1 2 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.564 0.587 19806 837 1 2 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.071 0.377 19806 838 1 2 . 1 1 71 71 ARG CB C 71 31.703 31.703 30.802 0.901 19806 839 1 2 . 1 1 72 72 ILE N N 72 125.686 125.686 127.525 -1.839 19806 840 1 2 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.168 0.428 19806 841 1 2 . 1 1 72 72 ILE CA C 72 59.512 59.512 61.316 -1.804 19806 842 1 2 . 1 1 72 72 ILE CB C 72 41.095 41.095 37.907 3.188 19806 843 1 2 . 1 1 73 73 THR N N 73 121.600 121.600 122.901 -1.301 19806 844 1 2 . 1 1 73 73 THR HA H 73 4.603 4.603 4.465 0.138 19806 845 1 2 . 1 1 73 73 THR CA C 73 61.937 61.937 61.390 0.547 19806 846 1 2 . 1 1 73 73 THR CB C 73 68.669 68.669 69.079 -0.410 19806 847 1 2 . 1 1 74 74 GLN N N 74 124.607 124.607 127.131 -2.524 19806 848 1 2 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.586 -0.005 19806 849 1 2 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.265 0.424 19806 850 1 2 . 1 1 74 74 GLN CB C 74 29.490 29.490 30.676 -1.186 19806 851 1 2 . 1 1 75 75 GLU N N 75 122.962 122.962 119.459 3.503 19806 852 1 2 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.445 -0.386 19806 853 1 2 . 1 1 75 75 GLU CA C 75 58.845 58.845 57.085 1.760 19806 854 1 2 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.137 -0.564 19806 855 1 2 . 1 1 76 76 GLU N N 76 115.466 115.466 118.947 -3.481 19806 856 1 2 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.460 -0.152 19806 857 1 2 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.991 -0.214 19806 858 1 2 . 1 1 76 76 GLU CB C 76 29.072 29.072 30.197 -1.125 19806 859 1 2 . 1 1 77 77 GLY N N 77 106.771 106.771 107.348 -0.577 19806 860 1 2 . 1 1 77 77 GLY CA C 77 45.014 45.014 44.339 0.675 19806 861 1 2 . 1 1 78 78 GLY N N 78 108.535 108.535 107.408 1.127 19806 862 1 2 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.180 0.527 19806 863 1 2 . 1 1 79 79 ILE N N 79 121.066 121.066 121.458 -0.392 19806 864 1 2 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.646 0.161 19806 865 1 2 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.243 -0.901 19806 866 1 2 . 1 1 79 79 ILE CB C 79 39.220 39.220 38.053 1.167 19806 867 1 2 . 1 1 80 80 TYR N N 80 130.709 130.709 129.697 1.012 19806 868 1 2 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.298 -0.034 19806 869 1 2 . 1 1 80 80 TYR CA C 80 58.161 58.161 58.864 -0.703 19806 870 1 2 . 1 1 80 80 TYR CB C 80 40.621 40.621 38.374 2.247 19806 871 1 2 . 1 1 81 81 VAL N N 81 126.965 126.965 127.509 -0.544 19806 872 1 2 . 1 1 81 81 VAL HA H 81 4.854 4.854 5.006 -0.152 19806 873 1 2 . 1 1 81 81 VAL CA C 81 60.457 60.457 60.006 0.451 19806 874 1 2 . 1 1 81 81 VAL CB C 81 35.004 35.004 35.151 -0.147 19806 875 1 2 . 1 1 82 82 SER N N 82 120.914 120.914 126.974 -6.060 19806 876 1 2 . 1 1 82 82 SER HA H 82 5.185 5.185 4.613 0.572 19806 877 1 2 . 1 1 82 82 SER CA C 82 55.260 55.260 57.376 -2.116 19806 878 1 2 . 1 1 82 82 SER CB C 82 64.785 64.785 62.577 2.208 19806 879 1 2 . 1 1 83 83 LYS N N 83 119.415 119.415 124.588 -5.173 19806 880 1 2 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.841 -0.063 19806 881 1 2 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.362 0.397 19806 882 1 2 . 1 1 83 83 LYS CB C 83 35.514 35.514 34.892 0.622 19806 883 1 2 . 1 1 84 84 PHE N N 84 119.220 119.220 116.154 3.066 19806 884 1 2 . 1 1 84 84 PHE HA H 84 5.441 5.441 5.576 -0.135 19806 885 1 2 . 1 1 84 84 PHE CA C 84 58.414 58.414 56.794 1.620 19806 886 1 2 . 1 1 84 84 PHE CB C 84 37.523 37.523 39.819 -2.296 19806 887 1 2 . 1 1 85 85 THR N N 85 119.257 119.257 113.268 5.989 19806 888 1 2 . 1 1 85 85 THR HA H 85 4.057 4.057 4.267 -0.210 19806 889 1 2 . 1 1 85 85 THR CA C 85 62.660 62.660 62.134 0.526 19806 890 1 2 . 1 1 85 85 THR CB C 85 67.698 67.698 69.172 -1.474 19806 891 1 2 . 1 1 86 86 LEU N N 86 121.612 121.612 123.169 -1.557 19806 892 1 2 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.586 0.012 19806 893 1 2 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.830 0.415 19806 894 1 2 . 1 1 86 86 LEU CB C 86 44.657 44.657 44.989 -0.332 19806 895 1 2 . 1 1 87 87 ASN N N 87 127.684 127.684 122.118 5.566 19806 896 1 2 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.554 0.457 19806 897 1 2 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.224 -0.925 19806 898 1 2 . 1 1 87 87 ASN CB C 87 38.595 38.595 37.898 0.697 19806 899 1 2 . 1 1 88 88 GLU N N 88 120.509 120.509 121.407 -0.898 19806 900 1 2 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.723 0.134 19806 901 1 2 . 1 1 88 88 GLU CA C 88 54.382 54.382 53.767 0.615 19806 902 1 2 . 1 1 88 88 GLU CB C 88 29.808 29.808 30.433 -0.625 19806 903 1 2 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.464 -0.083 19806 904 1 2 . 1 1 89 89 PRO CA C 89 65.898 65.898 64.936 0.962 19806 905 1 2 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.161 0.190 19806 906 1 2 . 1 1 90 90 LYS N N 90 107.288 107.288 118.489 -11.201 19806 907 1 2 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.730 -0.046 19806 908 1 2 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.360 -0.381 19806 909 1 2 . 1 1 90 90 LYS CB C 90 32.994 32.994 32.213 0.781 19806 910 1 2 . 1 1 91 91 HIS N N 91 119.523 119.523 116.974 2.549 19806 911 1 2 . 1 1 91 91 HIS HA H 91 5.777 5.777 4.780 0.997 19806 912 1 2 . 1 1 91 91 HIS CA C 91 53.705 53.705 56.360 -2.655 19806 913 1 2 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.692 -0.498 19806 914 1 2 . 1 1 92 92 LYS N N 92 122.527 122.527 126.343 -3.816 19806 915 1 2 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.918 0.211 19806 916 1 2 . 1 1 92 92 LYS CA C 92 54.291 54.291 55.027 -0.736 19806 917 1 2 . 1 1 92 92 LYS CB C 92 37.479 37.479 36.268 1.211 19806 918 1 2 . 1 1 93 93 ILE N N 93 121.564 121.564 125.878 -4.314 19806 919 1 2 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.400 0.910 19806 920 1 2 . 1 1 93 93 ILE CA C 93 61.137 61.137 58.689 2.448 19806 921 1 2 . 1 1 93 93 ILE CB C 93 41.088 41.088 37.095 3.993 19806 922 1 2 . 1 1 94 94 PHE N N 94 128.955 128.955 128.877 0.078 19806 923 1 2 . 1 1 94 94 PHE HA H 94 4.900 4.900 4.739 0.161 19806 924 1 2 . 1 1 94 94 PHE CA C 94 55.843 55.843 55.593 0.249 19806 925 1 2 . 1 1 95 95 GLU N N 95 124.809 124.809 126.102 -1.293 19806 926 1 2 . 1 1 95 95 GLU HA H 95 5.418 5.418 4.981 0.437 19806 927 1 2 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.698 0.783 19806 928 1 2 . 1 1 95 95 GLU CB C 95 35.160 35.160 31.399 3.761 19806 929 1 2 . 1 1 96 96 ALA N N 96 123.759 123.759 126.195 -2.436 19806 930 1 2 . 1 1 96 96 ALA HA H 96 5.379 5.379 4.780 0.599 19806 931 1 2 . 1 1 96 96 ALA CA C 96 49.541 49.541 49.956 -0.415 19806 932 1 2 . 1 1 96 96 ALA CB C 96 23.830 23.830 21.043 2.787 19806 933 1 2 . 1 1 97 97 GLY N N 97 106.592 106.592 105.195 1.397 19806 934 1 2 . 1 1 97 97 GLY CA C 97 45.435 45.435 43.890 1.545 19806 935 1 2 . 1 1 98 98 TYR N N 98 119.250 119.250 120.968 -1.718 19806 936 1 2 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.231 0.587 19806 937 1 2 . 1 1 98 98 TYR CA C 98 59.387 59.387 57.835 1.552 19806 938 1 2 . 1 1 98 98 TYR CB C 98 38.122 38.122 38.048 0.074 19806 939 1 2 . 1 1 99 99 GLU N N 99 123.080 123.080 123.334 -0.254 19806 940 1 2 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.007 0.002 19806 941 1 2 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.632 -0.223 19806 942 1 2 . 1 1 99 99 GLU CB C 99 30.254 30.254 30.111 0.143 19806 943 1 2 . 1 1 100 100 GLU N N 100 116.459 116.459 117.567 -1.108 19806 944 1 2 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.544 -0.508 19806 945 1 2 . 1 1 100 100 GLU CA C 100 57.404 57.404 55.778 1.626 19806 946 1 2 . 1 1 100 100 GLU CB C 100 27.576 27.576 29.437 -1.861 19806 947 1 2 . 1 1 101 101 SER N N 101 113.069 113.069 115.466 -2.397 19806 948 1 2 . 1 1 101 101 SER HA H 101 4.839 4.839 4.535 0.304 19806 949 1 2 . 1 1 101 101 SER CA C 101 56.024 56.024 57.603 -1.579 19806 950 1 2 . 1 1 101 101 SER CB C 101 64.806 64.806 64.642 0.164 19806 951 1 2 . 1 1 102 102 GLU N N 102 120.439 120.439 119.643 0.796 19806 952 1 2 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.364 0.025 19806 953 1 2 . 1 1 102 102 GLU CA C 102 55.804 55.804 55.853 -0.049 19806 954 1 2 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.182 -0.197 19806 955 1 2 . 1 1 103 103 VAL N N 103 118.899 118.899 114.494 4.405 19806 956 1 2 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.414 -0.328 19806 957 1 2 . 1 1 103 103 VAL CA C 103 62.699 62.699 59.796 2.903 19806 958 1 2 . 1 1 103 103 VAL CB C 103 32.261 32.261 34.747 -2.486 19806 959 1 2 . 1 1 104 104 ASP N N 104 120.965 120.965 119.443 1.522 19806 960 1 2 . 1 1 104 104 ASP HA H 104 5.003 5.003 4.805 0.198 19806 961 1 2 . 1 1 104 104 ASP CA C 104 54.914 54.914 53.709 1.205 19806 962 1 2 . 1 1 104 104 ASP CB C 104 42.791 42.791 43.954 -1.163 19806 963 1 2 . 1 1 105 105 LEU N N 105 120.365 120.365 118.450 1.915 19806 964 1 2 . 1 1 105 105 LEU HA H 105 5.295 5.295 4.650 0.645 19806 965 1 2 . 1 1 105 105 LEU CA C 105 54.431 54.431 55.620 -1.189 19806 966 1 2 . 1 1 105 105 LEU CB C 105 46.001 46.001 44.988 1.013 19806 967 1 2 . 1 1 106 106 ARG N N 106 126.289 126.289 124.887 1.402 19806 968 1 2 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.299 0.526 19806 969 1 2 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.806 -0.134 19806 970 1 2 . 1 1 106 106 ARG CB C 106 33.920 33.920 33.832 0.088 19806 971 1 2 . 1 1 107 107 VAL N N 107 126.145 126.145 123.624 2.521 19806 972 1 2 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.536 0.143 19806 973 1 2 . 1 1 107 107 VAL CA C 107 61.671 61.671 61.576 0.095 19806 974 1 2 . 1 1 107 107 VAL CB C 107 35.350 35.350 33.343 2.007 19806 975 1 2 . 1 1 108 108 GLU N N 108 127.093 127.093 124.904 2.189 19806 976 1 2 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.375 0.892 19806 977 1 2 . 1 1 108 108 GLU CA C 108 54.761 54.761 56.288 -1.527 19806 978 1 2 . 1 1 108 108 GLU CB C 108 32.567 32.567 31.077 1.490 19806 979 1 2 . 1 1 109 109 PHE N N 109 124.592 124.592 122.136 2.456 19806 980 1 2 . 1 1 109 109 PHE HA H 109 6.028 6.028 4.960 1.068 19806 981 1 2 . 1 1 109 109 PHE CA C 109 55.945 55.945 57.000 -1.055 19806 982 1 2 . 1 1 109 109 PHE CB C 109 43.099 43.099 40.275 2.824 19806 983 1 2 . 1 1 110 110 GLU N N 110 122.143 122.143 122.619 -0.476 19806 984 1 2 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.185 0.008 19806 985 1 2 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.644 0.799 19806 986 1 2 . 1 1 110 110 GLU CB C 110 35.816 35.816 33.972 1.844 19806 987 1 2 . 1 1 111 111 LEU N N 111 129.616 129.616 122.510 7.106 19806 988 1 2 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.691 0.117 19806 989 1 2 . 1 1 111 111 LEU CA C 111 53.470 53.470 55.479 -2.009 19806 990 1 2 . 1 1 111 111 LEU CB C 111 40.400 40.400 42.274 -1.874 19806 991 1 2 . 1 1 112 112 GLN N N 112 124.742 124.742 122.039 2.703 19806 992 1 2 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.328 0.111 19806 993 1 2 . 1 1 112 112 GLN CA C 112 55.802 55.802 56.233 -0.431 19806 994 1 2 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.216 -0.463 19806 995 1 2 . 1 1 113 113 ALA N N 113 121.195 121.195 121.032 0.163 19806 996 1 2 . 1 1 113 113 ALA HA H 113 4.048 4.048 4.262 -0.214 19806 997 1 2 . 1 1 113 113 ALA CA C 113 54.518 54.518 51.711 2.807 19806 998 1 2 . 1 1 113 113 ALA CB C 113 18.199 18.199 19.113 -0.914 19806 999 1 2 . 1 1 114 114 ASP N N 114 114.525 114.525 114.236 0.289 19806 1000 1 2 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.166 0.233 19806 1001 1 2 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.577 -1.669 19806 1002 1 2 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.712 -1.654 19806 1003 1 2 . 1 1 115 115 GLY N N 115 107.526 107.526 104.134 3.392 19806 1004 1 2 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.268 0.516 19806 1005 1 2 . 1 1 116 116 LYS N N 116 118.818 118.818 120.920 -2.102 19806 1006 1 2 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.603 -0.153 19806 1007 1 2 . 1 1 116 116 LYS CA C 116 54.171 54.171 55.055 -0.884 19806 1008 1 2 . 1 1 116 116 LYS CB C 116 35.039 35.039 34.745 0.294 19806 1009 1 2 . 1 1 117 117 TRP N N 117 118.939 118.939 124.460 -5.521 19806 1010 1 2 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.441 -0.484 19806 1011 1 2 . 1 1 118 118 TYR N N 118 112.644 112.644 120.194 -7.550 19806 1012 1 2 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.808 0.469 19806 1013 1 2 . 1 1 118 118 TYR CA C 118 56.219 56.219 57.448 -1.229 19806 1014 1 2 . 1 1 118 118 TYR CB C 118 43.282 43.282 41.187 2.095 19806 1015 1 2 . 1 1 119 119 VAL N N 119 119.842 119.842 124.490 -4.648 19806 1016 1 2 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.272 0.243 19806 1017 1 2 . 1 1 119 119 VAL CA C 119 62.442 62.442 64.824 -2.382 19806 1018 1 2 . 1 1 120 120 VAL N N 120 114.552 114.552 116.406 -1.854 19806 1019 1 2 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.504 0.234 19806 1020 1 2 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.365 -0.770 19806 1021 1 2 . 1 1 120 120 VAL CB C 120 32.852 32.852 32.336 0.516 19806 1022 1 2 . 1 1 121 121 ASP N N 121 118.234 118.234 119.401 -1.167 19806 1023 1 2 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.692 0.571 19806 1024 1 2 . 1 1 121 121 ASP CA C 121 53.663 53.663 54.763 -1.100 19806 1025 1 2 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.236 -0.349 19806 1026 1 2 . 1 1 122 122 CYS N N 122 121.036 121.036 125.675 -4.639 19806 1027 1 2 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.886 0.685 19806 1028 1 2 . 1 1 122 122 CYS CA C 122 57.052 57.052 57.880 -0.828 19806 1029 1 2 . 1 1 122 122 CYS CB C 122 30.834 30.834 27.897 2.937 19806 1030 1 2 . 1 1 123 123 TYR N N 123 127.672 127.672 128.589 -0.917 19806 1031 1 2 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.791 0.219 19806 1032 1 2 . 1 1 123 123 TYR CA C 123 57.169 57.169 57.618 -0.449 19806 1033 1 2 . 1 1 123 123 TYR CB C 123 41.408 41.408 42.650 -1.242 19806 1034 1 2 . 1 1 124 124 THR N N 124 120.833 120.833 118.187 2.646 19806 1035 1 2 . 1 1 124 124 THR HA H 124 4.987 4.987 4.613 0.374 19806 1036 1 2 . 1 1 124 124 THR CA C 124 57.153 57.153 61.043 -3.890 19806 1037 1 2 . 1 1 124 124 THR CB C 124 68.607 68.607 70.765 -2.158 19806 1038 1 2 . 1 1 125 125 GLY N N 125 114.347 114.347 111.583 2.764 19806 1039 1 2 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.366 -0.038 19806 1040 1 2 . 1 1 126 126 TRP N N 126 119.918 119.918 121.758 -1.840 19806 1041 1 2 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.008 0.062 19806 1042 1 2 . 1 1 126 126 TRP CA C 126 60.564 60.564 59.020 1.544 19806 1043 1 2 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.364 0.275 19806 1044 1 2 . 1 1 127 127 TYR N N 127 113.911 113.911 117.043 -3.132 19806 1045 1 2 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.681 0.313 19806 1046 1 2 . 1 1 127 127 TYR CA C 127 53.384 53.384 57.574 -4.190 19806 1047 1 2 . 1 1 127 127 TYR CB C 127 38.584 38.584 37.070 1.514 19806 1048 1 2 . 1 1 128 128 GLY N N 128 105.181 105.181 108.733 -3.552 19806 1049 1 2 . 1 1 128 128 GLY CA C 128 45.189 45.189 45.472 -0.283 19806 1050 1 2 . 1 1 129 129 TYR N N 129 116.588 116.588 120.843 -4.255 19806 1051 1 2 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.578 0.086 19806 1052 1 2 . 1 1 129 129 TYR CA C 129 59.565 59.565 58.626 0.939 19806 1053 1 2 . 1 1 129 129 TYR CB C 129 38.853 38.853 36.495 2.358 19806 1054 1 2 . 1 1 130 130 ASP N N 130 115.195 115.195 120.759 -5.564 19806 1055 1 2 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.733 -0.348 19806 1056 1 2 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.717 -1.587 19806 1057 1 2 . 1 1 130 130 ASP CB C 130 38.685 38.685 43.221 -4.536 19806 1058 1 2 . 1 1 131 131 LEU N N 131 124.887 124.887 121.277 3.610 19806 1059 1 2 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.873 -0.392 19806 1060 1 2 . 1 1 131 131 LEU CA C 131 53.605 53.605 51.985 1.620 19806 1061 1 2 . 1 1 131 131 LEU CB C 131 42.441 42.441 44.066 -1.625 19806 1062 1 2 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.461 0.222 19806 1063 1 2 . 1 1 132 132 PRO CA C 132 127.065 127.065 62.660 64.405 19806 1064 1 2 . 1 1 132 132 PRO CB C 132 32.327 32.327 32.696 -0.369 19806 1065 1 2 . 1 1 133 133 ILE N N 133 123.765 123.765 118.578 5.187 19806 1066 1 2 . 1 1 133 133 ILE HA H 133 3.729 3.729 4.054 -0.325 19806 1067 1 2 . 1 1 133 133 ILE CA C 133 64.860 64.860 61.394 3.466 19806 1068 1 2 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.102 -0.039 19806 1069 1 2 . 1 1 134 134 GLY N N 134 107.030 107.030 107.565 -0.535 19806 1070 1 2 . 1 1 134 134 GLY CA C 134 45.976 45.976 45.071 0.906 19806 1071 1 2 . 1 1 135 135 GLU N N 135 116.566 116.566 119.774 -3.208 19806 1072 1 2 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.244 0.420 19806 1073 1 2 . 1 1 135 135 GLU CA C 135 55.414 55.414 57.690 -2.276 19806 1074 1 2 . 1 1 135 135 GLU CB C 135 30.195 30.195 29.475 0.720 19806 1075 1 2 . 1 1 136 136 LEU N N 136 124.239 124.239 121.491 2.748 19806 1076 1 2 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.896 0.148 19806 1077 1 2 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.998 0.118 19806 1078 1 2 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.762 -0.755 19806 1079 1 2 . 1 1 137 137 LYS N N 137 117.225 117.225 116.755 0.470 19806 1080 1 2 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.910 -0.047 19806 1081 1 2 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.717 0.738 19806 1082 1 2 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.752 -0.549 19806 1083 1 2 . 1 1 138 138 GLN N N 138 118.718 118.718 118.005 0.713 19806 1084 1 2 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.238 -0.186 19806 1085 1 2 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.451 -0.576 19806 1086 1 2 . 1 1 138 138 GLN CB C 138 28.235 28.235 28.210 0.025 19806 1087 1 2 . 1 1 139 139 THR N N 139 117.970 117.970 117.786 0.184 19806 1088 1 2 . 1 1 139 139 THR HA H 139 4.532 4.532 4.101 0.431 19806 1089 1 2 . 1 1 139 139 THR CA C 139 68.145 68.145 66.510 1.635 19806 1090 1 2 . 1 1 139 139 THR CB C 139 68.103 68.103 68.458 -0.355 19806 1091 1 2 . 1 1 140 140 ILE N N 140 120.391 120.391 121.219 -0.828 19806 1092 1 2 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.824 -0.097 19806 1093 1 2 . 1 1 140 140 ILE CA C 140 65.256 65.256 65.177 0.079 19806 1094 1 2 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.458 0.655 19806 1095 1 2 . 1 1 141 141 GLN N N 141 118.917 118.917 116.331 2.586 19806 1096 1 2 . 1 1 141 141 GLN HA H 141 4.015 4.015 4.081 -0.066 19806 1097 1 2 . 1 1 141 141 GLN CA C 141 58.371 58.371 58.485 -0.114 19806 1098 1 2 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.253 -0.906 19806 1099 1 2 . 1 1 142 142 ASN N N 142 119.936 119.936 118.957 0.979 19806 1100 1 2 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.628 -0.113 19806 1101 1 2 . 1 1 142 142 ASN CA C 142 55.799 55.799 55.958 -0.159 19806 1102 1 2 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.956 -1.325 19806 1103 1 2 . 1 1 143 143 VAL N N 143 123.195 123.195 120.329 2.866 19806 1104 1 2 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.204 -0.488 19806 1105 1 2 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.431 0.066 19806 1106 1 2 . 1 1 143 143 VAL CB C 143 30.989 30.989 30.734 0.255 19806 1107 1 2 . 1 1 144 144 LYS N N 144 120.348 120.348 119.047 1.301 19806 1108 1 2 . 1 1 144 144 LYS HA H 144 3.881 3.881 3.903 -0.022 19806 1109 1 2 . 1 1 144 144 LYS CA C 144 60.123 60.123 60.466 -0.343 19806 1110 1 2 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.082 -0.200 19806 1111 1 2 . 1 1 145 145 GLU N N 145 119.220 119.220 119.003 0.217 19806 1112 1 2 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.029 0.154 19806 1113 1 2 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.598 -0.420 19806 1114 1 2 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.405 -0.334 19806 1115 1 2 . 1 1 146 146 GLU N N 146 121.420 121.420 119.270 2.150 19806 1116 1 2 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.085 0.192 19806 1117 1 2 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.505 -0.387 19806 1118 1 2 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.562 -1.220 19806 1119 1 2 . 1 1 147 147 ASN N N 147 119.197 119.197 117.817 1.380 19806 1120 1 2 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.561 0.007 19806 1121 1 2 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.748 -1.597 19806 1122 1 2 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.958 -0.585 19806 1123 1 2 . 1 1 148 148 ALA N N 148 123.672 123.672 123.098 0.574 19806 1124 1 2 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.083 0.040 19806 1125 1 2 . 1 1 148 148 ALA CA C 148 55.133 55.133 55.353 -0.221 19806 1126 1 2 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.110 -0.503 19806 1127 1 2 . 1 1 149 149 ALA N N 149 119.979 119.979 120.513 -0.534 19806 1128 1 2 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.293 -0.032 19806 1129 1 2 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.804 -0.159 19806 1130 1 2 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.608 -0.870 19806 1131 1 2 . 1 1 150 150 PHE N N 150 119.592 119.592 119.972 -0.380 19806 1132 1 2 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.196 0.028 19806 1133 1 2 . 1 1 150 150 PHE CA C 150 61.008 61.008 60.944 0.064 19806 1134 1 2 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.536 -0.474 19806 1135 1 2 . 1 1 151 151 LYS N N 151 116.869 116.869 119.338 -2.469 19806 1136 1 2 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.158 -0.252 19806 1137 1 2 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.787 -0.017 19806 1138 1 2 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.044 0.697 19806 1139 1 2 . 1 1 152 152 GLU N N 152 115.868 115.868 119.864 -3.996 19806 1140 1 2 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.114 -0.061 19806 1141 1 2 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.703 -0.047 19806 1142 1 2 . 1 1 152 152 GLU CB C 152 29.753 29.753 29.975 -0.222 19806 1143 1 2 . 1 1 153 153 ILE N N 153 110.437 110.437 116.987 -6.550 19806 1144 1 2 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.979 0.197 19806 1145 1 2 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.794 -1.760 19806 1146 1 2 . 1 1 153 153 ILE CB C 153 39.272 39.272 39.224 0.048 19806 1147 1 2 . 1 1 154 154 HIS N N 154 117.779 117.779 117.270 0.509 19806 1148 1 2 . 1 1 154 154 HIS HA H 154 5.174 5.174 4.815 0.359 19806 1149 1 2 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.435 -0.819 19806 1150 1 2 . 1 1 154 154 HIS CB C 154 28.547 28.547 30.544 -1.997 19806 1151 1 3 . 1 1 3 3 SER N N 3 114.847 114.847 113.741 1.106 19806 1152 1 3 . 1 1 3 3 SER HA H 3 4.463 4.463 4.545 -0.082 19806 1153 1 3 . 1 1 3 3 SER CA C 3 58.340 58.340 58.270 0.070 19806 1154 1 3 . 1 1 3 3 SER CB C 3 63.457 63.457 65.419 -1.962 19806 1155 1 3 . 1 1 4 4 GLU N N 4 121.498 121.498 122.337 -0.839 19806 1156 1 3 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.502 -0.170 19806 1157 1 3 . 1 1 4 4 GLU CA C 4 56.443 56.443 56.444 -0.001 19806 1158 1 3 . 1 1 4 4 GLU CB C 4 29.966 29.966 30.467 -0.501 19806 1159 1 3 . 1 1 5 5 LEU N N 5 121.589 121.589 122.430 -0.841 19806 1160 1 3 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.015 0.422 19806 1161 1 3 . 1 1 5 5 LEU CA C 5 55.019 55.019 56.177 -1.158 19806 1162 1 3 . 1 1 5 5 LEU CB C 5 42.243 42.243 42.296 -0.053 19806 1163 1 3 . 1 1 6 6 THR N N 6 113.708 113.708 116.964 -3.256 19806 1164 1 3 . 1 1 6 6 THR HA H 6 4.470 4.470 4.487 -0.017 19806 1165 1 3 . 1 1 6 6 THR CA C 6 61.409 61.409 63.091 -1.682 19806 1166 1 3 . 1 1 6 6 THR CB C 6 69.544 69.544 68.302 1.242 19806 1167 1 3 . 1 1 7 7 THR N N 7 114.945 114.945 119.445 -4.500 19806 1168 1 3 . 1 1 7 7 THR HA H 7 4.415 4.415 4.664 -0.249 19806 1169 1 3 . 1 1 7 7 THR CA C 7 61.435 61.435 60.358 1.077 19806 1170 1 3 . 1 1 7 7 THR CB C 7 69.506 69.506 69.914 -0.408 19806 1171 1 3 . 1 1 8 8 GLN N N 8 121.368 121.368 121.309 0.059 19806 1172 1 3 . 1 1 8 8 GLN CA C 8 55.684 55.684 55.725 -0.041 19806 1173 1 3 . 1 1 9 9 ASP N N 9 120.595 120.595 118.592 2.003 19806 1174 1 3 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.427 0.220 19806 1175 1 3 . 1 1 9 9 ASP CA C 9 54.115 54.115 54.390 -0.275 19806 1176 1 3 . 1 1 9 9 ASP CB C 9 41.328 41.328 40.599 0.729 19806 1177 1 3 . 1 1 10 10 GLY N N 10 106.984 106.984 109.116 -2.132 19806 1178 1 3 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.998 -0.503 19806 1179 1 3 . 1 1 11 11 GLU N N 11 120.879 120.879 122.217 -1.338 19806 1180 1 3 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.310 -0.121 19806 1181 1 3 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.942 -0.432 19806 1182 1 3 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.516 1.553 19806 1183 1 3 . 1 1 12 12 ASP N N 12 126.686 126.686 123.483 3.203 19806 1184 1 3 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.613 0.137 19806 1185 1 3 . 1 1 12 12 ASP CA C 12 54.347 54.347 54.764 -0.417 19806 1186 1 3 . 1 1 12 12 ASP CB C 12 42.771 42.771 42.160 0.611 19806 1187 1 3 . 1 1 13 13 PHE N N 13 128.055 128.055 121.937 6.118 19806 1188 1 3 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.953 -0.541 19806 1189 1 3 . 1 1 13 13 PHE CA C 13 62.551 62.551 59.718 2.833 19806 1190 1 3 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.612 0.221 19806 1191 1 3 . 1 1 14 14 LYS N N 14 117.498 117.498 119.097 -1.599 19806 1192 1 3 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.947 -0.366 19806 1193 1 3 . 1 1 14 14 LYS CA C 14 59.461 59.461 57.285 2.176 19806 1194 1 3 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.863 -0.519 19806 1195 1 3 . 1 1 15 15 SER N N 15 113.775 113.775 116.162 -2.387 19806 1196 1 3 . 1 1 15 15 SER HA H 15 4.167 4.167 4.087 0.080 19806 1197 1 3 . 1 1 15 15 SER CA C 15 61.099 61.099 62.585 -1.486 19806 1198 1 3 . 1 1 15 15 SER CB C 15 62.428 62.428 63.017 -0.589 19806 1199 1 3 . 1 1 16 16 PHE N N 16 122.292 122.292 119.682 2.610 19806 1200 1 3 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.536 -0.246 19806 1201 1 3 . 1 1 16 16 PHE CA C 16 59.773 59.773 60.175 -0.402 19806 1202 1 3 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.143 -0.968 19806 1203 1 3 . 1 1 17 17 LEU N N 17 122.472 122.472 121.190 1.282 19806 1204 1 3 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.490 -0.640 19806 1205 1 3 . 1 1 17 17 LEU CA C 17 56.619 56.619 57.119 -0.500 19806 1206 1 3 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.201 0.261 19806 1207 1 3 . 1 1 18 18 ASP N N 18 117.331 117.331 119.449 -2.118 19806 1208 1 3 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.240 -0.125 19806 1209 1 3 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.529 -1.134 19806 1210 1 3 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.417 -0.064 19806 1211 1 3 . 1 1 19 19 LYS N N 19 120.032 120.032 118.695 1.337 19806 1212 1 3 . 1 1 19 19 LYS HA H 19 3.677 3.677 4.090 -0.413 19806 1213 1 3 . 1 1 19 19 LYS CA C 19 59.067 59.067 58.563 0.504 19806 1214 1 3 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.745 -0.809 19806 1215 1 3 . 1 1 20 20 PHE N N 20 119.607 119.607 121.910 -2.303 19806 1216 1 3 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.248 -0.139 19806 1217 1 3 . 1 1 20 20 PHE CA C 20 62.090 62.090 61.222 0.868 19806 1218 1 3 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.176 1.293 19806 1219 1 3 . 1 1 21 21 THR N N 21 101.473 101.473 109.560 -8.087 19806 1220 1 3 . 1 1 21 21 THR HA H 21 4.259 4.259 4.157 0.102 19806 1221 1 3 . 1 1 21 21 THR CA C 21 61.774 61.774 64.319 -2.545 19806 1222 1 3 . 1 1 22 22 SER N N 22 111.453 111.453 115.634 -4.181 19806 1223 1 3 . 1 1 22 22 SER HA H 22 4.165 4.165 3.666 0.499 19806 1224 1 3 . 1 1 22 22 SER CA C 22 58.215 58.215 57.678 0.537 19806 1225 1 3 . 1 1 22 22 SER CB C 22 64.570 64.570 64.352 0.218 19806 1226 1 3 . 1 1 23 23 SER N N 23 114.184 114.184 115.403 -1.219 19806 1227 1 3 . 1 1 23 23 SER HA H 23 4.764 4.764 4.869 -0.105 19806 1228 1 3 . 1 1 23 23 SER CA C 23 55.669 55.669 57.268 -1.599 19806 1229 1 3 . 1 1 23 23 SER CB C 23 64.011 64.011 64.909 -0.898 19806 1230 1 3 . 1 1 24 24 ALA N N 24 133.370 133.370 130.304 3.066 19806 1231 1 3 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.154 -0.198 19806 1232 1 3 . 1 1 24 24 ALA CA C 24 55.106 55.106 55.365 -0.259 19806 1233 1 3 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.188 0.647 19806 1234 1 3 . 1 1 25 25 ALA N N 25 117.430 117.430 121.038 -3.608 19806 1235 1 3 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.436 -0.119 19806 1236 1 3 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.804 0.397 19806 1237 1 3 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.413 -0.064 19806 1238 1 3 . 1 1 26 26 PHE N N 26 116.042 116.042 116.550 -0.508 19806 1239 1 3 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.452 -0.142 19806 1240 1 3 . 1 1 26 26 PHE CA C 26 60.759 60.759 59.137 1.622 19806 1241 1 3 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.153 0.157 19806 1242 1 3 . 1 1 27 27 GLN N N 27 121.820 121.820 118.694 3.126 19806 1243 1 3 . 1 1 27 27 GLN HA H 27 3.391 3.391 3.963 -0.572 19806 1244 1 3 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.060 1.034 19806 1245 1 3 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.947 -1.490 19806 1246 1 3 . 1 1 28 28 TYR N N 28 111.517 111.517 117.278 -5.761 19806 1247 1 3 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.902 0.228 19806 1248 1 3 . 1 1 28 28 TYR CA C 28 62.357 62.357 60.214 2.143 19806 1249 1 3 . 1 1 28 28 TYR CB C 28 38.568 38.568 38.091 0.477 19806 1250 1 3 . 1 1 29 29 THR N N 29 106.324 106.324 111.521 -5.197 19806 1251 1 3 . 1 1 29 29 THR HA H 29 4.489 4.489 4.096 0.393 19806 1252 1 3 . 1 1 29 29 THR CA C 29 63.765 63.765 63.255 0.510 19806 1253 1 3 . 1 1 29 29 THR CB C 29 69.568 69.568 68.094 1.474 19806 1254 1 3 . 1 1 30 30 ARG N N 30 117.696 117.696 119.467 -1.771 19806 1255 1 3 . 1 1 30 30 ARG HA H 30 4.701 4.701 3.481 1.220 19806 1256 1 3 . 1 1 30 30 ARG CA C 30 52.760 52.760 54.387 -1.627 19806 1257 1 3 . 1 1 30 30 ARG CB C 30 35.047 35.047 30.944 4.103 19806 1258 1 3 . 1 1 31 31 VAL N N 31 119.395 119.395 118.053 1.342 19806 1259 1 3 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.847 -0.617 19806 1260 1 3 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.003 1.188 19806 1261 1 3 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.848 -2.675 19806 1262 1 3 . 1 1 32 32 LYS N N 32 126.124 126.124 126.342 -0.218 19806 1263 1 3 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.499 -0.315 19806 1264 1 3 . 1 1 32 32 LYS CA C 32 53.958 53.958 55.516 -1.558 19806 1265 1 3 . 1 1 32 32 LYS CB C 32 31.112 31.112 33.380 -2.268 19806 1266 1 3 . 1 1 33 33 PHE N N 33 119.303 119.303 118.501 0.802 19806 1267 1 3 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.890 -0.376 19806 1268 1 3 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.655 0.617 19806 1269 1 3 . 1 1 33 33 PHE CB C 33 40.378 40.378 39.906 0.472 19806 1270 1 3 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.800 0.168 19806 1271 1 3 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.812 -1.179 19806 1272 1 3 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.705 1.027 19806 1273 1 3 . 1 1 35 35 LEU N N 35 120.016 120.016 119.276 0.740 19806 1274 1 3 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.531 -0.309 19806 1275 1 3 . 1 1 35 35 LEU CA C 35 54.840 54.840 54.056 0.784 19806 1276 1 3 . 1 1 35 35 LEU CB C 35 41.244 41.244 43.188 -1.944 19806 1277 1 3 . 1 1 36 36 LYS N N 36 117.066 117.066 119.606 -2.540 19806 1278 1 3 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.353 -0.378 19806 1279 1 3 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.750 2.497 19806 1280 1 3 . 1 1 36 36 LYS CB C 36 32.832 32.832 32.983 -0.151 19806 1281 1 3 . 1 1 37 37 THR N N 37 117.574 117.574 118.147 -0.573 19806 1282 1 3 . 1 1 37 37 THR HA H 37 4.797 4.797 4.906 -0.109 19806 1283 1 3 . 1 1 37 37 THR CA C 37 60.396 60.396 58.704 1.692 19806 1284 1 3 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.674 0.345 19806 1285 1 3 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.390 -0.467 19806 1286 1 3 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.808 -0.177 19806 1287 1 3 . 1 1 39 39 ILE N N 39 119.949 119.949 120.175 -0.226 19806 1288 1 3 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.245 -0.006 19806 1289 1 3 . 1 1 39 39 ILE CA C 39 62.133 62.133 61.314 0.819 19806 1290 1 3 . 1 1 40 40 THR N N 40 123.962 123.962 123.723 0.239 19806 1291 1 3 . 1 1 40 40 THR HA H 40 5.057 5.057 4.894 0.163 19806 1292 1 3 . 1 1 40 40 THR CA C 40 62.262 62.262 61.500 0.762 19806 1293 1 3 . 1 1 40 40 THR CB C 40 69.891 69.891 70.617 -0.726 19806 1294 1 3 . 1 1 41 41 LEU N N 41 125.633 125.633 124.007 1.626 19806 1295 1 3 . 1 1 41 41 LEU HA H 41 5.102 5.102 5.029 0.073 19806 1296 1 3 . 1 1 41 41 LEU CA C 41 52.638 52.638 52.750 -0.112 19806 1297 1 3 . 1 1 41 41 LEU CB C 41 45.180 45.180 45.725 -0.545 19806 1298 1 3 . 1 1 42 42 LEU N N 42 120.788 120.788 121.594 -0.806 19806 1299 1 3 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.483 0.265 19806 1300 1 3 . 1 1 42 42 LEU CA C 42 53.724 53.724 53.848 -0.124 19806 1301 1 3 . 1 1 42 42 LEU CB C 42 44.384 44.384 41.143 3.241 19806 1302 1 3 . 1 1 43 43 ALA N N 43 123.073 123.073 128.018 -4.945 19806 1303 1 3 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.197 0.233 19806 1304 1 3 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.658 -1.370 19806 1305 1 3 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.358 0.656 19806 1306 1 3 . 1 1 44 44 ASP N N 44 118.196 118.196 117.849 0.347 19806 1307 1 3 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.370 0.056 19806 1308 1 3 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.995 -0.967 19806 1309 1 3 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.895 -0.685 19806 1310 1 3 . 1 1 45 45 ASP N N 45 115.018 115.018 118.224 -3.206 19806 1311 1 3 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.494 -0.025 19806 1312 1 3 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.501 -0.707 19806 1313 1 3 . 1 1 45 45 ASP CB C 45 39.864 39.864 40.657 -0.793 19806 1314 1 3 . 1 1 46 46 GLY N N 46 107.499 107.499 107.505 -0.006 19806 1315 1 3 . 1 1 46 46 GLY CA C 46 45.914 45.914 46.082 -0.168 19806 1316 1 3 . 1 1 47 47 GLU N N 47 117.331 117.331 118.864 -1.533 19806 1317 1 3 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.405 0.126 19806 1318 1 3 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.968 -0.030 19806 1319 1 3 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.419 2.714 19806 1320 1 3 . 1 1 48 48 THR N N 48 118.462 118.462 119.265 -0.803 19806 1321 1 3 . 1 1 48 48 THR HA H 48 4.243 4.243 4.231 0.012 19806 1322 1 3 . 1 1 48 48 THR CA C 48 62.834 62.834 62.731 0.103 19806 1323 1 3 . 1 1 48 48 THR CB C 48 68.649 68.649 68.886 -0.237 19806 1324 1 3 . 1 1 49 49 GLU N N 49 123.834 123.834 128.745 -4.911 19806 1325 1 3 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.429 0.516 19806 1326 1 3 . 1 1 49 49 GLU CA C 49 55.358 55.358 56.989 -1.631 19806 1327 1 3 . 1 1 49 49 GLU CB C 49 31.395 31.395 29.067 2.328 19806 1328 1 3 . 1 1 50 50 LYS N N 50 122.868 122.868 127.810 -4.942 19806 1329 1 3 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.523 0.118 19806 1330 1 3 . 1 1 50 50 LYS CA C 50 54.111 54.111 55.388 -1.277 19806 1331 1 3 . 1 1 50 50 LYS CB C 50 35.312 35.312 33.542 1.770 19806 1332 1 3 . 1 1 51 51 THR N N 51 111.386 111.386 118.643 -7.257 19806 1333 1 3 . 1 1 51 51 THR HA H 51 5.619 5.619 5.056 0.563 19806 1334 1 3 . 1 1 51 51 THR CA C 51 58.980 58.980 62.509 -3.529 19806 1335 1 3 . 1 1 51 51 THR CB C 51 71.277 71.277 69.647 1.630 19806 1336 1 3 . 1 1 52 52 PHE N N 52 120.631 120.631 120.179 0.452 19806 1337 1 3 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.904 0.059 19806 1338 1 3 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.839 -1.710 19806 1339 1 3 . 1 1 52 52 PHE CB C 52 41.049 41.049 42.408 -1.359 19806 1340 1 3 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.578 -0.130 19806 1341 1 3 . 1 1 53 53 PRO CA C 53 62.489 62.489 62.810 -0.321 19806 1342 1 3 . 1 1 53 53 PRO CB C 53 32.240 32.240 32.362 -0.122 19806 1343 1 3 . 1 1 54 54 PHE N N 54 128.034 128.034 121.380 6.654 19806 1344 1 3 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.815 0.013 19806 1345 1 3 . 1 1 54 54 PHE CA C 54 55.509 55.509 56.936 -1.427 19806 1346 1 3 . 1 1 54 54 PHE CB C 54 37.028 37.028 41.299 -4.271 19806 1347 1 3 . 1 1 55 55 THR N N 55 111.757 111.757 116.636 -4.879 19806 1348 1 3 . 1 1 55 55 THR HA H 55 4.413 4.413 4.598 -0.185 19806 1349 1 3 . 1 1 55 55 THR CA C 55 60.578 60.578 59.587 0.990 19806 1350 1 3 . 1 1 55 55 THR CB C 55 69.447 69.447 71.281 -1.834 19806 1351 1 3 . 1 1 56 56 LYS N N 56 118.734 118.734 119.081 -0.347 19806 1352 1 3 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.485 -2.003 19806 1353 1 3 . 1 1 56 56 LYS CA C 56 59.381 59.381 58.706 0.675 19806 1354 1 3 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.580 0.670 19806 1355 1 3 . 1 1 57 57 GLU N N 57 119.675 119.675 118.874 0.801 19806 1356 1 3 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.036 0.233 19806 1357 1 3 . 1 1 57 57 GLU CA C 57 57.152 57.152 59.689 -2.537 19806 1358 1 3 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.257 -2.307 19806 1359 1 3 . 1 1 58 58 LYS N N 58 114.700 114.700 116.568 -1.868 19806 1360 1 3 . 1 1 58 58 LYS HA H 58 4.312 4.312 3.991 0.321 19806 1361 1 3 . 1 1 58 58 LYS CA C 58 55.595 55.595 56.159 -0.564 19806 1362 1 3 . 1 1 58 58 LYS CB C 58 32.011 32.011 31.510 0.501 19806 1363 1 3 . 1 1 59 59 TRP N N 59 118.204 118.204 124.377 -6.173 19806 1364 1 3 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.242 -0.143 19806 1365 1 3 . 1 1 59 59 TRP CA C 59 55.577 55.577 54.958 0.619 19806 1366 1 3 . 1 1 59 59 TRP CB C 59 32.037 32.037 29.967 2.070 19806 1367 1 3 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.539 -0.276 19806 1368 1 3 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.456 -2.735 19806 1369 1 3 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.537 -2.688 19806 1370 1 3 . 1 1 61 61 LEU N N 61 123.758 123.758 123.245 0.513 19806 1371 1 3 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.278 -0.639 19806 1372 1 3 . 1 1 61 61 LEU CA C 61 54.875 54.875 53.709 1.165 19806 1373 1 3 . 1 1 61 61 LEU CB C 61 40.815 40.815 41.780 -0.965 19806 1374 1 3 . 1 1 62 62 LEU N N 62 124.052 124.052 126.544 -2.492 19806 1375 1 3 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.276 0.079 19806 1376 1 3 . 1 1 62 62 LEU CA C 62 53.992 53.992 54.866 -0.874 19806 1377 1 3 . 1 1 62 62 LEU CB C 62 44.686 44.686 42.421 2.265 19806 1378 1 3 . 1 1 63 63 ASP N N 63 117.271 117.271 120.058 -2.787 19806 1379 1 3 . 1 1 63 63 ASP HA H 63 5.033 5.033 5.245 -0.212 19806 1380 1 3 . 1 1 63 63 ASP CA C 63 51.101 51.101 53.482 -2.381 19806 1381 1 3 . 1 1 63 63 ASP CB C 63 43.345 43.345 44.056 -0.711 19806 1382 1 3 . 1 1 64 64 SER N N 64 112.856 112.856 115.171 -2.315 19806 1383 1 3 . 1 1 64 64 SER HA H 64 3.865 3.865 4.312 -0.447 19806 1384 1 3 . 1 1 64 64 SER CA C 64 60.910 60.910 60.797 0.113 19806 1385 1 3 . 1 1 64 64 SER CB C 64 62.378 62.378 63.409 -1.031 19806 1386 1 3 . 1 1 65 65 GLU N N 65 120.070 120.070 119.760 0.310 19806 1387 1 3 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.266 -0.248 19806 1388 1 3 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.724 -0.381 19806 1389 1 3 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.277 -0.390 19806 1390 1 3 . 1 1 66 66 THR N N 66 115.852 115.852 113.447 2.405 19806 1391 1 3 . 1 1 66 66 THR HA H 66 3.991 3.991 4.259 -0.268 19806 1392 1 3 . 1 1 66 66 THR CA C 66 65.804 65.804 64.672 1.132 19806 1393 1 3 . 1 1 66 66 THR CB C 66 68.451 68.451 68.791 -0.340 19806 1394 1 3 . 1 1 67 67 MET N N 67 113.585 113.585 121.512 -7.927 19806 1395 1 3 . 1 1 67 67 MET HA H 67 4.267 4.267 4.152 0.115 19806 1396 1 3 . 1 1 67 67 MET CA C 67 52.135 52.135 54.384 -2.249 19806 1397 1 3 . 1 1 67 67 MET CB C 67 28.963 28.963 30.052 -1.089 19806 1398 1 3 . 1 1 68 68 LYS N N 68 118.462 118.462 121.164 -2.702 19806 1399 1 3 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.657 -0.287 19806 1400 1 3 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.440 0.042 19806 1401 1 3 . 1 1 68 68 LYS CB C 68 34.179 34.179 36.147 -1.968 19806 1402 1 3 . 1 1 69 69 GLU N N 69 121.700 121.700 122.036 -0.336 19806 1403 1 3 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.361 0.163 19806 1404 1 3 . 1 1 69 69 GLU CA C 69 55.942 55.942 55.792 0.150 19806 1405 1 3 . 1 1 69 69 GLU CB C 69 30.424 30.424 30.322 0.102 19806 1406 1 3 . 1 1 70 70 GLU N N 70 123.445 123.445 121.828 1.617 19806 1407 1 3 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.522 0.175 19806 1408 1 3 . 1 1 70 70 GLU CA C 70 55.473 55.473 55.126 0.347 19806 1409 1 3 . 1 1 70 70 GLU CB C 70 33.162 33.162 32.525 0.637 19806 1410 1 3 . 1 1 71 71 ARG N N 71 122.150 122.150 122.207 -0.057 19806 1411 1 3 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.791 0.360 19806 1412 1 3 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.302 0.146 19806 1413 1 3 . 1 1 71 71 ARG CB C 71 31.703 31.703 30.755 0.948 19806 1414 1 3 . 1 1 72 72 ILE N N 72 125.686 125.686 127.559 -1.873 19806 1415 1 3 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.325 0.271 19806 1416 1 3 . 1 1 72 72 ILE CA C 72 59.512 59.512 60.888 -1.376 19806 1417 1 3 . 1 1 72 72 ILE CB C 72 41.095 41.095 38.703 2.392 19806 1418 1 3 . 1 1 73 73 THR N N 73 121.600 121.600 122.857 -1.257 19806 1419 1 3 . 1 1 73 73 THR HA H 73 4.603 4.603 4.383 0.220 19806 1420 1 3 . 1 1 73 73 THR CA C 73 61.937 61.937 61.805 0.132 19806 1421 1 3 . 1 1 73 73 THR CB C 73 68.669 68.669 68.969 -0.300 19806 1422 1 3 . 1 1 74 74 GLN N N 74 124.607 124.607 127.401 -2.794 19806 1423 1 3 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.589 -0.008 19806 1424 1 3 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.254 0.435 19806 1425 1 3 . 1 1 74 74 GLN CB C 74 29.490 29.490 30.628 -1.138 19806 1426 1 3 . 1 1 75 75 GLU N N 75 122.962 122.962 118.989 3.973 19806 1427 1 3 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.500 -0.441 19806 1428 1 3 . 1 1 75 75 GLU CA C 75 58.845 58.845 56.785 2.061 19806 1429 1 3 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.224 -0.652 19806 1430 1 3 . 1 1 76 76 GLU N N 76 115.466 115.466 118.684 -3.218 19806 1431 1 3 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.380 -0.072 19806 1432 1 3 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.616 0.161 19806 1433 1 3 . 1 1 76 76 GLU CB C 76 29.072 29.072 29.853 -0.781 19806 1434 1 3 . 1 1 77 77 GLY N N 77 106.771 106.771 108.293 -1.522 19806 1435 1 3 . 1 1 77 77 GLY CA C 77 45.014 45.014 45.077 -0.063 19806 1436 1 3 . 1 1 78 78 GLY N N 78 108.535 108.535 107.549 0.986 19806 1437 1 3 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.802 -0.095 19806 1438 1 3 . 1 1 79 79 ILE N N 79 121.066 121.066 120.756 0.310 19806 1439 1 3 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.361 0.446 19806 1440 1 3 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.583 -1.240 19806 1441 1 3 . 1 1 79 79 ILE CB C 79 39.220 39.220 38.714 0.506 19806 1442 1 3 . 1 1 80 80 TYR N N 80 130.709 130.709 130.393 0.316 19806 1443 1 3 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.171 0.093 19806 1444 1 3 . 1 1 80 80 TYR CA C 80 58.161 58.161 57.520 0.641 19806 1445 1 3 . 1 1 80 80 TYR CB C 80 40.621 40.621 37.585 3.036 19806 1446 1 3 . 1 1 81 81 VAL N N 81 126.965 126.965 128.443 -1.478 19806 1447 1 3 . 1 1 81 81 VAL HA H 81 4.854 4.854 3.988 0.866 19806 1448 1 3 . 1 1 81 81 VAL CA C 81 60.457 60.457 62.031 -1.574 19806 1449 1 3 . 1 1 81 81 VAL CB C 81 35.004 35.004 33.428 1.576 19806 1450 1 3 . 1 1 82 82 SER N N 82 120.914 120.914 118.744 2.170 19806 1451 1 3 . 1 1 82 82 SER HA H 82 5.185 5.185 5.200 -0.015 19806 1452 1 3 . 1 1 82 82 SER CA C 82 55.260 55.260 56.773 -1.513 19806 1453 1 3 . 1 1 82 82 SER CB C 82 64.785 64.785 65.604 -0.819 19806 1454 1 3 . 1 1 83 83 LYS N N 83 119.415 119.415 120.829 -1.414 19806 1455 1 3 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.727 0.051 19806 1456 1 3 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.758 0.001 19806 1457 1 3 . 1 1 83 83 LYS CB C 83 35.514 35.514 35.222 0.291 19806 1458 1 3 . 1 1 84 84 PHE N N 84 119.220 119.220 119.254 -0.034 19806 1459 1 3 . 1 1 84 84 PHE HA H 84 5.441 5.441 4.570 0.871 19806 1460 1 3 . 1 1 84 84 PHE CA C 84 58.414 58.414 58.148 0.266 19806 1461 1 3 . 1 1 84 84 PHE CB C 84 37.523 37.523 38.655 -1.132 19806 1462 1 3 . 1 1 85 85 THR N N 85 119.257 119.257 115.280 3.977 19806 1463 1 3 . 1 1 85 85 THR HA H 85 4.057 4.057 4.078 -0.021 19806 1464 1 3 . 1 1 85 85 THR CA C 85 62.660 62.660 62.925 -0.265 19806 1465 1 3 . 1 1 85 85 THR CB C 85 67.698 67.698 69.269 -1.571 19806 1466 1 3 . 1 1 86 86 LEU N N 86 121.612 121.612 121.128 0.484 19806 1467 1 3 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.601 -0.003 19806 1468 1 3 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.593 0.652 19806 1469 1 3 . 1 1 86 86 LEU CB C 86 44.657 44.657 44.863 -0.206 19806 1470 1 3 . 1 1 87 87 ASN N N 87 127.684 127.684 122.115 5.569 19806 1471 1 3 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.796 0.215 19806 1472 1 3 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.899 -1.600 19806 1473 1 3 . 1 1 87 87 ASN CB C 87 38.595 38.595 39.044 -0.448 19806 1474 1 3 . 1 1 88 88 GLU N N 88 120.509 120.509 122.654 -2.145 19806 1475 1 3 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.846 0.011 19806 1476 1 3 . 1 1 88 88 GLU CA C 88 54.382 54.382 53.139 1.243 19806 1477 1 3 . 1 1 88 88 GLU CB C 88 29.808 29.808 31.078 -1.270 19806 1478 1 3 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.423 -0.042 19806 1479 1 3 . 1 1 89 89 PRO CA C 89 65.898 65.898 65.118 0.780 19806 1480 1 3 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.418 -0.067 19806 1481 1 3 . 1 1 90 90 LYS N N 90 107.288 107.288 114.659 -7.371 19806 1482 1 3 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.242 0.442 19806 1483 1 3 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.869 -0.890 19806 1484 1 3 . 1 1 90 90 LYS CB C 90 32.994 32.994 32.368 0.626 19806 1485 1 3 . 1 1 91 91 HIS N N 91 119.523 119.523 117.732 1.791 19806 1486 1 3 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.647 0.130 19806 1487 1 3 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.295 -0.590 19806 1488 1 3 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.779 -0.585 19806 1489 1 3 . 1 1 92 92 LYS N N 92 122.527 122.527 121.873 0.654 19806 1490 1 3 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.535 0.594 19806 1491 1 3 . 1 1 92 92 LYS CA C 92 54.291 54.291 54.706 -0.415 19806 1492 1 3 . 1 1 92 92 LYS CB C 92 37.479 37.479 36.200 1.279 19806 1493 1 3 . 1 1 93 93 ILE N N 93 121.564 121.564 118.781 2.783 19806 1494 1 3 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.713 0.597 19806 1495 1 3 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.292 0.845 19806 1496 1 3 . 1 1 93 93 ILE CB C 93 41.088 41.088 42.205 -1.117 19806 1497 1 3 . 1 1 94 94 PHE N N 94 128.955 128.955 125.354 3.601 19806 1498 1 3 . 1 1 94 94 PHE HA H 94 4.900 4.900 4.944 -0.044 19806 1499 1 3 . 1 1 94 94 PHE CA C 94 55.843 55.843 56.874 -1.031 19806 1500 1 3 . 1 1 95 95 GLU N N 95 124.809 124.809 126.871 -2.062 19806 1501 1 3 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.137 0.281 19806 1502 1 3 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.584 0.897 19806 1503 1 3 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.035 2.125 19806 1504 1 3 . 1 1 96 96 ALA N N 96 123.759 123.759 120.660 3.099 19806 1505 1 3 . 1 1 96 96 ALA HA H 96 5.379 5.379 4.706 0.673 19806 1506 1 3 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.933 -1.392 19806 1507 1 3 . 1 1 96 96 ALA CB C 96 23.830 23.830 21.906 1.924 19806 1508 1 3 . 1 1 97 97 GLY N N 97 106.592 106.592 107.890 -1.298 19806 1509 1 3 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.543 -0.108 19806 1510 1 3 . 1 1 98 98 TYR N N 98 119.250 119.250 119.990 -0.740 19806 1511 1 3 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.721 0.097 19806 1512 1 3 . 1 1 98 98 TYR CA C 98 59.387 59.387 58.857 0.530 19806 1513 1 3 . 1 1 98 98 TYR CB C 98 38.122 38.122 38.684 -0.562 19806 1514 1 3 . 1 1 99 99 GLU N N 99 123.080 123.080 124.619 -1.539 19806 1515 1 3 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.102 -0.093 19806 1516 1 3 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.878 -0.469 19806 1517 1 3 . 1 1 99 99 GLU CB C 99 30.254 30.254 29.867 0.387 19806 1518 1 3 . 1 1 100 100 GLU N N 100 116.459 116.459 117.065 -0.606 19806 1519 1 3 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.393 -0.357 19806 1520 1 3 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.805 0.599 19806 1521 1 3 . 1 1 100 100 GLU CB C 100 27.576 27.576 30.281 -2.705 19806 1522 1 3 . 1 1 101 101 SER N N 101 113.069 113.069 114.587 -1.518 19806 1523 1 3 . 1 1 101 101 SER HA H 101 4.839 4.839 4.688 0.151 19806 1524 1 3 . 1 1 101 101 SER CA C 101 56.024 56.024 57.417 -1.393 19806 1525 1 3 . 1 1 101 101 SER CB C 101 64.806 64.806 65.259 -0.453 19806 1526 1 3 . 1 1 102 102 GLU N N 102 120.439 120.439 120.918 -0.479 19806 1527 1 3 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.465 -0.076 19806 1528 1 3 . 1 1 102 102 GLU CA C 102 55.804 55.804 55.983 -0.179 19806 1529 1 3 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.253 -0.268 19806 1530 1 3 . 1 1 103 103 VAL N N 103 118.899 118.899 116.761 2.138 19806 1531 1 3 . 1 1 103 103 VAL HA H 103 4.086 4.086 3.961 0.125 19806 1532 1 3 . 1 1 103 103 VAL CA C 103 62.699 62.699 63.213 -0.514 19806 1533 1 3 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.395 -0.134 19806 1534 1 3 . 1 1 104 104 ASP N N 104 120.965 120.965 119.733 1.232 19806 1535 1 3 . 1 1 104 104 ASP HA H 104 5.003 5.003 4.882 0.121 19806 1536 1 3 . 1 1 104 104 ASP CA C 104 54.914 54.914 55.813 -0.899 19806 1537 1 3 . 1 1 104 104 ASP CB C 104 42.791 42.791 43.976 -1.185 19806 1538 1 3 . 1 1 105 105 LEU N N 105 120.365 120.365 117.772 2.593 19806 1539 1 3 . 1 1 105 105 LEU HA H 105 5.295 5.295 4.827 0.468 19806 1540 1 3 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.958 -0.527 19806 1541 1 3 . 1 1 105 105 LEU CB C 105 46.001 46.001 45.515 0.486 19806 1542 1 3 . 1 1 106 106 ARG N N 106 126.289 126.289 123.188 3.101 19806 1543 1 3 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.260 0.565 19806 1544 1 3 . 1 1 106 106 ARG CA C 106 54.672 54.672 55.095 -0.423 19806 1545 1 3 . 1 1 106 106 ARG CB C 106 33.920 33.920 34.890 -0.970 19806 1546 1 3 . 1 1 107 107 VAL N N 107 126.145 126.145 117.121 9.024 19806 1547 1 3 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.925 -0.246 19806 1548 1 3 . 1 1 107 107 VAL CA C 107 61.671 61.671 60.195 1.476 19806 1549 1 3 . 1 1 107 107 VAL CB C 107 35.350 35.350 35.578 -0.228 19806 1550 1 3 . 1 1 108 108 GLU N N 108 127.093 127.093 119.627 7.466 19806 1551 1 3 . 1 1 108 108 GLU HA H 108 5.267 5.267 5.002 0.265 19806 1552 1 3 . 1 1 108 108 GLU CA C 108 54.761 54.761 55.260 -0.499 19806 1553 1 3 . 1 1 108 108 GLU CB C 108 32.567 32.567 34.115 -1.548 19806 1554 1 3 . 1 1 109 109 PHE N N 109 124.592 124.592 121.559 3.033 19806 1555 1 3 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.424 0.604 19806 1556 1 3 . 1 1 109 109 PHE CA C 109 55.945 55.945 54.860 1.085 19806 1557 1 3 . 1 1 109 109 PHE CB C 109 43.099 43.099 42.448 0.651 19806 1558 1 3 . 1 1 110 110 GLU N N 110 122.143 122.143 121.109 1.034 19806 1559 1 3 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.359 -0.166 19806 1560 1 3 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.446 0.997 19806 1561 1 3 . 1 1 110 110 GLU CB C 110 35.816 35.816 34.677 1.139 19806 1562 1 3 . 1 1 111 111 LEU N N 111 129.616 129.616 125.668 3.948 19806 1563 1 3 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.692 0.116 19806 1564 1 3 . 1 1 111 111 LEU CA C 111 53.470 53.470 54.617 -1.147 19806 1565 1 3 . 1 1 111 111 LEU CB C 111 40.400 40.400 41.562 -1.162 19806 1566 1 3 . 1 1 112 112 GLN N N 112 124.742 124.742 123.715 1.027 19806 1567 1 3 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.340 0.099 19806 1568 1 3 . 1 1 112 112 GLN CA C 112 55.802 55.802 53.792 2.010 19806 1569 1 3 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.630 -0.877 19806 1570 1 3 . 1 1 113 113 ALA N N 113 121.195 121.195 124.312 -3.117 19806 1571 1 3 . 1 1 113 113 ALA HA H 113 4.048 4.048 4.098 -0.050 19806 1572 1 3 . 1 1 113 113 ALA CA C 113 54.518 54.518 53.862 0.656 19806 1573 1 3 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.615 -0.416 19806 1574 1 3 . 1 1 114 114 ASP N N 114 114.525 114.525 117.786 -3.261 19806 1575 1 3 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.459 -0.060 19806 1576 1 3 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.806 -1.898 19806 1577 1 3 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.978 -1.920 19806 1578 1 3 . 1 1 115 115 GLY N N 115 107.526 107.526 109.024 -1.498 19806 1579 1 3 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.772 0.012 19806 1580 1 3 . 1 1 116 116 LYS N N 116 118.818 118.818 119.368 -0.550 19806 1581 1 3 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.994 -0.544 19806 1582 1 3 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.876 -0.705 19806 1583 1 3 . 1 1 116 116 LYS CB C 116 35.039 35.039 34.956 0.083 19806 1584 1 3 . 1 1 117 117 TRP N N 117 118.939 118.939 123.995 -5.056 19806 1585 1 3 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.702 -0.746 19806 1586 1 3 . 1 1 118 118 TYR N N 118 112.644 112.644 120.286 -7.642 19806 1587 1 3 . 1 1 118 118 TYR HA H 118 5.277 5.277 5.130 0.147 19806 1588 1 3 . 1 1 118 118 TYR CA C 118 56.219 56.219 56.934 -0.715 19806 1589 1 3 . 1 1 118 118 TYR CB C 118 43.282 43.282 42.690 0.593 19806 1590 1 3 . 1 1 119 119 VAL N N 119 119.842 119.842 119.604 0.238 19806 1591 1 3 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.860 -0.345 19806 1592 1 3 . 1 1 119 119 VAL CA C 119 62.442 62.442 60.354 2.088 19806 1593 1 3 . 1 1 120 120 VAL N N 120 114.552 114.552 116.762 -2.210 19806 1594 1 3 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.571 0.167 19806 1595 1 3 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.873 -1.278 19806 1596 1 3 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.426 -0.574 19806 1597 1 3 . 1 1 121 121 ASP N N 121 118.234 118.234 119.868 -1.634 19806 1598 1 3 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.862 0.401 19806 1599 1 3 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.934 -0.271 19806 1600 1 3 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.731 -0.844 19806 1601 1 3 . 1 1 122 122 CYS N N 122 121.036 121.036 122.818 -1.782 19806 1602 1 3 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.815 0.756 19806 1603 1 3 . 1 1 122 122 CYS CA C 122 57.052 57.052 58.479 -1.427 19806 1604 1 3 . 1 1 122 122 CYS CB C 122 30.834 30.834 28.681 2.153 19806 1605 1 3 . 1 1 123 123 TYR N N 123 127.672 127.672 128.427 -0.755 19806 1606 1 3 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.938 0.072 19806 1607 1 3 . 1 1 123 123 TYR CA C 123 57.169 57.169 58.474 -1.305 19806 1608 1 3 . 1 1 123 123 TYR CB C 123 41.408 41.408 41.995 -0.587 19806 1609 1 3 . 1 1 124 124 THR N N 124 120.833 120.833 114.815 6.018 19806 1610 1 3 . 1 1 124 124 THR HA H 124 4.987 4.987 4.646 0.341 19806 1611 1 3 . 1 1 124 124 THR CA C 124 57.153 57.153 60.704 -3.551 19806 1612 1 3 . 1 1 124 124 THR CB C 124 68.607 68.607 71.546 -2.938 19806 1613 1 3 . 1 1 125 125 GLY N N 125 114.347 114.347 111.614 2.733 19806 1614 1 3 . 1 1 125 125 GLY CA C 125 46.328 46.328 45.763 0.565 19806 1615 1 3 . 1 1 126 126 TRP N N 126 119.918 119.918 122.185 -2.267 19806 1616 1 3 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.073 -0.003 19806 1617 1 3 . 1 1 126 126 TRP CA C 126 60.564 60.564 59.127 1.437 19806 1618 1 3 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.377 0.262 19806 1619 1 3 . 1 1 127 127 TYR N N 127 113.911 113.911 116.802 -2.891 19806 1620 1 3 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.715 0.279 19806 1621 1 3 . 1 1 127 127 TYR CA C 127 53.384 53.384 56.710 -3.326 19806 1622 1 3 . 1 1 127 127 TYR CB C 127 38.584 38.584 36.985 1.599 19806 1623 1 3 . 1 1 128 128 GLY N N 128 105.181 105.181 107.892 -2.711 19806 1624 1 3 . 1 1 128 128 GLY CA C 128 45.189 45.189 43.631 1.558 19806 1625 1 3 . 1 1 129 129 TYR N N 129 116.588 116.588 120.662 -4.074 19806 1626 1 3 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.597 0.067 19806 1627 1 3 . 1 1 129 129 TYR CA C 129 59.565 59.565 58.650 0.915 19806 1628 1 3 . 1 1 129 129 TYR CB C 129 38.853 38.853 36.751 2.102 19806 1629 1 3 . 1 1 130 130 ASP N N 130 115.195 115.195 119.568 -4.373 19806 1630 1 3 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.692 -0.307 19806 1631 1 3 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.528 -1.398 19806 1632 1 3 . 1 1 130 130 ASP CB C 130 38.685 38.685 42.784 -4.099 19806 1633 1 3 . 1 1 131 131 LEU N N 131 124.887 124.887 122.383 2.504 19806 1634 1 3 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.790 -0.309 19806 1635 1 3 . 1 1 131 131 LEU CA C 131 53.605 53.605 53.529 0.076 19806 1636 1 3 . 1 1 131 131 LEU CB C 131 42.441 42.441 42.041 0.400 19806 1637 1 3 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.820 -0.137 19806 1638 1 3 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.561 65.504 19806 1639 1 3 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.706 -1.379 19806 1640 1 3 . 1 1 133 133 ILE N N 133 123.765 123.765 118.649 5.116 19806 1641 1 3 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.799 -0.070 19806 1642 1 3 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.143 1.717 19806 1643 1 3 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.143 -0.080 19806 1644 1 3 . 1 1 134 134 GLY N N 134 107.030 107.030 108.852 -1.822 19806 1645 1 3 . 1 1 134 134 GLY CA C 134 45.976 45.976 45.805 0.171 19806 1646 1 3 . 1 1 135 135 GLU N N 135 116.566 116.566 122.512 -5.946 19806 1647 1 3 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.185 0.479 19806 1648 1 3 . 1 1 135 135 GLU CA C 135 55.414 55.414 56.958 -1.544 19806 1649 1 3 . 1 1 135 135 GLU CB C 135 30.195 30.195 28.475 1.720 19806 1650 1 3 . 1 1 136 136 LEU N N 136 124.239 124.239 122.377 1.862 19806 1651 1 3 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.804 0.240 19806 1652 1 3 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.310 0.806 19806 1653 1 3 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.700 -0.694 19806 1654 1 3 . 1 1 137 137 LYS N N 137 117.225 117.225 117.152 0.073 19806 1655 1 3 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.839 0.024 19806 1656 1 3 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.605 0.850 19806 1657 1 3 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.906 -0.703 19806 1658 1 3 . 1 1 138 138 GLN N N 138 118.718 118.718 119.190 -0.472 19806 1659 1 3 . 1 1 138 138 GLN HA H 138 4.052 4.052 3.974 0.078 19806 1660 1 3 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.891 -1.016 19806 1661 1 3 . 1 1 138 138 GLN CB C 138 28.235 28.235 27.694 0.541 19806 1662 1 3 . 1 1 139 139 THR N N 139 117.970 117.970 116.225 1.745 19806 1663 1 3 . 1 1 139 139 THR HA H 139 4.532 4.532 3.806 0.726 19806 1664 1 3 . 1 1 139 139 THR CA C 139 68.145 68.145 66.582 1.563 19806 1665 1 3 . 1 1 139 139 THR CB C 139 68.103 68.103 68.437 -0.334 19806 1666 1 3 . 1 1 140 140 ILE N N 140 120.391 120.391 122.678 -2.287 19806 1667 1 3 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.780 -0.053 19806 1668 1 3 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.737 0.519 19806 1669 1 3 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.714 0.399 19806 1670 1 3 . 1 1 141 141 GLN N N 141 118.917 118.917 118.759 0.158 19806 1671 1 3 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.860 0.155 19806 1672 1 3 . 1 1 141 141 GLN CA C 141 58.371 58.371 59.107 -0.736 19806 1673 1 3 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.302 -0.955 19806 1674 1 3 . 1 1 142 142 ASN N N 142 119.936 119.936 118.478 1.458 19806 1675 1 3 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.410 0.105 19806 1676 1 3 . 1 1 142 142 ASN CA C 142 55.799 55.799 55.402 0.397 19806 1677 1 3 . 1 1 142 142 ASN CB C 142 37.630 37.630 37.941 -0.311 19806 1678 1 3 . 1 1 143 143 VAL N N 143 123.195 123.195 119.960 3.235 19806 1679 1 3 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.106 -0.390 19806 1680 1 3 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.315 0.182 19806 1681 1 3 . 1 1 143 143 VAL CB C 143 30.989 30.989 31.080 -0.091 19806 1682 1 3 . 1 1 144 144 LYS N N 144 120.348 120.348 118.337 2.011 19806 1683 1 3 . 1 1 144 144 LYS HA H 144 3.881 3.881 4.022 -0.141 19806 1684 1 3 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.455 0.668 19806 1685 1 3 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.098 -0.216 19806 1686 1 3 . 1 1 145 145 GLU N N 145 119.220 119.220 119.865 -0.645 19806 1687 1 3 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.111 0.072 19806 1688 1 3 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.320 -0.142 19806 1689 1 3 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.580 -0.509 19806 1690 1 3 . 1 1 146 146 GLU N N 146 121.420 121.420 120.421 0.999 19806 1691 1 3 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.110 0.167 19806 1692 1 3 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.588 -0.470 19806 1693 1 3 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.676 -1.334 19806 1694 1 3 . 1 1 147 147 ASN N N 147 119.197 119.197 117.527 1.670 19806 1695 1 3 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.591 -0.023 19806 1696 1 3 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.884 -1.733 19806 1697 1 3 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.845 -0.472 19806 1698 1 3 . 1 1 148 148 ALA N N 148 123.672 123.672 122.858 0.814 19806 1699 1 3 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.220 -0.097 19806 1700 1 3 . 1 1 148 148 ALA CA C 148 55.133 55.133 55.266 -0.133 19806 1701 1 3 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.062 -0.455 19806 1702 1 3 . 1 1 149 149 ALA N N 149 119.979 119.979 121.736 -1.757 19806 1703 1 3 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.117 0.144 19806 1704 1 3 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.699 -0.054 19806 1705 1 3 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.171 -0.433 19806 1706 1 3 . 1 1 150 150 PHE N N 150 119.592 119.592 119.955 -0.363 19806 1707 1 3 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.146 0.078 19806 1708 1 3 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.584 -0.576 19806 1709 1 3 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.507 -0.445 19806 1710 1 3 . 1 1 151 151 LYS N N 151 116.869 116.869 118.653 -1.784 19806 1711 1 3 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.489 -0.583 19806 1712 1 3 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.678 0.092 19806 1713 1 3 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.123 0.618 19806 1714 1 3 . 1 1 152 152 GLU N N 152 115.868 115.868 120.080 -4.212 19806 1715 1 3 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.129 -0.076 19806 1716 1 3 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.940 -0.284 19806 1717 1 3 . 1 1 152 152 GLU CB C 152 29.753 29.753 29.491 0.262 19806 1718 1 3 . 1 1 153 153 ILE N N 153 110.437 110.437 117.637 -7.200 19806 1719 1 3 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.931 0.245 19806 1720 1 3 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.615 -1.581 19806 1721 1 3 . 1 1 153 153 ILE CB C 153 39.272 39.272 39.202 0.070 19806 1722 1 3 . 1 1 154 154 HIS N N 154 117.779 117.779 117.455 0.324 19806 1723 1 3 . 1 1 154 154 HIS HA H 154 5.174 5.174 5.016 0.158 19806 1724 1 3 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.467 -0.851 19806 1725 1 3 . 1 1 154 154 HIS CB C 154 28.547 28.547 29.159 -0.612 19806 1726 1 4 . 1 1 3 3 SER N N 3 114.847 114.847 114.214 0.633 19806 1727 1 4 . 1 1 3 3 SER HA H 3 4.463 4.463 4.650 -0.187 19806 1728 1 4 . 1 1 3 3 SER CA C 3 58.340 58.340 57.559 0.781 19806 1729 1 4 . 1 1 3 3 SER CB C 3 63.457 63.457 64.636 -1.179 19806 1730 1 4 . 1 1 4 4 GLU N N 4 121.498 121.498 119.719 1.779 19806 1731 1 4 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.682 -0.350 19806 1732 1 4 . 1 1 4 4 GLU CA C 4 56.443 56.443 55.642 0.801 19806 1733 1 4 . 1 1 4 4 GLU CB C 4 29.966 29.966 30.657 -0.691 19806 1734 1 4 . 1 1 5 5 LEU N N 5 121.589 121.589 122.414 -0.825 19806 1735 1 4 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.445 -0.008 19806 1736 1 4 . 1 1 5 5 LEU CA C 5 55.019 55.019 56.386 -1.367 19806 1737 1 4 . 1 1 5 5 LEU CB C 5 42.243 42.243 42.806 -0.563 19806 1738 1 4 . 1 1 6 6 THR N N 6 113.708 113.708 115.503 -1.795 19806 1739 1 4 . 1 1 6 6 THR HA H 6 4.470 4.470 4.603 -0.133 19806 1740 1 4 . 1 1 6 6 THR CA C 6 61.409 61.409 60.709 0.700 19806 1741 1 4 . 1 1 6 6 THR CB C 6 69.544 69.544 70.508 -0.964 19806 1742 1 4 . 1 1 7 7 THR N N 7 114.945 114.945 114.162 0.783 19806 1743 1 4 . 1 1 7 7 THR HA H 7 4.415 4.415 4.458 -0.043 19806 1744 1 4 . 1 1 7 7 THR CA C 7 61.435 61.435 60.964 0.471 19806 1745 1 4 . 1 1 7 7 THR CB C 7 69.506 69.506 69.795 -0.289 19806 1746 1 4 . 1 1 8 8 GLN N N 8 121.368 121.368 120.575 0.793 19806 1747 1 4 . 1 1 8 8 GLN CA C 8 55.684 55.684 56.089 -0.405 19806 1748 1 4 . 1 1 9 9 ASP N N 9 120.595 120.595 120.142 0.453 19806 1749 1 4 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.673 -0.026 19806 1750 1 4 . 1 1 9 9 ASP CA C 9 54.115 54.115 54.488 -0.373 19806 1751 1 4 . 1 1 9 9 ASP CB C 9 41.328 41.328 43.082 -1.754 19806 1752 1 4 . 1 1 10 10 GLY N N 10 106.984 106.984 111.075 -4.091 19806 1753 1 4 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.169 0.326 19806 1754 1 4 . 1 1 11 11 GLU N N 11 120.879 120.879 120.235 0.644 19806 1755 1 4 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.288 -0.099 19806 1756 1 4 . 1 1 11 11 GLU CA C 11 56.510 56.510 57.005 -0.495 19806 1757 1 4 . 1 1 11 11 GLU CB C 11 33.069 33.069 30.745 2.324 19806 1758 1 4 . 1 1 12 12 ASP N N 12 126.686 126.686 121.149 5.537 19806 1759 1 4 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.428 0.322 19806 1760 1 4 . 1 1 12 12 ASP CA C 12 54.347 54.347 54.251 0.096 19806 1761 1 4 . 1 1 12 12 ASP CB C 12 42.771 42.771 41.980 0.791 19806 1762 1 4 . 1 1 13 13 PHE N N 13 128.055 128.055 123.271 4.784 19806 1763 1 4 . 1 1 13 13 PHE HA H 13 3.412 3.412 4.149 -0.737 19806 1764 1 4 . 1 1 13 13 PHE CA C 13 62.551 62.551 61.495 1.056 19806 1765 1 4 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.960 -0.127 19806 1766 1 4 . 1 1 14 14 LYS N N 14 117.498 117.498 119.008 -1.510 19806 1767 1 4 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.969 -0.388 19806 1768 1 4 . 1 1 14 14 LYS CA C 14 59.461 59.461 57.848 1.613 19806 1769 1 4 . 1 1 14 14 LYS CB C 14 31.344 31.344 32.035 -0.691 19806 1770 1 4 . 1 1 15 15 SER N N 15 113.775 113.775 116.313 -2.538 19806 1771 1 4 . 1 1 15 15 SER HA H 15 4.167 4.167 4.118 0.049 19806 1772 1 4 . 1 1 15 15 SER CA C 15 61.099 61.099 61.982 -0.883 19806 1773 1 4 . 1 1 15 15 SER CB C 15 62.428 62.428 63.018 -0.590 19806 1774 1 4 . 1 1 16 16 PHE N N 16 122.292 122.292 119.301 2.991 19806 1775 1 4 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.299 -0.009 19806 1776 1 4 . 1 1 16 16 PHE CA C 16 59.773 59.773 60.295 -0.522 19806 1777 1 4 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.307 -1.132 19806 1778 1 4 . 1 1 17 17 LEU N N 17 122.472 122.472 120.581 1.891 19806 1779 1 4 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.529 -0.679 19806 1780 1 4 . 1 1 17 17 LEU CA C 17 56.619 56.619 56.804 -0.185 19806 1781 1 4 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.394 0.068 19806 1782 1 4 . 1 1 18 18 ASP N N 18 117.331 117.331 121.399 -4.068 19806 1783 1 4 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.292 -0.177 19806 1784 1 4 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.326 -0.931 19806 1785 1 4 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.712 -0.359 19806 1786 1 4 . 1 1 19 19 LYS N N 19 120.032 120.032 117.745 2.287 19806 1787 1 4 . 1 1 19 19 LYS HA H 19 3.677 3.677 4.124 -0.447 19806 1788 1 4 . 1 1 19 19 LYS CA C 19 59.067 59.067 58.454 0.613 19806 1789 1 4 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.683 -0.747 19806 1790 1 4 . 1 1 20 20 PHE N N 20 119.607 119.607 118.221 1.386 19806 1791 1 4 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.464 -0.355 19806 1792 1 4 . 1 1 20 20 PHE CA C 20 62.090 62.090 60.473 1.617 19806 1793 1 4 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.467 1.002 19806 1794 1 4 . 1 1 21 21 THR N N 21 101.473 101.473 110.764 -9.291 19806 1795 1 4 . 1 1 21 21 THR HA H 21 4.259 4.259 3.879 0.380 19806 1796 1 4 . 1 1 21 21 THR CA C 21 61.774 61.774 63.854 -2.080 19806 1797 1 4 . 1 1 22 22 SER N N 22 111.453 111.453 115.281 -3.828 19806 1798 1 4 . 1 1 22 22 SER HA H 22 4.165 4.165 4.530 -0.365 19806 1799 1 4 . 1 1 22 22 SER CA C 22 58.215 58.215 57.439 0.776 19806 1800 1 4 . 1 1 22 22 SER CB C 22 64.570 64.570 63.359 1.211 19806 1801 1 4 . 1 1 23 23 SER N N 23 114.184 114.184 117.504 -3.320 19806 1802 1 4 . 1 1 23 23 SER HA H 23 4.764 4.764 4.826 -0.062 19806 1803 1 4 . 1 1 23 23 SER CA C 23 55.669 55.669 58.681 -3.012 19806 1804 1 4 . 1 1 23 23 SER CB C 23 64.011 64.011 64.820 -0.809 19806 1805 1 4 . 1 1 24 24 ALA N N 24 133.370 133.370 129.519 3.851 19806 1806 1 4 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.060 -0.104 19806 1807 1 4 . 1 1 24 24 ALA CA C 24 55.106 55.106 55.845 -0.739 19806 1808 1 4 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.273 0.561 19806 1809 1 4 . 1 1 25 25 ALA N N 25 117.430 117.430 118.545 -1.115 19806 1810 1 4 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.615 -0.298 19806 1811 1 4 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.507 0.694 19806 1812 1 4 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.269 0.080 19806 1813 1 4 . 1 1 26 26 PHE N N 26 116.042 116.042 118.842 -2.800 19806 1814 1 4 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.561 -0.251 19806 1815 1 4 . 1 1 26 26 PHE CA C 26 60.759 60.759 58.828 1.931 19806 1816 1 4 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.885 -0.574 19806 1817 1 4 . 1 1 27 27 GLN N N 27 121.820 121.820 120.656 1.164 19806 1818 1 4 . 1 1 27 27 GLN HA H 27 3.391 3.391 3.925 -0.534 19806 1819 1 4 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.968 0.127 19806 1820 1 4 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.730 -1.272 19806 1821 1 4 . 1 1 28 28 TYR N N 28 111.517 111.517 115.389 -3.872 19806 1822 1 4 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.828 0.302 19806 1823 1 4 . 1 1 28 28 TYR CA C 28 62.357 62.357 59.925 2.432 19806 1824 1 4 . 1 1 28 28 TYR CB C 28 38.568 38.568 38.102 0.466 19806 1825 1 4 . 1 1 29 29 THR N N 29 106.324 106.324 110.956 -4.632 19806 1826 1 4 . 1 1 29 29 THR HA H 29 4.489 4.489 4.239 0.250 19806 1827 1 4 . 1 1 29 29 THR CA C 29 63.765 63.765 62.782 0.983 19806 1828 1 4 . 1 1 29 29 THR CB C 29 69.568 69.568 68.784 0.784 19806 1829 1 4 . 1 1 30 30 ARG N N 30 117.696 117.696 119.993 -2.297 19806 1830 1 4 . 1 1 30 30 ARG HA H 30 4.701 4.701 4.162 0.539 19806 1831 1 4 . 1 1 30 30 ARG CA C 30 52.760 52.760 54.988 -2.228 19806 1832 1 4 . 1 1 30 30 ARG CB C 30 35.047 35.047 30.678 4.369 19806 1833 1 4 . 1 1 31 31 VAL N N 31 119.395 119.395 117.994 1.401 19806 1834 1 4 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.733 -0.503 19806 1835 1 4 . 1 1 31 31 VAL CA C 31 61.191 61.191 59.910 1.281 19806 1836 1 4 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.561 -2.388 19806 1837 1 4 . 1 1 32 32 LYS N N 32 126.124 126.124 124.418 1.706 19806 1838 1 4 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.597 -0.413 19806 1839 1 4 . 1 1 32 32 LYS CA C 32 53.958 53.958 54.459 -0.501 19806 1840 1 4 . 1 1 32 32 LYS CB C 32 31.112 31.112 34.295 -3.183 19806 1841 1 4 . 1 1 33 33 PHE N N 33 119.303 119.303 118.012 1.291 19806 1842 1 4 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.842 -0.328 19806 1843 1 4 . 1 1 33 33 PHE CA C 33 56.272 56.272 56.089 0.183 19806 1844 1 4 . 1 1 33 33 PHE CB C 33 40.378 40.378 39.760 0.619 19806 1845 1 4 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.776 0.192 19806 1846 1 4 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.887 -1.254 19806 1847 1 4 . 1 1 34 34 PRO CB C 34 33.732 33.732 33.203 0.528 19806 1848 1 4 . 1 1 35 35 LEU N N 35 120.016 120.016 119.179 0.837 19806 1849 1 4 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.431 -0.209 19806 1850 1 4 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.457 1.383 19806 1851 1 4 . 1 1 35 35 LEU CB C 35 41.244 41.244 44.437 -3.193 19806 1852 1 4 . 1 1 36 36 LYS N N 36 117.066 117.066 119.184 -2.118 19806 1853 1 4 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.140 -0.165 19806 1854 1 4 . 1 1 36 36 LYS CA C 36 60.247 60.247 58.096 2.151 19806 1855 1 4 . 1 1 36 36 LYS CB C 36 32.832 32.832 32.780 0.052 19806 1856 1 4 . 1 1 37 37 THR N N 37 117.574 117.574 116.627 0.947 19806 1857 1 4 . 1 1 37 37 THR HA H 37 4.797 4.797 4.916 -0.119 19806 1858 1 4 . 1 1 37 37 THR CA C 37 60.396 60.396 58.523 1.873 19806 1859 1 4 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.831 0.188 19806 1860 1 4 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.482 -0.559 19806 1861 1 4 . 1 1 38 38 PRO CB C 38 32.631 32.631 33.189 -0.558 19806 1862 1 4 . 1 1 39 39 ILE N N 39 119.949 119.949 116.847 3.102 19806 1863 1 4 . 1 1 39 39 ILE HA H 39 4.239 4.239 3.880 0.359 19806 1864 1 4 . 1 1 39 39 ILE CA C 39 62.133 62.133 63.630 -1.497 19806 1865 1 4 . 1 1 40 40 THR N N 40 123.962 123.962 110.839 13.123 19806 1866 1 4 . 1 1 40 40 THR HA H 40 5.057 5.057 3.959 1.098 19806 1867 1 4 . 1 1 40 40 THR CA C 40 62.262 62.262 62.776 -0.513 19806 1868 1 4 . 1 1 40 40 THR CB C 40 69.891 69.891 67.127 2.764 19806 1869 1 4 . 1 1 41 41 LEU N N 41 125.633 125.633 118.380 7.253 19806 1870 1 4 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.841 0.261 19806 1871 1 4 . 1 1 41 41 LEU CA C 41 52.638 52.638 52.302 0.336 19806 1872 1 4 . 1 1 41 41 LEU CB C 41 45.180 45.180 43.325 1.855 19806 1873 1 4 . 1 1 42 42 LEU N N 42 120.788 120.788 122.483 -1.695 19806 1874 1 4 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.523 0.225 19806 1875 1 4 . 1 1 42 42 LEU CA C 42 53.724 53.724 53.497 0.227 19806 1876 1 4 . 1 1 42 42 LEU CB C 42 44.384 44.384 41.080 3.304 19806 1877 1 4 . 1 1 43 43 ALA N N 43 123.073 123.073 130.222 -7.149 19806 1878 1 4 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.126 0.304 19806 1879 1 4 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.594 -1.306 19806 1880 1 4 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.272 0.742 19806 1881 1 4 . 1 1 44 44 ASP N N 44 118.196 118.196 119.479 -1.283 19806 1882 1 4 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.372 0.054 19806 1883 1 4 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.876 -0.848 19806 1884 1 4 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.586 -0.376 19806 1885 1 4 . 1 1 45 45 ASP N N 45 115.018 115.018 118.659 -3.641 19806 1886 1 4 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.560 -0.091 19806 1887 1 4 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.617 -0.823 19806 1888 1 4 . 1 1 45 45 ASP CB C 45 39.864 39.864 40.599 -0.735 19806 1889 1 4 . 1 1 46 46 GLY N N 46 107.499 107.499 107.621 -0.122 19806 1890 1 4 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.584 0.330 19806 1891 1 4 . 1 1 47 47 GLU N N 47 117.331 117.331 118.515 -1.184 19806 1892 1 4 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.600 -0.069 19806 1893 1 4 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.151 0.787 19806 1894 1 4 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.993 2.140 19806 1895 1 4 . 1 1 48 48 THR N N 48 118.462 118.462 117.579 0.883 19806 1896 1 4 . 1 1 48 48 THR HA H 48 4.243 4.243 4.578 -0.335 19806 1897 1 4 . 1 1 48 48 THR CA C 48 62.834 62.834 61.798 1.036 19806 1898 1 4 . 1 1 48 48 THR CB C 48 68.649 68.649 69.704 -1.055 19806 1899 1 4 . 1 1 49 49 GLU N N 49 123.834 123.834 128.056 -4.222 19806 1900 1 4 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.108 0.837 19806 1901 1 4 . 1 1 49 49 GLU CA C 49 55.358 55.358 58.099 -2.741 19806 1902 1 4 . 1 1 49 49 GLU CB C 49 31.395 31.395 29.797 1.598 19806 1903 1 4 . 1 1 50 50 LYS N N 50 122.868 122.868 127.753 -4.885 19806 1904 1 4 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.771 -0.130 19806 1905 1 4 . 1 1 50 50 LYS CA C 50 54.111 54.111 54.782 -0.671 19806 1906 1 4 . 1 1 50 50 LYS CB C 50 35.312 35.312 35.188 0.124 19806 1907 1 4 . 1 1 51 51 THR N N 51 111.386 111.386 115.816 -4.430 19806 1908 1 4 . 1 1 51 51 THR HA H 51 5.619 5.619 4.362 1.257 19806 1909 1 4 . 1 1 51 51 THR CA C 51 58.980 58.980 62.708 -3.728 19806 1910 1 4 . 1 1 51 51 THR CB C 51 71.277 71.277 69.412 1.865 19806 1911 1 4 . 1 1 52 52 PHE N N 52 120.631 120.631 121.537 -0.906 19806 1912 1 4 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.841 0.122 19806 1913 1 4 . 1 1 52 52 PHE CA C 52 54.129 54.129 54.728 -0.599 19806 1914 1 4 . 1 1 52 52 PHE CB C 52 41.049 41.049 40.943 0.106 19806 1915 1 4 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.412 0.036 19806 1916 1 4 . 1 1 53 53 PRO CA C 53 62.489 62.489 63.059 -0.570 19806 1917 1 4 . 1 1 53 53 PRO CB C 53 32.240 32.240 31.866 0.374 19806 1918 1 4 . 1 1 54 54 PHE N N 54 128.034 128.034 125.707 2.327 19806 1919 1 4 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.618 0.210 19806 1920 1 4 . 1 1 54 54 PHE CA C 54 55.509 55.509 57.749 -2.240 19806 1921 1 4 . 1 1 54 54 PHE CB C 54 37.028 37.028 40.562 -3.534 19806 1922 1 4 . 1 1 55 55 THR N N 55 111.757 111.757 117.776 -6.019 19806 1923 1 4 . 1 1 55 55 THR HA H 55 4.413 4.413 4.186 0.227 19806 1924 1 4 . 1 1 55 55 THR CA C 55 60.578 60.578 59.961 0.617 19806 1925 1 4 . 1 1 55 55 THR CB C 55 69.447 69.447 71.740 -2.293 19806 1926 1 4 . 1 1 56 56 LYS N N 56 118.734 118.734 119.450 -0.716 19806 1927 1 4 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.348 -1.866 19806 1928 1 4 . 1 1 56 56 LYS CA C 56 59.381 59.381 58.841 0.540 19806 1929 1 4 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.031 1.219 19806 1930 1 4 . 1 1 57 57 GLU N N 57 119.675 119.675 118.024 1.651 19806 1931 1 4 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.137 0.132 19806 1932 1 4 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.528 -1.376 19806 1933 1 4 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.488 -2.538 19806 1934 1 4 . 1 1 58 58 LYS N N 58 114.700 114.700 118.118 -3.418 19806 1935 1 4 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.418 -0.106 19806 1936 1 4 . 1 1 58 58 LYS CA C 58 55.595 55.595 55.323 0.272 19806 1937 1 4 . 1 1 58 58 LYS CB C 58 32.011 32.011 30.270 1.741 19806 1938 1 4 . 1 1 59 59 TRP N N 59 118.204 118.204 124.298 -6.094 19806 1939 1 4 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.350 -0.251 19806 1940 1 4 . 1 1 59 59 TRP CA C 59 55.577 55.577 55.090 0.487 19806 1941 1 4 . 1 1 59 59 TRP CB C 59 32.037 32.037 31.152 0.885 19806 1942 1 4 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.504 -0.241 19806 1943 1 4 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.721 -3.000 19806 1944 1 4 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.008 -2.159 19806 1945 1 4 . 1 1 61 61 LEU N N 61 123.758 123.758 123.680 0.078 19806 1946 1 4 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.157 -0.518 19806 1947 1 4 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.608 0.268 19806 1948 1 4 . 1 1 61 61 LEU CB C 61 40.815 40.815 42.231 -1.417 19806 1949 1 4 . 1 1 62 62 LEU N N 62 124.052 124.052 124.575 -0.523 19806 1950 1 4 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.399 -0.044 19806 1951 1 4 . 1 1 62 62 LEU CA C 62 53.992 53.992 53.380 0.612 19806 1952 1 4 . 1 1 62 62 LEU CB C 62 44.686 44.686 45.268 -0.582 19806 1953 1 4 . 1 1 63 63 ASP N N 63 117.271 117.271 121.398 -4.127 19806 1954 1 4 . 1 1 63 63 ASP HA H 63 5.033 5.033 4.916 0.117 19806 1955 1 4 . 1 1 63 63 ASP CA C 63 51.101 51.101 53.340 -2.239 19806 1956 1 4 . 1 1 63 63 ASP CB C 63 43.345 43.345 42.251 1.094 19806 1957 1 4 . 1 1 64 64 SER N N 64 112.856 112.856 115.496 -2.640 19806 1958 1 4 . 1 1 64 64 SER HA H 64 3.865 3.865 4.155 -0.290 19806 1959 1 4 . 1 1 64 64 SER CA C 64 60.910 60.910 61.118 -0.208 19806 1960 1 4 . 1 1 64 64 SER CB C 64 62.378 62.378 63.312 -0.934 19806 1961 1 4 . 1 1 65 65 GLU N N 65 120.070 120.070 120.017 0.053 19806 1962 1 4 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.162 -0.144 19806 1963 1 4 . 1 1 65 65 GLU CA C 65 58.343 58.343 59.100 -0.757 19806 1964 1 4 . 1 1 65 65 GLU CB C 65 28.887 28.887 28.996 -0.109 19806 1965 1 4 . 1 1 66 66 THR N N 66 115.852 115.852 112.787 3.065 19806 1966 1 4 . 1 1 66 66 THR HA H 66 3.991 3.991 4.304 -0.313 19806 1967 1 4 . 1 1 66 66 THR CA C 66 65.804 65.804 64.386 1.418 19806 1968 1 4 . 1 1 66 66 THR CB C 66 68.451 68.451 68.861 -0.409 19806 1969 1 4 . 1 1 67 67 MET N N 67 113.585 113.585 122.656 -9.071 19806 1970 1 4 . 1 1 67 67 MET HA H 67 4.267 4.267 4.267 -0.000 19806 1971 1 4 . 1 1 67 67 MET CA C 67 52.135 52.135 54.033 -1.898 19806 1972 1 4 . 1 1 67 67 MET CB C 67 28.963 28.963 31.351 -2.388 19806 1973 1 4 . 1 1 68 68 LYS N N 68 118.462 118.462 121.027 -2.565 19806 1974 1 4 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.556 -0.186 19806 1975 1 4 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.418 0.064 19806 1976 1 4 . 1 1 68 68 LYS CB C 68 34.179 34.179 34.767 -0.588 19806 1977 1 4 . 1 1 69 69 GLU N N 69 121.700 121.700 123.160 -1.460 19806 1978 1 4 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.744 -0.220 19806 1979 1 4 . 1 1 69 69 GLU CA C 69 55.942 55.942 56.568 -0.626 19806 1980 1 4 . 1 1 69 69 GLU CB C 69 30.424 30.424 30.608 -0.184 19806 1981 1 4 . 1 1 70 70 GLU N N 70 123.445 123.445 121.807 1.638 19806 1982 1 4 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.613 0.084 19806 1983 1 4 . 1 1 70 70 GLU CA C 70 55.473 55.473 55.483 -0.009 19806 1984 1 4 . 1 1 70 70 GLU CB C 70 33.162 33.162 32.174 0.988 19806 1985 1 4 . 1 1 71 71 ARG N N 71 122.150 122.150 121.445 0.705 19806 1986 1 4 . 1 1 71 71 ARG HA H 71 5.151 5.151 5.001 0.150 19806 1987 1 4 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.725 -0.277 19806 1988 1 4 . 1 1 71 71 ARG CB C 71 31.703 31.703 31.354 0.349 19806 1989 1 4 . 1 1 72 72 ILE N N 72 125.686 125.686 128.591 -2.905 19806 1990 1 4 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.258 0.338 19806 1991 1 4 . 1 1 72 72 ILE CA C 72 59.512 59.512 60.725 -1.213 19806 1992 1 4 . 1 1 72 72 ILE CB C 72 41.095 41.095 38.274 2.821 19806 1993 1 4 . 1 1 73 73 THR N N 73 121.600 121.600 123.198 -1.598 19806 1994 1 4 . 1 1 73 73 THR HA H 73 4.603 4.603 4.338 0.265 19806 1995 1 4 . 1 1 73 73 THR CA C 73 61.937 61.937 62.756 -0.819 19806 1996 1 4 . 1 1 73 73 THR CB C 73 68.669 68.669 69.515 -0.846 19806 1997 1 4 . 1 1 74 74 GLN N N 74 124.607 124.607 125.828 -1.221 19806 1998 1 4 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.686 -0.105 19806 1999 1 4 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.999 -0.310 19806 2000 1 4 . 1 1 74 74 GLN CB C 74 29.490 29.490 31.389 -1.899 19806 2001 1 4 . 1 1 75 75 GLU N N 75 122.962 122.962 119.876 3.086 19806 2002 1 4 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.299 -0.240 19806 2003 1 4 . 1 1 75 75 GLU CA C 75 58.845 58.845 57.057 1.788 19806 2004 1 4 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.118 -0.545 19806 2005 1 4 . 1 1 76 76 GLU N N 76 115.466 115.466 120.163 -4.697 19806 2006 1 4 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.414 -0.106 19806 2007 1 4 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.430 0.347 19806 2008 1 4 . 1 1 76 76 GLU CB C 76 29.072 29.072 30.415 -1.343 19806 2009 1 4 . 1 1 77 77 GLY N N 77 106.771 106.771 107.288 -0.517 19806 2010 1 4 . 1 1 77 77 GLY CA C 77 45.014 45.014 45.917 -0.903 19806 2011 1 4 . 1 1 78 78 GLY N N 78 108.535 108.535 107.424 1.111 19806 2012 1 4 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.834 -0.127 19806 2013 1 4 . 1 1 79 79 ILE N N 79 121.066 121.066 120.681 0.385 19806 2014 1 4 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.850 -0.043 19806 2015 1 4 . 1 1 79 79 ILE CA C 79 60.343 60.343 60.625 -0.282 19806 2016 1 4 . 1 1 79 79 ILE CB C 79 39.220 39.220 39.660 -0.440 19806 2017 1 4 . 1 1 80 80 TYR N N 80 130.709 130.709 129.670 1.039 19806 2018 1 4 . 1 1 80 80 TYR HA H 80 4.264 4.264 3.943 0.321 19806 2019 1 4 . 1 1 80 80 TYR CA C 80 58.161 58.161 59.075 -0.914 19806 2020 1 4 . 1 1 80 80 TYR CB C 80 40.621 40.621 39.264 1.357 19806 2021 1 4 . 1 1 81 81 VAL N N 81 126.965 126.965 127.615 -0.650 19806 2022 1 4 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.166 0.688 19806 2023 1 4 . 1 1 81 81 VAL CA C 81 60.457 60.457 61.622 -1.165 19806 2024 1 4 . 1 1 81 81 VAL CB C 81 35.004 35.004 33.998 1.006 19806 2025 1 4 . 1 1 82 82 SER N N 82 120.914 120.914 122.760 -1.846 19806 2026 1 4 . 1 1 82 82 SER HA H 82 5.185 5.185 5.005 0.180 19806 2027 1 4 . 1 1 82 82 SER CA C 82 55.260 55.260 56.878 -1.618 19806 2028 1 4 . 1 1 82 82 SER CB C 82 64.785 64.785 63.445 1.340 19806 2029 1 4 . 1 1 83 83 LYS N N 83 119.415 119.415 122.322 -2.907 19806 2030 1 4 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.898 -0.120 19806 2031 1 4 . 1 1 83 83 LYS CA C 83 54.759 54.759 55.060 -0.301 19806 2032 1 4 . 1 1 83 83 LYS CB C 83 35.514 35.514 35.947 -0.433 19806 2033 1 4 . 1 1 84 84 PHE N N 84 119.220 119.220 117.592 1.628 19806 2034 1 4 . 1 1 84 84 PHE HA H 84 5.441 5.441 5.474 -0.033 19806 2035 1 4 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.522 0.892 19806 2036 1 4 . 1 1 84 84 PHE CB C 84 37.523 37.523 39.182 -1.659 19806 2037 1 4 . 1 1 85 85 THR N N 85 119.257 119.257 113.943 5.314 19806 2038 1 4 . 1 1 85 85 THR HA H 85 4.057 4.057 4.225 -0.168 19806 2039 1 4 . 1 1 85 85 THR CA C 85 62.660 62.660 62.873 -0.213 19806 2040 1 4 . 1 1 85 85 THR CB C 85 67.698 67.698 69.407 -1.709 19806 2041 1 4 . 1 1 86 86 LEU N N 86 121.612 121.612 123.675 -2.063 19806 2042 1 4 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.615 -0.017 19806 2043 1 4 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.645 0.600 19806 2044 1 4 . 1 1 86 86 LEU CB C 86 44.657 44.657 44.164 0.493 19806 2045 1 4 . 1 1 87 87 ASN N N 87 127.684 127.684 122.402 5.282 19806 2046 1 4 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.733 0.278 19806 2047 1 4 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.784 -1.485 19806 2048 1 4 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.750 -0.155 19806 2049 1 4 . 1 1 88 88 GLU N N 88 120.509 120.509 122.558 -2.049 19806 2050 1 4 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.814 0.043 19806 2051 1 4 . 1 1 88 88 GLU CA C 88 54.382 54.382 53.963 0.419 19806 2052 1 4 . 1 1 88 88 GLU CB C 88 29.808 29.808 30.749 -0.941 19806 2053 1 4 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.253 0.128 19806 2054 1 4 . 1 1 89 89 PRO CA C 89 65.898 65.898 64.787 1.111 19806 2055 1 4 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.482 -0.131 19806 2056 1 4 . 1 1 90 90 LYS N N 90 107.288 107.288 116.875 -9.587 19806 2057 1 4 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.651 0.033 19806 2058 1 4 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.740 -0.761 19806 2059 1 4 . 1 1 90 90 LYS CB C 90 32.994 32.994 32.708 0.286 19806 2060 1 4 . 1 1 91 91 HIS N N 91 119.523 119.523 116.588 2.935 19806 2061 1 4 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.426 0.351 19806 2062 1 4 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.594 -0.889 19806 2063 1 4 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.909 -0.715 19806 2064 1 4 . 1 1 92 92 LYS N N 92 122.527 122.527 122.291 0.236 19806 2065 1 4 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.720 0.409 19806 2066 1 4 . 1 1 92 92 LYS CA C 92 54.291 54.291 55.089 -0.798 19806 2067 1 4 . 1 1 92 92 LYS CB C 92 37.479 37.479 36.413 1.066 19806 2068 1 4 . 1 1 93 93 ILE N N 93 121.564 121.564 120.012 1.552 19806 2069 1 4 . 1 1 93 93 ILE HA H 93 5.310 5.310 5.057 0.253 19806 2070 1 4 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.610 0.527 19806 2071 1 4 . 1 1 93 93 ILE CB C 93 41.088 41.088 42.376 -1.288 19806 2072 1 4 . 1 1 94 94 PHE N N 94 128.955 128.955 127.856 1.099 19806 2073 1 4 . 1 1 94 94 PHE HA H 94 4.900 4.900 5.312 -0.412 19806 2074 1 4 . 1 1 94 94 PHE CA C 94 55.843 55.843 56.003 -0.160 19806 2075 1 4 . 1 1 95 95 GLU N N 95 124.809 124.809 125.692 -0.883 19806 2076 1 4 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.050 0.368 19806 2077 1 4 . 1 1 95 95 GLU CA C 95 54.481 54.481 54.151 0.330 19806 2078 1 4 . 1 1 95 95 GLU CB C 95 35.160 35.160 34.535 0.625 19806 2079 1 4 . 1 1 96 96 ALA N N 96 123.759 123.759 123.147 0.612 19806 2080 1 4 . 1 1 96 96 ALA HA H 96 5.379 5.379 4.972 0.407 19806 2081 1 4 . 1 1 96 96 ALA CA C 96 49.541 49.541 49.999 -0.458 19806 2082 1 4 . 1 1 96 96 ALA CB C 96 23.830 23.830 22.361 1.469 19806 2083 1 4 . 1 1 97 97 GLY N N 97 106.592 106.592 108.046 -1.454 19806 2084 1 4 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.546 -0.111 19806 2085 1 4 . 1 1 98 98 TYR N N 98 119.250 119.250 119.264 -0.014 19806 2086 1 4 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.674 0.144 19806 2087 1 4 . 1 1 98 98 TYR CA C 98 59.387 59.387 58.675 0.712 19806 2088 1 4 . 1 1 98 98 TYR CB C 98 38.122 38.122 39.604 -1.482 19806 2089 1 4 . 1 1 99 99 GLU N N 99 123.080 123.080 120.865 2.215 19806 2090 1 4 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.044 -0.035 19806 2091 1 4 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.871 -0.462 19806 2092 1 4 . 1 1 99 99 GLU CB C 99 30.254 30.254 30.028 0.226 19806 2093 1 4 . 1 1 100 100 GLU N N 100 116.459 116.459 117.959 -1.500 19806 2094 1 4 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.574 -0.538 19806 2095 1 4 . 1 1 100 100 GLU CA C 100 57.404 57.404 55.933 1.471 19806 2096 1 4 . 1 1 100 100 GLU CB C 100 27.576 27.576 29.917 -2.341 19806 2097 1 4 . 1 1 101 101 SER N N 101 113.069 113.069 115.797 -2.728 19806 2098 1 4 . 1 1 101 101 SER HA H 101 4.839 4.839 4.601 0.238 19806 2099 1 4 . 1 1 101 101 SER CA C 101 56.024 56.024 57.035 -1.011 19806 2100 1 4 . 1 1 101 101 SER CB C 101 64.806 64.806 64.662 0.144 19806 2101 1 4 . 1 1 102 102 GLU N N 102 120.439 120.439 120.736 -0.297 19806 2102 1 4 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.408 -0.019 19806 2103 1 4 . 1 1 102 102 GLU CA C 102 55.804 55.804 56.069 -0.265 19806 2104 1 4 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.317 -0.332 19806 2105 1 4 . 1 1 103 103 VAL N N 103 118.899 118.899 113.594 5.305 19806 2106 1 4 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.441 -0.355 19806 2107 1 4 . 1 1 103 103 VAL CA C 103 62.699 62.699 60.410 2.289 19806 2108 1 4 . 1 1 103 103 VAL CB C 103 32.261 32.261 34.377 -2.116 19806 2109 1 4 . 1 1 104 104 ASP N N 104 120.965 120.965 119.471 1.494 19806 2110 1 4 . 1 1 104 104 ASP HA H 104 5.003 5.003 5.024 -0.021 19806 2111 1 4 . 1 1 104 104 ASP CA C 104 54.914 54.914 54.156 0.758 19806 2112 1 4 . 1 1 104 104 ASP CB C 104 42.791 42.791 44.261 -1.470 19806 2113 1 4 . 1 1 105 105 LEU N N 105 120.365 120.365 119.854 0.511 19806 2114 1 4 . 1 1 105 105 LEU HA H 105 5.295 5.295 5.141 0.154 19806 2115 1 4 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.540 -0.109 19806 2116 1 4 . 1 1 105 105 LEU CB C 105 46.001 46.001 45.964 0.037 19806 2117 1 4 . 1 1 106 106 ARG N N 106 126.289 126.289 125.126 1.163 19806 2118 1 4 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.240 0.585 19806 2119 1 4 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.392 0.279 19806 2120 1 4 . 1 1 106 106 ARG CB C 106 33.920 33.920 34.080 -0.160 19806 2121 1 4 . 1 1 107 107 VAL N N 107 126.145 126.145 121.865 4.280 19806 2122 1 4 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.508 0.171 19806 2123 1 4 . 1 1 107 107 VAL CA C 107 61.671 61.671 59.851 1.820 19806 2124 1 4 . 1 1 107 107 VAL CB C 107 35.350 35.350 35.783 -0.434 19806 2125 1 4 . 1 1 108 108 GLU N N 108 127.093 127.093 124.367 2.726 19806 2126 1 4 . 1 1 108 108 GLU HA H 108 5.267 5.267 5.237 0.030 19806 2127 1 4 . 1 1 108 108 GLU CA C 108 54.761 54.761 55.067 -0.306 19806 2128 1 4 . 1 1 108 108 GLU CB C 108 32.567 32.567 33.916 -1.349 19806 2129 1 4 . 1 1 109 109 PHE N N 109 124.592 124.592 121.786 2.806 19806 2130 1 4 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.209 0.819 19806 2131 1 4 . 1 1 109 109 PHE CA C 109 55.945 55.945 57.515 -1.570 19806 2132 1 4 . 1 1 109 109 PHE CB C 109 43.099 43.099 42.777 0.322 19806 2133 1 4 . 1 1 110 110 GLU N N 110 122.143 122.143 122.265 -0.122 19806 2134 1 4 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.001 0.192 19806 2135 1 4 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.503 0.940 19806 2136 1 4 . 1 1 110 110 GLU CB C 110 35.816 35.816 34.423 1.393 19806 2137 1 4 . 1 1 111 111 LEU N N 111 129.616 129.616 122.996 6.620 19806 2138 1 4 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.540 0.268 19806 2139 1 4 . 1 1 111 111 LEU CA C 111 53.470 53.470 53.578 -0.108 19806 2140 1 4 . 1 1 111 111 LEU CB C 111 40.400 40.400 41.511 -1.111 19806 2141 1 4 . 1 1 112 112 GLN N N 112 124.742 124.742 123.207 1.535 19806 2142 1 4 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.373 0.066 19806 2143 1 4 . 1 1 112 112 GLN CA C 112 55.802 55.802 53.824 1.978 19806 2144 1 4 . 1 1 112 112 GLN CB C 112 28.753 28.753 30.411 -1.658 19806 2145 1 4 . 1 1 113 113 ALA N N 113 121.195 121.195 124.788 -3.593 19806 2146 1 4 . 1 1 113 113 ALA HA H 113 4.048 4.048 4.002 0.046 19806 2147 1 4 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.061 0.457 19806 2148 1 4 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.518 -0.319 19806 2149 1 4 . 1 1 114 114 ASP N N 114 114.525 114.525 117.145 -2.620 19806 2150 1 4 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.478 -0.079 19806 2151 1 4 . 1 1 114 114 ASP CA C 114 52.908 52.908 55.373 -2.465 19806 2152 1 4 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.763 -1.705 19806 2153 1 4 . 1 1 115 115 GLY N N 115 107.526 107.526 106.363 1.163 19806 2154 1 4 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.139 0.645 19806 2155 1 4 . 1 1 116 116 LYS N N 116 118.818 118.818 120.673 -1.855 19806 2156 1 4 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.650 -0.200 19806 2157 1 4 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.683 -0.512 19806 2158 1 4 . 1 1 116 116 LYS CB C 116 35.039 35.039 33.673 1.366 19806 2159 1 4 . 1 1 117 117 TRP N N 117 118.939 118.939 122.597 -3.658 19806 2160 1 4 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.680 -0.724 19806 2161 1 4 . 1 1 118 118 TYR N N 118 112.644 112.644 121.017 -8.373 19806 2162 1 4 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.928 0.349 19806 2163 1 4 . 1 1 118 118 TYR CA C 118 56.219 56.219 57.076 -0.857 19806 2164 1 4 . 1 1 118 118 TYR CB C 118 43.282 43.282 42.263 1.019 19806 2165 1 4 . 1 1 119 119 VAL N N 119 119.842 119.842 121.648 -1.806 19806 2166 1 4 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.077 0.438 19806 2167 1 4 . 1 1 119 119 VAL CA C 119 62.442 62.442 62.941 -0.499 19806 2168 1 4 . 1 1 120 120 VAL N N 120 114.552 114.552 114.987 -0.435 19806 2169 1 4 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.370 0.367 19806 2170 1 4 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.605 -1.010 19806 2171 1 4 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.370 -0.518 19806 2172 1 4 . 1 1 121 121 ASP N N 121 118.234 118.234 118.808 -0.574 19806 2173 1 4 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.750 0.513 19806 2174 1 4 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.758 -0.095 19806 2175 1 4 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.498 -0.611 19806 2176 1 4 . 1 1 122 122 CYS N N 122 121.036 121.036 122.455 -1.419 19806 2177 1 4 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.628 0.943 19806 2178 1 4 . 1 1 122 122 CYS CA C 122 57.052 57.052 58.758 -1.706 19806 2179 1 4 . 1 1 122 122 CYS CB C 122 30.834 30.834 27.470 3.364 19806 2180 1 4 . 1 1 123 123 TYR N N 123 127.672 127.672 127.479 0.193 19806 2181 1 4 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.958 0.052 19806 2182 1 4 . 1 1 123 123 TYR CA C 123 57.169 57.169 57.172 -0.004 19806 2183 1 4 . 1 1 123 123 TYR CB C 123 41.408 41.408 42.801 -1.393 19806 2184 1 4 . 1 1 124 124 THR N N 124 120.833 120.833 118.463 2.370 19806 2185 1 4 . 1 1 124 124 THR HA H 124 4.987 4.987 4.790 0.197 19806 2186 1 4 . 1 1 124 124 THR CA C 124 57.153 57.153 60.357 -3.204 19806 2187 1 4 . 1 1 124 124 THR CB C 124 68.607 68.607 70.944 -2.337 19806 2188 1 4 . 1 1 125 125 GLY N N 125 114.347 114.347 111.978 2.369 19806 2189 1 4 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.651 -0.323 19806 2190 1 4 . 1 1 126 126 TRP N N 126 119.918 119.918 122.327 -2.409 19806 2191 1 4 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.086 -0.016 19806 2192 1 4 . 1 1 126 126 TRP CA C 126 60.564 60.564 59.067 1.497 19806 2193 1 4 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.460 0.179 19806 2194 1 4 . 1 1 127 127 TYR N N 127 113.911 113.911 115.513 -1.602 19806 2195 1 4 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.753 0.241 19806 2196 1 4 . 1 1 127 127 TYR CA C 127 53.384 53.384 56.971 -3.587 19806 2197 1 4 . 1 1 127 127 TYR CB C 127 38.584 38.584 37.322 1.262 19806 2198 1 4 . 1 1 128 128 GLY N N 128 105.181 105.181 108.744 -3.563 19806 2199 1 4 . 1 1 128 128 GLY CA C 128 45.189 45.189 43.394 1.795 19806 2200 1 4 . 1 1 129 129 TYR N N 129 116.588 116.588 121.633 -5.045 19806 2201 1 4 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.841 -0.177 19806 2202 1 4 . 1 1 129 129 TYR CA C 129 59.565 59.565 56.575 2.990 19806 2203 1 4 . 1 1 129 129 TYR CB C 129 38.853 38.853 36.000 2.853 19806 2204 1 4 . 1 1 130 130 ASP N N 130 115.195 115.195 120.336 -5.141 19806 2205 1 4 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.852 -0.467 19806 2206 1 4 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.647 -1.517 19806 2207 1 4 . 1 1 130 130 ASP CB C 130 38.685 38.685 42.868 -4.183 19806 2208 1 4 . 1 1 131 131 LEU N N 131 124.887 124.887 122.584 2.303 19806 2209 1 4 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.676 -0.195 19806 2210 1 4 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.958 0.647 19806 2211 1 4 . 1 1 131 131 LEU CB C 131 42.441 42.441 41.000 1.441 19806 2212 1 4 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.733 -0.050 19806 2213 1 4 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.817 65.248 19806 2214 1 4 . 1 1 132 132 PRO CB C 132 32.327 32.327 32.898 -0.571 19806 2215 1 4 . 1 1 133 133 ILE N N 133 123.765 123.765 121.465 2.300 19806 2216 1 4 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.523 0.206 19806 2217 1 4 . 1 1 133 133 ILE CA C 133 64.860 64.860 64.194 0.666 19806 2218 1 4 . 1 1 133 133 ILE CB C 133 38.063 38.063 37.995 0.068 19806 2219 1 4 . 1 1 134 134 GLY N N 134 107.030 107.030 106.275 0.755 19806 2220 1 4 . 1 1 134 134 GLY CA C 134 45.976 45.976 46.358 -0.382 19806 2221 1 4 . 1 1 135 135 GLU N N 135 116.566 116.566 119.657 -3.091 19806 2222 1 4 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.611 0.053 19806 2223 1 4 . 1 1 135 135 GLU CA C 135 55.414 55.414 55.603 -0.189 19806 2224 1 4 . 1 1 135 135 GLU CB C 135 30.195 30.195 29.793 0.402 19806 2225 1 4 . 1 1 136 136 LEU N N 136 124.239 124.239 123.103 1.136 19806 2226 1 4 . 1 1 136 136 LEU HA H 136 4.044 4.044 4.045 -0.001 19806 2227 1 4 . 1 1 136 136 LEU CA C 136 59.116 59.116 59.064 0.052 19806 2228 1 4 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.708 -0.701 19806 2229 1 4 . 1 1 137 137 LYS N N 137 117.225 117.225 116.754 0.471 19806 2230 1 4 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.878 -0.015 19806 2231 1 4 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.906 0.549 19806 2232 1 4 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.755 -0.552 19806 2233 1 4 . 1 1 138 138 GLN N N 138 118.718 118.718 118.335 0.383 19806 2234 1 4 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.082 -0.030 19806 2235 1 4 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.746 -0.871 19806 2236 1 4 . 1 1 138 138 GLN CB C 138 28.235 28.235 27.788 0.447 19806 2237 1 4 . 1 1 139 139 THR N N 139 117.970 117.970 116.611 1.359 19806 2238 1 4 . 1 1 139 139 THR HA H 139 4.532 4.532 3.987 0.545 19806 2239 1 4 . 1 1 139 139 THR CA C 139 68.145 68.145 66.692 1.453 19806 2240 1 4 . 1 1 139 139 THR CB C 139 68.103 68.103 68.446 -0.343 19806 2241 1 4 . 1 1 140 140 ILE N N 140 120.391 120.391 122.166 -1.775 19806 2242 1 4 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.883 -0.156 19806 2243 1 4 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.850 0.406 19806 2244 1 4 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.502 0.611 19806 2245 1 4 . 1 1 141 141 GLN N N 141 118.917 118.917 118.349 0.568 19806 2246 1 4 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.888 0.127 19806 2247 1 4 . 1 1 141 141 GLN CA C 141 58.371 58.371 59.126 -0.755 19806 2248 1 4 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.076 -0.729 19806 2249 1 4 . 1 1 142 142 ASN N N 142 119.936 119.936 117.651 2.285 19806 2250 1 4 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.660 -0.145 19806 2251 1 4 . 1 1 142 142 ASN CA C 142 55.799 55.799 56.116 -0.317 19806 2252 1 4 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.619 -0.989 19806 2253 1 4 . 1 1 143 143 VAL N N 143 123.195 123.195 119.035 4.160 19806 2254 1 4 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.230 -0.514 19806 2255 1 4 . 1 1 143 143 VAL CA C 143 66.497 66.497 65.462 1.035 19806 2256 1 4 . 1 1 143 143 VAL CB C 143 30.989 30.989 30.389 0.600 19806 2257 1 4 . 1 1 144 144 LYS N N 144 120.348 120.348 118.955 1.393 19806 2258 1 4 . 1 1 144 144 LYS HA H 144 3.881 3.881 4.032 -0.151 19806 2259 1 4 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.586 0.537 19806 2260 1 4 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.103 -0.221 19806 2261 1 4 . 1 1 145 145 GLU N N 145 119.220 119.220 120.361 -1.141 19806 2262 1 4 . 1 1 145 145 GLU HA H 145 4.183 4.183 3.969 0.214 19806 2263 1 4 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.590 -0.412 19806 2264 1 4 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.342 -0.271 19806 2265 1 4 . 1 1 146 146 GLU N N 146 121.420 121.420 118.920 2.500 19806 2266 1 4 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.108 0.169 19806 2267 1 4 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.187 -0.069 19806 2268 1 4 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.242 -0.900 19806 2269 1 4 . 1 1 147 147 ASN N N 147 119.197 119.197 117.748 1.449 19806 2270 1 4 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.646 -0.078 19806 2271 1 4 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.882 -1.731 19806 2272 1 4 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.990 -0.617 19806 2273 1 4 . 1 1 148 148 ALA N N 148 123.672 123.672 123.128 0.544 19806 2274 1 4 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.259 -0.136 19806 2275 1 4 . 1 1 148 148 ALA CA C 148 55.133 55.133 55.050 0.083 19806 2276 1 4 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.229 -0.622 19806 2277 1 4 . 1 1 149 149 ALA N N 149 119.979 119.979 122.543 -2.564 19806 2278 1 4 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.102 0.159 19806 2279 1 4 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.825 -0.180 19806 2280 1 4 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.584 -0.846 19806 2281 1 4 . 1 1 150 150 PHE N N 150 119.592 119.592 119.686 -0.094 19806 2282 1 4 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.159 0.065 19806 2283 1 4 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.800 -0.792 19806 2284 1 4 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.491 -0.429 19806 2285 1 4 . 1 1 151 151 LYS N N 151 116.869 116.869 120.245 -3.376 19806 2286 1 4 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.382 -0.476 19806 2287 1 4 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.406 0.364 19806 2288 1 4 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.334 0.408 19806 2289 1 4 . 1 1 152 152 GLU N N 152 115.868 115.868 120.166 -4.298 19806 2290 1 4 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.101 -0.048 19806 2291 1 4 . 1 1 152 152 GLU CA C 152 58.656 58.656 59.166 -0.510 19806 2292 1 4 . 1 1 152 152 GLU CB C 152 29.753 29.753 29.938 -0.185 19806 2293 1 4 . 1 1 153 153 ILE N N 153 110.437 110.437 117.208 -6.771 19806 2294 1 4 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.925 0.251 19806 2295 1 4 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.732 -1.698 19806 2296 1 4 . 1 1 153 153 ILE CB C 153 39.272 39.272 39.303 -0.031 19806 2297 1 4 . 1 1 154 154 HIS N N 154 117.779 117.779 117.561 0.218 19806 2298 1 4 . 1 1 154 154 HIS HA H 154 5.174 5.174 4.996 0.178 19806 2299 1 4 . 1 1 154 154 HIS CA C 154 51.616 51.616 53.144 -1.528 19806 2300 1 4 . 1 1 154 154 HIS CB C 154 28.547 28.547 30.627 -2.080 19806 2301 1 5 . 1 1 3 3 SER N N 3 114.847 114.847 113.510 1.337 19806 2302 1 5 . 1 1 3 3 SER HA H 3 4.463 4.463 4.611 -0.148 19806 2303 1 5 . 1 1 3 3 SER CA C 3 58.340 58.340 57.648 0.692 19806 2304 1 5 . 1 1 3 3 SER CB C 3 63.457 63.457 65.124 -1.667 19806 2305 1 5 . 1 1 4 4 GLU N N 4 121.498 121.498 120.066 1.432 19806 2306 1 5 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.518 -0.186 19806 2307 1 5 . 1 1 4 4 GLU CA C 4 56.443 56.443 56.067 0.376 19806 2308 1 5 . 1 1 4 4 GLU CB C 4 29.966 29.966 30.133 -0.167 19806 2309 1 5 . 1 1 5 5 LEU N N 5 121.589 121.589 122.992 -1.403 19806 2310 1 5 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.544 -0.107 19806 2311 1 5 . 1 1 5 5 LEU CA C 5 55.019 55.019 56.485 -1.466 19806 2312 1 5 . 1 1 5 5 LEU CB C 5 42.243 42.243 43.060 -0.817 19806 2313 1 5 . 1 1 6 6 THR N N 6 113.708 113.708 115.878 -2.170 19806 2314 1 5 . 1 1 6 6 THR HA H 6 4.470 4.470 4.861 -0.391 19806 2315 1 5 . 1 1 6 6 THR CA C 6 61.409 61.409 61.557 -0.148 19806 2316 1 5 . 1 1 6 6 THR CB C 6 69.544 69.544 69.767 -0.223 19806 2317 1 5 . 1 1 7 7 THR N N 7 114.945 114.945 115.964 -1.019 19806 2318 1 5 . 1 1 7 7 THR HA H 7 4.415 4.415 4.463 -0.048 19806 2319 1 5 . 1 1 7 7 THR CA C 7 61.435 61.435 61.708 -0.273 19806 2320 1 5 . 1 1 7 7 THR CB C 7 69.506 69.506 70.029 -0.523 19806 2321 1 5 . 1 1 8 8 GLN N N 8 121.368 121.368 121.975 -0.607 19806 2322 1 5 . 1 1 8 8 GLN CA C 8 55.684 55.684 55.692 -0.008 19806 2323 1 5 . 1 1 9 9 ASP N N 9 120.595 120.595 119.300 1.295 19806 2324 1 5 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.717 -0.070 19806 2325 1 5 . 1 1 9 9 ASP CA C 9 54.115 54.115 53.405 0.710 19806 2326 1 5 . 1 1 9 9 ASP CB C 9 41.328 41.328 42.247 -0.919 19806 2327 1 5 . 1 1 10 10 GLY N N 10 106.984 106.984 107.882 -0.898 19806 2328 1 5 . 1 1 10 10 GLY CA C 10 44.495 44.495 45.245 -0.750 19806 2329 1 5 . 1 1 11 11 GLU N N 11 120.879 120.879 120.001 0.878 19806 2330 1 5 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.351 -0.162 19806 2331 1 5 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.738 -0.228 19806 2332 1 5 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.655 1.414 19806 2333 1 5 . 1 1 12 12 ASP N N 12 126.686 126.686 123.009 3.677 19806 2334 1 5 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.604 0.146 19806 2335 1 5 . 1 1 12 12 ASP CA C 12 54.347 54.347 53.954 0.393 19806 2336 1 5 . 1 1 12 12 ASP CB C 12 42.771 42.771 41.618 1.153 19806 2337 1 5 . 1 1 13 13 PHE N N 13 128.055 128.055 120.966 7.089 19806 2338 1 5 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.798 -0.386 19806 2339 1 5 . 1 1 13 13 PHE CA C 13 62.551 62.551 60.152 2.399 19806 2340 1 5 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.476 0.357 19806 2341 1 5 . 1 1 14 14 LYS N N 14 117.498 117.498 118.582 -1.084 19806 2342 1 5 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.902 -0.321 19806 2343 1 5 . 1 1 14 14 LYS CA C 14 59.461 59.461 57.074 2.387 19806 2344 1 5 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.866 -0.522 19806 2345 1 5 . 1 1 15 15 SER N N 15 113.775 113.775 116.021 -2.246 19806 2346 1 5 . 1 1 15 15 SER HA H 15 4.167 4.167 4.022 0.145 19806 2347 1 5 . 1 1 15 15 SER CA C 15 61.099 61.099 61.355 -0.256 19806 2348 1 5 . 1 1 15 15 SER CB C 15 62.428 62.428 62.913 -0.485 19806 2349 1 5 . 1 1 16 16 PHE N N 16 122.292 122.292 119.257 3.035 19806 2350 1 5 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.428 -0.138 19806 2351 1 5 . 1 1 16 16 PHE CA C 16 59.773 59.773 59.997 -0.224 19806 2352 1 5 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.429 -1.254 19806 2353 1 5 . 1 1 17 17 LEU N N 17 122.472 122.472 121.601 0.871 19806 2354 1 5 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.148 -0.298 19806 2355 1 5 . 1 1 17 17 LEU CA C 17 56.619 56.619 56.608 0.011 19806 2356 1 5 . 1 1 17 17 LEU CB C 17 40.462 40.462 39.930 0.532 19806 2357 1 5 . 1 1 18 18 ASP N N 18 117.331 117.331 117.654 -0.323 19806 2358 1 5 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.233 -0.118 19806 2359 1 5 . 1 1 18 18 ASP CA C 18 56.395 56.395 56.818 -0.423 19806 2360 1 5 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.492 -0.139 19806 2361 1 5 . 1 1 19 19 LYS N N 19 120.032 120.032 116.543 3.489 19806 2362 1 5 . 1 1 19 19 LYS HA H 19 3.677 3.677 4.141 -0.464 19806 2363 1 5 . 1 1 19 19 LYS CA C 19 59.067 59.067 57.580 1.487 19806 2364 1 5 . 1 1 19 19 LYS CB C 19 31.936 31.936 33.073 -1.137 19806 2365 1 5 . 1 1 20 20 PHE N N 20 119.607 119.607 121.473 -1.866 19806 2366 1 5 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.278 -0.169 19806 2367 1 5 . 1 1 20 20 PHE CA C 20 62.090 62.090 61.354 0.736 19806 2368 1 5 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.415 1.054 19806 2369 1 5 . 1 1 21 21 THR N N 21 101.473 101.473 108.721 -7.248 19806 2370 1 5 . 1 1 21 21 THR HA H 21 4.259 4.259 4.242 0.017 19806 2371 1 5 . 1 1 21 21 THR CA C 21 61.774 61.774 62.644 -0.870 19806 2372 1 5 . 1 1 22 22 SER N N 22 111.453 111.453 117.152 -5.699 19806 2373 1 5 . 1 1 22 22 SER HA H 22 4.165 4.165 4.340 -0.175 19806 2374 1 5 . 1 1 22 22 SER CA C 22 58.215 58.215 57.070 1.145 19806 2375 1 5 . 1 1 22 22 SER CB C 22 64.570 64.570 63.882 0.688 19806 2376 1 5 . 1 1 23 23 SER N N 23 114.184 114.184 115.512 -1.328 19806 2377 1 5 . 1 1 23 23 SER HA H 23 4.764 4.764 4.763 0.001 19806 2378 1 5 . 1 1 23 23 SER CA C 23 55.669 55.669 58.007 -2.338 19806 2379 1 5 . 1 1 23 23 SER CB C 23 64.011 64.011 63.783 0.228 19806 2380 1 5 . 1 1 24 24 ALA N N 24 133.370 133.370 129.735 3.635 19806 2381 1 5 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.028 -0.072 19806 2382 1 5 . 1 1 24 24 ALA CA C 24 55.106 55.106 55.878 -0.772 19806 2383 1 5 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.146 0.688 19806 2384 1 5 . 1 1 25 25 ALA N N 25 117.430 117.430 119.998 -2.568 19806 2385 1 5 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.475 -0.158 19806 2386 1 5 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.473 0.728 19806 2387 1 5 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.526 -0.177 19806 2388 1 5 . 1 1 26 26 PHE N N 26 116.042 116.042 114.376 1.666 19806 2389 1 5 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.862 -0.552 19806 2390 1 5 . 1 1 26 26 PHE CA C 26 60.759 60.759 58.642 2.116 19806 2391 1 5 . 1 1 26 26 PHE CB C 26 39.310 39.310 40.212 -0.902 19806 2392 1 5 . 1 1 27 27 GLN N N 27 121.820 121.820 120.469 1.351 19806 2393 1 5 . 1 1 27 27 GLN HA H 27 3.391 3.391 3.865 -0.474 19806 2394 1 5 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.559 0.535 19806 2395 1 5 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.469 -1.012 19806 2396 1 5 . 1 1 28 28 TYR N N 28 111.517 111.517 117.089 -5.572 19806 2397 1 5 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.748 0.382 19806 2398 1 5 . 1 1 28 28 TYR CA C 28 62.357 62.357 60.210 2.147 19806 2399 1 5 . 1 1 28 28 TYR CB C 28 38.568 38.568 37.566 1.002 19806 2400 1 5 . 1 1 29 29 THR N N 29 106.324 106.324 106.737 -0.413 19806 2401 1 5 . 1 1 29 29 THR HA H 29 4.489 4.489 4.252 0.237 19806 2402 1 5 . 1 1 29 29 THR CA C 29 63.765 63.765 63.072 0.693 19806 2403 1 5 . 1 1 29 29 THR CB C 29 69.568 69.568 68.642 0.926 19806 2404 1 5 . 1 1 30 30 ARG N N 30 117.696 117.696 122.015 -4.319 19806 2405 1 5 . 1 1 30 30 ARG HA H 30 4.701 4.701 3.843 0.858 19806 2406 1 5 . 1 1 30 30 ARG CA C 30 52.760 52.760 55.077 -2.317 19806 2407 1 5 . 1 1 30 30 ARG CB C 30 35.047 35.047 31.077 3.970 19806 2408 1 5 . 1 1 31 31 VAL N N 31 119.395 119.395 118.549 0.846 19806 2409 1 5 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.703 -0.473 19806 2410 1 5 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.632 0.559 19806 2411 1 5 . 1 1 31 31 VAL CB C 31 32.173 32.173 35.382 -3.208 19806 2412 1 5 . 1 1 32 32 LYS N N 32 126.124 126.124 125.804 0.320 19806 2413 1 5 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.676 -0.492 19806 2414 1 5 . 1 1 32 32 LYS CA C 32 53.958 53.958 54.618 -0.660 19806 2415 1 5 . 1 1 32 32 LYS CB C 32 31.112 31.112 33.683 -2.571 19806 2416 1 5 . 1 1 33 33 PHE N N 33 119.303 119.303 118.882 0.421 19806 2417 1 5 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.897 -0.383 19806 2418 1 5 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.331 0.941 19806 2419 1 5 . 1 1 33 33 PHE CB C 33 40.378 40.378 40.173 0.205 19806 2420 1 5 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.720 0.248 19806 2421 1 5 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.881 -1.248 19806 2422 1 5 . 1 1 34 34 PRO CB C 34 33.732 33.732 33.041 0.690 19806 2423 1 5 . 1 1 35 35 LEU N N 35 120.016 120.016 119.538 0.478 19806 2424 1 5 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.566 -0.344 19806 2425 1 5 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.851 0.989 19806 2426 1 5 . 1 1 35 35 LEU CB C 35 41.244 41.244 43.623 -2.379 19806 2427 1 5 . 1 1 36 36 LYS N N 36 117.066 117.066 119.052 -1.986 19806 2428 1 5 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.350 -0.375 19806 2429 1 5 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.299 2.948 19806 2430 1 5 . 1 1 36 36 LYS CB C 36 32.832 32.832 32.800 0.032 19806 2431 1 5 . 1 1 37 37 THR N N 37 117.574 117.574 118.169 -0.595 19806 2432 1 5 . 1 1 37 37 THR HA H 37 4.797 4.797 4.747 0.050 19806 2433 1 5 . 1 1 37 37 THR CA C 37 60.396 60.396 60.184 0.212 19806 2434 1 5 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.871 0.148 19806 2435 1 5 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.336 -0.413 19806 2436 1 5 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.578 0.054 19806 2437 1 5 . 1 1 39 39 ILE N N 39 119.949 119.949 121.309 -1.360 19806 2438 1 5 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.201 0.038 19806 2439 1 5 . 1 1 39 39 ILE CA C 39 62.133 62.133 62.278 -0.145 19806 2440 1 5 . 1 1 40 40 THR N N 40 123.962 123.962 123.668 0.294 19806 2441 1 5 . 1 1 40 40 THR HA H 40 5.057 5.057 5.043 0.014 19806 2442 1 5 . 1 1 40 40 THR CA C 40 62.262 62.262 61.564 0.698 19806 2443 1 5 . 1 1 40 40 THR CB C 40 69.891 69.891 69.894 -0.003 19806 2444 1 5 . 1 1 41 41 LEU N N 41 125.633 125.633 125.433 0.200 19806 2445 1 5 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.685 0.417 19806 2446 1 5 . 1 1 41 41 LEU CA C 41 52.638 52.638 53.387 -0.749 19806 2447 1 5 . 1 1 41 41 LEU CB C 41 45.180 45.180 45.399 -0.219 19806 2448 1 5 . 1 1 42 42 LEU N N 42 120.788 120.788 123.213 -2.425 19806 2449 1 5 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.520 0.228 19806 2450 1 5 . 1 1 42 42 LEU CA C 42 53.724 53.724 54.203 -0.479 19806 2451 1 5 . 1 1 42 42 LEU CB C 42 44.384 44.384 41.652 2.732 19806 2452 1 5 . 1 1 43 43 ALA N N 43 123.073 123.073 129.022 -5.949 19806 2453 1 5 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.228 0.202 19806 2454 1 5 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.527 -1.239 19806 2455 1 5 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.632 0.382 19806 2456 1 5 . 1 1 44 44 ASP N N 44 118.196 118.196 118.835 -0.639 19806 2457 1 5 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.384 0.042 19806 2458 1 5 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.875 -0.847 19806 2459 1 5 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.670 -0.460 19806 2460 1 5 . 1 1 45 45 ASP N N 45 115.018 115.018 118.015 -2.997 19806 2461 1 5 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.506 -0.037 19806 2462 1 5 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.205 -0.411 19806 2463 1 5 . 1 1 45 45 ASP CB C 45 39.864 39.864 41.006 -1.142 19806 2464 1 5 . 1 1 46 46 GLY N N 46 107.499 107.499 108.029 -0.530 19806 2465 1 5 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.509 0.405 19806 2466 1 5 . 1 1 47 47 GLU N N 47 117.331 117.331 117.137 0.194 19806 2467 1 5 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.541 -0.010 19806 2468 1 5 . 1 1 47 47 GLU CA C 47 56.938 56.938 55.605 1.333 19806 2469 1 5 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.607 2.526 19806 2470 1 5 . 1 1 48 48 THR N N 48 118.462 118.462 118.629 -0.167 19806 2471 1 5 . 1 1 48 48 THR HA H 48 4.243 4.243 4.553 -0.310 19806 2472 1 5 . 1 1 48 48 THR CA C 48 62.834 62.834 61.845 0.989 19806 2473 1 5 . 1 1 48 48 THR CB C 48 68.649 68.649 70.146 -1.497 19806 2474 1 5 . 1 1 49 49 GLU N N 49 123.834 123.834 127.790 -3.956 19806 2475 1 5 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.408 0.537 19806 2476 1 5 . 1 1 49 49 GLU CA C 49 55.358 55.358 57.606 -2.248 19806 2477 1 5 . 1 1 49 49 GLU CB C 49 31.395 31.395 30.303 1.092 19806 2478 1 5 . 1 1 50 50 LYS N N 50 122.868 122.868 126.152 -3.284 19806 2479 1 5 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.673 -0.032 19806 2480 1 5 . 1 1 50 50 LYS CA C 50 54.111 54.111 54.738 -0.627 19806 2481 1 5 . 1 1 50 50 LYS CB C 50 35.312 35.312 35.718 -0.406 19806 2482 1 5 . 1 1 51 51 THR N N 51 111.386 111.386 114.308 -2.922 19806 2483 1 5 . 1 1 51 51 THR HA H 51 5.619 5.619 5.206 0.413 19806 2484 1 5 . 1 1 51 51 THR CA C 51 58.980 58.980 61.417 -2.437 19806 2485 1 5 . 1 1 51 51 THR CB C 51 71.277 71.277 69.644 1.633 19806 2486 1 5 . 1 1 52 52 PHE N N 52 120.631 120.631 118.809 1.822 19806 2487 1 5 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.831 0.132 19806 2488 1 5 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.474 -1.345 19806 2489 1 5 . 1 1 52 52 PHE CB C 52 41.049 41.049 41.542 -0.493 19806 2490 1 5 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.518 -0.070 19806 2491 1 5 . 1 1 53 53 PRO CA C 53 62.489 62.489 62.962 -0.473 19806 2492 1 5 . 1 1 53 53 PRO CB C 53 32.240 32.240 31.678 0.562 19806 2493 1 5 . 1 1 54 54 PHE N N 54 128.034 128.034 126.858 1.176 19806 2494 1 5 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.518 0.310 19806 2495 1 5 . 1 1 54 54 PHE CA C 54 55.509 55.509 57.802 -2.293 19806 2496 1 5 . 1 1 54 54 PHE CB C 54 37.028 37.028 39.909 -2.881 19806 2497 1 5 . 1 1 55 55 THR N N 55 111.757 111.757 118.096 -6.339 19806 2498 1 5 . 1 1 55 55 THR HA H 55 4.413 4.413 4.205 0.208 19806 2499 1 5 . 1 1 55 55 THR CA C 55 60.578 60.578 59.908 0.670 19806 2500 1 5 . 1 1 55 55 THR CB C 55 69.447 69.447 71.396 -1.949 19806 2501 1 5 . 1 1 56 56 LYS N N 56 118.734 118.734 119.813 -1.079 19806 2502 1 5 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.099 -1.617 19806 2503 1 5 . 1 1 56 56 LYS CA C 56 59.381 59.381 59.199 0.182 19806 2504 1 5 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.843 1.407 19806 2505 1 5 . 1 1 57 57 GLU N N 57 119.675 119.675 118.782 0.893 19806 2506 1 5 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.057 0.212 19806 2507 1 5 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.732 -1.580 19806 2508 1 5 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.154 -2.204 19806 2509 1 5 . 1 1 58 58 LYS N N 58 114.700 114.700 115.776 -1.076 19806 2510 1 5 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.480 -0.168 19806 2511 1 5 . 1 1 58 58 LYS CA C 58 55.595 55.595 54.921 0.674 19806 2512 1 5 . 1 1 58 58 LYS CB C 58 32.011 32.011 30.770 1.241 19806 2513 1 5 . 1 1 59 59 TRP N N 59 118.204 118.204 124.874 -6.670 19806 2514 1 5 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.329 -0.230 19806 2515 1 5 . 1 1 59 59 TRP CA C 59 55.577 55.577 54.952 0.625 19806 2516 1 5 . 1 1 59 59 TRP CB C 59 32.037 32.037 30.146 1.891 19806 2517 1 5 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.539 -0.276 19806 2518 1 5 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.772 -3.051 19806 2519 1 5 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.066 -2.217 19806 2520 1 5 . 1 1 61 61 LEU N N 61 123.758 123.758 124.915 -1.157 19806 2521 1 5 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.235 -0.596 19806 2522 1 5 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.390 0.485 19806 2523 1 5 . 1 1 61 61 LEU CB C 61 40.815 40.815 42.337 -1.522 19806 2524 1 5 . 1 1 62 62 LEU N N 62 124.052 124.052 125.123 -1.071 19806 2525 1 5 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.230 0.125 19806 2526 1 5 . 1 1 62 62 LEU CA C 62 53.992 53.992 54.462 -0.470 19806 2527 1 5 . 1 1 62 62 LEU CB C 62 44.686 44.686 42.285 2.401 19806 2528 1 5 . 1 1 63 63 ASP N N 63 117.271 117.271 120.549 -3.278 19806 2529 1 5 . 1 1 63 63 ASP HA H 63 5.033 5.033 4.786 0.247 19806 2530 1 5 . 1 1 63 63 ASP CA C 63 51.101 51.101 52.681 -1.579 19806 2531 1 5 . 1 1 63 63 ASP CB C 63 43.345 43.345 43.595 -0.250 19806 2532 1 5 . 1 1 64 64 SER N N 64 112.856 112.856 116.130 -3.274 19806 2533 1 5 . 1 1 64 64 SER HA H 64 3.865 3.865 4.201 -0.336 19806 2534 1 5 . 1 1 64 64 SER CA C 64 60.910 60.910 61.363 -0.453 19806 2535 1 5 . 1 1 64 64 SER CB C 64 62.378 62.378 63.321 -0.943 19806 2536 1 5 . 1 1 65 65 GLU N N 65 120.070 120.070 120.836 -0.766 19806 2537 1 5 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.244 -0.226 19806 2538 1 5 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.832 -0.489 19806 2539 1 5 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.373 -0.487 19806 2540 1 5 . 1 1 66 66 THR N N 66 115.852 115.852 112.633 3.219 19806 2541 1 5 . 1 1 66 66 THR HA H 66 3.991 3.991 4.293 -0.302 19806 2542 1 5 . 1 1 66 66 THR CA C 66 65.804 65.804 64.963 0.841 19806 2543 1 5 . 1 1 66 66 THR CB C 66 68.451 68.451 68.838 -0.387 19806 2544 1 5 . 1 1 67 67 MET N N 67 113.585 113.585 121.138 -7.553 19806 2545 1 5 . 1 1 67 67 MET HA H 67 4.267 4.267 4.573 -0.306 19806 2546 1 5 . 1 1 67 67 MET CA C 67 52.135 52.135 55.496 -3.361 19806 2547 1 5 . 1 1 67 67 MET CB C 67 28.963 28.963 30.843 -1.880 19806 2548 1 5 . 1 1 68 68 LYS N N 68 118.462 118.462 120.707 -2.245 19806 2549 1 5 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.550 -0.180 19806 2550 1 5 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.524 -0.042 19806 2551 1 5 . 1 1 68 68 LYS CB C 68 34.179 34.179 35.581 -1.402 19806 2552 1 5 . 1 1 69 69 GLU N N 69 121.700 121.700 123.089 -1.389 19806 2553 1 5 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.991 -0.467 19806 2554 1 5 . 1 1 69 69 GLU CA C 69 55.942 55.942 56.147 -0.205 19806 2555 1 5 . 1 1 69 69 GLU CB C 69 30.424 30.424 30.613 -0.189 19806 2556 1 5 . 1 1 70 70 GLU N N 70 123.445 123.445 125.968 -2.523 19806 2557 1 5 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.666 0.031 19806 2558 1 5 . 1 1 70 70 GLU CA C 70 55.473 55.473 55.007 0.466 19806 2559 1 5 . 1 1 70 70 GLU CB C 70 33.162 33.162 32.824 0.338 19806 2560 1 5 . 1 1 71 71 ARG N N 71 122.150 122.150 121.817 0.333 19806 2561 1 5 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.840 0.311 19806 2562 1 5 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.682 -0.234 19806 2563 1 5 . 1 1 71 71 ARG CB C 71 31.703 31.703 31.636 0.067 19806 2564 1 5 . 1 1 72 72 ILE N N 72 125.686 125.686 129.036 -3.350 19806 2565 1 5 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.362 0.234 19806 2566 1 5 . 1 1 72 72 ILE CA C 72 59.512 59.512 60.018 -0.506 19806 2567 1 5 . 1 1 72 72 ILE CB C 72 41.095 41.095 38.487 2.608 19806 2568 1 5 . 1 1 73 73 THR N N 73 121.600 121.600 123.395 -1.795 19806 2569 1 5 . 1 1 73 73 THR HA H 73 4.603 4.603 4.316 0.287 19806 2570 1 5 . 1 1 73 73 THR CA C 73 61.937 61.937 62.736 -0.799 19806 2571 1 5 . 1 1 73 73 THR CB C 73 68.669 68.669 67.231 1.438 19806 2572 1 5 . 1 1 74 74 GLN N N 74 124.607 124.607 125.877 -1.270 19806 2573 1 5 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.435 0.146 19806 2574 1 5 . 1 1 74 74 GLN CA C 74 54.689 54.689 55.357 -0.668 19806 2575 1 5 . 1 1 74 74 GLN CB C 74 29.490 29.490 29.015 0.475 19806 2576 1 5 . 1 1 75 75 GLU N N 75 122.962 122.962 125.601 -2.639 19806 2577 1 5 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.094 -0.035 19806 2578 1 5 . 1 1 75 75 GLU CA C 75 58.845 58.845 58.757 0.088 19806 2579 1 5 . 1 1 75 75 GLU CB C 75 29.573 29.573 29.018 0.555 19806 2580 1 5 . 1 1 76 76 GLU N N 76 115.466 115.466 117.351 -1.885 19806 2581 1 5 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.417 -0.109 19806 2582 1 5 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.352 0.425 19806 2583 1 5 . 1 1 76 76 GLU CB C 76 29.072 29.072 29.773 -0.700 19806 2584 1 5 . 1 1 77 77 GLY N N 77 106.771 106.771 106.415 0.356 19806 2585 1 5 . 1 1 77 77 GLY CA C 77 45.014 45.014 45.023 -0.009 19806 2586 1 5 . 1 1 78 78 GLY N N 78 108.535 108.535 107.497 1.038 19806 2587 1 5 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.869 -0.162 19806 2588 1 5 . 1 1 79 79 ILE N N 79 121.066 121.066 121.643 -0.577 19806 2589 1 5 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.487 0.320 19806 2590 1 5 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.661 -1.318 19806 2591 1 5 . 1 1 79 79 ILE CB C 79 39.220 39.220 37.507 1.713 19806 2592 1 5 . 1 1 80 80 TYR N N 80 130.709 130.709 130.458 0.251 19806 2593 1 5 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.542 -0.278 19806 2594 1 5 . 1 1 80 80 TYR CA C 80 58.161 58.161 58.529 -0.368 19806 2595 1 5 . 1 1 80 80 TYR CB C 80 40.621 40.621 38.774 1.847 19806 2596 1 5 . 1 1 81 81 VAL N N 81 126.965 126.965 126.671 0.294 19806 2597 1 5 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.869 -0.015 19806 2598 1 5 . 1 1 81 81 VAL CA C 81 60.457 60.457 60.386 0.071 19806 2599 1 5 . 1 1 81 81 VAL CB C 81 35.004 35.004 36.353 -1.349 19806 2600 1 5 . 1 1 82 82 SER N N 82 120.914 120.914 123.871 -2.957 19806 2601 1 5 . 1 1 82 82 SER HA H 82 5.185 5.185 4.911 0.274 19806 2602 1 5 . 1 1 82 82 SER CA C 82 55.260 55.260 57.523 -2.263 19806 2603 1 5 . 1 1 82 82 SER CB C 82 64.785 64.785 63.481 1.304 19806 2604 1 5 . 1 1 83 83 LYS N N 83 119.415 119.415 122.617 -3.202 19806 2605 1 5 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.693 0.085 19806 2606 1 5 . 1 1 83 83 LYS CA C 83 54.759 54.759 53.985 0.774 19806 2607 1 5 . 1 1 83 83 LYS CB C 83 35.514 35.514 36.810 -1.296 19806 2608 1 5 . 1 1 84 84 PHE N N 84 119.220 119.220 116.788 2.432 19806 2609 1 5 . 1 1 84 84 PHE HA H 84 5.441 5.441 4.970 0.471 19806 2610 1 5 . 1 1 84 84 PHE CA C 84 58.414 58.414 56.182 2.232 19806 2611 1 5 . 1 1 84 84 PHE CB C 84 37.523 37.523 38.270 -0.747 19806 2612 1 5 . 1 1 85 85 THR N N 85 119.257 119.257 117.827 1.430 19806 2613 1 5 . 1 1 85 85 THR HA H 85 4.057 4.057 4.115 -0.058 19806 2614 1 5 . 1 1 85 85 THR CA C 85 62.660 62.660 64.104 -1.444 19806 2615 1 5 . 1 1 85 85 THR CB C 85 67.698 67.698 69.314 -1.616 19806 2616 1 5 . 1 1 86 86 LEU N N 86 121.612 121.612 121.734 -0.122 19806 2617 1 5 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.620 -0.022 19806 2618 1 5 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.593 0.652 19806 2619 1 5 . 1 1 86 86 LEU CB C 86 44.657 44.657 43.778 0.879 19806 2620 1 5 . 1 1 87 87 ASN N N 87 127.684 127.684 122.555 5.129 19806 2621 1 5 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.645 0.366 19806 2622 1 5 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.742 -1.443 19806 2623 1 5 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.032 0.563 19806 2624 1 5 . 1 1 88 88 GLU N N 88 120.509 120.509 120.961 -0.452 19806 2625 1 5 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.472 0.385 19806 2626 1 5 . 1 1 88 88 GLU CA C 88 54.382 54.382 54.858 -0.476 19806 2627 1 5 . 1 1 88 88 GLU CB C 88 29.808 29.808 29.790 0.018 19806 2628 1 5 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.532 -0.151 19806 2629 1 5 . 1 1 89 89 PRO CA C 89 65.898 65.898 65.180 0.719 19806 2630 1 5 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.084 0.267 19806 2631 1 5 . 1 1 90 90 LYS N N 90 107.288 107.288 115.162 -7.874 19806 2632 1 5 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.647 0.037 19806 2633 1 5 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.746 -0.767 19806 2634 1 5 . 1 1 90 90 LYS CB C 90 32.994 32.994 32.900 0.094 19806 2635 1 5 . 1 1 91 91 HIS N N 91 119.523 119.523 118.748 0.775 19806 2636 1 5 . 1 1 91 91 HIS HA H 91 5.777 5.777 4.855 0.922 19806 2637 1 5 . 1 1 91 91 HIS CA C 91 53.705 53.705 55.066 -1.361 19806 2638 1 5 . 1 1 91 91 HIS CB C 91 32.194 32.194 30.409 1.785 19806 2639 1 5 . 1 1 92 92 LYS N N 92 122.527 122.527 127.018 -4.491 19806 2640 1 5 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.941 0.188 19806 2641 1 5 . 1 1 92 92 LYS CA C 92 54.291 54.291 54.666 -0.375 19806 2642 1 5 . 1 1 92 92 LYS CB C 92 37.479 37.479 33.950 3.529 19806 2643 1 5 . 1 1 93 93 ILE N N 93 121.564 121.564 126.243 -4.679 19806 2644 1 5 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.143 1.167 19806 2645 1 5 . 1 1 93 93 ILE CA C 93 61.137 61.137 61.358 -0.221 19806 2646 1 5 . 1 1 93 93 ILE CB C 93 41.088 41.088 37.993 3.095 19806 2647 1 5 . 1 1 94 94 PHE N N 94 128.955 128.955 125.869 3.086 19806 2648 1 5 . 1 1 94 94 PHE HA H 94 4.900 4.900 5.269 -0.369 19806 2649 1 5 . 1 1 94 94 PHE CA C 94 55.843 55.843 56.277 -0.434 19806 2650 1 5 . 1 1 95 95 GLU N N 95 124.809 124.809 127.912 -3.103 19806 2651 1 5 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.224 0.194 19806 2652 1 5 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.439 1.042 19806 2653 1 5 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.688 1.472 19806 2654 1 5 . 1 1 96 96 ALA N N 96 123.759 123.759 122.922 0.837 19806 2655 1 5 . 1 1 96 96 ALA HA H 96 5.379 5.379 5.232 0.147 19806 2656 1 5 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.183 -0.642 19806 2657 1 5 . 1 1 96 96 ALA CB C 96 23.830 23.830 22.082 1.748 19806 2658 1 5 . 1 1 97 97 GLY N N 97 106.592 106.592 106.215 0.377 19806 2659 1 5 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.186 0.249 19806 2660 1 5 . 1 1 98 98 TYR N N 98 119.250 119.250 120.028 -0.778 19806 2661 1 5 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.979 -0.161 19806 2662 1 5 . 1 1 98 98 TYR CA C 98 59.387 59.387 57.677 1.710 19806 2663 1 5 . 1 1 98 98 TYR CB C 98 38.122 38.122 38.926 -0.804 19806 2664 1 5 . 1 1 99 99 GLU N N 99 123.080 123.080 125.756 -2.676 19806 2665 1 5 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.070 -0.061 19806 2666 1 5 . 1 1 99 99 GLU CA C 99 58.409 58.409 59.092 -0.683 19806 2667 1 5 . 1 1 99 99 GLU CB C 99 30.254 30.254 29.901 0.353 19806 2668 1 5 . 1 1 100 100 GLU N N 100 116.459 116.459 116.705 -0.246 19806 2669 1 5 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.512 -0.476 19806 2670 1 5 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.235 1.169 19806 2671 1 5 . 1 1 100 100 GLU CB C 100 27.576 27.576 30.085 -2.509 19806 2672 1 5 . 1 1 101 101 SER N N 101 113.069 113.069 115.135 -2.066 19806 2673 1 5 . 1 1 101 101 SER HA H 101 4.839 4.839 4.637 0.202 19806 2674 1 5 . 1 1 101 101 SER CA C 101 56.024 56.024 57.722 -1.698 19806 2675 1 5 . 1 1 101 101 SER CB C 101 64.806 64.806 65.276 -0.470 19806 2676 1 5 . 1 1 102 102 GLU N N 102 120.439 120.439 121.536 -1.097 19806 2677 1 5 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.505 -0.116 19806 2678 1 5 . 1 1 102 102 GLU CA C 102 55.804 55.804 56.015 -0.211 19806 2679 1 5 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.159 -0.174 19806 2680 1 5 . 1 1 103 103 VAL N N 103 118.899 118.899 117.053 1.846 19806 2681 1 5 . 1 1 103 103 VAL HA H 103 4.086 4.086 3.957 0.129 19806 2682 1 5 . 1 1 103 103 VAL CA C 103 62.699 62.699 62.962 -0.264 19806 2683 1 5 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.203 0.058 19806 2684 1 5 . 1 1 104 104 ASP N N 104 120.965 120.965 120.060 0.905 19806 2685 1 5 . 1 1 104 104 ASP HA H 104 5.003 5.003 5.029 -0.026 19806 2686 1 5 . 1 1 104 104 ASP CA C 104 54.914 54.914 54.169 0.745 19806 2687 1 5 . 1 1 104 104 ASP CB C 104 42.791 42.791 43.906 -1.115 19806 2688 1 5 . 1 1 105 105 LEU N N 105 120.365 120.365 119.563 0.802 19806 2689 1 5 . 1 1 105 105 LEU HA H 105 5.295 5.295 4.858 0.437 19806 2690 1 5 . 1 1 105 105 LEU CA C 105 54.431 54.431 55.188 -0.756 19806 2691 1 5 . 1 1 105 105 LEU CB C 105 46.001 46.001 45.022 0.979 19806 2692 1 5 . 1 1 106 106 ARG N N 106 126.289 126.289 125.620 0.669 19806 2693 1 5 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.202 0.623 19806 2694 1 5 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.972 -0.300 19806 2695 1 5 . 1 1 106 106 ARG CB C 106 33.920 33.920 34.583 -0.663 19806 2696 1 5 . 1 1 107 107 VAL N N 107 126.145 126.145 121.808 4.337 19806 2697 1 5 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.584 0.095 19806 2698 1 5 . 1 1 107 107 VAL CA C 107 61.671 61.671 60.292 1.379 19806 2699 1 5 . 1 1 107 107 VAL CB C 107 35.350 35.350 36.185 -0.835 19806 2700 1 5 . 1 1 108 108 GLU N N 108 127.093 127.093 121.305 5.788 19806 2701 1 5 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.813 0.454 19806 2702 1 5 . 1 1 108 108 GLU CA C 108 54.761 54.761 55.063 -0.302 19806 2703 1 5 . 1 1 108 108 GLU CB C 108 32.567 32.567 33.945 -1.378 19806 2704 1 5 . 1 1 109 109 PHE N N 109 124.592 124.592 122.770 1.822 19806 2705 1 5 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.242 0.786 19806 2706 1 5 . 1 1 109 109 PHE CA C 109 55.945 55.945 57.108 -1.163 19806 2707 1 5 . 1 1 109 109 PHE CB C 109 43.099 43.099 41.484 1.615 19806 2708 1 5 . 1 1 110 110 GLU N N 110 122.143 122.143 122.814 -0.671 19806 2709 1 5 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.570 -0.377 19806 2710 1 5 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.505 0.938 19806 2711 1 5 . 1 1 110 110 GLU CB C 110 35.816 35.816 33.717 2.099 19806 2712 1 5 . 1 1 111 111 LEU N N 111 129.616 129.616 123.091 6.525 19806 2713 1 5 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.948 -0.140 19806 2714 1 5 . 1 1 111 111 LEU CA C 111 53.470 53.470 52.875 0.595 19806 2715 1 5 . 1 1 111 111 LEU CB C 111 40.400 40.400 41.795 -1.395 19806 2716 1 5 . 1 1 112 112 GLN N N 112 124.742 124.742 124.314 0.428 19806 2717 1 5 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.216 0.223 19806 2718 1 5 . 1 1 112 112 GLN CA C 112 55.802 55.802 54.375 1.427 19806 2719 1 5 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.614 -0.861 19806 2720 1 5 . 1 1 113 113 ALA N N 113 121.195 121.195 125.049 -3.854 19806 2721 1 5 . 1 1 113 113 ALA HA H 113 4.048 4.048 3.935 0.113 19806 2722 1 5 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.401 0.117 19806 2723 1 5 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.327 -0.128 19806 2724 1 5 . 1 1 114 114 ASP N N 114 114.525 114.525 116.334 -1.809 19806 2725 1 5 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.490 -0.091 19806 2726 1 5 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.329 -1.421 19806 2727 1 5 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.699 -1.641 19806 2728 1 5 . 1 1 115 115 GLY N N 115 107.526 107.526 106.962 0.564 19806 2729 1 5 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.698 0.086 19806 2730 1 5 . 1 1 116 116 LYS N N 116 118.818 118.818 119.850 -1.032 19806 2731 1 5 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.735 -0.285 19806 2732 1 5 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.684 -0.513 19806 2733 1 5 . 1 1 116 116 LYS CB C 116 35.039 35.039 33.684 1.355 19806 2734 1 5 . 1 1 117 117 TRP N N 117 118.939 118.939 124.242 -5.303 19806 2735 1 5 . 1 1 117 117 TRP CA C 117 56.956 56.956 58.295 -1.339 19806 2736 1 5 . 1 1 118 118 TYR N N 118 112.644 112.644 120.167 -7.523 19806 2737 1 5 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.925 0.352 19806 2738 1 5 . 1 1 118 118 TYR CA C 118 56.219 56.219 56.867 -0.648 19806 2739 1 5 . 1 1 118 118 TYR CB C 118 43.282 43.282 41.671 1.611 19806 2740 1 5 . 1 1 119 119 VAL N N 119 119.842 119.842 123.348 -3.506 19806 2741 1 5 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.315 0.200 19806 2742 1 5 . 1 1 119 119 VAL CA C 119 62.442 62.442 64.006 -1.564 19806 2743 1 5 . 1 1 120 120 VAL N N 120 114.552 114.552 112.299 2.253 19806 2744 1 5 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.507 0.231 19806 2745 1 5 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.307 -0.712 19806 2746 1 5 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.179 -0.327 19806 2747 1 5 . 1 1 121 121 ASP N N 121 118.234 118.234 119.408 -1.174 19806 2748 1 5 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.795 0.468 19806 2749 1 5 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.958 -0.295 19806 2750 1 5 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.552 -0.665 19806 2751 1 5 . 1 1 122 122 CYS N N 122 121.036 121.036 123.512 -2.476 19806 2752 1 5 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.611 0.960 19806 2753 1 5 . 1 1 122 122 CYS CA C 122 57.052 57.052 57.757 -0.705 19806 2754 1 5 . 1 1 122 122 CYS CB C 122 30.834 30.834 27.440 3.394 19806 2755 1 5 . 1 1 123 123 TYR N N 123 127.672 127.672 123.501 4.171 19806 2756 1 5 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.665 0.345 19806 2757 1 5 . 1 1 123 123 TYR CA C 123 57.169 57.169 59.454 -2.285 19806 2758 1 5 . 1 1 123 123 TYR CB C 123 41.408 41.408 40.240 1.168 19806 2759 1 5 . 1 1 124 124 THR N N 124 120.833 120.833 119.322 1.511 19806 2760 1 5 . 1 1 124 124 THR HA H 124 4.987 4.987 4.438 0.549 19806 2761 1 5 . 1 1 124 124 THR CA C 124 57.153 57.153 60.193 -3.040 19806 2762 1 5 . 1 1 124 124 THR CB C 124 68.607 68.607 71.360 -2.753 19806 2763 1 5 . 1 1 125 125 GLY N N 125 114.347 114.347 111.261 3.086 19806 2764 1 5 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.033 0.295 19806 2765 1 5 . 1 1 126 126 TRP N N 126 119.918 119.918 122.216 -2.298 19806 2766 1 5 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.088 -0.018 19806 2767 1 5 . 1 1 126 126 TRP CA C 126 60.564 60.564 59.170 1.393 19806 2768 1 5 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.250 0.389 19806 2769 1 5 . 1 1 127 127 TYR N N 127 113.911 113.911 117.387 -3.476 19806 2770 1 5 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.710 0.284 19806 2771 1 5 . 1 1 127 127 TYR CA C 127 53.384 53.384 56.598 -3.214 19806 2772 1 5 . 1 1 127 127 TYR CB C 127 38.584 38.584 36.329 2.255 19806 2773 1 5 . 1 1 128 128 GLY N N 128 105.181 105.181 108.969 -3.788 19806 2774 1 5 . 1 1 128 128 GLY CA C 128 45.189 45.189 44.578 0.611 19806 2775 1 5 . 1 1 129 129 TYR N N 129 116.588 116.588 117.240 -0.652 19806 2776 1 5 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.881 -0.217 19806 2777 1 5 . 1 1 129 129 TYR CA C 129 59.565 59.565 58.106 1.458 19806 2778 1 5 . 1 1 129 129 TYR CB C 129 38.853 38.853 38.993 -0.140 19806 2779 1 5 . 1 1 130 130 ASP N N 130 115.195 115.195 118.084 -2.889 19806 2780 1 5 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.627 -0.242 19806 2781 1 5 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.750 -1.620 19806 2782 1 5 . 1 1 130 130 ASP CB C 130 38.685 38.685 40.929 -2.244 19806 2783 1 5 . 1 1 131 131 LEU N N 131 124.887 124.887 122.342 2.545 19806 2784 1 5 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.736 -0.255 19806 2785 1 5 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.763 0.842 19806 2786 1 5 . 1 1 131 131 LEU CB C 131 42.441 42.441 43.051 -0.610 19806 2787 1 5 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.655 0.028 19806 2788 1 5 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.871 65.194 19806 2789 1 5 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.088 -0.761 19806 2790 1 5 . 1 1 133 133 ILE N N 133 123.765 123.765 119.797 3.968 19806 2791 1 5 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.799 -0.070 19806 2792 1 5 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.225 1.635 19806 2793 1 5 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.245 -0.182 19806 2794 1 5 . 1 1 134 134 GLY N N 134 107.030 107.030 107.733 -0.703 19806 2795 1 5 . 1 1 134 134 GLY CA C 134 45.976 45.976 46.129 -0.153 19806 2796 1 5 . 1 1 135 135 GLU N N 135 116.566 116.566 122.452 -5.886 19806 2797 1 5 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.181 0.483 19806 2798 1 5 . 1 1 135 135 GLU CA C 135 55.414 55.414 57.605 -2.191 19806 2799 1 5 . 1 1 135 135 GLU CB C 135 30.195 30.195 28.745 1.450 19806 2800 1 5 . 1 1 136 136 LEU N N 136 124.239 124.239 122.311 1.928 19806 2801 1 5 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.928 0.116 19806 2802 1 5 . 1 1 136 136 LEU CA C 136 59.116 59.116 57.776 1.340 19806 2803 1 5 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.602 -0.595 19806 2804 1 5 . 1 1 137 137 LYS N N 137 117.225 117.225 117.340 -0.115 19806 2805 1 5 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.826 0.037 19806 2806 1 5 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.834 0.621 19806 2807 1 5 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.949 -0.746 19806 2808 1 5 . 1 1 138 138 GLN N N 138 118.718 118.718 118.365 0.353 19806 2809 1 5 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.112 -0.060 19806 2810 1 5 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.571 -0.695 19806 2811 1 5 . 1 1 138 138 GLN CB C 138 28.235 28.235 28.132 0.103 19806 2812 1 5 . 1 1 139 139 THR N N 139 117.970 117.970 116.734 1.236 19806 2813 1 5 . 1 1 139 139 THR HA H 139 4.532 4.532 3.929 0.603 19806 2814 1 5 . 1 1 139 139 THR CA C 139 68.145 68.145 66.453 1.692 19806 2815 1 5 . 1 1 139 139 THR CB C 139 68.103 68.103 68.150 -0.047 19806 2816 1 5 . 1 1 140 140 ILE N N 140 120.391 120.391 123.131 -2.740 19806 2817 1 5 . 1 1 140 140 ILE HA H 140 3.727 3.727 4.119 -0.392 19806 2818 1 5 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.029 1.227 19806 2819 1 5 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.895 0.218 19806 2820 1 5 . 1 1 141 141 GLN N N 141 118.917 118.917 119.717 -0.800 19806 2821 1 5 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.869 0.146 19806 2822 1 5 . 1 1 141 141 GLN CA C 141 58.371 58.371 59.108 -0.737 19806 2823 1 5 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.169 -0.822 19806 2824 1 5 . 1 1 142 142 ASN N N 142 119.936 119.936 116.867 3.069 19806 2825 1 5 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.423 0.092 19806 2826 1 5 . 1 1 142 142 ASN CA C 142 55.799 55.799 55.521 0.278 19806 2827 1 5 . 1 1 142 142 ASN CB C 142 37.630 37.630 37.907 -0.277 19806 2828 1 5 . 1 1 143 143 VAL N N 143 123.195 123.195 119.211 3.984 19806 2829 1 5 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.296 -0.580 19806 2830 1 5 . 1 1 143 143 VAL CA C 143 66.497 66.497 65.642 0.855 19806 2831 1 5 . 1 1 143 143 VAL CB C 143 30.989 30.989 30.794 0.195 19806 2832 1 5 . 1 1 144 144 LYS N N 144 120.348 120.348 118.084 2.264 19806 2833 1 5 . 1 1 144 144 LYS HA H 144 3.881 3.881 3.985 -0.104 19806 2834 1 5 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.827 0.296 19806 2835 1 5 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.139 -0.258 19806 2836 1 5 . 1 1 145 145 GLU N N 145 119.220 119.220 118.800 0.420 19806 2837 1 5 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.137 0.046 19806 2838 1 5 . 1 1 145 145 GLU CA C 145 59.178 59.178 58.991 0.187 19806 2839 1 5 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.644 -0.573 19806 2840 1 5 . 1 1 146 146 GLU N N 146 121.420 121.420 119.399 2.021 19806 2841 1 5 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.090 0.187 19806 2842 1 5 . 1 1 146 146 GLU CA C 146 59.118 59.118 58.922 0.196 19806 2843 1 5 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.263 -0.921 19806 2844 1 5 . 1 1 147 147 ASN N N 147 119.197 119.197 117.691 1.506 19806 2845 1 5 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.579 -0.011 19806 2846 1 5 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.974 -1.823 19806 2847 1 5 . 1 1 147 147 ASN CB C 147 37.373 37.373 38.130 -0.757 19806 2848 1 5 . 1 1 148 148 ALA N N 148 123.672 123.672 121.847 1.825 19806 2849 1 5 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.290 -0.167 19806 2850 1 5 . 1 1 148 148 ALA CA C 148 55.133 55.133 54.807 0.326 19806 2851 1 5 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.234 -0.627 19806 2852 1 5 . 1 1 149 149 ALA N N 149 119.979 119.979 121.743 -1.764 19806 2853 1 5 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.095 0.166 19806 2854 1 5 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.678 -0.034 19806 2855 1 5 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.195 -0.457 19806 2856 1 5 . 1 1 150 150 PHE N N 150 119.592 119.592 119.624 -0.032 19806 2857 1 5 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.171 0.053 19806 2858 1 5 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.345 -0.337 19806 2859 1 5 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.343 -0.281 19806 2860 1 5 . 1 1 151 151 LYS N N 151 116.869 116.869 118.076 -1.207 19806 2861 1 5 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.007 -0.101 19806 2862 1 5 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.548 0.222 19806 2863 1 5 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.153 0.588 19806 2864 1 5 . 1 1 152 152 GLU N N 152 115.868 115.868 119.485 -3.617 19806 2865 1 5 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.035 0.018 19806 2866 1 5 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.969 -0.313 19806 2867 1 5 . 1 1 152 152 GLU CB C 152 29.753 29.753 29.918 -0.165 19806 2868 1 5 . 1 1 153 153 ILE N N 153 110.437 110.437 117.409 -6.972 19806 2869 1 5 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.753 0.423 19806 2870 1 5 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.539 -1.505 19806 2871 1 5 . 1 1 153 153 ILE CB C 153 39.272 39.272 39.207 0.065 19806 2872 1 5 . 1 1 154 154 HIS N N 154 117.779 117.779 116.262 1.517 19806 2873 1 5 . 1 1 154 154 HIS HA H 154 5.174 5.174 4.997 0.177 19806 2874 1 5 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.768 -1.152 19806 2875 1 5 . 1 1 154 154 HIS CB C 154 28.547 28.547 30.090 -1.543 19806 2876 1 6 . 1 1 3 3 SER N N 3 114.847 114.847 116.732 -1.885 19806 2877 1 6 . 1 1 3 3 SER HA H 3 4.463 4.463 4.372 0.091 19806 2878 1 6 . 1 1 3 3 SER CA C 3 58.340 58.340 58.481 -0.141 19806 2879 1 6 . 1 1 3 3 SER CB C 3 63.457 63.457 63.833 -0.376 19806 2880 1 6 . 1 1 4 4 GLU N N 4 121.498 121.498 121.409 0.089 19806 2881 1 6 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.579 -0.247 19806 2882 1 6 . 1 1 4 4 GLU CA C 4 56.443 56.443 56.879 -0.436 19806 2883 1 6 . 1 1 4 4 GLU CB C 4 29.966 29.966 29.062 0.904 19806 2884 1 6 . 1 1 5 5 LEU N N 5 121.589 121.589 122.789 -1.200 19806 2885 1 6 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.576 -0.139 19806 2886 1 6 . 1 1 5 5 LEU CA C 5 55.019 55.019 55.871 -0.852 19806 2887 1 6 . 1 1 5 5 LEU CB C 5 42.243 42.243 42.652 -0.409 19806 2888 1 6 . 1 1 6 6 THR N N 6 113.708 113.708 114.467 -0.759 19806 2889 1 6 . 1 1 6 6 THR HA H 6 4.470 4.470 4.699 -0.229 19806 2890 1 6 . 1 1 6 6 THR CA C 6 61.409 61.409 61.498 -0.089 19806 2891 1 6 . 1 1 6 6 THR CB C 6 69.544 69.544 70.338 -0.794 19806 2892 1 6 . 1 1 7 7 THR N N 7 114.945 114.945 115.431 -0.486 19806 2893 1 6 . 1 1 7 7 THR HA H 7 4.415 4.415 4.806 -0.391 19806 2894 1 6 . 1 1 7 7 THR CA C 7 61.435 61.435 61.214 0.221 19806 2895 1 6 . 1 1 7 7 THR CB C 7 69.506 69.506 70.670 -1.164 19806 2896 1 6 . 1 1 8 8 GLN N N 8 121.368 121.368 120.580 0.788 19806 2897 1 6 . 1 1 8 8 GLN CA C 8 55.684 55.684 55.592 0.092 19806 2898 1 6 . 1 1 9 9 ASP N N 9 120.595 120.595 123.361 -2.766 19806 2899 1 6 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.633 0.014 19806 2900 1 6 . 1 1 9 9 ASP CA C 9 54.115 54.115 54.045 0.070 19806 2901 1 6 . 1 1 9 9 ASP CB C 9 41.328 41.328 40.993 0.335 19806 2902 1 6 . 1 1 10 10 GLY N N 10 106.984 106.984 103.875 3.109 19806 2903 1 6 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.403 0.092 19806 2904 1 6 . 1 1 11 11 GLU N N 11 120.879 120.879 120.290 0.589 19806 2905 1 6 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.368 -0.179 19806 2906 1 6 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.528 -0.018 19806 2907 1 6 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.464 1.605 19806 2908 1 6 . 1 1 12 12 ASP N N 12 126.686 126.686 120.949 5.737 19806 2909 1 6 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.621 0.129 19806 2910 1 6 . 1 1 12 12 ASP CA C 12 54.347 54.347 52.785 1.562 19806 2911 1 6 . 1 1 12 12 ASP CB C 12 42.771 42.771 42.593 0.178 19806 2912 1 6 . 1 1 13 13 PHE N N 13 128.055 128.055 120.043 8.012 19806 2913 1 6 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.153 0.259 19806 2914 1 6 . 1 1 13 13 PHE CA C 13 62.551 62.551 58.019 4.532 19806 2915 1 6 . 1 1 13 13 PHE CB C 13 38.833 38.833 37.843 0.990 19806 2916 1 6 . 1 1 14 14 LYS N N 14 117.498 117.498 119.174 -1.676 19806 2917 1 6 . 1 1 14 14 LYS HA H 14 3.581 3.581 4.065 -0.484 19806 2918 1 6 . 1 1 14 14 LYS CA C 14 59.461 59.461 57.078 2.383 19806 2919 1 6 . 1 1 14 14 LYS CB C 14 31.344 31.344 32.098 -0.754 19806 2920 1 6 . 1 1 15 15 SER N N 15 113.775 113.775 115.799 -2.024 19806 2921 1 6 . 1 1 15 15 SER HA H 15 4.167 4.167 4.108 0.059 19806 2922 1 6 . 1 1 15 15 SER CA C 15 61.099 61.099 61.340 -0.241 19806 2923 1 6 . 1 1 15 15 SER CB C 15 62.428 62.428 62.921 -0.493 19806 2924 1 6 . 1 1 16 16 PHE N N 16 122.292 122.292 118.257 4.035 19806 2925 1 6 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.379 -0.089 19806 2926 1 6 . 1 1 16 16 PHE CA C 16 59.773 59.773 59.208 0.565 19806 2927 1 6 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.479 -1.304 19806 2928 1 6 . 1 1 17 17 LEU N N 17 122.472 122.472 119.918 2.554 19806 2929 1 6 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.051 -0.201 19806 2930 1 6 . 1 1 17 17 LEU CA C 17 56.619 56.619 56.413 0.206 19806 2931 1 6 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.230 0.232 19806 2932 1 6 . 1 1 18 18 ASP N N 18 117.331 117.331 120.167 -2.836 19806 2933 1 6 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.195 -0.080 19806 2934 1 6 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.892 -1.497 19806 2935 1 6 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.865 -0.512 19806 2936 1 6 . 1 1 19 19 LYS N N 19 120.032 120.032 117.922 2.110 19806 2937 1 6 . 1 1 19 19 LYS HA H 19 3.677 3.677 4.075 -0.398 19806 2938 1 6 . 1 1 19 19 LYS CA C 19 59.067 59.067 58.302 0.765 19806 2939 1 6 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.007 -0.071 19806 2940 1 6 . 1 1 20 20 PHE N N 20 119.607 119.607 119.952 -0.345 19806 2941 1 6 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.378 -0.269 19806 2942 1 6 . 1 1 20 20 PHE CA C 20 62.090 62.090 61.242 0.848 19806 2943 1 6 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.503 0.966 19806 2944 1 6 . 1 1 21 21 THR N N 21 101.473 101.473 111.292 -9.819 19806 2945 1 6 . 1 1 21 21 THR HA H 21 4.259 4.259 4.115 0.144 19806 2946 1 6 . 1 1 21 21 THR CA C 21 61.774 61.774 64.166 -2.392 19806 2947 1 6 . 1 1 22 22 SER N N 22 111.453 111.453 116.027 -4.574 19806 2948 1 6 . 1 1 22 22 SER HA H 22 4.165 4.165 4.865 -0.700 19806 2949 1 6 . 1 1 22 22 SER CA C 22 58.215 58.215 57.260 0.955 19806 2950 1 6 . 1 1 22 22 SER CB C 22 64.570 64.570 63.735 0.835 19806 2951 1 6 . 1 1 23 23 SER N N 23 114.184 114.184 117.392 -3.208 19806 2952 1 6 . 1 1 23 23 SER HA H 23 4.764 4.764 4.910 -0.146 19806 2953 1 6 . 1 1 23 23 SER CA C 23 55.669 55.669 58.367 -2.698 19806 2954 1 6 . 1 1 23 23 SER CB C 23 64.011 64.011 64.227 -0.216 19806 2955 1 6 . 1 1 24 24 ALA N N 24 133.370 133.370 126.608 6.762 19806 2956 1 6 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.461 -0.505 19806 2957 1 6 . 1 1 24 24 ALA CA C 24 55.106 55.106 53.824 1.282 19806 2958 1 6 . 1 1 24 24 ALA CB C 24 19.835 19.835 18.689 1.146 19806 2959 1 6 . 1 1 25 25 ALA N N 25 117.430 117.430 119.234 -1.804 19806 2960 1 6 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.738 -0.421 19806 2961 1 6 . 1 1 25 25 ALA CA C 25 55.201 55.201 53.029 2.172 19806 2962 1 6 . 1 1 25 25 ALA CB C 25 18.349 18.349 19.482 -1.133 19806 2963 1 6 . 1 1 26 26 PHE N N 26 116.042 116.042 118.130 -2.088 19806 2964 1 6 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.918 -0.608 19806 2965 1 6 . 1 1 26 26 PHE CA C 26 60.759 60.759 58.282 2.477 19806 2966 1 6 . 1 1 26 26 PHE CB C 26 39.310 39.310 41.779 -2.469 19806 2967 1 6 . 1 1 27 27 GLN N N 27 121.820 121.820 121.494 0.326 19806 2968 1 6 . 1 1 27 27 GLN HA H 27 3.391 3.391 3.998 -0.607 19806 2969 1 6 . 1 1 27 27 GLN CA C 27 60.094 60.094 60.485 -0.391 19806 2970 1 6 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.508 -1.051 19806 2971 1 6 . 1 1 28 28 TYR N N 28 111.517 111.517 115.209 -3.692 19806 2972 1 6 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.832 0.298 19806 2973 1 6 . 1 1 28 28 TYR CA C 28 62.357 62.357 60.176 2.181 19806 2974 1 6 . 1 1 28 28 TYR CB C 28 38.568 38.568 37.778 0.790 19806 2975 1 6 . 1 1 29 29 THR N N 29 106.324 106.324 107.959 -1.635 19806 2976 1 6 . 1 1 29 29 THR HA H 29 4.489 4.489 4.231 0.258 19806 2977 1 6 . 1 1 29 29 THR CA C 29 63.765 63.765 62.166 1.599 19806 2978 1 6 . 1 1 29 29 THR CB C 29 69.568 69.568 68.783 0.785 19806 2979 1 6 . 1 1 30 30 ARG N N 30 117.696 117.696 120.256 -2.560 19806 2980 1 6 . 1 1 30 30 ARG HA H 30 4.701 4.701 3.943 0.758 19806 2981 1 6 . 1 1 30 30 ARG CA C 30 52.760 52.760 55.370 -2.610 19806 2982 1 6 . 1 1 30 30 ARG CB C 30 35.047 35.047 30.834 4.213 19806 2983 1 6 . 1 1 31 31 VAL N N 31 119.395 119.395 119.243 0.152 19806 2984 1 6 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.698 -0.468 19806 2985 1 6 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.283 0.908 19806 2986 1 6 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.486 -2.313 19806 2987 1 6 . 1 1 32 32 LYS N N 32 126.124 126.124 124.590 1.534 19806 2988 1 6 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.546 -0.362 19806 2989 1 6 . 1 1 32 32 LYS CA C 32 53.958 53.958 54.063 -0.105 19806 2990 1 6 . 1 1 32 32 LYS CB C 32 31.112 31.112 34.683 -3.571 19806 2991 1 6 . 1 1 33 33 PHE N N 33 119.303 119.303 118.714 0.589 19806 2992 1 6 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.934 -0.420 19806 2993 1 6 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.567 0.705 19806 2994 1 6 . 1 1 33 33 PHE CB C 33 40.378 40.378 39.740 0.638 19806 2995 1 6 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.783 0.185 19806 2996 1 6 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.913 -1.280 19806 2997 1 6 . 1 1 34 34 PRO CB C 34 33.732 33.732 33.275 0.457 19806 2998 1 6 . 1 1 35 35 LEU N N 35 120.016 120.016 118.411 1.605 19806 2999 1 6 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.773 -0.551 19806 3000 1 6 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.409 1.431 19806 3001 1 6 . 1 1 35 35 LEU CB C 35 41.244 41.244 44.949 -3.705 19806 3002 1 6 . 1 1 36 36 LYS N N 36 117.066 117.066 120.303 -3.237 19806 3003 1 6 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.311 -0.336 19806 3004 1 6 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.906 2.341 19806 3005 1 6 . 1 1 36 36 LYS CB C 36 32.832 32.832 32.904 -0.071 19806 3006 1 6 . 1 1 37 37 THR N N 37 117.574 117.574 115.469 2.105 19806 3007 1 6 . 1 1 37 37 THR HA H 37 4.797 4.797 4.880 -0.083 19806 3008 1 6 . 1 1 37 37 THR CA C 37 60.396 60.396 59.197 1.199 19806 3009 1 6 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.651 0.368 19806 3010 1 6 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.588 -0.665 19806 3011 1 6 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.774 -0.143 19806 3012 1 6 . 1 1 39 39 ILE N N 39 119.949 119.949 120.041 -0.092 19806 3013 1 6 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.225 0.014 19806 3014 1 6 . 1 1 39 39 ILE CA C 39 62.133 62.133 63.130 -0.997 19806 3015 1 6 . 1 1 40 40 THR N N 40 123.962 123.962 124.294 -0.332 19806 3016 1 6 . 1 1 40 40 THR HA H 40 5.057 5.057 4.932 0.125 19806 3017 1 6 . 1 1 40 40 THR CA C 40 62.262 62.262 61.584 0.678 19806 3018 1 6 . 1 1 40 40 THR CB C 40 69.891 69.891 69.519 0.372 19806 3019 1 6 . 1 1 41 41 LEU N N 41 125.633 125.633 126.145 -0.512 19806 3020 1 6 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.708 0.394 19806 3021 1 6 . 1 1 41 41 LEU CA C 41 52.638 52.638 53.013 -0.375 19806 3022 1 6 . 1 1 41 41 LEU CB C 41 45.180 45.180 44.396 0.784 19806 3023 1 6 . 1 1 42 42 LEU N N 42 120.788 120.788 121.102 -0.314 19806 3024 1 6 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.661 0.087 19806 3025 1 6 . 1 1 42 42 LEU CA C 42 53.724 53.724 54.504 -0.780 19806 3026 1 6 . 1 1 42 42 LEU CB C 42 44.384 44.384 41.499 2.885 19806 3027 1 6 . 1 1 43 43 ALA N N 43 123.073 123.073 126.361 -3.288 19806 3028 1 6 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.254 0.176 19806 3029 1 6 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.330 -1.042 19806 3030 1 6 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.477 0.537 19806 3031 1 6 . 1 1 44 44 ASP N N 44 118.196 118.196 118.171 0.025 19806 3032 1 6 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.341 0.085 19806 3033 1 6 . 1 1 44 44 ASP CA C 44 56.028 56.028 57.451 -1.423 19806 3034 1 6 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.858 -0.648 19806 3035 1 6 . 1 1 45 45 ASP N N 45 115.018 115.018 117.776 -2.758 19806 3036 1 6 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.562 -0.093 19806 3037 1 6 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.261 -0.467 19806 3038 1 6 . 1 1 45 45 ASP CB C 45 39.864 39.864 40.623 -0.759 19806 3039 1 6 . 1 1 46 46 GLY N N 46 107.499 107.499 108.553 -1.054 19806 3040 1 6 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.995 -0.081 19806 3041 1 6 . 1 1 47 47 GLU N N 47 117.331 117.331 117.334 -0.003 19806 3042 1 6 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.448 0.083 19806 3043 1 6 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.276 0.662 19806 3044 1 6 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.053 3.080 19806 3045 1 6 . 1 1 48 48 THR N N 48 118.462 118.462 119.425 -0.963 19806 3046 1 6 . 1 1 48 48 THR HA H 48 4.243 4.243 4.294 -0.051 19806 3047 1 6 . 1 1 48 48 THR CA C 48 62.834 62.834 63.296 -0.462 19806 3048 1 6 . 1 1 48 48 THR CB C 48 68.649 68.649 68.789 -0.140 19806 3049 1 6 . 1 1 49 49 GLU N N 49 123.834 123.834 128.269 -4.435 19806 3050 1 6 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.688 0.257 19806 3051 1 6 . 1 1 49 49 GLU CA C 49 55.358 55.358 57.434 -2.075 19806 3052 1 6 . 1 1 49 49 GLU CB C 49 31.395 31.395 29.972 1.423 19806 3053 1 6 . 1 1 50 50 LYS N N 50 122.868 122.868 127.526 -4.658 19806 3054 1 6 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.792 -0.151 19806 3055 1 6 . 1 1 50 50 LYS CA C 50 54.111 54.111 55.004 -0.893 19806 3056 1 6 . 1 1 50 50 LYS CB C 50 35.312 35.312 35.845 -0.533 19806 3057 1 6 . 1 1 51 51 THR N N 51 111.386 111.386 113.474 -2.088 19806 3058 1 6 . 1 1 51 51 THR HA H 51 5.619 5.619 5.546 0.073 19806 3059 1 6 . 1 1 51 51 THR CA C 51 58.980 58.980 60.005 -1.025 19806 3060 1 6 . 1 1 51 51 THR CB C 51 71.277 71.277 70.698 0.579 19806 3061 1 6 . 1 1 52 52 PHE N N 52 120.631 120.631 118.618 2.013 19806 3062 1 6 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.852 0.111 19806 3063 1 6 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.938 -1.809 19806 3064 1 6 . 1 1 52 52 PHE CB C 52 41.049 41.049 41.625 -0.576 19806 3065 1 6 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.567 -0.119 19806 3066 1 6 . 1 1 53 53 PRO CA C 53 62.489 62.489 62.949 -0.460 19806 3067 1 6 . 1 1 53 53 PRO CB C 53 32.240 32.240 32.462 -0.222 19806 3068 1 6 . 1 1 54 54 PHE N N 54 128.034 128.034 121.699 6.335 19806 3069 1 6 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.665 0.163 19806 3070 1 6 . 1 1 54 54 PHE CA C 54 55.509 55.509 56.917 -1.408 19806 3071 1 6 . 1 1 54 54 PHE CB C 54 37.028 37.028 40.932 -3.904 19806 3072 1 6 . 1 1 55 55 THR N N 55 111.757 111.757 115.084 -3.327 19806 3073 1 6 . 1 1 55 55 THR HA H 55 4.413 4.413 4.037 0.376 19806 3074 1 6 . 1 1 55 55 THR CA C 55 60.578 60.578 59.355 1.223 19806 3075 1 6 . 1 1 55 55 THR CB C 55 69.447 69.447 71.511 -2.064 19806 3076 1 6 . 1 1 56 56 LYS N N 56 118.734 118.734 118.946 -0.212 19806 3077 1 6 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.318 -1.836 19806 3078 1 6 . 1 1 56 56 LYS CA C 56 59.381 59.381 59.116 0.265 19806 3079 1 6 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.148 1.102 19806 3080 1 6 . 1 1 57 57 GLU N N 57 119.675 119.675 120.284 -0.609 19806 3081 1 6 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.099 0.170 19806 3082 1 6 . 1 1 57 57 GLU CA C 57 57.152 57.152 59.260 -2.108 19806 3083 1 6 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.576 -2.626 19806 3084 1 6 . 1 1 58 58 LYS N N 58 114.700 114.700 119.539 -4.839 19806 3085 1 6 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.269 0.043 19806 3086 1 6 . 1 1 58 58 LYS CA C 58 55.595 55.595 55.777 -0.182 19806 3087 1 6 . 1 1 58 58 LYS CB C 58 32.011 32.011 31.030 0.981 19806 3088 1 6 . 1 1 59 59 TRP N N 59 118.204 118.204 124.711 -6.507 19806 3089 1 6 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.193 -0.094 19806 3090 1 6 . 1 1 59 59 TRP CA C 59 55.577 55.577 54.645 0.931 19806 3091 1 6 . 1 1 59 59 TRP CB C 59 32.037 32.037 30.939 1.098 19806 3092 1 6 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.236 0.027 19806 3093 1 6 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.715 -2.994 19806 3094 1 6 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.203 -2.354 19806 3095 1 6 . 1 1 61 61 LEU N N 61 123.758 123.758 125.171 -1.413 19806 3096 1 6 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.325 -0.686 19806 3097 1 6 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.453 0.422 19806 3098 1 6 . 1 1 61 61 LEU CB C 61 40.815 40.815 42.106 -1.291 19806 3099 1 6 . 1 1 62 62 LEU N N 62 124.052 124.052 125.870 -1.818 19806 3100 1 6 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.229 0.126 19806 3101 1 6 . 1 1 62 62 LEU CA C 62 53.992 53.992 54.029 -0.037 19806 3102 1 6 . 1 1 62 62 LEU CB C 62 44.686 44.686 42.220 2.466 19806 3103 1 6 . 1 1 63 63 ASP N N 63 117.271 117.271 122.751 -5.480 19806 3104 1 6 . 1 1 63 63 ASP HA H 63 5.033 5.033 4.558 0.475 19806 3105 1 6 . 1 1 63 63 ASP CA C 63 51.101 51.101 52.750 -1.649 19806 3106 1 6 . 1 1 63 63 ASP CB C 63 43.345 43.345 41.166 2.179 19806 3107 1 6 . 1 1 64 64 SER N N 64 112.856 112.856 115.058 -2.202 19806 3108 1 6 . 1 1 64 64 SER HA H 64 3.865 3.865 4.214 -0.349 19806 3109 1 6 . 1 1 64 64 SER CA C 64 60.910 60.910 61.233 -0.323 19806 3110 1 6 . 1 1 64 64 SER CB C 64 62.378 62.378 63.260 -0.882 19806 3111 1 6 . 1 1 65 65 GLU N N 65 120.070 120.070 120.223 -0.153 19806 3112 1 6 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.140 -0.122 19806 3113 1 6 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.895 -0.552 19806 3114 1 6 . 1 1 65 65 GLU CB C 65 28.887 28.887 28.875 0.011 19806 3115 1 6 . 1 1 66 66 THR N N 66 115.852 115.852 112.315 3.537 19806 3116 1 6 . 1 1 66 66 THR HA H 66 3.991 3.991 4.461 -0.470 19806 3117 1 6 . 1 1 66 66 THR CA C 66 65.804 65.804 62.724 3.080 19806 3118 1 6 . 1 1 66 66 THR CB C 66 68.451 68.451 69.538 -1.087 19806 3119 1 6 . 1 1 67 67 MET N N 67 113.585 113.585 118.486 -4.901 19806 3120 1 6 . 1 1 67 67 MET HA H 67 4.267 4.267 4.726 -0.459 19806 3121 1 6 . 1 1 67 67 MET CA C 67 52.135 52.135 54.119 -1.984 19806 3122 1 6 . 1 1 67 67 MET CB C 67 28.963 28.963 33.708 -4.745 19806 3123 1 6 . 1 1 68 68 LYS N N 68 118.462 118.462 121.268 -2.806 19806 3124 1 6 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.394 -0.024 19806 3125 1 6 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.927 -0.445 19806 3126 1 6 . 1 1 68 68 LYS CB C 68 34.179 34.179 33.080 1.099 19806 3127 1 6 . 1 1 69 69 GLU N N 69 121.700 121.700 123.055 -1.355 19806 3128 1 6 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.677 -0.153 19806 3129 1 6 . 1 1 69 69 GLU CA C 69 55.942 55.942 56.398 -0.456 19806 3130 1 6 . 1 1 69 69 GLU CB C 69 30.424 30.424 31.069 -0.645 19806 3131 1 6 . 1 1 70 70 GLU N N 70 123.445 123.445 125.796 -2.351 19806 3132 1 6 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.603 0.094 19806 3133 1 6 . 1 1 70 70 GLU CA C 70 55.473 55.473 54.909 0.564 19806 3134 1 6 . 1 1 70 70 GLU CB C 70 33.162 33.162 32.421 0.741 19806 3135 1 6 . 1 1 71 71 ARG N N 71 122.150 122.150 122.140 0.010 19806 3136 1 6 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.952 0.199 19806 3137 1 6 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.285 0.163 19806 3138 1 6 . 1 1 71 71 ARG CB C 71 31.703 31.703 31.135 0.568 19806 3139 1 6 . 1 1 72 72 ILE N N 72 125.686 125.686 127.223 -1.537 19806 3140 1 6 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.395 0.201 19806 3141 1 6 . 1 1 72 72 ILE CA C 72 59.512 59.512 60.339 -0.827 19806 3142 1 6 . 1 1 72 72 ILE CB C 72 41.095 41.095 38.754 2.341 19806 3143 1 6 . 1 1 73 73 THR N N 73 121.600 121.600 122.851 -1.251 19806 3144 1 6 . 1 1 73 73 THR HA H 73 4.603 4.603 4.331 0.272 19806 3145 1 6 . 1 1 73 73 THR CA C 73 61.937 61.937 62.356 -0.419 19806 3146 1 6 . 1 1 73 73 THR CB C 73 68.669 68.669 68.932 -0.263 19806 3147 1 6 . 1 1 74 74 GLN N N 74 124.607 124.607 127.182 -2.575 19806 3148 1 6 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.624 -0.043 19806 3149 1 6 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.180 0.509 19806 3150 1 6 . 1 1 74 74 GLN CB C 74 29.490 29.490 31.563 -2.073 19806 3151 1 6 . 1 1 75 75 GLU N N 75 122.962 122.962 119.123 3.839 19806 3152 1 6 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.426 -0.367 19806 3153 1 6 . 1 1 75 75 GLU CA C 75 58.845 58.845 56.536 2.309 19806 3154 1 6 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.506 -0.933 19806 3155 1 6 . 1 1 76 76 GLU N N 76 115.466 115.466 118.955 -3.489 19806 3156 1 6 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.578 -0.270 19806 3157 1 6 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.362 0.415 19806 3158 1 6 . 1 1 76 76 GLU CB C 76 29.072 29.072 29.788 -0.716 19806 3159 1 6 . 1 1 77 77 GLY N N 77 106.771 106.771 107.878 -1.107 19806 3160 1 6 . 1 1 77 77 GLY CA C 77 45.014 45.014 45.550 -0.536 19806 3161 1 6 . 1 1 78 78 GLY N N 78 108.535 108.535 107.599 0.936 19806 3162 1 6 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.659 0.048 19806 3163 1 6 . 1 1 79 79 ILE N N 79 121.066 121.066 121.602 -0.536 19806 3164 1 6 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.422 0.385 19806 3165 1 6 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.897 -1.554 19806 3166 1 6 . 1 1 79 79 ILE CB C 79 39.220 39.220 37.800 1.420 19806 3167 1 6 . 1 1 80 80 TYR N N 80 130.709 130.709 130.193 0.516 19806 3168 1 6 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.336 -0.072 19806 3169 1 6 . 1 1 80 80 TYR CA C 80 58.161 58.161 58.081 0.080 19806 3170 1 6 . 1 1 80 80 TYR CB C 80 40.621 40.621 39.924 0.697 19806 3171 1 6 . 1 1 81 81 VAL N N 81 126.965 126.965 126.044 0.921 19806 3172 1 6 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.230 0.624 19806 3173 1 6 . 1 1 81 81 VAL CA C 81 60.457 60.457 61.288 -0.831 19806 3174 1 6 . 1 1 81 81 VAL CB C 81 35.004 35.004 35.593 -0.589 19806 3175 1 6 . 1 1 82 82 SER N N 82 120.914 120.914 121.440 -0.526 19806 3176 1 6 . 1 1 82 82 SER HA H 82 5.185 5.185 5.015 0.170 19806 3177 1 6 . 1 1 82 82 SER CA C 82 55.260 55.260 56.715 -1.455 19806 3178 1 6 . 1 1 82 82 SER CB C 82 64.785 64.785 63.463 1.322 19806 3179 1 6 . 1 1 83 83 LYS N N 83 119.415 119.415 124.689 -5.274 19806 3180 1 6 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.446 0.332 19806 3181 1 6 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.885 -0.126 19806 3182 1 6 . 1 1 83 83 LYS CB C 83 35.514 35.514 35.371 0.143 19806 3183 1 6 . 1 1 84 84 PHE N N 84 119.220 119.220 119.758 -0.538 19806 3184 1 6 . 1 1 84 84 PHE HA H 84 5.441 5.441 5.106 0.335 19806 3185 1 6 . 1 1 84 84 PHE CA C 84 58.414 58.414 58.484 -0.070 19806 3186 1 6 . 1 1 84 84 PHE CB C 84 37.523 37.523 39.346 -1.823 19806 3187 1 6 . 1 1 85 85 THR N N 85 119.257 119.257 116.056 3.201 19806 3188 1 6 . 1 1 85 85 THR HA H 85 4.057 4.057 4.346 -0.289 19806 3189 1 6 . 1 1 85 85 THR CA C 85 62.660 62.660 62.616 0.044 19806 3190 1 6 . 1 1 85 85 THR CB C 85 67.698 67.698 69.672 -1.974 19806 3191 1 6 . 1 1 86 86 LEU N N 86 121.612 121.612 123.153 -1.541 19806 3192 1 6 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.540 0.058 19806 3193 1 6 . 1 1 86 86 LEU CA C 86 55.245 55.245 55.643 -0.398 19806 3194 1 6 . 1 1 86 86 LEU CB C 86 44.657 44.657 44.883 -0.226 19806 3195 1 6 . 1 1 87 87 ASN N N 87 127.684 127.684 123.657 4.027 19806 3196 1 6 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.731 0.280 19806 3197 1 6 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.762 -1.463 19806 3198 1 6 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.271 0.324 19806 3199 1 6 . 1 1 88 88 GLU N N 88 120.509 120.509 123.159 -2.650 19806 3200 1 6 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.869 -0.012 19806 3201 1 6 . 1 1 88 88 GLU CA C 88 54.382 54.382 53.935 0.447 19806 3202 1 6 . 1 1 88 88 GLU CB C 88 29.808 29.808 31.187 -1.379 19806 3203 1 6 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.754 -0.373 19806 3204 1 6 . 1 1 89 89 PRO CA C 89 65.898 65.898 65.272 0.626 19806 3205 1 6 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.532 -0.181 19806 3206 1 6 . 1 1 90 90 LYS N N 90 107.288 107.288 114.856 -7.568 19806 3207 1 6 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.469 0.215 19806 3208 1 6 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.484 -0.505 19806 3209 1 6 . 1 1 90 90 LYS CB C 90 32.994 32.994 32.868 0.126 19806 3210 1 6 . 1 1 91 91 HIS N N 91 119.523 119.523 118.064 1.459 19806 3211 1 6 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.636 0.141 19806 3212 1 6 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.544 -0.839 19806 3213 1 6 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.848 -0.654 19806 3214 1 6 . 1 1 92 92 LYS N N 92 122.527 122.527 127.123 -4.596 19806 3215 1 6 . 1 1 92 92 LYS HA H 92 5.129 5.129 5.118 0.011 19806 3216 1 6 . 1 1 92 92 LYS CA C 92 54.291 54.291 54.827 -0.536 19806 3217 1 6 . 1 1 92 92 LYS CB C 92 37.479 37.479 36.980 0.499 19806 3218 1 6 . 1 1 93 93 ILE N N 93 121.564 121.564 124.937 -3.373 19806 3219 1 6 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.484 0.826 19806 3220 1 6 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.527 0.610 19806 3221 1 6 . 1 1 93 93 ILE CB C 93 41.088 41.088 40.889 0.199 19806 3222 1 6 . 1 1 94 94 PHE N N 94 128.955 128.955 129.887 -0.932 19806 3223 1 6 . 1 1 94 94 PHE HA H 94 4.900 4.900 4.955 -0.055 19806 3224 1 6 . 1 1 94 94 PHE CA C 94 55.843 55.843 55.703 0.140 19806 3225 1 6 . 1 1 95 95 GLU N N 95 124.809 124.809 125.884 -1.075 19806 3226 1 6 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.329 0.089 19806 3227 1 6 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.428 1.053 19806 3228 1 6 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.858 1.302 19806 3229 1 6 . 1 1 96 96 ALA N N 96 123.759 123.759 121.528 2.231 19806 3230 1 6 . 1 1 96 96 ALA HA H 96 5.379 5.379 5.138 0.241 19806 3231 1 6 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.009 -0.468 19806 3232 1 6 . 1 1 96 96 ALA CB C 96 23.830 23.830 22.370 1.460 19806 3233 1 6 . 1 1 97 97 GLY N N 97 106.592 106.592 108.122 -1.530 19806 3234 1 6 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.763 -0.327 19806 3235 1 6 . 1 1 98 98 TYR N N 98 119.250 119.250 118.541 0.709 19806 3236 1 6 . 1 1 98 98 TYR HA H 98 4.818 4.818 5.148 -0.330 19806 3237 1 6 . 1 1 98 98 TYR CA C 98 59.387 59.387 57.441 1.946 19806 3238 1 6 . 1 1 98 98 TYR CB C 98 38.122 38.122 41.439 -3.317 19806 3239 1 6 . 1 1 99 99 GLU N N 99 123.080 123.080 123.128 -0.048 19806 3240 1 6 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.155 -0.146 19806 3241 1 6 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.749 -0.340 19806 3242 1 6 . 1 1 99 99 GLU CB C 99 30.254 30.254 30.137 0.117 19806 3243 1 6 . 1 1 100 100 GLU N N 100 116.459 116.459 117.255 -0.796 19806 3244 1 6 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.571 -0.535 19806 3245 1 6 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.079 1.325 19806 3246 1 6 . 1 1 100 100 GLU CB C 100 27.576 27.576 30.001 -2.425 19806 3247 1 6 . 1 1 101 101 SER N N 101 113.069 113.069 114.974 -1.905 19806 3248 1 6 . 1 1 101 101 SER HA H 101 4.839 4.839 4.620 0.219 19806 3249 1 6 . 1 1 101 101 SER CA C 101 56.024 56.024 57.569 -1.545 19806 3250 1 6 . 1 1 101 101 SER CB C 101 64.806 64.806 65.100 -0.294 19806 3251 1 6 . 1 1 102 102 GLU N N 102 120.439 120.439 120.855 -0.416 19806 3252 1 6 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.463 -0.074 19806 3253 1 6 . 1 1 102 102 GLU CA C 102 55.804 55.804 56.458 -0.654 19806 3254 1 6 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.608 -0.623 19806 3255 1 6 . 1 1 103 103 VAL N N 103 118.899 118.899 115.790 3.109 19806 3256 1 6 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.134 -0.048 19806 3257 1 6 . 1 1 103 103 VAL CA C 103 62.699 62.699 61.396 1.303 19806 3258 1 6 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.996 -0.735 19806 3259 1 6 . 1 1 104 104 ASP N N 104 120.965 120.965 118.319 2.646 19806 3260 1 6 . 1 1 104 104 ASP HA H 104 5.003 5.003 5.036 -0.033 19806 3261 1 6 . 1 1 104 104 ASP CA C 104 54.914 54.914 54.567 0.347 19806 3262 1 6 . 1 1 104 104 ASP CB C 104 42.791 42.791 44.867 -2.075 19806 3263 1 6 . 1 1 105 105 LEU N N 105 120.365 120.365 121.029 -0.664 19806 3264 1 6 . 1 1 105 105 LEU HA H 105 5.295 5.295 5.444 -0.149 19806 3265 1 6 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.578 -0.146 19806 3266 1 6 . 1 1 105 105 LEU CB C 105 46.001 46.001 44.394 1.607 19806 3267 1 6 . 1 1 106 106 ARG N N 106 126.289 126.289 126.387 -0.098 19806 3268 1 6 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.241 0.584 19806 3269 1 6 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.263 0.409 19806 3270 1 6 . 1 1 106 106 ARG CB C 106 33.920 33.920 33.926 -0.006 19806 3271 1 6 . 1 1 107 107 VAL N N 107 126.145 126.145 122.830 3.315 19806 3272 1 6 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.562 0.117 19806 3273 1 6 . 1 1 107 107 VAL CA C 107 61.671 61.671 60.800 0.872 19806 3274 1 6 . 1 1 107 107 VAL CB C 107 35.350 35.350 35.526 -0.176 19806 3275 1 6 . 1 1 108 108 GLU N N 108 127.093 127.093 123.470 3.623 19806 3276 1 6 . 1 1 108 108 GLU HA H 108 5.267 5.267 5.128 0.139 19806 3277 1 6 . 1 1 108 108 GLU CA C 108 54.761 54.761 54.001 0.760 19806 3278 1 6 . 1 1 108 108 GLU CB C 108 32.567 32.567 34.106 -1.539 19806 3279 1 6 . 1 1 109 109 PHE N N 109 124.592 124.592 119.858 4.734 19806 3280 1 6 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.452 0.576 19806 3281 1 6 . 1 1 109 109 PHE CA C 109 55.945 55.945 57.050 -1.105 19806 3282 1 6 . 1 1 109 109 PHE CB C 109 43.099 43.099 42.822 0.277 19806 3283 1 6 . 1 1 110 110 GLU N N 110 122.143 122.143 121.520 0.623 19806 3284 1 6 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.461 -0.268 19806 3285 1 6 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.278 1.165 19806 3286 1 6 . 1 1 110 110 GLU CB C 110 35.816 35.816 34.486 1.330 19806 3287 1 6 . 1 1 111 111 LEU N N 111 129.616 129.616 125.905 3.711 19806 3288 1 6 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.702 0.106 19806 3289 1 6 . 1 1 111 111 LEU CA C 111 53.470 53.470 54.650 -1.179 19806 3290 1 6 . 1 1 111 111 LEU CB C 111 40.400 40.400 41.541 -1.141 19806 3291 1 6 . 1 1 112 112 GLN N N 112 124.742 124.742 125.455 -0.713 19806 3292 1 6 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.138 0.301 19806 3293 1 6 . 1 1 112 112 GLN CA C 112 55.802 55.802 54.956 0.846 19806 3294 1 6 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.688 -0.935 19806 3295 1 6 . 1 1 113 113 ALA N N 113 121.195 121.195 124.801 -3.606 19806 3296 1 6 . 1 1 113 113 ALA HA H 113 4.048 4.048 3.929 0.119 19806 3297 1 6 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.754 -0.236 19806 3298 1 6 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.699 -0.500 19806 3299 1 6 . 1 1 114 114 ASP N N 114 114.525 114.525 117.671 -3.146 19806 3300 1 6 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.384 0.015 19806 3301 1 6 . 1 1 114 114 ASP CA C 114 52.908 52.908 55.020 -2.112 19806 3302 1 6 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.525 -1.467 19806 3303 1 6 . 1 1 115 115 GLY N N 115 107.526 107.526 105.225 2.301 19806 3304 1 6 . 1 1 115 115 GLY CA C 115 45.784 45.784 44.826 0.958 19806 3305 1 6 . 1 1 116 116 LYS N N 116 118.818 118.818 119.962 -1.144 19806 3306 1 6 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.693 -0.243 19806 3307 1 6 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.575 -0.404 19806 3308 1 6 . 1 1 116 116 LYS CB C 116 35.039 35.039 35.895 -0.856 19806 3309 1 6 . 1 1 117 117 TRP N N 117 118.939 118.939 122.883 -3.944 19806 3310 1 6 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.895 -0.939 19806 3311 1 6 . 1 1 118 118 TYR N N 118 112.644 112.644 117.959 -5.315 19806 3312 1 6 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.724 0.553 19806 3313 1 6 . 1 1 118 118 TYR CA C 118 56.219 56.219 57.072 -0.853 19806 3314 1 6 . 1 1 118 118 TYR CB C 118 43.282 43.282 42.055 1.227 19806 3315 1 6 . 1 1 119 119 VAL N N 119 119.842 119.842 122.348 -2.506 19806 3316 1 6 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.466 0.049 19806 3317 1 6 . 1 1 119 119 VAL CA C 119 62.442 62.442 63.849 -1.407 19806 3318 1 6 . 1 1 120 120 VAL N N 120 114.552 114.552 117.163 -2.611 19806 3319 1 6 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.486 0.252 19806 3320 1 6 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.736 -1.141 19806 3321 1 6 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.682 -0.830 19806 3322 1 6 . 1 1 121 121 ASP N N 121 118.234 118.234 119.467 -1.233 19806 3323 1 6 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.782 0.481 19806 3324 1 6 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.893 -0.230 19806 3325 1 6 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.556 -0.669 19806 3326 1 6 . 1 1 122 122 CYS N N 122 121.036 121.036 123.591 -2.555 19806 3327 1 6 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.865 0.706 19806 3328 1 6 . 1 1 122 122 CYS CA C 122 57.052 57.052 58.370 -1.318 19806 3329 1 6 . 1 1 122 122 CYS CB C 122 30.834 30.834 27.441 3.393 19806 3330 1 6 . 1 1 123 123 TYR N N 123 127.672 127.672 126.574 1.098 19806 3331 1 6 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.784 0.226 19806 3332 1 6 . 1 1 123 123 TYR CA C 123 57.169 57.169 58.327 -1.158 19806 3333 1 6 . 1 1 123 123 TYR CB C 123 41.408 41.408 40.149 1.259 19806 3334 1 6 . 1 1 124 124 THR N N 124 120.833 120.833 121.809 -0.976 19806 3335 1 6 . 1 1 124 124 THR HA H 124 4.987 4.987 5.241 -0.254 19806 3336 1 6 . 1 1 124 124 THR CA C 124 57.153 57.153 58.508 -1.355 19806 3337 1 6 . 1 1 124 124 THR CB C 124 68.607 68.607 71.478 -2.871 19806 3338 1 6 . 1 1 125 125 GLY N N 125 114.347 114.347 112.197 2.150 19806 3339 1 6 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.957 -0.629 19806 3340 1 6 . 1 1 126 126 TRP N N 126 119.918 119.918 121.971 -2.053 19806 3341 1 6 . 1 1 126 126 TRP HA H 126 4.070 4.070 3.966 0.104 19806 3342 1 6 . 1 1 126 126 TRP CA C 126 60.564 60.564 58.970 1.594 19806 3343 1 6 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.079 0.560 19806 3344 1 6 . 1 1 127 127 TYR N N 127 113.911 113.911 112.731 1.180 19806 3345 1 6 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.702 0.292 19806 3346 1 6 . 1 1 127 127 TYR CA C 127 53.384 53.384 56.743 -3.359 19806 3347 1 6 . 1 1 127 127 TYR CB C 127 38.584 38.584 39.084 -0.500 19806 3348 1 6 . 1 1 128 128 GLY N N 128 105.181 105.181 107.446 -2.265 19806 3349 1 6 . 1 1 128 128 GLY CA C 128 45.189 45.189 43.186 2.003 19806 3350 1 6 . 1 1 129 129 TYR N N 129 116.588 116.588 119.637 -3.049 19806 3351 1 6 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.544 0.120 19806 3352 1 6 . 1 1 129 129 TYR CA C 129 59.565 59.565 58.959 0.606 19806 3353 1 6 . 1 1 129 129 TYR CB C 129 38.853 38.853 36.720 2.133 19806 3354 1 6 . 1 1 130 130 ASP N N 130 115.195 115.195 122.621 -7.426 19806 3355 1 6 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.675 -0.290 19806 3356 1 6 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.679 -1.549 19806 3357 1 6 . 1 1 130 130 ASP CB C 130 38.685 38.685 42.426 -3.741 19806 3358 1 6 . 1 1 131 131 LEU N N 131 124.887 124.887 123.883 1.004 19806 3359 1 6 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.819 -0.338 19806 3360 1 6 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.767 0.838 19806 3361 1 6 . 1 1 131 131 LEU CB C 131 42.441 42.441 42.311 0.130 19806 3362 1 6 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.747 -0.064 19806 3363 1 6 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.901 65.164 19806 3364 1 6 . 1 1 132 132 PRO CB C 132 32.327 32.327 32.976 -0.649 19806 3365 1 6 . 1 1 133 133 ILE N N 133 123.765 123.765 119.223 4.542 19806 3366 1 6 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.871 -0.142 19806 3367 1 6 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.012 1.848 19806 3368 1 6 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.156 -0.093 19806 3369 1 6 . 1 1 134 134 GLY N N 134 107.030 107.030 108.104 -1.074 19806 3370 1 6 . 1 1 134 134 GLY CA C 134 45.976 45.976 45.775 0.201 19806 3371 1 6 . 1 1 135 135 GLU N N 135 116.566 116.566 123.787 -7.221 19806 3372 1 6 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.084 0.580 19806 3373 1 6 . 1 1 135 135 GLU CA C 135 55.414 55.414 57.932 -2.518 19806 3374 1 6 . 1 1 135 135 GLU CB C 135 30.195 30.195 28.732 1.463 19806 3375 1 6 . 1 1 136 136 LEU N N 136 124.239 124.239 123.130 1.109 19806 3376 1 6 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.760 0.284 19806 3377 1 6 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.378 0.738 19806 3378 1 6 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.652 -0.645 19806 3379 1 6 . 1 1 137 137 LYS N N 137 117.225 117.225 117.211 0.014 19806 3380 1 6 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.814 0.049 19806 3381 1 6 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.692 0.763 19806 3382 1 6 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.749 -0.546 19806 3383 1 6 . 1 1 138 138 GLN N N 138 118.718 118.718 118.547 0.171 19806 3384 1 6 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.130 -0.078 19806 3385 1 6 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.695 -0.820 19806 3386 1 6 . 1 1 138 138 GLN CB C 138 28.235 28.235 27.961 0.274 19806 3387 1 6 . 1 1 139 139 THR N N 139 117.970 117.970 117.819 0.151 19806 3388 1 6 . 1 1 139 139 THR HA H 139 4.532 4.532 4.027 0.505 19806 3389 1 6 . 1 1 139 139 THR CA C 139 68.145 68.145 67.484 0.661 19806 3390 1 6 . 1 1 139 139 THR CB C 139 68.103 68.103 68.376 -0.273 19806 3391 1 6 . 1 1 140 140 ILE N N 140 120.391 120.391 120.268 0.123 19806 3392 1 6 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.650 0.077 19806 3393 1 6 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.955 0.301 19806 3394 1 6 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.321 0.792 19806 3395 1 6 . 1 1 141 141 GLN N N 141 118.917 118.917 118.327 0.590 19806 3396 1 6 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.965 0.050 19806 3397 1 6 . 1 1 141 141 GLN CA C 141 58.371 58.371 58.847 -0.476 19806 3398 1 6 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.271 -0.924 19806 3399 1 6 . 1 1 142 142 ASN N N 142 119.936 119.936 118.738 1.198 19806 3400 1 6 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.463 0.052 19806 3401 1 6 . 1 1 142 142 ASN CA C 142 55.799 55.799 56.558 -0.759 19806 3402 1 6 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.745 -1.115 19806 3403 1 6 . 1 1 143 143 VAL N N 143 123.195 123.195 119.515 3.680 19806 3404 1 6 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.414 -0.698 19806 3405 1 6 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.285 0.212 19806 3406 1 6 . 1 1 143 143 VAL CB C 143 30.989 30.989 30.630 0.359 19806 3407 1 6 . 1 1 144 144 LYS N N 144 120.348 120.348 119.055 1.293 19806 3408 1 6 . 1 1 144 144 LYS HA H 144 3.881 3.881 4.290 -0.409 19806 3409 1 6 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.861 0.262 19806 3410 1 6 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.203 -0.320 19806 3411 1 6 . 1 1 145 145 GLU N N 145 119.220 119.220 118.580 0.640 19806 3412 1 6 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.080 0.103 19806 3413 1 6 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.326 -0.148 19806 3414 1 6 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.602 -0.531 19806 3415 1 6 . 1 1 146 146 GLU N N 146 121.420 121.420 119.800 1.620 19806 3416 1 6 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.054 0.223 19806 3417 1 6 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.458 -0.340 19806 3418 1 6 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.162 -0.820 19806 3419 1 6 . 1 1 147 147 ASN N N 147 119.197 119.197 119.219 -0.022 19806 3420 1 6 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.591 -0.023 19806 3421 1 6 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.739 -1.588 19806 3422 1 6 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.894 -0.521 19806 3423 1 6 . 1 1 148 148 ALA N N 148 123.672 123.672 120.917 2.755 19806 3424 1 6 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.419 -0.296 19806 3425 1 6 . 1 1 148 148 ALA CA C 148 55.133 55.133 53.086 2.047 19806 3426 1 6 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.816 -1.209 19806 3427 1 6 . 1 1 149 149 ALA N N 149 119.979 119.979 121.472 -1.493 19806 3428 1 6 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.215 0.046 19806 3429 1 6 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.306 0.339 19806 3430 1 6 . 1 1 149 149 ALA CB C 149 17.738 17.738 19.057 -1.319 19806 3431 1 6 . 1 1 150 150 PHE N N 150 119.592 119.592 120.674 -1.082 19806 3432 1 6 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.164 0.060 19806 3433 1 6 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.615 -0.607 19806 3434 1 6 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.314 -0.252 19806 3435 1 6 . 1 1 151 151 LYS N N 151 116.869 116.869 118.010 -1.141 19806 3436 1 6 . 1 1 151 151 LYS HA H 151 3.906 3.906 3.926 -0.020 19806 3437 1 6 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.214 0.556 19806 3438 1 6 . 1 1 151 151 LYS CB C 151 32.741 32.741 31.963 0.778 19806 3439 1 6 . 1 1 152 152 GLU N N 152 115.868 115.868 119.027 -3.159 19806 3440 1 6 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.138 -0.085 19806 3441 1 6 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.444 0.212 19806 3442 1 6 . 1 1 152 152 GLU CB C 152 29.753 29.753 30.195 -0.442 19806 3443 1 6 . 1 1 153 153 ILE N N 153 110.437 110.437 117.870 -7.433 19806 3444 1 6 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.860 0.316 19806 3445 1 6 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.897 -1.863 19806 3446 1 6 . 1 1 153 153 ILE CB C 153 39.272 39.272 39.313 -0.041 19806 3447 1 6 . 1 1 154 154 HIS N N 154 117.779 117.779 117.008 0.771 19806 3448 1 6 . 1 1 154 154 HIS HA H 154 5.174 5.174 4.919 0.255 19806 3449 1 6 . 1 1 154 154 HIS CA C 154 51.616 51.616 53.026 -1.410 19806 3450 1 6 . 1 1 154 154 HIS CB C 154 28.547 28.547 31.310 -2.763 19806 3451 1 7 . 1 1 3 3 SER N N 3 114.847 114.847 116.686 -1.839 19806 3452 1 7 . 1 1 3 3 SER HA H 3 4.463 4.463 4.356 0.107 19806 3453 1 7 . 1 1 3 3 SER CA C 3 58.340 58.340 59.218 -0.878 19806 3454 1 7 . 1 1 3 3 SER CB C 3 63.457 63.457 63.675 -0.218 19806 3455 1 7 . 1 1 4 4 GLU N N 4 121.498 121.498 119.672 1.826 19806 3456 1 7 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.071 0.261 19806 3457 1 7 . 1 1 4 4 GLU CA C 4 56.443 56.443 56.682 -0.239 19806 3458 1 7 . 1 1 4 4 GLU CB C 4 29.966 29.966 29.933 0.032 19806 3459 1 7 . 1 1 5 5 LEU N N 5 121.589 121.589 118.865 2.724 19806 3460 1 7 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.159 0.278 19806 3461 1 7 . 1 1 5 5 LEU CA C 5 55.019 55.019 55.809 -0.790 19806 3462 1 7 . 1 1 5 5 LEU CB C 5 42.243 42.243 42.178 0.065 19806 3463 1 7 . 1 1 6 6 THR N N 6 113.708 113.708 114.118 -0.410 19806 3464 1 7 . 1 1 6 6 THR HA H 6 4.470 4.470 4.519 -0.049 19806 3465 1 7 . 1 1 6 6 THR CA C 6 61.409 61.409 61.736 -0.327 19806 3466 1 7 . 1 1 6 6 THR CB C 6 69.544 69.544 69.503 0.041 19806 3467 1 7 . 1 1 7 7 THR N N 7 114.945 114.945 115.849 -0.904 19806 3468 1 7 . 1 1 7 7 THR HA H 7 4.415 4.415 4.763 -0.348 19806 3469 1 7 . 1 1 7 7 THR CA C 7 61.435 61.435 62.036 -0.601 19806 3470 1 7 . 1 1 7 7 THR CB C 7 69.506 69.506 70.830 -1.324 19806 3471 1 7 . 1 1 8 8 GLN N N 8 121.368 121.368 124.679 -3.311 19806 3472 1 7 . 1 1 8 8 GLN CA C 8 55.684 55.684 56.575 -0.891 19806 3473 1 7 . 1 1 9 9 ASP N N 9 120.595 120.595 120.212 0.383 19806 3474 1 7 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.776 -0.129 19806 3475 1 7 . 1 1 9 9 ASP CA C 9 54.115 54.115 54.198 -0.083 19806 3476 1 7 . 1 1 9 9 ASP CB C 9 41.328 41.328 40.504 0.824 19806 3477 1 7 . 1 1 10 10 GLY N N 10 106.984 106.984 110.513 -3.529 19806 3478 1 7 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.740 -0.245 19806 3479 1 7 . 1 1 11 11 GLU N N 11 120.879 120.879 122.628 -1.749 19806 3480 1 7 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.381 -0.192 19806 3481 1 7 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.392 0.118 19806 3482 1 7 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.582 1.487 19806 3483 1 7 . 1 1 12 12 ASP N N 12 126.686 126.686 123.174 3.512 19806 3484 1 7 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.726 0.024 19806 3485 1 7 . 1 1 12 12 ASP CA C 12 54.347 54.347 54.172 0.175 19806 3486 1 7 . 1 1 12 12 ASP CB C 12 42.771 42.771 42.157 0.614 19806 3487 1 7 . 1 1 13 13 PHE N N 13 128.055 128.055 122.595 5.460 19806 3488 1 7 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.923 -0.511 19806 3489 1 7 . 1 1 13 13 PHE CA C 13 62.551 62.551 60.744 1.807 19806 3490 1 7 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.686 0.147 19806 3491 1 7 . 1 1 14 14 LYS N N 14 117.498 117.498 118.148 -0.650 19806 3492 1 7 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.364 0.217 19806 3493 1 7 . 1 1 14 14 LYS CA C 14 59.461 59.461 57.404 2.057 19806 3494 1 7 . 1 1 14 14 LYS CB C 14 31.344 31.344 30.818 0.526 19806 3495 1 7 . 1 1 15 15 SER N N 15 113.775 113.775 115.146 -1.371 19806 3496 1 7 . 1 1 15 15 SER HA H 15 4.167 4.167 4.024 0.143 19806 3497 1 7 . 1 1 15 15 SER CA C 15 61.099 61.099 61.787 -0.688 19806 3498 1 7 . 1 1 15 15 SER CB C 15 62.428 62.428 62.899 -0.471 19806 3499 1 7 . 1 1 16 16 PHE N N 16 122.292 122.292 119.452 2.840 19806 3500 1 7 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.319 -0.029 19806 3501 1 7 . 1 1 16 16 PHE CA C 16 59.773 59.773 59.997 -0.224 19806 3502 1 7 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.281 -1.106 19806 3503 1 7 . 1 1 17 17 LEU N N 17 122.472 122.472 120.461 2.011 19806 3504 1 7 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.409 -0.559 19806 3505 1 7 . 1 1 17 17 LEU CA C 17 56.619 56.619 56.724 -0.105 19806 3506 1 7 . 1 1 17 17 LEU CB C 17 40.462 40.462 39.999 0.463 19806 3507 1 7 . 1 1 18 18 ASP N N 18 117.331 117.331 120.669 -3.338 19806 3508 1 7 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.227 -0.112 19806 3509 1 7 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.770 -1.375 19806 3510 1 7 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.934 -0.581 19806 3511 1 7 . 1 1 19 19 LYS N N 19 120.032 120.032 119.766 0.266 19806 3512 1 7 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.983 -0.306 19806 3513 1 7 . 1 1 19 19 LYS CA C 19 59.067 59.067 58.952 0.116 19806 3514 1 7 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.477 -0.541 19806 3515 1 7 . 1 1 20 20 PHE N N 20 119.607 119.607 119.428 0.179 19806 3516 1 7 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.291 -0.182 19806 3517 1 7 . 1 1 20 20 PHE CA C 20 62.090 62.090 61.290 0.800 19806 3518 1 7 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.196 1.273 19806 3519 1 7 . 1 1 21 21 THR N N 21 101.473 101.473 108.865 -7.392 19806 3520 1 7 . 1 1 21 21 THR HA H 21 4.259 4.259 4.227 0.032 19806 3521 1 7 . 1 1 21 21 THR CA C 21 61.774 61.774 63.836 -2.062 19806 3522 1 7 . 1 1 22 22 SER N N 22 111.453 111.453 113.975 -2.522 19806 3523 1 7 . 1 1 22 22 SER HA H 22 4.165 4.165 4.530 -0.365 19806 3524 1 7 . 1 1 22 22 SER CA C 22 58.215 58.215 57.611 0.604 19806 3525 1 7 . 1 1 22 22 SER CB C 22 64.570 64.570 63.386 1.184 19806 3526 1 7 . 1 1 23 23 SER N N 23 114.184 114.184 116.580 -2.396 19806 3527 1 7 . 1 1 23 23 SER HA H 23 4.764 4.764 4.830 -0.066 19806 3528 1 7 . 1 1 23 23 SER CA C 23 55.669 55.669 58.096 -2.428 19806 3529 1 7 . 1 1 23 23 SER CB C 23 64.011 64.011 65.064 -1.052 19806 3530 1 7 . 1 1 24 24 ALA N N 24 133.370 133.370 131.784 1.586 19806 3531 1 7 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.089 -0.133 19806 3532 1 7 . 1 1 24 24 ALA CA C 24 55.106 55.106 55.788 -0.682 19806 3533 1 7 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.325 0.510 19806 3534 1 7 . 1 1 25 25 ALA N N 25 117.430 117.430 120.078 -2.648 19806 3535 1 7 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.333 -0.016 19806 3536 1 7 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.583 0.618 19806 3537 1 7 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.497 -0.148 19806 3538 1 7 . 1 1 26 26 PHE N N 26 116.042 116.042 116.794 -0.752 19806 3539 1 7 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.602 -0.292 19806 3540 1 7 . 1 1 26 26 PHE CA C 26 60.759 60.759 60.825 -0.066 19806 3541 1 7 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.594 -0.284 19806 3542 1 7 . 1 1 27 27 GLN N N 27 121.820 121.820 121.458 0.362 19806 3543 1 7 . 1 1 27 27 GLN HA H 27 3.391 3.391 3.989 -0.598 19806 3544 1 7 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.660 0.434 19806 3545 1 7 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.447 -0.990 19806 3546 1 7 . 1 1 28 28 TYR N N 28 111.517 111.517 115.557 -4.040 19806 3547 1 7 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.919 0.211 19806 3548 1 7 . 1 1 28 28 TYR CA C 28 62.357 62.357 59.762 2.595 19806 3549 1 7 . 1 1 28 28 TYR CB C 28 38.568 38.568 38.176 0.392 19806 3550 1 7 . 1 1 29 29 THR N N 29 106.324 106.324 111.658 -5.334 19806 3551 1 7 . 1 1 29 29 THR HA H 29 4.489 4.489 4.471 0.018 19806 3552 1 7 . 1 1 29 29 THR CA C 29 63.765 63.765 61.536 2.229 19806 3553 1 7 . 1 1 29 29 THR CB C 29 69.568 69.568 68.887 0.681 19806 3554 1 7 . 1 1 30 30 ARG N N 30 117.696 117.696 119.326 -1.630 19806 3555 1 7 . 1 1 30 30 ARG HA H 30 4.701 4.701 3.787 0.914 19806 3556 1 7 . 1 1 30 30 ARG CA C 30 52.760 52.760 54.571 -1.811 19806 3557 1 7 . 1 1 30 30 ARG CB C 30 35.047 35.047 30.454 4.593 19806 3558 1 7 . 1 1 31 31 VAL N N 31 119.395 119.395 118.355 1.040 19806 3559 1 7 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.560 -0.330 19806 3560 1 7 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.085 1.106 19806 3561 1 7 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.255 -2.082 19806 3562 1 7 . 1 1 32 32 LYS N N 32 126.124 126.124 125.745 0.379 19806 3563 1 7 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.568 -0.384 19806 3564 1 7 . 1 1 32 32 LYS CA C 32 53.958 53.958 54.744 -0.786 19806 3565 1 7 . 1 1 32 32 LYS CB C 32 31.112 31.112 33.318 -2.206 19806 3566 1 7 . 1 1 33 33 PHE N N 33 119.303 119.303 117.890 1.413 19806 3567 1 7 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.965 -0.451 19806 3568 1 7 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.886 0.386 19806 3569 1 7 . 1 1 33 33 PHE CB C 33 40.378 40.378 39.940 0.438 19806 3570 1 7 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.792 0.176 19806 3571 1 7 . 1 1 34 34 PRO CA C 34 61.633 61.633 63.014 -1.381 19806 3572 1 7 . 1 1 34 34 PRO CB C 34 33.732 33.732 33.217 0.515 19806 3573 1 7 . 1 1 35 35 LEU N N 35 120.016 120.016 118.132 1.884 19806 3574 1 7 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.570 -0.348 19806 3575 1 7 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.513 1.327 19806 3576 1 7 . 1 1 35 35 LEU CB C 35 41.244 41.244 45.057 -3.813 19806 3577 1 7 . 1 1 36 36 LYS N N 36 117.066 117.066 118.693 -1.627 19806 3578 1 7 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.397 -0.422 19806 3579 1 7 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.556 2.691 19806 3580 1 7 . 1 1 36 36 LYS CB C 36 32.832 32.832 33.466 -0.634 19806 3581 1 7 . 1 1 37 37 THR N N 37 117.574 117.574 115.512 2.062 19806 3582 1 7 . 1 1 37 37 THR HA H 37 4.797 4.797 4.840 -0.043 19806 3583 1 7 . 1 1 37 37 THR CA C 37 60.396 60.396 59.518 0.878 19806 3584 1 7 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.667 0.352 19806 3585 1 7 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.497 -0.574 19806 3586 1 7 . 1 1 38 38 PRO CB C 38 32.631 32.631 33.023 -0.392 19806 3587 1 7 . 1 1 39 39 ILE N N 39 119.949 119.949 116.999 2.950 19806 3588 1 7 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.420 -0.181 19806 3589 1 7 . 1 1 39 39 ILE CA C 39 62.133 62.133 63.011 -0.878 19806 3590 1 7 . 1 1 40 40 THR N N 40 123.962 123.962 114.463 9.499 19806 3591 1 7 . 1 1 40 40 THR HA H 40 5.057 5.057 4.140 0.917 19806 3592 1 7 . 1 1 40 40 THR CA C 40 62.262 62.262 62.610 -0.348 19806 3593 1 7 . 1 1 40 40 THR CB C 40 69.891 69.891 67.414 2.477 19806 3594 1 7 . 1 1 41 41 LEU N N 41 125.633 125.633 117.835 7.798 19806 3595 1 7 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.923 0.179 19806 3596 1 7 . 1 1 41 41 LEU CA C 41 52.638 52.638 52.624 0.014 19806 3597 1 7 . 1 1 41 41 LEU CB C 41 45.180 45.180 43.649 1.531 19806 3598 1 7 . 1 1 42 42 LEU N N 42 120.788 120.788 120.950 -0.162 19806 3599 1 7 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.596 0.152 19806 3600 1 7 . 1 1 42 42 LEU CA C 42 53.724 53.724 53.564 0.160 19806 3601 1 7 . 1 1 42 42 LEU CB C 42 44.384 44.384 41.074 3.310 19806 3602 1 7 . 1 1 43 43 ALA N N 43 123.073 123.073 129.643 -6.570 19806 3603 1 7 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.234 0.196 19806 3604 1 7 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.477 -1.189 19806 3605 1 7 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.407 0.607 19806 3606 1 7 . 1 1 44 44 ASP N N 44 118.196 118.196 117.977 0.219 19806 3607 1 7 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.376 0.050 19806 3608 1 7 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.464 -0.436 19806 3609 1 7 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.221 -0.011 19806 3610 1 7 . 1 1 45 45 ASP N N 45 115.018 115.018 118.632 -3.614 19806 3611 1 7 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.560 -0.091 19806 3612 1 7 . 1 1 45 45 ASP CA C 45 53.794 53.794 53.723 0.071 19806 3613 1 7 . 1 1 45 45 ASP CB C 45 39.864 39.864 40.962 -1.098 19806 3614 1 7 . 1 1 46 46 GLY N N 46 107.499 107.499 107.678 -0.179 19806 3615 1 7 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.455 0.459 19806 3616 1 7 . 1 1 47 47 GLU N N 47 117.331 117.331 119.111 -1.780 19806 3617 1 7 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.445 0.086 19806 3618 1 7 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.419 0.519 19806 3619 1 7 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.590 2.543 19806 3620 1 7 . 1 1 48 48 THR N N 48 118.462 118.462 118.790 -0.328 19806 3621 1 7 . 1 1 48 48 THR HA H 48 4.243 4.243 4.305 -0.062 19806 3622 1 7 . 1 1 48 48 THR CA C 48 62.834 62.834 62.650 0.184 19806 3623 1 7 . 1 1 48 48 THR CB C 48 68.649 68.649 69.255 -0.606 19806 3624 1 7 . 1 1 49 49 GLU N N 49 123.834 123.834 128.411 -4.577 19806 3625 1 7 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.508 0.437 19806 3626 1 7 . 1 1 49 49 GLU CA C 49 55.358 55.358 57.139 -1.782 19806 3627 1 7 . 1 1 49 49 GLU CB C 49 31.395 31.395 29.042 2.353 19806 3628 1 7 . 1 1 50 50 LYS N N 50 122.868 122.868 127.033 -4.165 19806 3629 1 7 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.487 0.154 19806 3630 1 7 . 1 1 50 50 LYS CA C 50 54.111 54.111 55.480 -1.369 19806 3631 1 7 . 1 1 50 50 LYS CB C 50 35.312 35.312 33.572 1.740 19806 3632 1 7 . 1 1 51 51 THR N N 51 111.386 111.386 117.795 -6.409 19806 3633 1 7 . 1 1 51 51 THR HA H 51 5.619 5.619 4.591 1.028 19806 3634 1 7 . 1 1 51 51 THR CA C 51 58.980 58.980 60.891 -1.911 19806 3635 1 7 . 1 1 51 51 THR CB C 51 71.277 71.277 69.872 1.405 19806 3636 1 7 . 1 1 52 52 PHE N N 52 120.631 120.631 118.067 2.564 19806 3637 1 7 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.901 0.062 19806 3638 1 7 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.231 -1.102 19806 3639 1 7 . 1 1 52 52 PHE CB C 52 41.049 41.049 41.124 -0.075 19806 3640 1 7 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.548 -0.100 19806 3641 1 7 . 1 1 53 53 PRO CA C 53 62.489 62.489 63.083 -0.594 19806 3642 1 7 . 1 1 53 53 PRO CB C 53 32.240 32.240 32.399 -0.159 19806 3643 1 7 . 1 1 54 54 PHE N N 54 128.034 128.034 123.118 4.916 19806 3644 1 7 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.513 0.315 19806 3645 1 7 . 1 1 54 54 PHE CA C 54 55.509 55.509 58.213 -2.704 19806 3646 1 7 . 1 1 54 54 PHE CB C 54 37.028 37.028 41.094 -4.066 19806 3647 1 7 . 1 1 55 55 THR N N 55 111.757 111.757 115.773 -4.016 19806 3648 1 7 . 1 1 55 55 THR HA H 55 4.413 4.413 4.015 0.398 19806 3649 1 7 . 1 1 55 55 THR CA C 55 60.578 60.578 59.489 1.089 19806 3650 1 7 . 1 1 55 55 THR CB C 55 69.447 69.447 71.739 -2.292 19806 3651 1 7 . 1 1 56 56 LYS N N 56 118.734 118.734 119.335 -0.601 19806 3652 1 7 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.165 -1.683 19806 3653 1 7 . 1 1 56 56 LYS CA C 56 59.381 59.381 57.768 1.613 19806 3654 1 7 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.292 0.958 19806 3655 1 7 . 1 1 57 57 GLU N N 57 119.675 119.675 117.795 1.880 19806 3656 1 7 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.103 0.166 19806 3657 1 7 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.880 -1.728 19806 3658 1 7 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.627 -2.677 19806 3659 1 7 . 1 1 58 58 LYS N N 58 114.700 114.700 117.501 -2.801 19806 3660 1 7 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.326 -0.014 19806 3661 1 7 . 1 1 58 58 LYS CA C 58 55.595 55.595 57.244 -1.649 19806 3662 1 7 . 1 1 58 58 LYS CB C 58 32.011 32.011 33.243 -1.232 19806 3663 1 7 . 1 1 59 59 TRP N N 59 118.204 118.204 120.603 -2.399 19806 3664 1 7 . 1 1 59 59 TRP HA H 59 5.099 5.099 4.699 0.400 19806 3665 1 7 . 1 1 59 59 TRP CA C 59 55.577 55.577 56.574 -0.997 19806 3666 1 7 . 1 1 59 59 TRP CB C 59 32.037 32.037 28.380 3.657 19806 3667 1 7 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.524 -0.261 19806 3668 1 7 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.687 -2.966 19806 3669 1 7 . 1 1 60 60 PRO CB C 60 29.849 29.849 31.830 -1.981 19806 3670 1 7 . 1 1 61 61 LEU N N 61 123.758 123.758 126.130 -2.372 19806 3671 1 7 . 1 1 61 61 LEU HA H 61 3.639 3.639 3.997 -0.358 19806 3672 1 7 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.536 0.339 19806 3673 1 7 . 1 1 61 61 LEU CB C 61 40.815 40.815 41.477 -0.662 19806 3674 1 7 . 1 1 62 62 LEU N N 62 124.052 124.052 126.986 -2.934 19806 3675 1 7 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.120 0.235 19806 3676 1 7 . 1 1 62 62 LEU CA C 62 53.992 53.992 54.153 -0.161 19806 3677 1 7 . 1 1 62 62 LEU CB C 62 44.686 44.686 41.273 3.413 19806 3678 1 7 . 1 1 63 63 ASP N N 63 117.271 117.271 118.599 -1.328 19806 3679 1 7 . 1 1 63 63 ASP HA H 63 5.033 5.033 4.841 0.192 19806 3680 1 7 . 1 1 63 63 ASP CA C 63 51.101 51.101 52.898 -1.797 19806 3681 1 7 . 1 1 63 63 ASP CB C 63 43.345 43.345 42.690 0.655 19806 3682 1 7 . 1 1 64 64 SER N N 64 112.856 112.856 113.520 -0.664 19806 3683 1 7 . 1 1 64 64 SER HA H 64 3.865 3.865 4.586 -0.721 19806 3684 1 7 . 1 1 64 64 SER CA C 64 60.910 60.910 59.690 1.220 19806 3685 1 7 . 1 1 64 64 SER CB C 64 62.378 62.378 63.495 -1.117 19806 3686 1 7 . 1 1 65 65 GLU N N 65 120.070 120.070 120.936 -0.866 19806 3687 1 7 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.344 -0.326 19806 3688 1 7 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.479 -0.136 19806 3689 1 7 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.961 -1.074 19806 3690 1 7 . 1 1 66 66 THR N N 66 115.852 115.852 114.897 0.955 19806 3691 1 7 . 1 1 66 66 THR HA H 66 3.991 3.991 4.577 -0.587 19806 3692 1 7 . 1 1 66 66 THR CA C 66 65.804 65.804 64.297 1.507 19806 3693 1 7 . 1 1 66 66 THR CB C 66 68.451 68.451 69.800 -1.349 19806 3694 1 7 . 1 1 67 67 MET N N 67 113.585 113.585 122.485 -8.900 19806 3695 1 7 . 1 1 67 67 MET HA H 67 4.267 4.267 4.452 -0.185 19806 3696 1 7 . 1 1 67 67 MET CA C 67 52.135 52.135 54.103 -1.968 19806 3697 1 7 . 1 1 67 67 MET CB C 67 28.963 28.963 30.285 -1.323 19806 3698 1 7 . 1 1 68 68 LYS N N 68 118.462 118.462 120.533 -2.071 19806 3699 1 7 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.646 -0.276 19806 3700 1 7 . 1 1 68 68 LYS CA C 68 55.482 55.482 54.408 1.074 19806 3701 1 7 . 1 1 68 68 LYS CB C 68 34.179 34.179 34.360 -0.181 19806 3702 1 7 . 1 1 69 69 GLU N N 69 121.700 121.700 120.630 1.070 19806 3703 1 7 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.929 -0.405 19806 3704 1 7 . 1 1 69 69 GLU CA C 69 55.942 55.942 55.987 -0.045 19806 3705 1 7 . 1 1 69 69 GLU CB C 69 30.424 30.424 30.524 -0.100 19806 3706 1 7 . 1 1 70 70 GLU N N 70 123.445 123.445 125.643 -2.198 19806 3707 1 7 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.645 0.052 19806 3708 1 7 . 1 1 70 70 GLU CA C 70 55.473 55.473 54.756 0.717 19806 3709 1 7 . 1 1 70 70 GLU CB C 70 33.162 33.162 33.281 -0.118 19806 3710 1 7 . 1 1 71 71 ARG N N 71 122.150 122.150 123.245 -1.095 19806 3711 1 7 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.657 0.494 19806 3712 1 7 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.052 0.396 19806 3713 1 7 . 1 1 71 71 ARG CB C 71 31.703 31.703 31.859 -0.156 19806 3714 1 7 . 1 1 72 72 ILE N N 72 125.686 125.686 128.671 -2.985 19806 3715 1 7 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.402 0.194 19806 3716 1 7 . 1 1 72 72 ILE CA C 72 59.512 59.512 60.332 -0.820 19806 3717 1 7 . 1 1 72 72 ILE CB C 72 41.095 41.095 39.442 1.653 19806 3718 1 7 . 1 1 73 73 THR N N 73 121.600 121.600 123.388 -1.788 19806 3719 1 7 . 1 1 73 73 THR HA H 73 4.603 4.603 4.237 0.366 19806 3720 1 7 . 1 1 73 73 THR CA C 73 61.937 61.937 62.865 -0.928 19806 3721 1 7 . 1 1 73 73 THR CB C 73 68.669 68.669 67.206 1.463 19806 3722 1 7 . 1 1 74 74 GLN N N 74 124.607 124.607 123.154 1.453 19806 3723 1 7 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.339 0.242 19806 3724 1 7 . 1 1 74 74 GLN CA C 74 54.689 54.689 56.308 -1.619 19806 3725 1 7 . 1 1 74 74 GLN CB C 74 29.490 29.490 29.555 -0.066 19806 3726 1 7 . 1 1 75 75 GLU N N 75 122.962 122.962 118.952 4.010 19806 3727 1 7 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.424 -0.365 19806 3728 1 7 . 1 1 75 75 GLU CA C 75 58.845 58.845 56.817 2.028 19806 3729 1 7 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.260 -0.687 19806 3730 1 7 . 1 1 76 76 GLU N N 76 115.466 115.466 118.529 -3.063 19806 3731 1 7 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.561 -0.253 19806 3732 1 7 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.508 0.269 19806 3733 1 7 . 1 1 76 76 GLU CB C 76 29.072 29.072 30.267 -1.195 19806 3734 1 7 . 1 1 77 77 GLY N N 77 106.771 106.771 106.697 0.074 19806 3735 1 7 . 1 1 77 77 GLY CA C 77 45.014 45.014 44.708 0.306 19806 3736 1 7 . 1 1 78 78 GLY N N 78 108.535 108.535 107.439 1.096 19806 3737 1 7 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.564 0.143 19806 3738 1 7 . 1 1 79 79 ILE N N 79 121.066 121.066 122.433 -1.367 19806 3739 1 7 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.588 0.219 19806 3740 1 7 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.156 -0.813 19806 3741 1 7 . 1 1 79 79 ILE CB C 79 39.220 39.220 37.214 2.006 19806 3742 1 7 . 1 1 80 80 TYR N N 80 130.709 130.709 129.891 0.818 19806 3743 1 7 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.115 0.149 19806 3744 1 7 . 1 1 80 80 TYR CA C 80 58.161 58.161 59.452 -1.291 19806 3745 1 7 . 1 1 80 80 TYR CB C 80 40.621 40.621 38.697 1.924 19806 3746 1 7 . 1 1 81 81 VAL N N 81 126.965 126.965 126.159 0.806 19806 3747 1 7 . 1 1 81 81 VAL HA H 81 4.854 4.854 5.105 -0.251 19806 3748 1 7 . 1 1 81 81 VAL CA C 81 60.457 60.457 59.672 0.784 19806 3749 1 7 . 1 1 81 81 VAL CB C 81 35.004 35.004 36.619 -1.615 19806 3750 1 7 . 1 1 82 82 SER N N 82 120.914 120.914 118.611 2.303 19806 3751 1 7 . 1 1 82 82 SER HA H 82 5.185 5.185 5.116 0.069 19806 3752 1 7 . 1 1 82 82 SER CA C 82 55.260 55.260 56.994 -1.734 19806 3753 1 7 . 1 1 82 82 SER CB C 82 64.785 64.785 65.035 -0.250 19806 3754 1 7 . 1 1 83 83 LYS N N 83 119.415 119.415 121.465 -2.050 19806 3755 1 7 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.695 0.083 19806 3756 1 7 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.691 0.067 19806 3757 1 7 . 1 1 83 83 LYS CB C 83 35.514 35.514 35.773 -0.259 19806 3758 1 7 . 1 1 84 84 PHE N N 84 119.220 119.220 117.280 1.940 19806 3759 1 7 . 1 1 84 84 PHE HA H 84 5.441 5.441 5.311 0.130 19806 3760 1 7 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.158 1.256 19806 3761 1 7 . 1 1 84 84 PHE CB C 84 37.523 37.523 39.014 -1.491 19806 3762 1 7 . 1 1 85 85 THR N N 85 119.257 119.257 114.747 4.510 19806 3763 1 7 . 1 1 85 85 THR HA H 85 4.057 4.057 4.086 -0.029 19806 3764 1 7 . 1 1 85 85 THR CA C 85 62.660 62.660 63.833 -1.173 19806 3765 1 7 . 1 1 85 85 THR CB C 85 67.698 67.698 69.335 -1.637 19806 3766 1 7 . 1 1 86 86 LEU N N 86 121.612 121.612 122.962 -1.350 19806 3767 1 7 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.691 -0.093 19806 3768 1 7 . 1 1 86 86 LEU CA C 86 55.245 55.245 53.658 1.587 19806 3769 1 7 . 1 1 86 86 LEU CB C 86 44.657 44.657 44.638 0.019 19806 3770 1 7 . 1 1 87 87 ASN N N 87 127.684 127.684 120.866 6.818 19806 3771 1 7 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.660 0.351 19806 3772 1 7 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.024 -0.725 19806 3773 1 7 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.768 -0.173 19806 3774 1 7 . 1 1 88 88 GLU N N 88 120.509 120.509 122.735 -2.226 19806 3775 1 7 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.459 0.398 19806 3776 1 7 . 1 1 88 88 GLU CA C 88 54.382 54.382 56.013 -1.631 19806 3777 1 7 . 1 1 88 88 GLU CB C 88 29.808 29.808 30.150 -0.342 19806 3778 1 7 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.374 0.007 19806 3779 1 7 . 1 1 89 89 PRO CA C 89 65.898 65.898 65.284 0.614 19806 3780 1 7 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.173 0.178 19806 3781 1 7 . 1 1 90 90 LYS N N 90 107.288 107.288 115.551 -8.263 19806 3782 1 7 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.441 0.243 19806 3783 1 7 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.850 -0.871 19806 3784 1 7 . 1 1 90 90 LYS CB C 90 32.994 32.994 32.996 -0.002 19806 3785 1 7 . 1 1 91 91 HIS N N 91 119.523 119.523 119.509 0.014 19806 3786 1 7 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.350 0.427 19806 3787 1 7 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.842 -1.137 19806 3788 1 7 . 1 1 91 91 HIS CB C 91 32.194 32.194 31.385 0.809 19806 3789 1 7 . 1 1 92 92 LYS N N 92 122.527 122.527 126.735 -4.208 19806 3790 1 7 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.845 0.284 19806 3791 1 7 . 1 1 92 92 LYS CA C 92 54.291 54.291 54.933 -0.642 19806 3792 1 7 . 1 1 92 92 LYS CB C 92 37.479 37.479 35.552 1.927 19806 3793 1 7 . 1 1 93 93 ILE N N 93 121.564 121.564 123.276 -1.712 19806 3794 1 7 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.363 0.947 19806 3795 1 7 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.773 0.364 19806 3796 1 7 . 1 1 93 93 ILE CB C 93 41.088 41.088 40.587 0.501 19806 3797 1 7 . 1 1 94 94 PHE N N 94 128.955 128.955 129.847 -0.892 19806 3798 1 7 . 1 1 94 94 PHE HA H 94 4.900 4.900 5.345 -0.445 19806 3799 1 7 . 1 1 94 94 PHE CA C 94 55.843 55.843 55.615 0.228 19806 3800 1 7 . 1 1 95 95 GLU N N 95 124.809 124.809 124.799 0.010 19806 3801 1 7 . 1 1 95 95 GLU HA H 95 5.418 5.418 4.955 0.463 19806 3802 1 7 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.405 1.076 19806 3803 1 7 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.400 1.760 19806 3804 1 7 . 1 1 96 96 ALA N N 96 123.759 123.759 121.847 1.912 19806 3805 1 7 . 1 1 96 96 ALA HA H 96 5.379 5.379 5.089 0.290 19806 3806 1 7 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.646 -1.105 19806 3807 1 7 . 1 1 96 96 ALA CB C 96 23.830 23.830 21.498 2.332 19806 3808 1 7 . 1 1 97 97 GLY N N 97 106.592 106.592 110.528 -3.936 19806 3809 1 7 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.253 0.182 19806 3810 1 7 . 1 1 98 98 TYR N N 98 119.250 119.250 120.551 -1.301 19806 3811 1 7 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.379 0.439 19806 3812 1 7 . 1 1 98 98 TYR CA C 98 59.387 59.387 57.923 1.464 19806 3813 1 7 . 1 1 98 98 TYR CB C 98 38.122 38.122 38.077 0.045 19806 3814 1 7 . 1 1 99 99 GLU N N 99 123.080 123.080 126.474 -3.394 19806 3815 1 7 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.056 -0.047 19806 3816 1 7 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.690 -0.280 19806 3817 1 7 . 1 1 99 99 GLU CB C 99 30.254 30.254 29.746 0.508 19806 3818 1 7 . 1 1 100 100 GLU N N 100 116.459 116.459 114.502 1.957 19806 3819 1 7 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.480 -0.444 19806 3820 1 7 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.034 1.370 19806 3821 1 7 . 1 1 100 100 GLU CB C 100 27.576 27.576 29.883 -2.307 19806 3822 1 7 . 1 1 101 101 SER N N 101 113.069 113.069 116.546 -3.477 19806 3823 1 7 . 1 1 101 101 SER HA H 101 4.839 4.839 4.584 0.255 19806 3824 1 7 . 1 1 101 101 SER CA C 101 56.024 56.024 57.374 -1.350 19806 3825 1 7 . 1 1 101 101 SER CB C 101 64.806 64.806 65.096 -0.290 19806 3826 1 7 . 1 1 102 102 GLU N N 102 120.439 120.439 120.979 -0.540 19806 3827 1 7 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.332 0.057 19806 3828 1 7 . 1 1 102 102 GLU CA C 102 55.804 55.804 56.297 -0.493 19806 3829 1 7 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.087 -0.102 19806 3830 1 7 . 1 1 103 103 VAL N N 103 118.899 118.899 117.072 1.827 19806 3831 1 7 . 1 1 103 103 VAL HA H 103 4.086 4.086 3.869 0.217 19806 3832 1 7 . 1 1 103 103 VAL CA C 103 62.699 62.699 62.727 -0.028 19806 3833 1 7 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.163 0.098 19806 3834 1 7 . 1 1 104 104 ASP N N 104 120.965 120.965 119.610 1.355 19806 3835 1 7 . 1 1 104 104 ASP HA H 104 5.003 5.003 5.143 -0.140 19806 3836 1 7 . 1 1 104 104 ASP CA C 104 54.914 54.914 54.590 0.324 19806 3837 1 7 . 1 1 104 104 ASP CB C 104 42.791 42.791 44.114 -1.323 19806 3838 1 7 . 1 1 105 105 LEU N N 105 120.365 120.365 119.122 1.243 19806 3839 1 7 . 1 1 105 105 LEU HA H 105 5.295 5.295 5.312 -0.017 19806 3840 1 7 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.703 -0.272 19806 3841 1 7 . 1 1 105 105 LEU CB C 105 46.001 46.001 46.087 -0.085 19806 3842 1 7 . 1 1 106 106 ARG N N 106 126.289 126.289 123.659 2.630 19806 3843 1 7 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.240 0.585 19806 3844 1 7 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.290 0.382 19806 3845 1 7 . 1 1 106 106 ARG CB C 106 33.920 33.920 34.556 -0.636 19806 3846 1 7 . 1 1 107 107 VAL N N 107 126.145 126.145 118.856 7.289 19806 3847 1 7 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.604 0.075 19806 3848 1 7 . 1 1 107 107 VAL CA C 107 61.671 61.671 60.430 1.241 19806 3849 1 7 . 1 1 107 107 VAL CB C 107 35.350 35.350 36.612 -1.262 19806 3850 1 7 . 1 1 108 108 GLU N N 108 127.093 127.093 122.292 4.801 19806 3851 1 7 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.924 0.343 19806 3852 1 7 . 1 1 108 108 GLU CA C 108 54.761 54.761 54.145 0.616 19806 3853 1 7 . 1 1 108 108 GLU CB C 108 32.567 32.567 33.802 -1.235 19806 3854 1 7 . 1 1 109 109 PHE N N 109 124.592 124.592 120.347 4.245 19806 3855 1 7 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.426 0.602 19806 3856 1 7 . 1 1 109 109 PHE CA C 109 55.945 55.945 56.503 -0.558 19806 3857 1 7 . 1 1 109 109 PHE CB C 109 43.099 43.099 42.401 0.698 19806 3858 1 7 . 1 1 110 110 GLU N N 110 122.143 122.143 122.033 0.110 19806 3859 1 7 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.402 -0.209 19806 3860 1 7 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.623 0.820 19806 3861 1 7 . 1 1 110 110 GLU CB C 110 35.816 35.816 34.186 1.630 19806 3862 1 7 . 1 1 111 111 LEU N N 111 129.616 129.616 126.978 2.638 19806 3863 1 7 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.750 0.058 19806 3864 1 7 . 1 1 111 111 LEU CA C 111 53.470 53.470 55.518 -2.048 19806 3865 1 7 . 1 1 111 111 LEU CB C 111 40.400 40.400 41.807 -1.407 19806 3866 1 7 . 1 1 112 112 GLN N N 112 124.742 124.742 124.043 0.699 19806 3867 1 7 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.252 0.187 19806 3868 1 7 . 1 1 112 112 GLN CA C 112 55.802 55.802 53.835 1.967 19806 3869 1 7 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.748 -0.995 19806 3870 1 7 . 1 1 113 113 ALA N N 113 121.195 121.195 126.425 -5.230 19806 3871 1 7 . 1 1 113 113 ALA HA H 113 4.048 4.048 4.032 0.016 19806 3872 1 7 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.205 0.313 19806 3873 1 7 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.253 -0.054 19806 3874 1 7 . 1 1 114 114 ASP N N 114 114.525 114.525 117.005 -2.480 19806 3875 1 7 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.551 -0.152 19806 3876 1 7 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.409 -1.501 19806 3877 1 7 . 1 1 114 114 ASP CB C 114 39.058 39.058 41.310 -2.252 19806 3878 1 7 . 1 1 115 115 GLY N N 115 107.526 107.526 107.636 -0.110 19806 3879 1 7 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.001 0.783 19806 3880 1 7 . 1 1 116 116 LYS N N 116 118.818 118.818 119.292 -0.474 19806 3881 1 7 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.849 -0.399 19806 3882 1 7 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.255 -0.084 19806 3883 1 7 . 1 1 116 116 LYS CB C 116 35.039 35.039 34.649 0.390 19806 3884 1 7 . 1 1 117 117 TRP N N 117 118.939 118.939 121.707 -2.768 19806 3885 1 7 . 1 1 117 117 TRP CA C 117 56.956 56.956 58.167 -1.212 19806 3886 1 7 . 1 1 118 118 TYR N N 118 112.644 112.644 119.168 -6.524 19806 3887 1 7 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.830 0.447 19806 3888 1 7 . 1 1 118 118 TYR CA C 118 56.219 56.219 56.792 -0.573 19806 3889 1 7 . 1 1 118 118 TYR CB C 118 43.282 43.282 41.949 1.333 19806 3890 1 7 . 1 1 119 119 VAL N N 119 119.842 119.842 121.928 -2.086 19806 3891 1 7 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.514 0.001 19806 3892 1 7 . 1 1 119 119 VAL CA C 119 62.442 62.442 63.764 -1.321 19806 3893 1 7 . 1 1 120 120 VAL N N 120 114.552 114.552 114.173 0.379 19806 3894 1 7 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.527 0.211 19806 3895 1 7 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.845 -1.250 19806 3896 1 7 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.186 -0.334 19806 3897 1 7 . 1 1 121 121 ASP N N 121 118.234 118.234 120.601 -2.367 19806 3898 1 7 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.928 0.335 19806 3899 1 7 . 1 1 121 121 ASP CA C 121 53.663 53.663 54.254 -0.591 19806 3900 1 7 . 1 1 121 121 ASP CB C 121 43.887 43.887 45.126 -1.239 19806 3901 1 7 . 1 1 122 122 CYS N N 122 121.036 121.036 121.826 -0.790 19806 3902 1 7 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.719 0.852 19806 3903 1 7 . 1 1 122 122 CYS CA C 122 57.052 57.052 56.419 0.633 19806 3904 1 7 . 1 1 122 122 CYS CB C 122 30.834 30.834 27.941 2.893 19806 3905 1 7 . 1 1 123 123 TYR N N 123 127.672 127.672 123.987 3.685 19806 3906 1 7 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.407 0.603 19806 3907 1 7 . 1 1 123 123 TYR CA C 123 57.169 57.169 60.366 -3.197 19806 3908 1 7 . 1 1 123 123 TYR CB C 123 41.408 41.408 38.823 2.585 19806 3909 1 7 . 1 1 124 124 THR N N 124 120.833 120.833 121.832 -0.999 19806 3910 1 7 . 1 1 124 124 THR HA H 124 4.987 4.987 4.837 0.150 19806 3911 1 7 . 1 1 124 124 THR CA C 124 57.153 57.153 59.654 -2.501 19806 3912 1 7 . 1 1 124 124 THR CB C 124 68.607 68.607 70.881 -2.274 19806 3913 1 7 . 1 1 125 125 GLY N N 125 114.347 114.347 113.525 0.822 19806 3914 1 7 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.852 -0.524 19806 3915 1 7 . 1 1 126 126 TRP N N 126 119.918 119.918 120.756 -0.838 19806 3916 1 7 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.093 -0.023 19806 3917 1 7 . 1 1 126 126 TRP CA C 126 60.564 60.564 58.586 1.978 19806 3918 1 7 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.661 -0.022 19806 3919 1 7 . 1 1 127 127 TYR N N 127 113.911 113.911 114.782 -0.871 19806 3920 1 7 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.815 0.179 19806 3921 1 7 . 1 1 127 127 TYR CA C 127 53.384 53.384 57.333 -3.949 19806 3922 1 7 . 1 1 127 127 TYR CB C 127 38.584 38.584 38.769 -0.185 19806 3923 1 7 . 1 1 128 128 GLY N N 128 105.181 105.181 107.123 -1.942 19806 3924 1 7 . 1 1 128 128 GLY CA C 128 45.189 45.189 45.803 -0.614 19806 3925 1 7 . 1 1 129 129 TYR N N 129 116.588 116.588 120.499 -3.911 19806 3926 1 7 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.205 0.459 19806 3927 1 7 . 1 1 129 129 TYR CA C 129 59.565 59.565 59.495 0.070 19806 3928 1 7 . 1 1 129 129 TYR CB C 129 38.853 38.853 36.673 2.180 19806 3929 1 7 . 1 1 130 130 ASP N N 130 115.195 115.195 118.259 -3.064 19806 3930 1 7 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.682 -0.297 19806 3931 1 7 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.712 -1.582 19806 3932 1 7 . 1 1 130 130 ASP CB C 130 38.685 38.685 42.800 -4.115 19806 3933 1 7 . 1 1 131 131 LEU N N 131 124.887 124.887 117.028 7.859 19806 3934 1 7 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.971 -0.490 19806 3935 1 7 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.107 1.498 19806 3936 1 7 . 1 1 131 131 LEU CB C 131 42.441 42.441 42.482 -0.041 19806 3937 1 7 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.952 -0.269 19806 3938 1 7 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.250 65.815 19806 3939 1 7 . 1 1 132 132 PRO CB C 132 32.327 32.327 34.077 -1.750 19806 3940 1 7 . 1 1 133 133 ILE N N 133 123.765 123.765 119.983 3.782 19806 3941 1 7 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.837 -0.108 19806 3942 1 7 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.829 1.031 19806 3943 1 7 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.341 -0.278 19806 3944 1 7 . 1 1 134 134 GLY N N 134 107.030 107.030 107.157 -0.127 19806 3945 1 7 . 1 1 134 134 GLY CA C 134 45.976 45.976 46.338 -0.362 19806 3946 1 7 . 1 1 135 135 GLU N N 135 116.566 116.566 122.347 -5.781 19806 3947 1 7 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.144 0.520 19806 3948 1 7 . 1 1 135 135 GLU CA C 135 55.414 55.414 57.533 -2.119 19806 3949 1 7 . 1 1 135 135 GLU CB C 135 30.195 30.195 29.084 1.111 19806 3950 1 7 . 1 1 136 136 LEU N N 136 124.239 124.239 122.016 2.223 19806 3951 1 7 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.911 0.133 19806 3952 1 7 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.207 0.909 19806 3953 1 7 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.936 -0.929 19806 3954 1 7 . 1 1 137 137 LYS N N 137 117.225 117.225 116.576 0.649 19806 3955 1 7 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.798 0.065 19806 3956 1 7 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.599 0.856 19806 3957 1 7 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.889 -0.686 19806 3958 1 7 . 1 1 138 138 GLN N N 138 118.718 118.718 118.784 -0.066 19806 3959 1 7 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.042 0.010 19806 3960 1 7 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.589 -0.714 19806 3961 1 7 . 1 1 138 138 GLN CB C 138 28.235 28.235 27.960 0.275 19806 3962 1 7 . 1 1 139 139 THR N N 139 117.970 117.970 115.505 2.465 19806 3963 1 7 . 1 1 139 139 THR HA H 139 4.532 4.532 3.930 0.602 19806 3964 1 7 . 1 1 139 139 THR CA C 139 68.145 68.145 66.156 1.989 19806 3965 1 7 . 1 1 139 139 THR CB C 139 68.103 68.103 68.344 -0.241 19806 3966 1 7 . 1 1 140 140 ILE N N 140 120.391 120.391 123.101 -2.710 19806 3967 1 7 . 1 1 140 140 ILE HA H 140 3.727 3.727 4.016 -0.289 19806 3968 1 7 . 1 1 140 140 ILE CA C 140 65.256 65.256 63.906 1.350 19806 3969 1 7 . 1 1 140 140 ILE CB C 140 38.113 38.113 36.936 1.177 19806 3970 1 7 . 1 1 141 141 GLN N N 141 118.917 118.917 119.242 -0.325 19806 3971 1 7 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.908 0.107 19806 3972 1 7 . 1 1 141 141 GLN CA C 141 58.371 58.371 58.708 -0.337 19806 3973 1 7 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.127 -0.780 19806 3974 1 7 . 1 1 142 142 ASN N N 142 119.936 119.936 118.110 1.826 19806 3975 1 7 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.541 -0.026 19806 3976 1 7 . 1 1 142 142 ASN CA C 142 55.799 55.799 55.787 0.012 19806 3977 1 7 . 1 1 142 142 ASN CB C 142 37.630 37.630 37.755 -0.125 19806 3978 1 7 . 1 1 143 143 VAL N N 143 123.195 123.195 119.333 3.862 19806 3979 1 7 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.289 -0.573 19806 3980 1 7 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.319 0.178 19806 3981 1 7 . 1 1 143 143 VAL CB C 143 30.989 30.989 31.250 -0.261 19806 3982 1 7 . 1 1 144 144 LYS N N 144 120.348 120.348 117.899 2.449 19806 3983 1 7 . 1 1 144 144 LYS HA H 144 3.881 3.881 4.037 -0.156 19806 3984 1 7 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.268 0.855 19806 3985 1 7 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.106 -0.224 19806 3986 1 7 . 1 1 145 145 GLU N N 145 119.220 119.220 117.962 1.258 19806 3987 1 7 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.179 0.004 19806 3988 1 7 . 1 1 145 145 GLU CA C 145 59.178 59.178 58.603 0.575 19806 3989 1 7 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.830 -0.759 19806 3990 1 7 . 1 1 146 146 GLU N N 146 121.420 121.420 120.866 0.554 19806 3991 1 7 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.091 0.186 19806 3992 1 7 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.469 -0.351 19806 3993 1 7 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.311 -0.969 19806 3994 1 7 . 1 1 147 147 ASN N N 147 119.197 119.197 116.953 2.244 19806 3995 1 7 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.609 -0.041 19806 3996 1 7 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.638 -1.487 19806 3997 1 7 . 1 1 147 147 ASN CB C 147 37.373 37.373 38.033 -0.660 19806 3998 1 7 . 1 1 148 148 ALA N N 148 123.672 123.672 122.177 1.495 19806 3999 1 7 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.364 -0.241 19806 4000 1 7 . 1 1 148 148 ALA CA C 148 55.133 55.133 54.589 0.544 19806 4001 1 7 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.408 -0.801 19806 4002 1 7 . 1 1 149 149 ALA N N 149 119.979 119.979 121.131 -1.152 19806 4003 1 7 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.082 0.179 19806 4004 1 7 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.361 0.284 19806 4005 1 7 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.909 -1.171 19806 4006 1 7 . 1 1 150 150 PHE N N 150 119.592 119.592 120.311 -0.719 19806 4007 1 7 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.152 0.072 19806 4008 1 7 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.777 -0.769 19806 4009 1 7 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.364 -0.302 19806 4010 1 7 . 1 1 151 151 LYS N N 151 116.869 116.869 118.029 -1.160 19806 4011 1 7 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.344 -0.438 19806 4012 1 7 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.267 0.504 19806 4013 1 7 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.022 0.719 19806 4014 1 7 . 1 1 152 152 GLU N N 152 115.868 115.868 120.458 -4.590 19806 4015 1 7 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.102 -0.049 19806 4016 1 7 . 1 1 152 152 GLU CA C 152 58.656 58.656 59.045 -0.389 19806 4017 1 7 . 1 1 152 152 GLU CB C 152 29.753 29.753 29.899 -0.146 19806 4018 1 7 . 1 1 153 153 ILE N N 153 110.437 110.437 117.247 -6.810 19806 4019 1 7 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.992 0.184 19806 4020 1 7 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.630 -1.597 19806 4021 1 7 . 1 1 153 153 ILE CB C 153 39.272 39.272 39.270 0.002 19806 4022 1 7 . 1 1 154 154 HIS N N 154 117.779 117.779 117.242 0.537 19806 4023 1 7 . 1 1 154 154 HIS HA H 154 5.174 5.174 4.936 0.238 19806 4024 1 7 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.839 -1.222 19806 4025 1 7 . 1 1 154 154 HIS CB C 154 28.547 28.547 31.352 -2.805 19806 4026 1 8 . 1 1 3 3 SER N N 3 114.847 114.847 114.380 0.467 19806 4027 1 8 . 1 1 3 3 SER HA H 3 4.463 4.463 4.823 -0.360 19806 4028 1 8 . 1 1 3 3 SER CA C 3 58.340 58.340 57.432 0.908 19806 4029 1 8 . 1 1 3 3 SER CB C 3 63.457 63.457 65.930 -2.473 19806 4030 1 8 . 1 1 4 4 GLU N N 4 121.498 121.498 120.564 0.934 19806 4031 1 8 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.755 -0.423 19806 4032 1 8 . 1 1 4 4 GLU CA C 4 56.443 56.443 55.998 0.445 19806 4033 1 8 . 1 1 4 4 GLU CB C 4 29.966 29.966 30.760 -0.794 19806 4034 1 8 . 1 1 5 5 LEU N N 5 121.589 121.589 121.950 -0.361 19806 4035 1 8 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.655 -0.218 19806 4036 1 8 . 1 1 5 5 LEU CA C 5 55.019 55.019 55.659 -0.640 19806 4037 1 8 . 1 1 5 5 LEU CB C 5 42.243 42.243 43.645 -1.402 19806 4038 1 8 . 1 1 6 6 THR N N 6 113.708 113.708 112.406 1.302 19806 4039 1 8 . 1 1 6 6 THR HA H 6 4.470 4.470 4.124 0.346 19806 4040 1 8 . 1 1 6 6 THR CA C 6 61.409 61.409 62.539 -1.130 19806 4041 1 8 . 1 1 6 6 THR CB C 6 69.544 69.544 68.781 0.763 19806 4042 1 8 . 1 1 7 7 THR N N 7 114.945 114.945 113.206 1.739 19806 4043 1 8 . 1 1 7 7 THR HA H 7 4.415 4.415 3.820 0.595 19806 4044 1 8 . 1 1 7 7 THR CA C 7 61.435 61.435 63.505 -2.070 19806 4045 1 8 . 1 1 7 7 THR CB C 7 69.506 69.506 68.455 1.051 19806 4046 1 8 . 1 1 8 8 GLN N N 8 121.368 121.368 120.383 0.985 19806 4047 1 8 . 1 1 8 8 GLN CA C 8 55.684 55.684 55.397 0.287 19806 4048 1 8 . 1 1 9 9 ASP N N 9 120.595 120.595 129.463 -8.868 19806 4049 1 8 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.613 0.034 19806 4050 1 8 . 1 1 9 9 ASP CA C 9 54.115 54.115 52.880 1.235 19806 4051 1 8 . 1 1 9 9 ASP CB C 9 41.328 41.328 40.413 0.914 19806 4052 1 8 . 1 1 10 10 GLY N N 10 106.984 106.984 105.581 1.403 19806 4053 1 8 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.251 0.244 19806 4054 1 8 . 1 1 11 11 GLU N N 11 120.879 120.879 121.769 -0.890 19806 4055 1 8 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.348 -0.159 19806 4056 1 8 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.659 -0.149 19806 4057 1 8 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.620 1.449 19806 4058 1 8 . 1 1 12 12 ASP N N 12 126.686 126.686 121.402 5.284 19806 4059 1 8 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.825 -0.075 19806 4060 1 8 . 1 1 12 12 ASP CA C 12 54.347 54.347 54.120 0.227 19806 4061 1 8 . 1 1 12 12 ASP CB C 12 42.771 42.771 42.025 0.746 19806 4062 1 8 . 1 1 13 13 PHE N N 13 128.055 128.055 121.764 6.291 19806 4063 1 8 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.789 -0.377 19806 4064 1 8 . 1 1 13 13 PHE CA C 13 62.551 62.551 60.958 1.593 19806 4065 1 8 . 1 1 13 13 PHE CB C 13 38.833 38.833 39.386 -0.553 19806 4066 1 8 . 1 1 14 14 LYS N N 14 117.498 117.498 116.786 0.712 19806 4067 1 8 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.298 0.283 19806 4068 1 8 . 1 1 14 14 LYS CA C 14 59.461 59.461 58.451 1.010 19806 4069 1 8 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.413 -0.069 19806 4070 1 8 . 1 1 15 15 SER N N 15 113.775 113.775 114.640 -0.865 19806 4071 1 8 . 1 1 15 15 SER HA H 15 4.167 4.167 4.165 0.002 19806 4072 1 8 . 1 1 15 15 SER CA C 15 61.099 61.099 61.566 -0.467 19806 4073 1 8 . 1 1 15 15 SER CB C 15 62.428 62.428 63.164 -0.736 19806 4074 1 8 . 1 1 16 16 PHE N N 16 122.292 122.292 118.450 3.842 19806 4075 1 8 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.552 -0.262 19806 4076 1 8 . 1 1 16 16 PHE CA C 16 59.773 59.773 59.273 0.500 19806 4077 1 8 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.544 -1.369 19806 4078 1 8 . 1 1 17 17 LEU N N 17 122.472 122.472 120.496 1.976 19806 4079 1 8 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.332 -0.482 19806 4080 1 8 . 1 1 17 17 LEU CA C 17 56.619 56.619 56.592 0.027 19806 4081 1 8 . 1 1 17 17 LEU CB C 17 40.462 40.462 39.650 0.812 19806 4082 1 8 . 1 1 18 18 ASP N N 18 117.331 117.331 119.104 -1.773 19806 4083 1 8 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.166 -0.051 19806 4084 1 8 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.602 -1.207 19806 4085 1 8 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.674 -0.321 19806 4086 1 8 . 1 1 19 19 LYS N N 19 120.032 120.032 117.951 2.081 19806 4087 1 8 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.863 -0.186 19806 4088 1 8 . 1 1 19 19 LYS CA C 19 59.067 59.067 59.095 -0.028 19806 4089 1 8 . 1 1 19 19 LYS CB C 19 31.936 31.936 31.692 0.244 19806 4090 1 8 . 1 1 20 20 PHE N N 20 119.607 119.607 118.881 0.726 19806 4091 1 8 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.300 -0.191 19806 4092 1 8 . 1 1 20 20 PHE CA C 20 62.090 62.090 60.792 1.298 19806 4093 1 8 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.261 1.208 19806 4094 1 8 . 1 1 21 21 THR N N 21 101.473 101.473 109.487 -8.014 19806 4095 1 8 . 1 1 21 21 THR HA H 21 4.259 4.259 4.199 0.060 19806 4096 1 8 . 1 1 21 21 THR CA C 21 61.774 61.774 64.185 -2.411 19806 4097 1 8 . 1 1 22 22 SER N N 22 111.453 111.453 115.966 -4.513 19806 4098 1 8 . 1 1 22 22 SER HA H 22 4.165 4.165 4.194 -0.029 19806 4099 1 8 . 1 1 22 22 SER CA C 22 58.215 58.215 59.934 -1.719 19806 4100 1 8 . 1 1 22 22 SER CB C 22 64.570 64.570 63.889 0.681 19806 4101 1 8 . 1 1 23 23 SER N N 23 114.184 114.184 115.873 -1.689 19806 4102 1 8 . 1 1 23 23 SER HA H 23 4.764 4.764 4.927 -0.163 19806 4103 1 8 . 1 1 23 23 SER CA C 23 55.669 55.669 58.316 -2.647 19806 4104 1 8 . 1 1 23 23 SER CB C 23 64.011 64.011 65.004 -0.993 19806 4105 1 8 . 1 1 24 24 ALA N N 24 133.370 133.370 130.202 3.168 19806 4106 1 8 . 1 1 24 24 ALA HA H 24 3.956 3.956 3.961 -0.005 19806 4107 1 8 . 1 1 24 24 ALA CA C 24 55.106 55.106 55.942 -0.836 19806 4108 1 8 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.288 0.547 19806 4109 1 8 . 1 1 25 25 ALA N N 25 117.430 117.430 120.561 -3.131 19806 4110 1 8 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.351 -0.034 19806 4111 1 8 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.503 0.698 19806 4112 1 8 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.323 0.026 19806 4113 1 8 . 1 1 26 26 PHE N N 26 116.042 116.042 116.863 -0.821 19806 4114 1 8 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.463 -0.153 19806 4115 1 8 . 1 1 26 26 PHE CA C 26 60.759 60.759 61.378 -0.619 19806 4116 1 8 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.483 -0.173 19806 4117 1 8 . 1 1 27 27 GLN N N 27 121.820 121.820 118.871 2.949 19806 4118 1 8 . 1 1 27 27 GLN HA H 27 3.391 3.391 3.960 -0.569 19806 4119 1 8 . 1 1 27 27 GLN CA C 27 60.094 60.094 58.802 1.292 19806 4120 1 8 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.013 -0.556 19806 4121 1 8 . 1 1 28 28 TYR N N 28 111.517 111.517 114.841 -3.324 19806 4122 1 8 . 1 1 28 28 TYR HA H 28 4.130 4.130 4.199 -0.069 19806 4123 1 8 . 1 1 28 28 TYR CA C 28 62.357 62.357 58.859 3.498 19806 4124 1 8 . 1 1 28 28 TYR CB C 28 38.568 38.568 38.160 0.408 19806 4125 1 8 . 1 1 29 29 THR N N 29 106.324 106.324 112.662 -6.338 19806 4126 1 8 . 1 1 29 29 THR HA H 29 4.489 4.489 4.598 -0.109 19806 4127 1 8 . 1 1 29 29 THR CA C 29 63.765 63.765 62.324 1.441 19806 4128 1 8 . 1 1 29 29 THR CB C 29 69.568 69.568 69.032 0.536 19806 4129 1 8 . 1 1 30 30 ARG N N 30 117.696 117.696 121.381 -3.685 19806 4130 1 8 . 1 1 30 30 ARG HA H 30 4.701 4.701 4.023 0.678 19806 4131 1 8 . 1 1 30 30 ARG CA C 30 52.760 52.760 55.672 -2.912 19806 4132 1 8 . 1 1 30 30 ARG CB C 30 35.047 35.047 31.852 3.195 19806 4133 1 8 . 1 1 31 31 VAL N N 31 119.395 119.395 118.771 0.624 19806 4134 1 8 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.630 -0.400 19806 4135 1 8 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.559 0.632 19806 4136 1 8 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.686 -2.513 19806 4137 1 8 . 1 1 32 32 LYS N N 32 126.124 126.124 127.933 -1.809 19806 4138 1 8 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.624 -0.440 19806 4139 1 8 . 1 1 32 32 LYS CA C 32 53.958 53.958 54.550 -0.592 19806 4140 1 8 . 1 1 32 32 LYS CB C 32 31.112 31.112 34.365 -3.253 19806 4141 1 8 . 1 1 33 33 PHE N N 33 119.303 119.303 118.187 1.116 19806 4142 1 8 . 1 1 33 33 PHE HA H 33 4.514 4.514 5.037 -0.523 19806 4143 1 8 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.496 0.776 19806 4144 1 8 . 1 1 33 33 PHE CB C 33 40.378 40.378 41.108 -0.731 19806 4145 1 8 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.950 0.018 19806 4146 1 8 . 1 1 34 34 PRO CA C 34 61.633 61.633 63.023 -1.390 19806 4147 1 8 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.624 1.108 19806 4148 1 8 . 1 1 35 35 LEU N N 35 120.016 120.016 119.539 0.477 19806 4149 1 8 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.286 -0.064 19806 4150 1 8 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.881 0.959 19806 4151 1 8 . 1 1 35 35 LEU CB C 35 41.244 41.244 42.557 -1.313 19806 4152 1 8 . 1 1 36 36 LYS N N 36 117.066 117.066 119.075 -2.009 19806 4153 1 8 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.371 -0.396 19806 4154 1 8 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.314 2.933 19806 4155 1 8 . 1 1 36 36 LYS CB C 36 32.832 32.832 33.095 -0.263 19806 4156 1 8 . 1 1 37 37 THR N N 37 117.574 117.574 116.072 1.502 19806 4157 1 8 . 1 1 37 37 THR HA H 37 4.797 4.797 4.789 0.008 19806 4158 1 8 . 1 1 37 37 THR CA C 37 60.396 60.396 59.571 0.825 19806 4159 1 8 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.899 0.120 19806 4160 1 8 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.435 -0.512 19806 4161 1 8 . 1 1 38 38 PRO CB C 38 32.631 32.631 33.219 -0.588 19806 4162 1 8 . 1 1 39 39 ILE N N 39 119.949 119.949 118.352 1.597 19806 4163 1 8 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.042 0.197 19806 4164 1 8 . 1 1 39 39 ILE CA C 39 62.133 62.133 62.498 -0.365 19806 4165 1 8 . 1 1 40 40 THR N N 40 123.962 123.962 111.976 11.986 19806 4166 1 8 . 1 1 40 40 THR HA H 40 5.057 5.057 4.123 0.934 19806 4167 1 8 . 1 1 40 40 THR CA C 40 62.262 62.262 62.501 -0.239 19806 4168 1 8 . 1 1 40 40 THR CB C 40 69.891 69.891 67.923 1.968 19806 4169 1 8 . 1 1 41 41 LEU N N 41 125.633 125.633 118.072 7.561 19806 4170 1 8 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.644 0.458 19806 4171 1 8 . 1 1 41 41 LEU CA C 41 52.638 52.638 51.697 0.941 19806 4172 1 8 . 1 1 41 41 LEU CB C 41 45.180 45.180 43.306 1.874 19806 4173 1 8 . 1 1 42 42 LEU N N 42 120.788 120.788 121.691 -0.903 19806 4174 1 8 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.460 0.288 19806 4175 1 8 . 1 1 42 42 LEU CA C 42 53.724 53.724 54.205 -0.481 19806 4176 1 8 . 1 1 42 42 LEU CB C 42 44.384 44.384 41.395 2.989 19806 4177 1 8 . 1 1 43 43 ALA N N 43 123.073 123.073 129.551 -6.478 19806 4178 1 8 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.203 0.227 19806 4179 1 8 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.371 -1.083 19806 4180 1 8 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.573 0.441 19806 4181 1 8 . 1 1 44 44 ASP N N 44 118.196 118.196 118.297 -0.101 19806 4182 1 8 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.422 0.004 19806 4183 1 8 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.287 -0.259 19806 4184 1 8 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.816 -0.606 19806 4185 1 8 . 1 1 45 45 ASP N N 45 115.018 115.018 117.522 -2.504 19806 4186 1 8 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.443 0.026 19806 4187 1 8 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.330 -0.536 19806 4188 1 8 . 1 1 45 45 ASP CB C 45 39.864 39.864 41.019 -1.155 19806 4189 1 8 . 1 1 46 46 GLY N N 46 107.499 107.499 107.068 0.431 19806 4190 1 8 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.650 0.265 19806 4191 1 8 . 1 1 47 47 GLU N N 47 117.331 117.331 116.771 0.560 19806 4192 1 8 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.461 0.070 19806 4193 1 8 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.250 0.688 19806 4194 1 8 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.466 2.667 19806 4195 1 8 . 1 1 48 48 THR N N 48 118.462 118.462 118.854 -0.392 19806 4196 1 8 . 1 1 48 48 THR HA H 48 4.243 4.243 4.271 -0.028 19806 4197 1 8 . 1 1 48 48 THR CA C 48 62.834 62.834 63.020 -0.186 19806 4198 1 8 . 1 1 48 48 THR CB C 48 68.649 68.649 69.288 -0.639 19806 4199 1 8 . 1 1 49 49 GLU N N 49 123.834 123.834 127.799 -3.965 19806 4200 1 8 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.510 0.435 19806 4201 1 8 . 1 1 49 49 GLU CA C 49 55.358 55.358 56.603 -1.245 19806 4202 1 8 . 1 1 49 49 GLU CB C 49 31.395 31.395 29.809 1.586 19806 4203 1 8 . 1 1 50 50 LYS N N 50 122.868 122.868 127.850 -4.982 19806 4204 1 8 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.760 -0.119 19806 4205 1 8 . 1 1 50 50 LYS CA C 50 54.111 54.111 54.873 -0.762 19806 4206 1 8 . 1 1 50 50 LYS CB C 50 35.312 35.312 34.558 0.754 19806 4207 1 8 . 1 1 51 51 THR N N 51 111.386 111.386 116.298 -4.912 19806 4208 1 8 . 1 1 51 51 THR HA H 51 5.619 5.619 4.460 1.159 19806 4209 1 8 . 1 1 51 51 THR CA C 51 58.980 58.980 62.630 -3.650 19806 4210 1 8 . 1 1 51 51 THR CB C 51 71.277 71.277 69.451 1.826 19806 4211 1 8 . 1 1 52 52 PHE N N 52 120.631 120.631 120.355 0.276 19806 4212 1 8 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.804 0.159 19806 4213 1 8 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.059 -0.929 19806 4214 1 8 . 1 1 52 52 PHE CB C 52 41.049 41.049 42.288 -1.240 19806 4215 1 8 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.186 0.262 19806 4216 1 8 . 1 1 53 53 PRO CA C 53 62.489 62.489 62.470 0.019 19806 4217 1 8 . 1 1 53 53 PRO CB C 53 32.240 32.240 31.899 0.341 19806 4218 1 8 . 1 1 54 54 PHE N N 54 128.034 128.034 117.893 10.141 19806 4219 1 8 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.967 -0.139 19806 4220 1 8 . 1 1 54 54 PHE CA C 54 55.509 55.509 54.094 1.415 19806 4221 1 8 . 1 1 54 54 PHE CB C 54 37.028 37.028 37.252 -0.223 19806 4222 1 8 . 1 1 55 55 THR N N 55 111.757 111.757 112.279 -0.522 19806 4223 1 8 . 1 1 55 55 THR HA H 55 4.413 4.413 4.329 0.084 19806 4224 1 8 . 1 1 55 55 THR CA C 55 60.578 60.578 60.422 0.156 19806 4225 1 8 . 1 1 55 55 THR CB C 55 69.447 69.447 70.409 -0.962 19806 4226 1 8 . 1 1 56 56 LYS N N 56 118.734 118.734 121.228 -2.494 19806 4227 1 8 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.252 -1.770 19806 4228 1 8 . 1 1 56 56 LYS CA C 56 59.381 59.381 59.730 -0.349 19806 4229 1 8 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.050 1.200 19806 4230 1 8 . 1 1 57 57 GLU N N 57 119.675 119.675 117.613 2.062 19806 4231 1 8 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.171 0.098 19806 4232 1 8 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.278 -1.126 19806 4233 1 8 . 1 1 57 57 GLU CB C 57 26.950 26.950 28.953 -2.002 19806 4234 1 8 . 1 1 58 58 LYS N N 58 114.700 114.700 116.352 -1.652 19806 4235 1 8 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.410 -0.098 19806 4236 1 8 . 1 1 58 58 LYS CA C 58 55.595 55.595 55.016 0.579 19806 4237 1 8 . 1 1 58 58 LYS CB C 58 32.011 32.011 32.205 -0.194 19806 4238 1 8 . 1 1 59 59 TRP N N 59 118.204 118.204 125.183 -6.979 19806 4239 1 8 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.070 0.029 19806 4240 1 8 . 1 1 59 59 TRP CA C 59 55.577 55.577 55.002 0.575 19806 4241 1 8 . 1 1 59 59 TRP CB C 59 32.037 32.037 29.925 2.112 19806 4242 1 8 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.434 -0.171 19806 4243 1 8 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.738 -3.017 19806 4244 1 8 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.541 -2.692 19806 4245 1 8 . 1 1 61 61 LEU N N 61 123.758 123.758 120.202 3.556 19806 4246 1 8 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.199 -0.560 19806 4247 1 8 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.475 0.400 19806 4248 1 8 . 1 1 61 61 LEU CB C 61 40.815 40.815 42.507 -1.692 19806 4249 1 8 . 1 1 62 62 LEU N N 62 124.052 124.052 118.108 5.944 19806 4250 1 8 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.574 -0.219 19806 4251 1 8 . 1 1 62 62 LEU CA C 62 53.992 53.992 53.355 0.637 19806 4252 1 8 . 1 1 62 62 LEU CB C 62 44.686 44.686 45.761 -1.075 19806 4253 1 8 . 1 1 63 63 ASP N N 63 117.271 117.271 119.691 -2.420 19806 4254 1 8 . 1 1 63 63 ASP HA H 63 5.033 5.033 5.312 -0.279 19806 4255 1 8 . 1 1 63 63 ASP CA C 63 51.101 51.101 53.087 -1.986 19806 4256 1 8 . 1 1 63 63 ASP CB C 63 43.345 43.345 43.192 0.153 19806 4257 1 8 . 1 1 64 64 SER N N 64 112.856 112.856 115.235 -2.379 19806 4258 1 8 . 1 1 64 64 SER HA H 64 3.865 3.865 4.154 -0.289 19806 4259 1 8 . 1 1 64 64 SER CA C 64 60.910 60.910 61.495 -0.585 19806 4260 1 8 . 1 1 64 64 SER CB C 64 62.378 62.378 63.203 -0.825 19806 4261 1 8 . 1 1 65 65 GLU N N 65 120.070 120.070 119.637 0.433 19806 4262 1 8 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.190 -0.172 19806 4263 1 8 . 1 1 65 65 GLU CA C 65 58.343 58.343 59.177 -0.834 19806 4264 1 8 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.051 -0.164 19806 4265 1 8 . 1 1 66 66 THR N N 66 115.852 115.852 113.122 2.730 19806 4266 1 8 . 1 1 66 66 THR HA H 66 3.991 3.991 4.349 -0.358 19806 4267 1 8 . 1 1 66 66 THR CA C 66 65.804 65.804 64.340 1.464 19806 4268 1 8 . 1 1 66 66 THR CB C 66 68.451 68.451 68.209 0.242 19806 4269 1 8 . 1 1 67 67 MET N N 67 113.585 113.585 119.899 -6.314 19806 4270 1 8 . 1 1 67 67 MET HA H 67 4.267 4.267 3.900 0.367 19806 4271 1 8 . 1 1 67 67 MET CA C 67 52.135 52.135 54.148 -2.013 19806 4272 1 8 . 1 1 67 67 MET CB C 67 28.963 28.963 34.501 -5.538 19806 4273 1 8 . 1 1 68 68 LYS N N 68 118.462 118.462 122.767 -4.305 19806 4274 1 8 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.500 -0.130 19806 4275 1 8 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.380 0.102 19806 4276 1 8 . 1 1 68 68 LYS CB C 68 34.179 34.179 32.880 1.298 19806 4277 1 8 . 1 1 69 69 GLU N N 69 121.700 121.700 124.487 -2.787 19806 4278 1 8 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.117 0.407 19806 4279 1 8 . 1 1 69 69 GLU CA C 69 55.942 55.942 56.850 -0.908 19806 4280 1 8 . 1 1 69 69 GLU CB C 69 30.424 30.424 28.901 1.523 19806 4281 1 8 . 1 1 70 70 GLU N N 70 123.445 123.445 125.417 -1.972 19806 4282 1 8 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.587 0.110 19806 4283 1 8 . 1 1 70 70 GLU CA C 70 55.473 55.473 54.679 0.793 19806 4284 1 8 . 1 1 70 70 GLU CB C 70 33.162 33.162 32.913 0.249 19806 4285 1 8 . 1 1 71 71 ARG N N 71 122.150 122.150 121.483 0.667 19806 4286 1 8 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.995 0.156 19806 4287 1 8 . 1 1 71 71 ARG CA C 71 55.448 55.448 54.743 0.705 19806 4288 1 8 . 1 1 71 71 ARG CB C 71 31.703 31.703 30.850 0.853 19806 4289 1 8 . 1 1 72 72 ILE N N 72 125.686 125.686 125.073 0.613 19806 4290 1 8 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.097 0.499 19806 4291 1 8 . 1 1 72 72 ILE CA C 72 59.512 59.512 61.494 -1.982 19806 4292 1 8 . 1 1 72 72 ILE CB C 72 41.095 41.095 39.329 1.766 19806 4293 1 8 . 1 1 73 73 THR N N 73 121.600 121.600 122.499 -0.899 19806 4294 1 8 . 1 1 73 73 THR HA H 73 4.603 4.603 4.514 0.089 19806 4295 1 8 . 1 1 73 73 THR CA C 73 61.937 61.937 60.889 1.048 19806 4296 1 8 . 1 1 73 73 THR CB C 73 68.669 68.669 68.485 0.184 19806 4297 1 8 . 1 1 74 74 GLN N N 74 124.607 124.607 126.407 -1.800 19806 4298 1 8 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.648 -0.067 19806 4299 1 8 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.510 0.179 19806 4300 1 8 . 1 1 74 74 GLN CB C 74 29.490 29.490 30.254 -0.764 19806 4301 1 8 . 1 1 75 75 GLU N N 75 122.962 122.962 118.918 4.044 19806 4302 1 8 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.491 -0.432 19806 4303 1 8 . 1 1 75 75 GLU CA C 75 58.845 58.845 56.759 2.086 19806 4304 1 8 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.377 -0.804 19806 4305 1 8 . 1 1 76 76 GLU N N 76 115.466 115.466 118.942 -3.476 19806 4306 1 8 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.454 -0.146 19806 4307 1 8 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.566 0.211 19806 4308 1 8 . 1 1 76 76 GLU CB C 76 29.072 29.072 30.295 -1.223 19806 4309 1 8 . 1 1 77 77 GLY N N 77 106.771 106.771 108.503 -1.732 19806 4310 1 8 . 1 1 77 77 GLY CA C 77 45.014 45.014 45.290 -0.276 19806 4311 1 8 . 1 1 78 78 GLY N N 78 108.535 108.535 107.376 1.159 19806 4312 1 8 . 1 1 78 78 GLY CA C 78 44.707 44.707 45.044 -0.337 19806 4313 1 8 . 1 1 79 79 ILE N N 79 121.066 121.066 121.736 -0.670 19806 4314 1 8 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.508 0.299 19806 4315 1 8 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.201 -0.858 19806 4316 1 8 . 1 1 79 79 ILE CB C 79 39.220 39.220 37.811 1.409 19806 4317 1 8 . 1 1 80 80 TYR N N 80 130.709 130.709 129.468 1.241 19806 4318 1 8 . 1 1 80 80 TYR HA H 80 4.264 4.264 3.598 0.666 19806 4319 1 8 . 1 1 80 80 TYR CA C 80 58.161 58.161 55.829 2.332 19806 4320 1 8 . 1 1 80 80 TYR CB C 80 40.621 40.621 38.188 2.433 19806 4321 1 8 . 1 1 81 81 VAL N N 81 126.965 126.965 128.570 -1.605 19806 4322 1 8 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.419 0.435 19806 4323 1 8 . 1 1 81 81 VAL CA C 81 60.457 60.457 61.295 -0.838 19806 4324 1 8 . 1 1 81 81 VAL CB C 81 35.004 35.004 34.130 0.874 19806 4325 1 8 . 1 1 82 82 SER N N 82 120.914 120.914 122.527 -1.613 19806 4326 1 8 . 1 1 82 82 SER HA H 82 5.185 5.185 4.988 0.197 19806 4327 1 8 . 1 1 82 82 SER CA C 82 55.260 55.260 56.349 -1.089 19806 4328 1 8 . 1 1 82 82 SER CB C 82 64.785 64.785 64.274 0.511 19806 4329 1 8 . 1 1 83 83 LYS N N 83 119.415 119.415 122.545 -3.130 19806 4330 1 8 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.575 0.203 19806 4331 1 8 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.432 0.327 19806 4332 1 8 . 1 1 83 83 LYS CB C 83 35.514 35.514 36.284 -0.770 19806 4333 1 8 . 1 1 84 84 PHE N N 84 119.220 119.220 118.916 0.304 19806 4334 1 8 . 1 1 84 84 PHE HA H 84 5.441 5.441 4.663 0.778 19806 4335 1 8 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.890 0.524 19806 4336 1 8 . 1 1 84 84 PHE CB C 84 37.523 37.523 38.715 -1.192 19806 4337 1 8 . 1 1 85 85 THR N N 85 119.257 119.257 111.255 8.002 19806 4338 1 8 . 1 1 85 85 THR HA H 85 4.057 4.057 4.370 -0.313 19806 4339 1 8 . 1 1 85 85 THR CA C 85 62.660 62.660 62.274 0.386 19806 4340 1 8 . 1 1 85 85 THR CB C 85 67.698 67.698 69.544 -1.846 19806 4341 1 8 . 1 1 86 86 LEU N N 86 121.612 121.612 122.367 -0.755 19806 4342 1 8 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.661 -0.063 19806 4343 1 8 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.636 0.609 19806 4344 1 8 . 1 1 86 86 LEU CB C 86 44.657 44.657 45.468 -0.810 19806 4345 1 8 . 1 1 87 87 ASN N N 87 127.684 127.684 120.796 6.888 19806 4346 1 8 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.784 0.227 19806 4347 1 8 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.782 -1.483 19806 4348 1 8 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.344 0.251 19806 4349 1 8 . 1 1 88 88 GLU N N 88 120.509 120.509 122.114 -1.605 19806 4350 1 8 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.714 0.143 19806 4351 1 8 . 1 1 88 88 GLU CA C 88 54.382 54.382 54.260 0.122 19806 4352 1 8 . 1 1 88 88 GLU CB C 88 29.808 29.808 30.567 -0.759 19806 4353 1 8 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.415 -0.034 19806 4354 1 8 . 1 1 89 89 PRO CA C 89 65.898 65.898 64.774 1.124 19806 4355 1 8 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.147 0.204 19806 4356 1 8 . 1 1 90 90 LYS N N 90 107.288 107.288 115.579 -8.291 19806 4357 1 8 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.818 -0.134 19806 4358 1 8 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.531 -0.551 19806 4359 1 8 . 1 1 90 90 LYS CB C 90 32.994 32.994 34.051 -1.057 19806 4360 1 8 . 1 1 91 91 HIS N N 91 119.523 119.523 118.588 0.935 19806 4361 1 8 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.784 -0.007 19806 4362 1 8 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.226 -0.521 19806 4363 1 8 . 1 1 91 91 HIS CB C 91 32.194 32.194 33.016 -0.821 19806 4364 1 8 . 1 1 92 92 LYS N N 92 122.527 122.527 122.959 -0.432 19806 4365 1 8 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.766 0.363 19806 4366 1 8 . 1 1 92 92 LYS CA C 92 54.291 54.291 55.404 -1.113 19806 4367 1 8 . 1 1 92 92 LYS CB C 92 37.479 37.479 37.220 0.259 19806 4368 1 8 . 1 1 93 93 ILE N N 93 121.564 121.564 120.827 0.737 19806 4369 1 8 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.688 0.622 19806 4370 1 8 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.555 0.582 19806 4371 1 8 . 1 1 93 93 ILE CB C 93 41.088 41.088 41.596 -0.508 19806 4372 1 8 . 1 1 94 94 PHE N N 94 128.955 128.955 128.420 0.535 19806 4373 1 8 . 1 1 94 94 PHE HA H 94 4.900 4.900 5.019 -0.119 19806 4374 1 8 . 1 1 94 94 PHE CA C 94 55.843 55.843 56.860 -1.017 19806 4375 1 8 . 1 1 95 95 GLU N N 95 124.809 124.809 127.725 -2.916 19806 4376 1 8 . 1 1 95 95 GLU HA H 95 5.418 5.418 4.986 0.432 19806 4377 1 8 . 1 1 95 95 GLU CA C 95 54.481 54.481 54.618 -0.137 19806 4378 1 8 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.706 1.454 19806 4379 1 8 . 1 1 96 96 ALA N N 96 123.759 123.759 127.018 -3.259 19806 4380 1 8 . 1 1 96 96 ALA HA H 96 5.379 5.379 5.268 0.111 19806 4381 1 8 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.514 -0.973 19806 4382 1 8 . 1 1 96 96 ALA CB C 96 23.830 23.830 21.827 2.003 19806 4383 1 8 . 1 1 97 97 GLY N N 97 106.592 106.592 111.011 -4.419 19806 4384 1 8 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.266 0.169 19806 4385 1 8 . 1 1 98 98 TYR N N 98 119.250 119.250 119.061 0.189 19806 4386 1 8 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.987 -0.169 19806 4387 1 8 . 1 1 98 98 TYR CA C 98 59.387 59.387 58.390 0.997 19806 4388 1 8 . 1 1 98 98 TYR CB C 98 38.122 38.122 40.541 -2.419 19806 4389 1 8 . 1 1 99 99 GLU N N 99 123.080 123.080 123.720 -0.640 19806 4390 1 8 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.145 -0.136 19806 4391 1 8 . 1 1 99 99 GLU CA C 99 58.409 58.409 59.044 -0.635 19806 4392 1 8 . 1 1 99 99 GLU CB C 99 30.254 30.254 29.945 0.309 19806 4393 1 8 . 1 1 100 100 GLU N N 100 116.459 116.459 117.281 -0.822 19806 4394 1 8 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.385 -0.349 19806 4395 1 8 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.879 0.525 19806 4396 1 8 . 1 1 100 100 GLU CB C 100 27.576 27.576 30.127 -2.551 19806 4397 1 8 . 1 1 101 101 SER N N 101 113.069 113.069 114.498 -1.429 19806 4398 1 8 . 1 1 101 101 SER HA H 101 4.839 4.839 4.699 0.140 19806 4399 1 8 . 1 1 101 101 SER CA C 101 56.024 56.024 57.455 -1.431 19806 4400 1 8 . 1 1 101 101 SER CB C 101 64.806 64.806 64.990 -0.184 19806 4401 1 8 . 1 1 102 102 GLU N N 102 120.439 120.439 120.338 0.101 19806 4402 1 8 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.532 -0.143 19806 4403 1 8 . 1 1 102 102 GLU CA C 102 55.804 55.804 55.569 0.235 19806 4404 1 8 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.372 -0.387 19806 4405 1 8 . 1 1 103 103 VAL N N 103 118.899 118.899 114.964 3.935 19806 4406 1 8 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.116 -0.030 19806 4407 1 8 . 1 1 103 103 VAL CA C 103 62.699 62.699 63.041 -0.342 19806 4408 1 8 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.080 0.181 19806 4409 1 8 . 1 1 104 104 ASP N N 104 120.965 120.965 121.456 -0.491 19806 4410 1 8 . 1 1 104 104 ASP HA H 104 5.003 5.003 4.925 0.078 19806 4411 1 8 . 1 1 104 104 ASP CA C 104 54.914 54.914 54.233 0.681 19806 4412 1 8 . 1 1 104 104 ASP CB C 104 42.791 42.791 43.683 -0.892 19806 4413 1 8 . 1 1 105 105 LEU N N 105 120.365 120.365 118.578 1.787 19806 4414 1 8 . 1 1 105 105 LEU HA H 105 5.295 5.295 5.234 0.061 19806 4415 1 8 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.769 -0.338 19806 4416 1 8 . 1 1 105 105 LEU CB C 105 46.001 46.001 45.146 0.855 19806 4417 1 8 . 1 1 106 106 ARG N N 106 126.289 126.289 124.953 1.336 19806 4418 1 8 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.438 0.387 19806 4419 1 8 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.345 0.327 19806 4420 1 8 . 1 1 106 106 ARG CB C 106 33.920 33.920 33.956 -0.036 19806 4421 1 8 . 1 1 107 107 VAL N N 107 126.145 126.145 117.485 8.660 19806 4422 1 8 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.566 0.113 19806 4423 1 8 . 1 1 107 107 VAL CA C 107 61.671 61.671 59.929 1.742 19806 4424 1 8 . 1 1 107 107 VAL CB C 107 35.350 35.350 35.837 -0.487 19806 4425 1 8 . 1 1 108 108 GLU N N 108 127.093 127.093 118.421 8.672 19806 4426 1 8 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.957 0.310 19806 4427 1 8 . 1 1 108 108 GLU CA C 108 54.761 54.761 54.840 -0.079 19806 4428 1 8 . 1 1 108 108 GLU CB C 108 32.567 32.567 34.420 -1.853 19806 4429 1 8 . 1 1 109 109 PHE N N 109 124.592 124.592 119.838 4.754 19806 4430 1 8 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.346 0.682 19806 4431 1 8 . 1 1 109 109 PHE CA C 109 55.945 55.945 57.206 -1.261 19806 4432 1 8 . 1 1 109 109 PHE CB C 109 43.099 43.099 42.224 0.875 19806 4433 1 8 . 1 1 110 110 GLU N N 110 122.143 122.143 122.123 0.020 19806 4434 1 8 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.434 -0.241 19806 4435 1 8 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.371 1.072 19806 4436 1 8 . 1 1 110 110 GLU CB C 110 35.816 35.816 34.215 1.601 19806 4437 1 8 . 1 1 111 111 LEU N N 111 129.616 129.616 125.427 4.189 19806 4438 1 8 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.911 -0.103 19806 4439 1 8 . 1 1 111 111 LEU CA C 111 53.470 53.470 55.024 -1.554 19806 4440 1 8 . 1 1 111 111 LEU CB C 111 40.400 40.400 41.741 -1.341 19806 4441 1 8 . 1 1 112 112 GLN N N 112 124.742 124.742 124.960 -0.218 19806 4442 1 8 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.212 0.227 19806 4443 1 8 . 1 1 112 112 GLN CA C 112 55.802 55.802 54.529 1.273 19806 4444 1 8 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.879 -1.126 19806 4445 1 8 . 1 1 113 113 ALA N N 113 121.195 121.195 124.927 -3.732 19806 4446 1 8 . 1 1 113 113 ALA HA H 113 4.048 4.048 3.964 0.084 19806 4447 1 8 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.223 0.295 19806 4448 1 8 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.422 -0.223 19806 4449 1 8 . 1 1 114 114 ASP N N 114 114.525 114.525 117.306 -2.781 19806 4450 1 8 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.459 -0.060 19806 4451 1 8 . 1 1 114 114 ASP CA C 114 52.908 52.908 53.860 -0.952 19806 4452 1 8 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.734 -1.676 19806 4453 1 8 . 1 1 115 115 GLY N N 115 107.526 107.526 106.215 1.311 19806 4454 1 8 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.562 0.222 19806 4455 1 8 . 1 1 116 116 LYS N N 116 118.818 118.818 118.848 -0.030 19806 4456 1 8 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.642 -0.192 19806 4457 1 8 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.017 0.154 19806 4458 1 8 . 1 1 116 116 LYS CB C 116 35.039 35.039 35.881 -0.842 19806 4459 1 8 . 1 1 117 117 TRP N N 117 118.939 118.939 121.726 -2.787 19806 4460 1 8 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.356 -0.400 19806 4461 1 8 . 1 1 118 118 TYR N N 118 112.644 112.644 117.659 -5.015 19806 4462 1 8 . 1 1 118 118 TYR HA H 118 5.277 5.277 5.031 0.246 19806 4463 1 8 . 1 1 118 118 TYR CA C 118 56.219 56.219 56.880 -0.661 19806 4464 1 8 . 1 1 118 118 TYR CB C 118 43.282 43.282 42.463 0.819 19806 4465 1 8 . 1 1 119 119 VAL N N 119 119.842 119.842 121.203 -1.361 19806 4466 1 8 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.368 0.147 19806 4467 1 8 . 1 1 119 119 VAL CA C 119 62.442 62.442 63.324 -0.882 19806 4468 1 8 . 1 1 120 120 VAL N N 120 114.552 114.552 115.768 -1.216 19806 4469 1 8 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.479 0.259 19806 4470 1 8 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.501 -0.906 19806 4471 1 8 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.581 -0.729 19806 4472 1 8 . 1 1 121 121 ASP N N 121 118.234 118.234 119.217 -0.983 19806 4473 1 8 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.997 0.266 19806 4474 1 8 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.730 -0.067 19806 4475 1 8 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.873 -0.986 19806 4476 1 8 . 1 1 122 122 CYS N N 122 121.036 121.036 120.640 0.396 19806 4477 1 8 . 1 1 122 122 CYS HA H 122 5.571 5.571 5.047 0.524 19806 4478 1 8 . 1 1 122 122 CYS CA C 122 57.052 57.052 58.443 -1.391 19806 4479 1 8 . 1 1 122 122 CYS CB C 122 30.834 30.834 29.995 0.839 19806 4480 1 8 . 1 1 123 123 TYR N N 123 127.672 127.672 128.883 -1.211 19806 4481 1 8 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.905 0.105 19806 4482 1 8 . 1 1 123 123 TYR CA C 123 57.169 57.169 57.721 -0.552 19806 4483 1 8 . 1 1 123 123 TYR CB C 123 41.408 41.408 42.958 -1.550 19806 4484 1 8 . 1 1 124 124 THR N N 124 120.833 120.833 119.259 1.574 19806 4485 1 8 . 1 1 124 124 THR HA H 124 4.987 4.987 4.937 0.050 19806 4486 1 8 . 1 1 124 124 THR CA C 124 57.153 57.153 60.007 -2.854 19806 4487 1 8 . 1 1 124 124 THR CB C 124 68.607 68.607 70.847 -2.240 19806 4488 1 8 . 1 1 125 125 GLY N N 125 114.347 114.347 113.812 0.535 19806 4489 1 8 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.723 -0.395 19806 4490 1 8 . 1 1 126 126 TRP N N 126 119.918 119.918 122.182 -2.264 19806 4491 1 8 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.013 0.057 19806 4492 1 8 . 1 1 126 126 TRP CA C 126 60.564 60.564 58.836 1.728 19806 4493 1 8 . 1 1 126 126 TRP CB C 126 29.639 29.639 28.921 0.718 19806 4494 1 8 . 1 1 127 127 TYR N N 127 113.911 113.911 112.578 1.333 19806 4495 1 8 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.716 0.278 19806 4496 1 8 . 1 1 127 127 TYR CA C 127 53.384 53.384 56.865 -3.481 19806 4497 1 8 . 1 1 127 127 TYR CB C 127 38.584 38.584 37.664 0.920 19806 4498 1 8 . 1 1 128 128 GLY N N 128 105.181 105.181 107.275 -2.094 19806 4499 1 8 . 1 1 128 128 GLY CA C 128 45.189 45.189 44.443 0.746 19806 4500 1 8 . 1 1 129 129 TYR N N 129 116.588 116.588 119.778 -3.190 19806 4501 1 8 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.445 0.219 19806 4502 1 8 . 1 1 129 129 TYR CA C 129 59.565 59.565 59.380 0.184 19806 4503 1 8 . 1 1 129 129 TYR CB C 129 38.853 38.853 36.382 2.471 19806 4504 1 8 . 1 1 130 130 ASP N N 130 115.195 115.195 120.680 -5.485 19806 4505 1 8 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.763 -0.378 19806 4506 1 8 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.671 -1.541 19806 4507 1 8 . 1 1 130 130 ASP CB C 130 38.685 38.685 43.026 -4.341 19806 4508 1 8 . 1 1 131 131 LEU N N 131 124.887 124.887 121.901 2.986 19806 4509 1 8 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.899 -0.417 19806 4510 1 8 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.123 1.482 19806 4511 1 8 . 1 1 131 131 LEU CB C 131 42.441 42.441 43.802 -1.361 19806 4512 1 8 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.794 -0.111 19806 4513 1 8 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.535 65.531 19806 4514 1 8 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.146 -0.819 19806 4515 1 8 . 1 1 133 133 ILE N N 133 123.765 123.765 119.837 3.928 19806 4516 1 8 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.406 0.323 19806 4517 1 8 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.553 1.307 19806 4518 1 8 . 1 1 133 133 ILE CB C 133 38.063 38.063 37.976 0.087 19806 4519 1 8 . 1 1 134 134 GLY N N 134 107.030 107.030 107.353 -0.323 19806 4520 1 8 . 1 1 134 134 GLY CA C 134 45.976 45.976 46.022 -0.046 19806 4521 1 8 . 1 1 135 135 GLU N N 135 116.566 116.566 121.327 -4.761 19806 4522 1 8 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.295 0.369 19806 4523 1 8 . 1 1 135 135 GLU CA C 135 55.414 55.414 57.353 -1.939 19806 4524 1 8 . 1 1 135 135 GLU CB C 135 30.195 30.195 29.635 0.560 19806 4525 1 8 . 1 1 136 136 LEU N N 136 124.239 124.239 121.446 2.793 19806 4526 1 8 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.974 0.070 19806 4527 1 8 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.493 0.623 19806 4528 1 8 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.780 -0.773 19806 4529 1 8 . 1 1 137 137 LYS N N 137 117.225 117.225 116.232 0.993 19806 4530 1 8 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.823 0.040 19806 4531 1 8 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.254 1.201 19806 4532 1 8 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.376 -0.173 19806 4533 1 8 . 1 1 138 138 GLN N N 138 118.718 118.718 118.480 0.238 19806 4534 1 8 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.053 -0.001 19806 4535 1 8 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.589 -0.714 19806 4536 1 8 . 1 1 138 138 GLN CB C 138 28.235 28.235 27.928 0.307 19806 4537 1 8 . 1 1 139 139 THR N N 139 117.970 117.970 116.000 1.970 19806 4538 1 8 . 1 1 139 139 THR HA H 139 4.532 4.532 3.972 0.560 19806 4539 1 8 . 1 1 139 139 THR CA C 139 68.145 68.145 66.304 1.841 19806 4540 1 8 . 1 1 139 139 THR CB C 139 68.103 68.103 68.244 -0.141 19806 4541 1 8 . 1 1 140 140 ILE N N 140 120.391 120.391 121.510 -1.119 19806 4542 1 8 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.714 0.013 19806 4543 1 8 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.897 0.359 19806 4544 1 8 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.303 0.810 19806 4545 1 8 . 1 1 141 141 GLN N N 141 118.917 118.917 118.324 0.593 19806 4546 1 8 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.984 0.031 19806 4547 1 8 . 1 1 141 141 GLN CA C 141 58.371 58.371 58.466 -0.095 19806 4548 1 8 . 1 1 141 141 GLN CB C 141 27.347 27.347 27.635 -0.288 19806 4549 1 8 . 1 1 142 142 ASN N N 142 119.936 119.936 117.538 2.398 19806 4550 1 8 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.495 0.020 19806 4551 1 8 . 1 1 142 142 ASN CA C 142 55.799 55.799 55.551 0.248 19806 4552 1 8 . 1 1 142 142 ASN CB C 142 37.630 37.630 37.688 -0.058 19806 4553 1 8 . 1 1 143 143 VAL N N 143 123.195 123.195 120.795 2.400 19806 4554 1 8 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.411 -0.695 19806 4555 1 8 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.087 0.410 19806 4556 1 8 . 1 1 143 143 VAL CB C 143 30.989 30.989 30.983 0.006 19806 4557 1 8 . 1 1 144 144 LYS N N 144 120.348 120.348 119.046 1.302 19806 4558 1 8 . 1 1 144 144 LYS HA H 144 3.881 3.881 3.971 -0.090 19806 4559 1 8 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.807 0.316 19806 4560 1 8 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.157 -0.275 19806 4561 1 8 . 1 1 145 145 GLU N N 145 119.220 119.220 118.785 0.435 19806 4562 1 8 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.153 0.030 19806 4563 1 8 . 1 1 145 145 GLU CA C 145 59.178 59.178 58.922 0.256 19806 4564 1 8 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.672 -0.601 19806 4565 1 8 . 1 1 146 146 GLU N N 146 121.420 121.420 120.413 1.007 19806 4566 1 8 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.064 0.213 19806 4567 1 8 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.746 -0.628 19806 4568 1 8 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.555 -1.213 19806 4569 1 8 . 1 1 147 147 ASN N N 147 119.197 119.197 117.088 2.109 19806 4570 1 8 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.634 -0.066 19806 4571 1 8 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.760 -1.609 19806 4572 1 8 . 1 1 147 147 ASN CB C 147 37.373 37.373 38.001 -0.628 19806 4573 1 8 . 1 1 148 148 ALA N N 148 123.672 123.672 122.985 0.687 19806 4574 1 8 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.324 -0.201 19806 4575 1 8 . 1 1 148 148 ALA CA C 148 55.133 55.133 54.932 0.201 19806 4576 1 8 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.346 -0.739 19806 4577 1 8 . 1 1 149 149 ALA N N 149 119.979 119.979 121.929 -1.950 19806 4578 1 8 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.082 0.179 19806 4579 1 8 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.676 -0.031 19806 4580 1 8 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.522 -0.784 19806 4581 1 8 . 1 1 150 150 PHE N N 150 119.592 119.592 119.644 -0.052 19806 4582 1 8 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.216 0.008 19806 4583 1 8 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.550 -0.542 19806 4584 1 8 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.619 -0.557 19806 4585 1 8 . 1 1 151 151 LYS N N 151 116.869 116.869 118.771 -1.902 19806 4586 1 8 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.384 -0.478 19806 4587 1 8 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.397 0.373 19806 4588 1 8 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.181 0.560 19806 4589 1 8 . 1 1 152 152 GLU N N 152 115.868 115.868 120.020 -4.152 19806 4590 1 8 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.157 -0.104 19806 4591 1 8 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.882 -0.226 19806 4592 1 8 . 1 1 152 152 GLU CB C 152 29.753 29.753 30.056 -0.303 19806 4593 1 8 . 1 1 153 153 ILE N N 153 110.437 110.437 114.528 -4.091 19806 4594 1 8 . 1 1 153 153 ILE HA H 153 4.176 4.176 4.163 0.013 19806 4595 1 8 . 1 1 153 153 ILE CA C 153 61.034 61.034 61.435 -0.401 19806 4596 1 8 . 1 1 153 153 ILE CB C 153 39.272 39.272 40.424 -1.152 19806 4597 1 8 . 1 1 154 154 HIS N N 154 117.779 117.779 119.660 -1.881 19806 4598 1 8 . 1 1 154 154 HIS HA H 154 5.174 5.174 5.275 -0.101 19806 4599 1 8 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.937 -1.321 19806 4600 1 8 . 1 1 154 154 HIS CB C 154 28.547 28.547 29.639 -1.092 19806 4601 1 9 . 1 1 3 3 SER N N 3 114.847 114.847 115.578 -0.731 19806 4602 1 9 . 1 1 3 3 SER HA H 3 4.463 4.463 5.060 -0.597 19806 4603 1 9 . 1 1 3 3 SER CA C 3 58.340 58.340 57.797 0.543 19806 4604 1 9 . 1 1 3 3 SER CB C 3 63.457 63.457 65.434 -1.977 19806 4605 1 9 . 1 1 4 4 GLU N N 4 121.498 121.498 119.589 1.909 19806 4606 1 9 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.569 -0.237 19806 4607 1 9 . 1 1 4 4 GLU CA C 4 56.443 56.443 55.864 0.579 19806 4608 1 9 . 1 1 4 4 GLU CB C 4 29.966 29.966 30.811 -0.845 19806 4609 1 9 . 1 1 5 5 LEU N N 5 121.589 121.589 121.058 0.531 19806 4610 1 9 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.765 -0.328 19806 4611 1 9 . 1 1 5 5 LEU CA C 5 55.019 55.019 54.191 0.829 19806 4612 1 9 . 1 1 5 5 LEU CB C 5 42.243 42.243 43.274 -1.031 19806 4613 1 9 . 1 1 6 6 THR N N 6 113.708 113.708 115.415 -1.707 19806 4614 1 9 . 1 1 6 6 THR HA H 6 4.470 4.470 4.685 -0.215 19806 4615 1 9 . 1 1 6 6 THR CA C 6 61.409 61.409 61.187 0.222 19806 4616 1 9 . 1 1 6 6 THR CB C 6 69.544 69.544 69.785 -0.241 19806 4617 1 9 . 1 1 7 7 THR N N 7 114.945 114.945 115.088 -0.143 19806 4618 1 9 . 1 1 7 7 THR HA H 7 4.415 4.415 4.643 -0.228 19806 4619 1 9 . 1 1 7 7 THR CA C 7 61.435 61.435 61.982 -0.547 19806 4620 1 9 . 1 1 7 7 THR CB C 7 69.506 69.506 70.378 -0.872 19806 4621 1 9 . 1 1 8 8 GLN N N 8 121.368 121.368 125.357 -3.989 19806 4622 1 9 . 1 1 8 8 GLN CA C 8 55.684 55.684 55.689 -0.005 19806 4623 1 9 . 1 1 9 9 ASP N N 9 120.595 120.595 122.341 -1.746 19806 4624 1 9 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.306 0.341 19806 4625 1 9 . 1 1 9 9 ASP CA C 9 54.115 54.115 55.025 -0.910 19806 4626 1 9 . 1 1 9 9 ASP CB C 9 41.328 41.328 40.917 0.411 19806 4627 1 9 . 1 1 10 10 GLY N N 10 106.984 106.984 101.944 5.040 19806 4628 1 9 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.330 0.165 19806 4629 1 9 . 1 1 11 11 GLU N N 11 120.879 120.879 120.936 -0.057 19806 4630 1 9 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.388 -0.199 19806 4631 1 9 . 1 1 11 11 GLU CA C 11 56.510 56.510 55.752 0.758 19806 4632 1 9 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.549 1.520 19806 4633 1 9 . 1 1 12 12 ASP N N 12 126.686 126.686 122.657 4.029 19806 4634 1 9 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.493 0.257 19806 4635 1 9 . 1 1 12 12 ASP CA C 12 54.347 54.347 54.549 -0.202 19806 4636 1 9 . 1 1 12 12 ASP CB C 12 42.771 42.771 41.586 1.185 19806 4637 1 9 . 1 1 13 13 PHE N N 13 128.055 128.055 121.876 6.179 19806 4638 1 9 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.477 -0.065 19806 4639 1 9 . 1 1 13 13 PHE CA C 13 62.551 62.551 59.327 3.224 19806 4640 1 9 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.116 0.717 19806 4641 1 9 . 1 1 14 14 LYS N N 14 117.498 117.498 119.542 -2.044 19806 4642 1 9 . 1 1 14 14 LYS HA H 14 3.581 3.581 4.214 -0.633 19806 4643 1 9 . 1 1 14 14 LYS CA C 14 59.461 59.461 57.700 1.761 19806 4644 1 9 . 1 1 14 14 LYS CB C 14 31.344 31.344 32.100 -0.756 19806 4645 1 9 . 1 1 15 15 SER N N 15 113.775 113.775 115.088 -1.313 19806 4646 1 9 . 1 1 15 15 SER HA H 15 4.167 4.167 4.118 0.049 19806 4647 1 9 . 1 1 15 15 SER CA C 15 61.099 61.099 61.901 -0.802 19806 4648 1 9 . 1 1 15 15 SER CB C 15 62.428 62.428 62.648 -0.220 19806 4649 1 9 . 1 1 16 16 PHE N N 16 122.292 122.292 118.842 3.450 19806 4650 1 9 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.547 -0.257 19806 4651 1 9 . 1 1 16 16 PHE CA C 16 59.773 59.773 58.875 0.898 19806 4652 1 9 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.209 -1.034 19806 4653 1 9 . 1 1 17 17 LEU N N 17 122.472 122.472 122.921 -0.449 19806 4654 1 9 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.774 -0.924 19806 4655 1 9 . 1 1 17 17 LEU CA C 17 56.619 56.619 57.792 -1.173 19806 4656 1 9 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.900 -0.438 19806 4657 1 9 . 1 1 18 18 ASP N N 18 117.331 117.331 119.688 -2.357 19806 4658 1 9 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.363 -0.248 19806 4659 1 9 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.270 -0.875 19806 4660 1 9 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.270 0.083 19806 4661 1 9 . 1 1 19 19 LYS N N 19 120.032 120.032 119.098 0.934 19806 4662 1 9 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.981 -0.304 19806 4663 1 9 . 1 1 19 19 LYS CA C 19 59.067 59.067 59.301 -0.234 19806 4664 1 9 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.613 -0.677 19806 4665 1 9 . 1 1 20 20 PHE N N 20 119.607 119.607 116.158 3.449 19806 4666 1 9 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.756 -0.647 19806 4667 1 9 . 1 1 20 20 PHE CA C 20 62.090 62.090 58.488 3.602 19806 4668 1 9 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.200 1.269 19806 4669 1 9 . 1 1 21 21 THR N N 21 101.473 101.473 112.014 -10.541 19806 4670 1 9 . 1 1 21 21 THR HA H 21 4.259 4.259 3.729 0.530 19806 4671 1 9 . 1 1 21 21 THR CA C 21 61.774 61.774 64.267 -2.493 19806 4672 1 9 . 1 1 22 22 SER N N 22 111.453 111.453 115.396 -3.943 19806 4673 1 9 . 1 1 22 22 SER HA H 22 4.165 4.165 3.654 0.511 19806 4674 1 9 . 1 1 22 22 SER CA C 22 58.215 58.215 59.723 -1.508 19806 4675 1 9 . 1 1 22 22 SER CB C 22 64.570 64.570 63.431 1.139 19806 4676 1 9 . 1 1 23 23 SER N N 23 114.184 114.184 112.799 1.385 19806 4677 1 9 . 1 1 23 23 SER HA H 23 4.764 4.764 4.613 0.151 19806 4678 1 9 . 1 1 23 23 SER CA C 23 55.669 55.669 57.698 -2.029 19806 4679 1 9 . 1 1 23 23 SER CB C 23 64.011 64.011 63.793 0.218 19806 4680 1 9 . 1 1 24 24 ALA N N 24 133.370 133.370 131.430 1.940 19806 4681 1 9 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.296 -0.340 19806 4682 1 9 . 1 1 24 24 ALA CA C 24 55.106 55.106 55.685 -0.579 19806 4683 1 9 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.238 0.597 19806 4684 1 9 . 1 1 25 25 ALA N N 25 117.430 117.430 119.800 -2.370 19806 4685 1 9 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.453 -0.136 19806 4686 1 9 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.348 0.853 19806 4687 1 9 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.397 -0.048 19806 4688 1 9 . 1 1 26 26 PHE N N 26 116.042 116.042 117.571 -1.529 19806 4689 1 9 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.624 -0.314 19806 4690 1 9 . 1 1 26 26 PHE CA C 26 60.759 60.759 59.765 0.994 19806 4691 1 9 . 1 1 26 26 PHE CB C 26 39.310 39.310 40.520 -1.210 19806 4692 1 9 . 1 1 27 27 GLN N N 27 121.820 121.820 119.040 2.780 19806 4693 1 9 . 1 1 27 27 GLN HA H 27 3.391 3.391 3.983 -0.592 19806 4694 1 9 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.040 1.054 19806 4695 1 9 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.625 -1.168 19806 4696 1 9 . 1 1 28 28 TYR N N 28 111.517 111.517 116.673 -5.156 19806 4697 1 9 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.802 0.328 19806 4698 1 9 . 1 1 28 28 TYR CA C 28 62.357 62.357 59.813 2.543 19806 4699 1 9 . 1 1 28 28 TYR CB C 28 38.568 38.568 38.080 0.488 19806 4700 1 9 . 1 1 29 29 THR N N 29 106.324 106.324 113.745 -7.421 19806 4701 1 9 . 1 1 29 29 THR HA H 29 4.489 4.489 4.159 0.330 19806 4702 1 9 . 1 1 29 29 THR CA C 29 63.765 63.765 62.469 1.296 19806 4703 1 9 . 1 1 29 29 THR CB C 29 69.568 69.568 67.297 2.271 19806 4704 1 9 . 1 1 30 30 ARG N N 30 117.696 117.696 121.480 -3.784 19806 4705 1 9 . 1 1 30 30 ARG HA H 30 4.701 4.701 3.818 0.883 19806 4706 1 9 . 1 1 30 30 ARG CA C 30 52.760 52.760 55.514 -2.754 19806 4707 1 9 . 1 1 30 30 ARG CB C 30 35.047 35.047 32.045 3.002 19806 4708 1 9 . 1 1 31 31 VAL N N 31 119.395 119.395 119.595 -0.200 19806 4709 1 9 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.562 -0.332 19806 4710 1 9 . 1 1 31 31 VAL CA C 31 61.191 61.191 61.164 0.027 19806 4711 1 9 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.316 -2.143 19806 4712 1 9 . 1 1 32 32 LYS N N 32 126.124 126.124 126.001 0.123 19806 4713 1 9 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.524 -0.340 19806 4714 1 9 . 1 1 32 32 LYS CA C 32 53.958 53.958 55.908 -1.950 19806 4715 1 9 . 1 1 32 32 LYS CB C 32 31.112 31.112 33.770 -2.658 19806 4716 1 9 . 1 1 33 33 PHE N N 33 119.303 119.303 118.742 0.561 19806 4717 1 9 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.815 -0.301 19806 4718 1 9 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.425 0.847 19806 4719 1 9 . 1 1 33 33 PHE CB C 33 40.378 40.378 40.523 -0.145 19806 4720 1 9 . 1 1 34 34 PRO HA H 34 4.968 4.968 2.914 2.054 19806 4721 1 9 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.092 -0.459 19806 4722 1 9 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.120 1.613 19806 4723 1 9 . 1 1 35 35 LEU N N 35 120.016 120.016 118.968 1.048 19806 4724 1 9 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.497 -0.275 19806 4725 1 9 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.963 0.877 19806 4726 1 9 . 1 1 35 35 LEU CB C 35 41.244 41.244 43.008 -1.764 19806 4727 1 9 . 1 1 36 36 LYS N N 36 117.066 117.066 119.734 -2.668 19806 4728 1 9 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.336 -0.361 19806 4729 1 9 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.628 2.619 19806 4730 1 9 . 1 1 36 36 LYS CB C 36 32.832 32.832 33.117 -0.285 19806 4731 1 9 . 1 1 37 37 THR N N 37 117.574 117.574 118.137 -0.563 19806 4732 1 9 . 1 1 37 37 THR HA H 37 4.797 4.797 4.878 -0.081 19806 4733 1 9 . 1 1 37 37 THR CA C 37 60.396 60.396 58.723 1.673 19806 4734 1 9 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.560 0.459 19806 4735 1 9 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.551 -0.628 19806 4736 1 9 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.877 -0.246 19806 4737 1 9 . 1 1 39 39 ILE N N 39 119.949 119.949 119.087 0.862 19806 4738 1 9 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.190 0.049 19806 4739 1 9 . 1 1 39 39 ILE CA C 39 62.133 62.133 62.904 -0.771 19806 4740 1 9 . 1 1 40 40 THR N N 40 123.962 123.962 124.194 -0.232 19806 4741 1 9 . 1 1 40 40 THR HA H 40 5.057 5.057 4.997 0.060 19806 4742 1 9 . 1 1 40 40 THR CA C 40 62.262 62.262 61.737 0.525 19806 4743 1 9 . 1 1 40 40 THR CB C 40 69.891 69.891 70.440 -0.549 19806 4744 1 9 . 1 1 41 41 LEU N N 41 125.633 125.633 129.542 -3.909 19806 4745 1 9 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.673 0.429 19806 4746 1 9 . 1 1 41 41 LEU CA C 41 52.638 52.638 53.529 -0.891 19806 4747 1 9 . 1 1 41 41 LEU CB C 41 45.180 45.180 44.370 0.810 19806 4748 1 9 . 1 1 42 42 LEU N N 42 120.788 120.788 126.342 -5.554 19806 4749 1 9 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.213 0.535 19806 4750 1 9 . 1 1 42 42 LEU CA C 42 53.724 53.724 55.054 -1.330 19806 4751 1 9 . 1 1 42 42 LEU CB C 42 44.384 44.384 42.196 2.188 19806 4752 1 9 . 1 1 43 43 ALA N N 43 123.073 123.073 130.205 -7.132 19806 4753 1 9 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.210 0.220 19806 4754 1 9 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.548 -1.260 19806 4755 1 9 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.535 0.479 19806 4756 1 9 . 1 1 44 44 ASP N N 44 118.196 118.196 118.101 0.095 19806 4757 1 9 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.366 0.060 19806 4758 1 9 . 1 1 44 44 ASP CA C 44 56.028 56.028 57.069 -1.041 19806 4759 1 9 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.659 -0.449 19806 4760 1 9 . 1 1 45 45 ASP N N 45 115.018 115.018 117.236 -2.218 19806 4761 1 9 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.538 -0.069 19806 4762 1 9 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.538 -0.745 19806 4763 1 9 . 1 1 45 45 ASP CB C 45 39.864 39.864 41.162 -1.298 19806 4764 1 9 . 1 1 46 46 GLY N N 46 107.499 107.499 106.917 0.582 19806 4765 1 9 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.699 0.215 19806 4766 1 9 . 1 1 47 47 GLU N N 47 117.331 117.331 117.708 -0.377 19806 4767 1 9 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.402 0.129 19806 4768 1 9 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.239 0.699 19806 4769 1 9 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.877 2.256 19806 4770 1 9 . 1 1 48 48 THR N N 48 118.462 118.462 120.025 -1.563 19806 4771 1 9 . 1 1 48 48 THR HA H 48 4.243 4.243 4.203 0.040 19806 4772 1 9 . 1 1 48 48 THR CA C 48 62.834 62.834 63.066 -0.231 19806 4773 1 9 . 1 1 48 48 THR CB C 48 68.649 68.649 68.879 -0.230 19806 4774 1 9 . 1 1 49 49 GLU N N 49 123.834 123.834 129.035 -5.201 19806 4775 1 9 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.488 0.457 19806 4776 1 9 . 1 1 49 49 GLU CA C 49 55.358 55.358 56.626 -1.268 19806 4777 1 9 . 1 1 49 49 GLU CB C 49 31.395 31.395 29.711 1.684 19806 4778 1 9 . 1 1 50 50 LYS N N 50 122.868 122.868 128.169 -5.301 19806 4779 1 9 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.687 -0.046 19806 4780 1 9 . 1 1 50 50 LYS CA C 50 54.111 54.111 54.927 -0.816 19806 4781 1 9 . 1 1 50 50 LYS CB C 50 35.312 35.312 34.273 1.039 19806 4782 1 9 . 1 1 51 51 THR N N 51 111.386 111.386 114.591 -3.205 19806 4783 1 9 . 1 1 51 51 THR HA H 51 5.619 5.619 5.298 0.321 19806 4784 1 9 . 1 1 51 51 THR CA C 51 58.980 58.980 61.087 -2.107 19806 4785 1 9 . 1 1 51 51 THR CB C 51 71.277 71.277 69.861 1.416 19806 4786 1 9 . 1 1 52 52 PHE N N 52 120.631 120.631 118.558 2.073 19806 4787 1 9 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.920 0.043 19806 4788 1 9 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.669 -1.540 19806 4789 1 9 . 1 1 52 52 PHE CB C 52 41.049 41.049 41.700 -0.651 19806 4790 1 9 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.585 -0.137 19806 4791 1 9 . 1 1 53 53 PRO CA C 53 62.489 62.489 63.128 -0.639 19806 4792 1 9 . 1 1 53 53 PRO CB C 53 32.240 32.240 32.369 -0.129 19806 4793 1 9 . 1 1 54 54 PHE N N 54 128.034 128.034 124.317 3.717 19806 4794 1 9 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.668 0.160 19806 4795 1 9 . 1 1 54 54 PHE CA C 54 55.509 55.509 57.308 -1.799 19806 4796 1 9 . 1 1 54 54 PHE CB C 54 37.028 37.028 40.849 -3.821 19806 4797 1 9 . 1 1 55 55 THR N N 55 111.757 111.757 117.807 -6.050 19806 4798 1 9 . 1 1 55 55 THR HA H 55 4.413 4.413 4.599 -0.186 19806 4799 1 9 . 1 1 55 55 THR CA C 55 60.578 60.578 59.564 1.014 19806 4800 1 9 . 1 1 55 55 THR CB C 55 69.447 69.447 71.348 -1.901 19806 4801 1 9 . 1 1 56 56 LYS N N 56 118.734 118.734 121.027 -2.293 19806 4802 1 9 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.131 -1.649 19806 4803 1 9 . 1 1 56 56 LYS CA C 56 59.381 59.381 59.224 0.157 19806 4804 1 9 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.210 1.040 19806 4805 1 9 . 1 1 57 57 GLU N N 57 119.675 119.675 118.789 0.886 19806 4806 1 9 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.142 0.127 19806 4807 1 9 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.156 -1.004 19806 4808 1 9 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.302 -2.352 19806 4809 1 9 . 1 1 58 58 LYS N N 58 114.700 114.700 116.326 -1.626 19806 4810 1 9 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.302 0.010 19806 4811 1 9 . 1 1 58 58 LYS CA C 58 55.595 55.595 54.977 0.618 19806 4812 1 9 . 1 1 58 58 LYS CB C 58 32.011 32.011 31.982 0.029 19806 4813 1 9 . 1 1 59 59 TRP N N 59 118.204 118.204 124.012 -5.808 19806 4814 1 9 . 1 1 59 59 TRP HA H 59 5.099 5.099 4.972 0.127 19806 4815 1 9 . 1 1 59 59 TRP CA C 59 55.577 55.577 54.972 0.605 19806 4816 1 9 . 1 1 59 59 TRP CB C 59 32.037 32.037 29.932 2.105 19806 4817 1 9 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.145 0.118 19806 4818 1 9 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.577 -2.856 19806 4819 1 9 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.130 -2.281 19806 4820 1 9 . 1 1 61 61 LEU N N 61 123.758 123.758 125.284 -1.526 19806 4821 1 9 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.385 -0.746 19806 4822 1 9 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.915 -0.040 19806 4823 1 9 . 1 1 61 61 LEU CB C 61 40.815 40.815 42.119 -1.304 19806 4824 1 9 . 1 1 62 62 LEU N N 62 124.052 124.052 125.015 -0.963 19806 4825 1 9 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.294 0.061 19806 4826 1 9 . 1 1 62 62 LEU CA C 62 53.992 53.992 53.798 0.194 19806 4827 1 9 . 1 1 62 62 LEU CB C 62 44.686 44.686 44.651 0.035 19806 4828 1 9 . 1 1 63 63 ASP N N 63 117.271 117.271 119.637 -2.366 19806 4829 1 9 . 1 1 63 63 ASP HA H 63 5.033 5.033 4.780 0.253 19806 4830 1 9 . 1 1 63 63 ASP CA C 63 51.101 51.101 52.714 -1.613 19806 4831 1 9 . 1 1 63 63 ASP CB C 63 43.345 43.345 43.452 -0.107 19806 4832 1 9 . 1 1 64 64 SER N N 64 112.856 112.856 114.653 -1.797 19806 4833 1 9 . 1 1 64 64 SER HA H 64 3.865 3.865 4.456 -0.591 19806 4834 1 9 . 1 1 64 64 SER CA C 64 60.910 60.910 60.072 0.838 19806 4835 1 9 . 1 1 64 64 SER CB C 64 62.378 62.378 63.463 -1.085 19806 4836 1 9 . 1 1 65 65 GLU N N 65 120.070 120.070 119.822 0.248 19806 4837 1 9 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.160 -0.142 19806 4838 1 9 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.917 -0.574 19806 4839 1 9 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.097 -0.210 19806 4840 1 9 . 1 1 66 66 THR N N 66 115.852 115.852 112.882 2.970 19806 4841 1 9 . 1 1 66 66 THR HA H 66 3.991 3.991 4.343 -0.352 19806 4842 1 9 . 1 1 66 66 THR CA C 66 65.804 65.804 64.086 1.718 19806 4843 1 9 . 1 1 66 66 THR CB C 66 68.451 68.451 69.107 -0.656 19806 4844 1 9 . 1 1 67 67 MET N N 67 113.585 113.585 121.162 -7.577 19806 4845 1 9 . 1 1 67 67 MET HA H 67 4.267 4.267 4.236 0.031 19806 4846 1 9 . 1 1 67 67 MET CA C 67 52.135 52.135 53.650 -1.515 19806 4847 1 9 . 1 1 67 67 MET CB C 67 28.963 28.963 30.067 -1.104 19806 4848 1 9 . 1 1 68 68 LYS N N 68 118.462 118.462 121.046 -2.584 19806 4849 1 9 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.551 -0.181 19806 4850 1 9 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.638 -0.156 19806 4851 1 9 . 1 1 68 68 LYS CB C 68 34.179 34.179 34.764 -0.585 19806 4852 1 9 . 1 1 69 69 GLU N N 69 121.700 121.700 125.183 -3.483 19806 4853 1 9 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.568 -0.044 19806 4854 1 9 . 1 1 69 69 GLU CA C 69 55.942 55.942 57.548 -1.606 19806 4855 1 9 . 1 1 69 69 GLU CB C 69 30.424 30.424 29.672 0.752 19806 4856 1 9 . 1 1 70 70 GLU N N 70 123.445 123.445 125.721 -2.276 19806 4857 1 9 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.610 0.087 19806 4858 1 9 . 1 1 70 70 GLU CA C 70 55.473 55.473 55.639 -0.166 19806 4859 1 9 . 1 1 70 70 GLU CB C 70 33.162 33.162 33.291 -0.129 19806 4860 1 9 . 1 1 71 71 ARG N N 71 122.150 122.150 123.676 -1.526 19806 4861 1 9 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.905 0.246 19806 4862 1 9 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.053 0.395 19806 4863 1 9 . 1 1 71 71 ARG CB C 71 31.703 31.703 31.997 -0.294 19806 4864 1 9 . 1 1 72 72 ILE N N 72 125.686 125.686 128.550 -2.864 19806 4865 1 9 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.398 0.198 19806 4866 1 9 . 1 1 72 72 ILE CA C 72 59.512 59.512 60.466 -0.954 19806 4867 1 9 . 1 1 72 72 ILE CB C 72 41.095 41.095 40.242 0.853 19806 4868 1 9 . 1 1 73 73 THR N N 73 121.600 121.600 122.683 -1.083 19806 4869 1 9 . 1 1 73 73 THR HA H 73 4.603 4.603 4.346 0.257 19806 4870 1 9 . 1 1 73 73 THR CA C 73 61.937 61.937 62.377 -0.440 19806 4871 1 9 . 1 1 73 73 THR CB C 73 68.669 68.669 68.821 -0.152 19806 4872 1 9 . 1 1 74 74 GLN N N 74 124.607 124.607 127.446 -2.839 19806 4873 1 9 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.639 -0.058 19806 4874 1 9 . 1 1 74 74 GLN CA C 74 54.689 54.689 53.993 0.696 19806 4875 1 9 . 1 1 74 74 GLN CB C 74 29.490 29.490 31.391 -1.901 19806 4876 1 9 . 1 1 75 75 GLU N N 75 122.962 122.962 118.632 4.330 19806 4877 1 9 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.286 -0.227 19806 4878 1 9 . 1 1 75 75 GLU CA C 75 58.845 58.845 57.571 1.274 19806 4879 1 9 . 1 1 75 75 GLU CB C 75 29.573 29.573 29.771 -0.198 19806 4880 1 9 . 1 1 76 76 GLU N N 76 115.466 115.466 120.744 -5.278 19806 4881 1 9 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.270 0.038 19806 4882 1 9 . 1 1 76 76 GLU CA C 76 56.777 56.777 57.195 -0.418 19806 4883 1 9 . 1 1 76 76 GLU CB C 76 29.072 29.072 29.483 -0.411 19806 4884 1 9 . 1 1 77 77 GLY N N 77 106.771 106.771 106.842 -0.071 19806 4885 1 9 . 1 1 77 77 GLY CA C 77 45.014 45.014 44.326 0.688 19806 4886 1 9 . 1 1 78 78 GLY N N 78 108.535 108.535 105.954 2.581 19806 4887 1 9 . 1 1 78 78 GLY CA C 78 44.707 44.707 43.925 0.782 19806 4888 1 9 . 1 1 79 79 ILE N N 79 121.066 121.066 121.678 -0.612 19806 4889 1 9 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.701 0.106 19806 4890 1 9 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.523 -1.180 19806 4891 1 9 . 1 1 79 79 ILE CB C 79 39.220 39.220 37.510 1.710 19806 4892 1 9 . 1 1 80 80 TYR N N 80 130.709 130.709 130.387 0.322 19806 4893 1 9 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.139 0.125 19806 4894 1 9 . 1 1 80 80 TYR CA C 80 58.161 58.161 58.414 -0.253 19806 4895 1 9 . 1 1 80 80 TYR CB C 80 40.621 40.621 38.795 1.826 19806 4896 1 9 . 1 1 81 81 VAL N N 81 126.965 126.965 128.801 -1.836 19806 4897 1 9 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.840 0.014 19806 4898 1 9 . 1 1 81 81 VAL CA C 81 60.457 60.457 60.268 0.189 19806 4899 1 9 . 1 1 81 81 VAL CB C 81 35.004 35.004 34.634 0.370 19806 4900 1 9 . 1 1 82 82 SER N N 82 120.914 120.914 126.359 -5.445 19806 4901 1 9 . 1 1 82 82 SER HA H 82 5.185 5.185 4.498 0.687 19806 4902 1 9 . 1 1 82 82 SER CA C 82 55.260 55.260 59.174 -3.914 19806 4903 1 9 . 1 1 82 82 SER CB C 82 64.785 64.785 63.278 1.507 19806 4904 1 9 . 1 1 83 83 LYS N N 83 119.415 119.415 123.009 -3.594 19806 4905 1 9 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.758 0.020 19806 4906 1 9 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.471 0.288 19806 4907 1 9 . 1 1 83 83 LYS CB C 83 35.514 35.514 35.874 -0.360 19806 4908 1 9 . 1 1 84 84 PHE N N 84 119.220 119.220 117.184 2.036 19806 4909 1 9 . 1 1 84 84 PHE HA H 84 5.441 5.441 5.547 -0.106 19806 4910 1 9 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.325 1.089 19806 4911 1 9 . 1 1 84 84 PHE CB C 84 37.523 37.523 40.108 -2.585 19806 4912 1 9 . 1 1 85 85 THR N N 85 119.257 119.257 115.268 3.989 19806 4913 1 9 . 1 1 85 85 THR HA H 85 4.057 4.057 4.446 -0.389 19806 4914 1 9 . 1 1 85 85 THR CA C 85 62.660 62.660 62.289 0.371 19806 4915 1 9 . 1 1 85 85 THR CB C 85 67.698 67.698 69.984 -2.285 19806 4916 1 9 . 1 1 86 86 LEU N N 86 121.612 121.612 123.091 -1.479 19806 4917 1 9 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.684 -0.086 19806 4918 1 9 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.449 0.796 19806 4919 1 9 . 1 1 86 86 LEU CB C 86 44.657 44.657 43.695 0.962 19806 4920 1 9 . 1 1 87 87 ASN N N 87 127.684 127.684 123.015 4.669 19806 4921 1 9 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.747 0.264 19806 4922 1 9 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.377 -1.078 19806 4923 1 9 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.945 -0.350 19806 4924 1 9 . 1 1 88 88 GLU N N 88 120.509 120.509 121.055 -0.546 19806 4925 1 9 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.514 0.343 19806 4926 1 9 . 1 1 88 88 GLU CA C 88 54.382 54.382 55.186 -0.804 19806 4927 1 9 . 1 1 88 88 GLU CB C 88 29.808 29.808 30.301 -0.493 19806 4928 1 9 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.434 -0.053 19806 4929 1 9 . 1 1 89 89 PRO CA C 89 65.898 65.898 65.011 0.887 19806 4930 1 9 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.017 0.334 19806 4931 1 9 . 1 1 90 90 LYS N N 90 107.288 107.288 115.417 -8.129 19806 4932 1 9 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.595 0.089 19806 4933 1 9 . 1 1 90 90 LYS CA C 90 54.979 54.979 56.120 -1.141 19806 4934 1 9 . 1 1 90 90 LYS CB C 90 32.994 32.994 32.995 -0.001 19806 4935 1 9 . 1 1 91 91 HIS N N 91 119.523 119.523 118.582 0.941 19806 4936 1 9 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.472 0.305 19806 4937 1 9 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.368 -0.663 19806 4938 1 9 . 1 1 91 91 HIS CB C 91 32.194 32.194 30.907 1.287 19806 4939 1 9 . 1 1 92 92 LYS N N 92 122.527 122.527 127.438 -4.911 19806 4940 1 9 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.748 0.381 19806 4941 1 9 . 1 1 92 92 LYS CA C 92 54.291 54.291 55.068 -0.777 19806 4942 1 9 . 1 1 92 92 LYS CB C 92 37.479 37.479 35.289 2.190 19806 4943 1 9 . 1 1 93 93 ILE N N 93 121.564 121.564 126.503 -4.939 19806 4944 1 9 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.961 0.349 19806 4945 1 9 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.364 0.773 19806 4946 1 9 . 1 1 93 93 ILE CB C 93 41.088 41.088 40.458 0.630 19806 4947 1 9 . 1 1 94 94 PHE N N 94 128.955 128.955 130.324 -1.369 19806 4948 1 9 . 1 1 94 94 PHE HA H 94 4.900 4.900 5.293 -0.393 19806 4949 1 9 . 1 1 94 94 PHE CA C 94 55.843 55.843 55.633 0.210 19806 4950 1 9 . 1 1 95 95 GLU N N 95 124.809 124.809 126.039 -1.230 19806 4951 1 9 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.222 0.196 19806 4952 1 9 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.766 0.715 19806 4953 1 9 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.470 1.690 19806 4954 1 9 . 1 1 96 96 ALA N N 96 123.759 123.759 123.273 0.486 19806 4955 1 9 . 1 1 96 96 ALA HA H 96 5.379 5.379 4.795 0.584 19806 4956 1 9 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.532 -0.991 19806 4957 1 9 . 1 1 96 96 ALA CB C 96 23.830 23.830 22.101 1.729 19806 4958 1 9 . 1 1 97 97 GLY N N 97 106.592 106.592 107.165 -0.573 19806 4959 1 9 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.342 0.093 19806 4960 1 9 . 1 1 98 98 TYR N N 98 119.250 119.250 119.518 -0.268 19806 4961 1 9 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.818 -0.000 19806 4962 1 9 . 1 1 98 98 TYR CA C 98 59.387 59.387 58.492 0.895 19806 4963 1 9 . 1 1 98 98 TYR CB C 98 38.122 38.122 38.706 -0.584 19806 4964 1 9 . 1 1 99 99 GLU N N 99 123.080 123.080 124.517 -1.437 19806 4965 1 9 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.097 -0.088 19806 4966 1 9 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.478 -0.069 19806 4967 1 9 . 1 1 99 99 GLU CB C 99 30.254 30.254 29.862 0.392 19806 4968 1 9 . 1 1 100 100 GLU N N 100 116.459 116.459 117.119 -0.660 19806 4969 1 9 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.575 -0.539 19806 4970 1 9 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.169 1.235 19806 4971 1 9 . 1 1 100 100 GLU CB C 100 27.576 27.576 30.071 -2.495 19806 4972 1 9 . 1 1 101 101 SER N N 101 113.069 113.069 115.038 -1.969 19806 4973 1 9 . 1 1 101 101 SER HA H 101 4.839 4.839 4.645 0.194 19806 4974 1 9 . 1 1 101 101 SER CA C 101 56.024 56.024 57.002 -0.978 19806 4975 1 9 . 1 1 101 101 SER CB C 101 64.806 64.806 64.445 0.361 19806 4976 1 9 . 1 1 102 102 GLU N N 102 120.439 120.439 121.955 -1.516 19806 4977 1 9 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.342 0.047 19806 4978 1 9 . 1 1 102 102 GLU CA C 102 55.804 55.804 56.496 -0.692 19806 4979 1 9 . 1 1 102 102 GLU CB C 102 29.985 29.985 29.806 0.179 19806 4980 1 9 . 1 1 103 103 VAL N N 103 118.899 118.899 115.663 3.236 19806 4981 1 9 . 1 1 103 103 VAL HA H 103 4.086 4.086 3.982 0.104 19806 4982 1 9 . 1 1 103 103 VAL CA C 103 62.699 62.699 62.473 0.226 19806 4983 1 9 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.392 -0.131 19806 4984 1 9 . 1 1 104 104 ASP N N 104 120.965 120.965 120.328 0.637 19806 4985 1 9 . 1 1 104 104 ASP HA H 104 5.003 5.003 4.884 0.119 19806 4986 1 9 . 1 1 104 104 ASP CA C 104 54.914 54.914 54.664 0.249 19806 4987 1 9 . 1 1 104 104 ASP CB C 104 42.791 42.791 44.173 -1.382 19806 4988 1 9 . 1 1 105 105 LEU N N 105 120.365 120.365 119.096 1.269 19806 4989 1 9 . 1 1 105 105 LEU HA H 105 5.295 5.295 5.030 0.265 19806 4990 1 9 . 1 1 105 105 LEU CA C 105 54.431 54.431 55.013 -0.582 19806 4991 1 9 . 1 1 105 105 LEU CB C 105 46.001 46.001 45.486 0.515 19806 4992 1 9 . 1 1 106 106 ARG N N 106 126.289 126.289 124.392 1.897 19806 4993 1 9 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.394 0.431 19806 4994 1 9 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.680 -0.008 19806 4995 1 9 . 1 1 106 106 ARG CB C 106 33.920 33.920 35.027 -1.107 19806 4996 1 9 . 1 1 107 107 VAL N N 107 126.145 126.145 120.125 6.020 19806 4997 1 9 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.534 0.145 19806 4998 1 9 . 1 1 107 107 VAL CA C 107 61.671 61.671 60.691 0.980 19806 4999 1 9 . 1 1 107 107 VAL CB C 107 35.350 35.350 36.403 -1.053 19806 5000 1 9 . 1 1 108 108 GLU N N 108 127.093 127.093 126.285 0.808 19806 5001 1 9 . 1 1 108 108 GLU HA H 108 5.267 5.267 5.071 0.196 19806 5002 1 9 . 1 1 108 108 GLU CA C 108 54.761 54.761 55.289 -0.528 19806 5003 1 9 . 1 1 108 108 GLU CB C 108 32.567 32.567 32.579 -0.012 19806 5004 1 9 . 1 1 109 109 PHE N N 109 124.592 124.592 124.965 -0.373 19806 5005 1 9 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.343 0.685 19806 5006 1 9 . 1 1 109 109 PHE CA C 109 55.945 55.945 57.442 -1.497 19806 5007 1 9 . 1 1 109 109 PHE CB C 109 43.099 43.099 41.312 1.787 19806 5008 1 9 . 1 1 110 110 GLU N N 110 122.143 122.143 123.431 -1.288 19806 5009 1 9 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.456 -0.263 19806 5010 1 9 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.420 1.023 19806 5011 1 9 . 1 1 110 110 GLU CB C 110 35.816 35.816 33.824 1.992 19806 5012 1 9 . 1 1 111 111 LEU N N 111 129.616 129.616 125.904 3.712 19806 5013 1 9 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.657 0.151 19806 5014 1 9 . 1 1 111 111 LEU CA C 111 53.470 53.470 55.450 -1.980 19806 5015 1 9 . 1 1 111 111 LEU CB C 111 40.400 40.400 41.533 -1.133 19806 5016 1 9 . 1 1 112 112 GLN N N 112 124.742 124.742 125.094 -0.352 19806 5017 1 9 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.487 -0.048 19806 5018 1 9 . 1 1 112 112 GLN CA C 112 55.802 55.802 54.005 1.798 19806 5019 1 9 . 1 1 112 112 GLN CB C 112 28.753 28.753 30.668 -1.915 19806 5020 1 9 . 1 1 113 113 ALA N N 113 121.195 121.195 124.727 -3.532 19806 5021 1 9 . 1 1 113 113 ALA HA H 113 4.048 4.048 3.954 0.094 19806 5022 1 9 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.829 -0.311 19806 5023 1 9 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.519 -0.320 19806 5024 1 9 . 1 1 114 114 ASP N N 114 114.525 114.525 116.507 -1.982 19806 5025 1 9 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.449 -0.050 19806 5026 1 9 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.271 -1.363 19806 5027 1 9 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.715 -1.657 19806 5028 1 9 . 1 1 115 115 GLY N N 115 107.526 107.526 106.788 0.738 19806 5029 1 9 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.429 0.355 19806 5030 1 9 . 1 1 116 116 LYS N N 116 118.818 118.818 120.153 -1.335 19806 5031 1 9 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.637 -0.187 19806 5032 1 9 . 1 1 116 116 LYS CA C 116 54.171 54.171 55.617 -1.446 19806 5033 1 9 . 1 1 116 116 LYS CB C 116 35.039 35.039 33.381 1.658 19806 5034 1 9 . 1 1 117 117 TRP N N 117 118.939 118.939 122.635 -3.696 19806 5035 1 9 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.943 -0.987 19806 5036 1 9 . 1 1 118 118 TYR N N 118 112.644 112.644 119.878 -7.234 19806 5037 1 9 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.865 0.412 19806 5038 1 9 . 1 1 118 118 TYR CA C 118 56.219 56.219 57.172 -0.952 19806 5039 1 9 . 1 1 118 118 TYR CB C 118 43.282 43.282 42.300 0.982 19806 5040 1 9 . 1 1 119 119 VAL N N 119 119.842 119.842 120.666 -0.824 19806 5041 1 9 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.287 0.228 19806 5042 1 9 . 1 1 119 119 VAL CA C 119 62.442 62.442 62.180 0.262 19806 5043 1 9 . 1 1 120 120 VAL N N 120 114.552 114.552 120.005 -5.453 19806 5044 1 9 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.495 0.243 19806 5045 1 9 . 1 1 120 120 VAL CA C 120 59.595 59.595 61.051 -1.456 19806 5046 1 9 . 1 1 120 120 VAL CB C 120 32.852 32.852 32.334 0.518 19806 5047 1 9 . 1 1 121 121 ASP N N 121 118.234 118.234 119.818 -1.584 19806 5048 1 9 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.798 0.465 19806 5049 1 9 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.709 -0.046 19806 5050 1 9 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.607 -0.720 19806 5051 1 9 . 1 1 122 122 CYS N N 122 121.036 121.036 124.980 -3.944 19806 5052 1 9 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.840 0.731 19806 5053 1 9 . 1 1 122 122 CYS CA C 122 57.052 57.052 57.677 -0.625 19806 5054 1 9 . 1 1 122 122 CYS CB C 122 30.834 30.834 28.336 2.498 19806 5055 1 9 . 1 1 123 123 TYR N N 123 127.672 127.672 127.520 0.152 19806 5056 1 9 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.862 0.148 19806 5057 1 9 . 1 1 123 123 TYR CA C 123 57.169 57.169 58.212 -1.043 19806 5058 1 9 . 1 1 123 123 TYR CB C 123 41.408 41.408 41.838 -0.430 19806 5059 1 9 . 1 1 124 124 THR N N 124 120.833 120.833 118.487 2.346 19806 5060 1 9 . 1 1 124 124 THR HA H 124 4.987 4.987 4.999 -0.012 19806 5061 1 9 . 1 1 124 124 THR CA C 124 57.153 57.153 59.984 -2.831 19806 5062 1 9 . 1 1 124 124 THR CB C 124 68.607 68.607 71.294 -2.687 19806 5063 1 9 . 1 1 125 125 GLY N N 125 114.347 114.347 112.938 1.409 19806 5064 1 9 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.634 -0.306 19806 5065 1 9 . 1 1 126 126 TRP N N 126 119.918 119.918 121.980 -2.062 19806 5066 1 9 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.065 0.005 19806 5067 1 9 . 1 1 126 126 TRP CA C 126 60.564 60.564 59.032 1.532 19806 5068 1 9 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.547 0.093 19806 5069 1 9 . 1 1 127 127 TYR N N 127 113.911 113.911 114.094 -0.183 19806 5070 1 9 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.698 0.296 19806 5071 1 9 . 1 1 127 127 TYR CA C 127 53.384 53.384 57.085 -3.701 19806 5072 1 9 . 1 1 127 127 TYR CB C 127 38.584 38.584 37.955 0.629 19806 5073 1 9 . 1 1 128 128 GLY N N 128 105.181 105.181 108.149 -2.968 19806 5074 1 9 . 1 1 128 128 GLY CA C 128 45.189 45.189 43.688 1.501 19806 5075 1 9 . 1 1 129 129 TYR N N 129 116.588 116.588 120.239 -3.651 19806 5076 1 9 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.676 -0.011 19806 5077 1 9 . 1 1 129 129 TYR CA C 129 59.565 59.565 57.494 2.071 19806 5078 1 9 . 1 1 129 129 TYR CB C 129 38.853 38.853 36.399 2.454 19806 5079 1 9 . 1 1 130 130 ASP N N 130 115.195 115.195 118.939 -3.744 19806 5080 1 9 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.812 -0.427 19806 5081 1 9 . 1 1 130 130 ASP CA C 130 53.130 53.130 55.088 -1.958 19806 5082 1 9 . 1 1 130 130 ASP CB C 130 38.685 38.685 42.965 -4.279 19806 5083 1 9 . 1 1 131 131 LEU N N 131 124.887 124.887 121.191 3.696 19806 5084 1 9 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.859 -0.378 19806 5085 1 9 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.383 1.222 19806 5086 1 9 . 1 1 131 131 LEU CB C 131 42.441 42.441 44.972 -2.531 19806 5087 1 9 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.759 -0.076 19806 5088 1 9 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.733 65.332 19806 5089 1 9 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.046 -0.719 19806 5090 1 9 . 1 1 133 133 ILE N N 133 123.765 123.765 120.962 2.803 19806 5091 1 9 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.699 0.030 19806 5092 1 9 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.720 1.140 19806 5093 1 9 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.175 -0.112 19806 5094 1 9 . 1 1 134 134 GLY N N 134 107.030 107.030 104.526 2.504 19806 5095 1 9 . 1 1 134 134 GLY CA C 134 45.976 45.976 45.633 0.343 19806 5096 1 9 . 1 1 135 135 GLU N N 135 116.566 116.566 121.125 -4.559 19806 5097 1 9 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.391 0.273 19806 5098 1 9 . 1 1 135 135 GLU CA C 135 55.414 55.414 56.883 -1.468 19806 5099 1 9 . 1 1 135 135 GLU CB C 135 30.195 30.195 29.648 0.547 19806 5100 1 9 . 1 1 136 136 LEU N N 136 124.239 124.239 121.486 2.753 19806 5101 1 9 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.802 0.242 19806 5102 1 9 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.957 0.159 19806 5103 1 9 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.501 -0.494 19806 5104 1 9 . 1 1 137 137 LYS N N 137 117.225 117.225 115.976 1.249 19806 5105 1 9 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.771 0.092 19806 5106 1 9 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.154 1.301 19806 5107 1 9 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.212 -0.009 19806 5108 1 9 . 1 1 138 138 GLN N N 138 118.718 118.718 119.997 -1.279 19806 5109 1 9 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.095 -0.043 19806 5110 1 9 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.339 -0.464 19806 5111 1 9 . 1 1 138 138 GLN CB C 138 28.235 28.235 28.129 0.106 19806 5112 1 9 . 1 1 139 139 THR N N 139 117.970 117.970 117.566 0.404 19806 5113 1 9 . 1 1 139 139 THR HA H 139 4.532 4.532 3.888 0.644 19806 5114 1 9 . 1 1 139 139 THR CA C 139 68.145 68.145 67.261 0.884 19806 5115 1 9 . 1 1 139 139 THR CB C 139 68.103 68.103 68.536 -0.433 19806 5116 1 9 . 1 1 140 140 ILE N N 140 120.391 120.391 121.342 -0.951 19806 5117 1 9 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.806 -0.079 19806 5118 1 9 . 1 1 140 140 ILE CA C 140 65.256 65.256 65.150 0.106 19806 5119 1 9 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.607 0.506 19806 5120 1 9 . 1 1 141 141 GLN N N 141 118.917 118.917 117.598 1.319 19806 5121 1 9 . 1 1 141 141 GLN HA H 141 4.015 4.015 4.039 -0.024 19806 5122 1 9 . 1 1 141 141 GLN CA C 141 58.371 58.371 58.453 -0.082 19806 5123 1 9 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.391 -1.044 19806 5124 1 9 . 1 1 142 142 ASN N N 142 119.936 119.936 118.100 1.836 19806 5125 1 9 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.714 -0.199 19806 5126 1 9 . 1 1 142 142 ASN CA C 142 55.799 55.799 55.688 0.111 19806 5127 1 9 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.860 -1.230 19806 5128 1 9 . 1 1 143 143 VAL N N 143 123.195 123.195 120.658 2.537 19806 5129 1 9 . 1 1 143 143 VAL HA H 143 2.716 2.716 2.995 -0.279 19806 5130 1 9 . 1 1 143 143 VAL CA C 143 66.497 66.497 65.995 0.502 19806 5131 1 9 . 1 1 143 143 VAL CB C 143 30.989 30.989 31.033 -0.044 19806 5132 1 9 . 1 1 144 144 LYS N N 144 120.348 120.348 115.555 4.793 19806 5133 1 9 . 1 1 144 144 LYS HA H 144 3.881 3.881 4.285 -0.404 19806 5134 1 9 . 1 1 144 144 LYS CA C 144 60.123 60.123 58.562 1.561 19806 5135 1 9 . 1 1 144 144 LYS CB C 144 31.882 31.882 31.949 -0.067 19806 5136 1 9 . 1 1 145 145 GLU N N 145 119.220 119.220 118.678 0.542 19806 5137 1 9 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.197 -0.014 19806 5138 1 9 . 1 1 145 145 GLU CA C 145 59.178 59.178 58.684 0.494 19806 5139 1 9 . 1 1 145 145 GLU CB C 145 29.071 29.071 30.162 -1.091 19806 5140 1 9 . 1 1 146 146 GLU N N 146 121.420 121.420 119.311 2.109 19806 5141 1 9 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.110 0.167 19806 5142 1 9 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.205 -0.086 19806 5143 1 9 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.643 -1.301 19806 5144 1 9 . 1 1 147 147 ASN N N 147 119.197 119.197 117.013 2.184 19806 5145 1 9 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.630 -0.062 19806 5146 1 9 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.606 -1.455 19806 5147 1 9 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.922 -0.549 19806 5148 1 9 . 1 1 148 148 ALA N N 148 123.672 123.672 121.183 2.489 19806 5149 1 9 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.327 -0.204 19806 5150 1 9 . 1 1 148 148 ALA CA C 148 55.133 55.133 53.414 1.719 19806 5151 1 9 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.648 -1.041 19806 5152 1 9 . 1 1 149 149 ALA N N 149 119.979 119.979 121.956 -1.977 19806 5153 1 9 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.167 0.094 19806 5154 1 9 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.210 0.435 19806 5155 1 9 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.871 -1.133 19806 5156 1 9 . 1 1 150 150 PHE N N 150 119.592 119.592 120.395 -0.803 19806 5157 1 9 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.101 0.123 19806 5158 1 9 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.214 -0.206 19806 5159 1 9 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.190 -0.128 19806 5160 1 9 . 1 1 151 151 LYS N N 151 116.869 116.869 118.065 -1.196 19806 5161 1 9 . 1 1 151 151 LYS HA H 151 3.906 3.906 3.929 -0.023 19806 5162 1 9 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.382 0.388 19806 5163 1 9 . 1 1 151 151 LYS CB C 151 32.741 32.741 31.756 0.985 19806 5164 1 9 . 1 1 152 152 GLU N N 152 115.868 115.868 119.376 -3.508 19806 5165 1 9 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.058 -0.005 19806 5166 1 9 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.553 0.102 19806 5167 1 9 . 1 1 152 152 GLU CB C 152 29.753 29.753 29.562 0.191 19806 5168 1 9 . 1 1 153 153 ILE N N 153 110.437 110.437 117.464 -7.027 19806 5169 1 9 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.758 0.418 19806 5170 1 9 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.958 -1.924 19806 5171 1 9 . 1 1 153 153 ILE CB C 153 39.272 39.272 38.520 0.752 19806 5172 1 9 . 1 1 154 154 HIS N N 154 117.779 117.779 116.092 1.687 19806 5173 1 9 . 1 1 154 154 HIS HA H 154 5.174 5.174 5.027 0.147 19806 5174 1 9 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.135 -0.519 19806 5175 1 9 . 1 1 154 154 HIS CB C 154 28.547 28.547 29.285 -0.738 19806 5176 1 10 . 1 1 3 3 SER N N 3 114.847 114.847 115.617 -0.770 19806 5177 1 10 . 1 1 3 3 SER HA H 3 4.463 4.463 4.077 0.386 19806 5178 1 10 . 1 1 3 3 SER CA C 3 58.340 58.340 59.670 -1.330 19806 5179 1 10 . 1 1 3 3 SER CB C 3 63.457 63.457 62.851 0.606 19806 5180 1 10 . 1 1 4 4 GLU N N 4 121.498 121.498 118.083 3.415 19806 5181 1 10 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.079 0.253 19806 5182 1 10 . 1 1 4 4 GLU CA C 4 56.443 56.443 56.425 0.019 19806 5183 1 10 . 1 1 4 4 GLU CB C 4 29.966 29.966 29.012 0.954 19806 5184 1 10 . 1 1 5 5 LEU N N 5 121.589 121.589 119.354 2.235 19806 5185 1 10 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.074 0.363 19806 5186 1 10 . 1 1 5 5 LEU CA C 5 55.019 55.019 55.014 0.005 19806 5187 1 10 . 1 1 5 5 LEU CB C 5 42.243 42.243 41.741 0.502 19806 5188 1 10 . 1 1 6 6 THR N N 6 113.708 113.708 112.916 0.792 19806 5189 1 10 . 1 1 6 6 THR HA H 6 4.470 4.470 4.417 0.053 19806 5190 1 10 . 1 1 6 6 THR CA C 6 61.409 61.409 62.662 -1.253 19806 5191 1 10 . 1 1 6 6 THR CB C 6 69.544 69.544 69.526 0.018 19806 5192 1 10 . 1 1 7 7 THR N N 7 114.945 114.945 113.737 1.208 19806 5193 1 10 . 1 1 7 7 THR HA H 7 4.415 4.415 4.741 -0.326 19806 5194 1 10 . 1 1 7 7 THR CA C 7 61.435 61.435 60.981 0.454 19806 5195 1 10 . 1 1 7 7 THR CB C 7 69.506 69.506 71.753 -2.247 19806 5196 1 10 . 1 1 8 8 GLN N N 8 121.368 121.368 119.850 1.518 19806 5197 1 10 . 1 1 8 8 GLN CA C 8 55.684 55.684 56.571 -0.887 19806 5198 1 10 . 1 1 9 9 ASP N N 9 120.595 120.595 120.965 -0.370 19806 5199 1 10 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.411 0.236 19806 5200 1 10 . 1 1 9 9 ASP CA C 9 54.115 54.115 54.617 -0.502 19806 5201 1 10 . 1 1 9 9 ASP CB C 9 41.328 41.328 40.119 1.209 19806 5202 1 10 . 1 1 10 10 GLY N N 10 106.984 106.984 103.389 3.595 19806 5203 1 10 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.591 -0.096 19806 5204 1 10 . 1 1 11 11 GLU N N 11 120.879 120.879 121.660 -0.781 19806 5205 1 10 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.289 -0.100 19806 5206 1 10 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.790 -0.280 19806 5207 1 10 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.755 1.314 19806 5208 1 10 . 1 1 12 12 ASP N N 12 126.686 126.686 121.366 5.320 19806 5209 1 10 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.728 0.022 19806 5210 1 10 . 1 1 12 12 ASP CA C 12 54.347 54.347 54.422 -0.075 19806 5211 1 10 . 1 1 12 12 ASP CB C 12 42.771 42.771 41.884 0.887 19806 5212 1 10 . 1 1 13 13 PHE N N 13 128.055 128.055 121.429 6.626 19806 5213 1 10 . 1 1 13 13 PHE HA H 13 3.412 3.412 4.121 -0.709 19806 5214 1 10 . 1 1 13 13 PHE CA C 13 62.551 62.551 60.066 2.485 19806 5215 1 10 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.839 -0.006 19806 5216 1 10 . 1 1 14 14 LYS N N 14 117.498 117.498 119.475 -1.977 19806 5217 1 10 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.840 -0.259 19806 5218 1 10 . 1 1 14 14 LYS CA C 14 59.461 59.461 58.085 1.376 19806 5219 1 10 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.647 -0.303 19806 5220 1 10 . 1 1 15 15 SER N N 15 113.775 113.775 114.642 -0.867 19806 5221 1 10 . 1 1 15 15 SER HA H 15 4.167 4.167 4.065 0.102 19806 5222 1 10 . 1 1 15 15 SER CA C 15 61.099 61.099 61.865 -0.766 19806 5223 1 10 . 1 1 15 15 SER CB C 15 62.428 62.428 62.810 -0.383 19806 5224 1 10 . 1 1 16 16 PHE N N 16 122.292 122.292 119.851 2.441 19806 5225 1 10 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.401 -0.111 19806 5226 1 10 . 1 1 16 16 PHE CA C 16 59.773 59.773 58.920 0.853 19806 5227 1 10 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.393 -1.218 19806 5228 1 10 . 1 1 17 17 LEU N N 17 122.472 122.472 121.006 1.466 19806 5229 1 10 . 1 1 17 17 LEU HA H 17 2.850 2.850 2.996 -0.146 19806 5230 1 10 . 1 1 17 17 LEU CA C 17 56.619 56.619 57.134 -0.515 19806 5231 1 10 . 1 1 17 17 LEU CB C 17 40.462 40.462 41.229 -0.767 19806 5232 1 10 . 1 1 18 18 ASP N N 18 117.331 117.331 120.721 -3.390 19806 5233 1 10 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.200 -0.085 19806 5234 1 10 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.580 -1.185 19806 5235 1 10 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.077 0.276 19806 5236 1 10 . 1 1 19 19 LYS N N 19 120.032 120.032 118.005 2.027 19806 5237 1 10 . 1 1 19 19 LYS HA H 19 3.677 3.677 4.096 -0.419 19806 5238 1 10 . 1 1 19 19 LYS CA C 19 59.067 59.067 57.695 1.372 19806 5239 1 10 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.156 -0.220 19806 5240 1 10 . 1 1 20 20 PHE N N 20 119.607 119.607 121.022 -1.415 19806 5241 1 10 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.586 -0.477 19806 5242 1 10 . 1 1 20 20 PHE CA C 20 62.090 62.090 61.301 0.789 19806 5243 1 10 . 1 1 20 20 PHE CB C 20 40.469 40.469 40.052 0.417 19806 5244 1 10 . 1 1 21 21 THR N N 21 101.473 101.473 113.301 -11.828 19806 5245 1 10 . 1 1 21 21 THR HA H 21 4.259 4.259 4.028 0.231 19806 5246 1 10 . 1 1 21 21 THR CA C 21 61.774 61.774 64.412 -2.638 19806 5247 1 10 . 1 1 22 22 SER N N 22 111.453 111.453 115.944 -4.491 19806 5248 1 10 . 1 1 22 22 SER HA H 22 4.165 4.165 4.880 -0.715 19806 5249 1 10 . 1 1 22 22 SER CA C 22 58.215 58.215 57.176 1.038 19806 5250 1 10 . 1 1 22 22 SER CB C 22 64.570 64.570 63.484 1.086 19806 5251 1 10 . 1 1 23 23 SER N N 23 114.184 114.184 116.735 -2.551 19806 5252 1 10 . 1 1 23 23 SER HA H 23 4.764 4.764 4.723 0.042 19806 5253 1 10 . 1 1 23 23 SER CA C 23 55.669 55.669 58.513 -2.844 19806 5254 1 10 . 1 1 23 23 SER CB C 23 64.011 64.011 65.941 -1.930 19806 5255 1 10 . 1 1 24 24 ALA N N 24 133.370 133.370 126.006 7.364 19806 5256 1 10 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.762 -0.806 19806 5257 1 10 . 1 1 24 24 ALA CA C 24 55.106 55.106 53.024 2.082 19806 5258 1 10 . 1 1 24 24 ALA CB C 24 19.835 19.835 20.077 -0.242 19806 5259 1 10 . 1 1 25 25 ALA N N 25 117.430 117.430 120.521 -3.091 19806 5260 1 10 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.677 -0.360 19806 5261 1 10 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.239 0.962 19806 5262 1 10 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.882 -0.533 19806 5263 1 10 . 1 1 26 26 PHE N N 26 116.042 116.042 118.146 -2.104 19806 5264 1 10 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.773 -0.463 19806 5265 1 10 . 1 1 26 26 PHE CA C 26 60.759 60.759 58.779 1.980 19806 5266 1 10 . 1 1 26 26 PHE CB C 26 39.310 39.310 40.005 -0.695 19806 5267 1 10 . 1 1 27 27 GLN N N 27 121.820 121.820 119.545 2.275 19806 5268 1 10 . 1 1 27 27 GLN HA H 27 3.391 3.391 4.241 -0.850 19806 5269 1 10 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.420 0.674 19806 5270 1 10 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.825 -1.368 19806 5271 1 10 . 1 1 28 28 TYR N N 28 111.517 111.517 116.043 -4.526 19806 5272 1 10 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.590 0.540 19806 5273 1 10 . 1 1 28 28 TYR CA C 28 62.357 62.357 59.075 3.283 19806 5274 1 10 . 1 1 28 28 TYR CB C 28 38.568 38.568 37.551 1.017 19806 5275 1 10 . 1 1 29 29 THR N N 29 106.324 106.324 109.768 -3.444 19806 5276 1 10 . 1 1 29 29 THR HA H 29 4.489 4.489 4.384 0.105 19806 5277 1 10 . 1 1 29 29 THR CA C 29 63.765 63.765 62.127 1.638 19806 5278 1 10 . 1 1 29 29 THR CB C 29 69.568 69.568 68.691 0.877 19806 5279 1 10 . 1 1 30 30 ARG N N 30 117.696 117.696 118.975 -1.279 19806 5280 1 10 . 1 1 30 30 ARG HA H 30 4.701 4.701 4.012 0.689 19806 5281 1 10 . 1 1 30 30 ARG CA C 30 52.760 52.760 54.923 -2.163 19806 5282 1 10 . 1 1 30 30 ARG CB C 30 35.047 35.047 30.465 4.582 19806 5283 1 10 . 1 1 31 31 VAL N N 31 119.395 119.395 120.825 -1.430 19806 5284 1 10 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.961 -0.731 19806 5285 1 10 . 1 1 31 31 VAL CA C 31 61.191 61.191 61.329 -0.138 19806 5286 1 10 . 1 1 31 31 VAL CB C 31 32.173 32.173 33.744 -1.571 19806 5287 1 10 . 1 1 32 32 LYS N N 32 126.124 126.124 126.597 -0.473 19806 5288 1 10 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.559 -0.375 19806 5289 1 10 . 1 1 32 32 LYS CA C 32 53.958 53.958 55.793 -1.835 19806 5290 1 10 . 1 1 32 32 LYS CB C 32 31.112 31.112 33.524 -2.412 19806 5291 1 10 . 1 1 33 33 PHE N N 33 119.303 119.303 120.238 -0.935 19806 5292 1 10 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.947 -0.433 19806 5293 1 10 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.337 0.935 19806 5294 1 10 . 1 1 33 33 PHE CB C 33 40.378 40.378 40.667 -0.289 19806 5295 1 10 . 1 1 34 34 PRO HA H 34 4.968 4.968 2.170 2.798 19806 5296 1 10 . 1 1 34 34 PRO CA C 34 61.633 61.633 61.818 -0.185 19806 5297 1 10 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.530 1.202 19806 5298 1 10 . 1 1 35 35 LEU N N 35 120.016 120.016 118.688 1.328 19806 5299 1 10 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.675 -0.453 19806 5300 1 10 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.851 0.989 19806 5301 1 10 . 1 1 35 35 LEU CB C 35 41.244 41.244 43.939 -2.695 19806 5302 1 10 . 1 1 36 36 LYS N N 36 117.066 117.066 118.083 -1.017 19806 5303 1 10 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.415 -0.440 19806 5304 1 10 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.290 2.957 19806 5305 1 10 . 1 1 36 36 LYS CB C 36 32.832 32.832 33.234 -0.402 19806 5306 1 10 . 1 1 37 37 THR N N 37 117.574 117.574 119.765 -2.191 19806 5307 1 10 . 1 1 37 37 THR HA H 37 4.797 4.797 4.729 0.068 19806 5308 1 10 . 1 1 37 37 THR CA C 37 60.396 60.396 59.866 0.530 19806 5309 1 10 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.456 0.563 19806 5310 1 10 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.611 -0.688 19806 5311 1 10 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.546 0.085 19806 5312 1 10 . 1 1 39 39 ILE N N 39 119.949 119.949 118.771 1.178 19806 5313 1 10 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.335 -0.096 19806 5314 1 10 . 1 1 39 39 ILE CA C 39 62.133 62.133 62.124 0.009 19806 5315 1 10 . 1 1 40 40 THR N N 40 123.962 123.962 123.435 0.527 19806 5316 1 10 . 1 1 40 40 THR HA H 40 5.057 5.057 5.078 -0.021 19806 5317 1 10 . 1 1 40 40 THR CA C 40 62.262 62.262 62.256 0.006 19806 5318 1 10 . 1 1 40 40 THR CB C 40 69.891 69.891 69.957 -0.066 19806 5319 1 10 . 1 1 41 41 LEU N N 41 125.633 125.633 128.203 -2.570 19806 5320 1 10 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.886 0.216 19806 5321 1 10 . 1 1 41 41 LEU CA C 41 52.638 52.638 53.642 -1.004 19806 5322 1 10 . 1 1 41 41 LEU CB C 41 45.180 45.180 44.635 0.545 19806 5323 1 10 . 1 1 42 42 LEU N N 42 120.788 120.788 125.588 -4.800 19806 5324 1 10 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.384 0.364 19806 5325 1 10 . 1 1 42 42 LEU CA C 42 53.724 53.724 54.932 -1.208 19806 5326 1 10 . 1 1 42 42 LEU CB C 42 44.384 44.384 42.886 1.498 19806 5327 1 10 . 1 1 43 43 ALA N N 43 123.073 123.073 128.988 -5.915 19806 5328 1 10 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.204 0.226 19806 5329 1 10 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.626 -1.338 19806 5330 1 10 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.417 0.597 19806 5331 1 10 . 1 1 44 44 ASP N N 44 118.196 118.196 120.385 -2.189 19806 5332 1 10 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.443 -0.017 19806 5333 1 10 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.690 -0.662 19806 5334 1 10 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.722 -0.512 19806 5335 1 10 . 1 1 45 45 ASP N N 45 115.018 115.018 117.801 -2.783 19806 5336 1 10 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.474 -0.005 19806 5337 1 10 . 1 1 45 45 ASP CA C 45 53.794 53.794 55.053 -1.259 19806 5338 1 10 . 1 1 45 45 ASP CB C 45 39.864 39.864 40.981 -1.117 19806 5339 1 10 . 1 1 46 46 GLY N N 46 107.499 107.499 108.827 -1.328 19806 5340 1 10 . 1 1 46 46 GLY CA C 46 45.914 45.914 46.296 -0.382 19806 5341 1 10 . 1 1 47 47 GLU N N 47 117.331 117.331 118.495 -1.164 19806 5342 1 10 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.487 0.044 19806 5343 1 10 . 1 1 47 47 GLU CA C 47 56.938 56.938 55.660 1.278 19806 5344 1 10 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.754 2.379 19806 5345 1 10 . 1 1 48 48 THR N N 48 118.462 118.462 118.273 0.189 19806 5346 1 10 . 1 1 48 48 THR HA H 48 4.243 4.243 4.567 -0.324 19806 5347 1 10 . 1 1 48 48 THR CA C 48 62.834 62.834 61.570 1.264 19806 5348 1 10 . 1 1 48 48 THR CB C 48 68.649 68.649 70.271 -1.622 19806 5349 1 10 . 1 1 49 49 GLU N N 49 123.834 123.834 127.423 -3.589 19806 5350 1 10 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.289 0.656 19806 5351 1 10 . 1 1 49 49 GLU CA C 49 55.358 55.358 57.249 -1.891 19806 5352 1 10 . 1 1 49 49 GLU CB C 49 31.395 31.395 30.404 0.991 19806 5353 1 10 . 1 1 50 50 LYS N N 50 122.868 122.868 125.271 -2.403 19806 5354 1 10 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.718 -0.077 19806 5355 1 10 . 1 1 50 50 LYS CA C 50 54.111 54.111 55.016 -0.905 19806 5356 1 10 . 1 1 50 50 LYS CB C 50 35.312 35.312 35.227 0.085 19806 5357 1 10 . 1 1 51 51 THR N N 51 111.386 111.386 115.136 -3.750 19806 5358 1 10 . 1 1 51 51 THR HA H 51 5.619 5.619 5.436 0.183 19806 5359 1 10 . 1 1 51 51 THR CA C 51 58.980 58.980 61.081 -2.101 19806 5360 1 10 . 1 1 51 51 THR CB C 51 71.277 71.277 69.874 1.403 19806 5361 1 10 . 1 1 52 52 PHE N N 52 120.631 120.631 119.025 1.606 19806 5362 1 10 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.962 0.001 19806 5363 1 10 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.631 -1.502 19806 5364 1 10 . 1 1 52 52 PHE CB C 52 41.049 41.049 41.761 -0.712 19806 5365 1 10 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.719 -0.271 19806 5366 1 10 . 1 1 53 53 PRO CA C 53 62.489 62.489 63.129 -0.640 19806 5367 1 10 . 1 1 53 53 PRO CB C 53 32.240 32.240 32.495 -0.255 19806 5368 1 10 . 1 1 54 54 PHE N N 54 128.034 128.034 123.094 4.940 19806 5369 1 10 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.600 0.228 19806 5370 1 10 . 1 1 54 54 PHE CA C 54 55.509 55.509 56.347 -0.838 19806 5371 1 10 . 1 1 54 54 PHE CB C 54 37.028 37.028 39.583 -2.555 19806 5372 1 10 . 1 1 55 55 THR N N 55 111.757 111.757 118.817 -7.060 19806 5373 1 10 . 1 1 55 55 THR HA H 55 4.413 4.413 4.161 0.252 19806 5374 1 10 . 1 1 55 55 THR CA C 55 60.578 60.578 60.638 -0.060 19806 5375 1 10 . 1 1 55 55 THR CB C 55 69.447 69.447 69.844 -0.397 19806 5376 1 10 . 1 1 56 56 LYS N N 56 118.734 118.734 120.650 -1.916 19806 5377 1 10 . 1 1 56 56 LYS HA H 56 2.482 2.482 3.962 -1.480 19806 5378 1 10 . 1 1 56 56 LYS CA C 56 59.381 59.381 58.035 1.346 19806 5379 1 10 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.629 1.621 19806 5380 1 10 . 1 1 57 57 GLU N N 57 119.675 119.675 117.985 1.690 19806 5381 1 10 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.073 0.196 19806 5382 1 10 . 1 1 57 57 GLU CA C 57 57.152 57.152 59.050 -1.898 19806 5383 1 10 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.488 -2.538 19806 5384 1 10 . 1 1 58 58 LYS N N 58 114.700 114.700 119.100 -4.400 19806 5385 1 10 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.268 0.044 19806 5386 1 10 . 1 1 58 58 LYS CA C 58 55.595 55.595 56.105 -0.510 19806 5387 1 10 . 1 1 58 58 LYS CB C 58 32.011 32.011 31.223 0.788 19806 5388 1 10 . 1 1 59 59 TRP N N 59 118.204 118.204 124.273 -6.069 19806 5389 1 10 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.034 0.065 19806 5390 1 10 . 1 1 59 59 TRP CA C 59 55.577 55.577 54.767 0.810 19806 5391 1 10 . 1 1 59 59 TRP CB C 59 32.037 32.037 30.511 1.526 19806 5392 1 10 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.263 0.000 19806 5393 1 10 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.263 -2.542 19806 5394 1 10 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.514 -2.665 19806 5395 1 10 . 1 1 61 61 LEU N N 61 123.758 123.758 124.361 -0.603 19806 5396 1 10 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.134 -0.495 19806 5397 1 10 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.040 0.835 19806 5398 1 10 . 1 1 61 61 LEU CB C 61 40.815 40.815 40.946 -0.131 19806 5399 1 10 . 1 1 62 62 LEU N N 62 124.052 124.052 125.264 -1.212 19806 5400 1 10 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.018 0.337 19806 5401 1 10 . 1 1 62 62 LEU CA C 62 53.992 53.992 53.785 0.207 19806 5402 1 10 . 1 1 62 62 LEU CB C 62 44.686 44.686 41.595 3.091 19806 5403 1 10 . 1 1 63 63 ASP N N 63 117.271 117.271 117.980 -0.709 19806 5404 1 10 . 1 1 63 63 ASP HA H 63 5.033 5.033 4.566 0.467 19806 5405 1 10 . 1 1 63 63 ASP CA C 63 51.101 51.101 51.670 -0.569 19806 5406 1 10 . 1 1 63 63 ASP CB C 63 43.345 43.345 42.362 0.983 19806 5407 1 10 . 1 1 64 64 SER N N 64 112.856 112.856 113.471 -0.615 19806 5408 1 10 . 1 1 64 64 SER HA H 64 3.865 3.865 4.381 -0.516 19806 5409 1 10 . 1 1 64 64 SER CA C 64 60.910 60.910 59.411 1.499 19806 5410 1 10 . 1 1 64 64 SER CB C 64 62.378 62.378 62.753 -0.375 19806 5411 1 10 . 1 1 65 65 GLU N N 65 120.070 120.070 119.665 0.405 19806 5412 1 10 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.376 -0.358 19806 5413 1 10 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.042 0.301 19806 5414 1 10 . 1 1 65 65 GLU CB C 65 28.887 28.887 30.337 -1.450 19806 5415 1 10 . 1 1 66 66 THR N N 66 115.852 115.852 113.388 2.464 19806 5416 1 10 . 1 1 66 66 THR HA H 66 3.991 3.991 4.218 -0.227 19806 5417 1 10 . 1 1 66 66 THR CA C 66 65.804 65.804 64.387 1.417 19806 5418 1 10 . 1 1 66 66 THR CB C 66 68.451 68.451 68.925 -0.474 19806 5419 1 10 . 1 1 67 67 MET N N 67 113.585 113.585 122.550 -8.965 19806 5420 1 10 . 1 1 67 67 MET HA H 67 4.267 4.267 4.401 -0.134 19806 5421 1 10 . 1 1 67 67 MET CA C 67 52.135 52.135 54.210 -2.075 19806 5422 1 10 . 1 1 67 67 MET CB C 67 28.963 28.963 31.037 -2.074 19806 5423 1 10 . 1 1 68 68 LYS N N 68 118.462 118.462 121.955 -3.493 19806 5424 1 10 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.561 -0.191 19806 5425 1 10 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.404 0.078 19806 5426 1 10 . 1 1 68 68 LYS CB C 68 34.179 34.179 35.240 -1.061 19806 5427 1 10 . 1 1 69 69 GLU N N 69 121.700 121.700 124.299 -2.599 19806 5428 1 10 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.836 -0.312 19806 5429 1 10 . 1 1 69 69 GLU CA C 69 55.942 55.942 55.760 0.182 19806 5430 1 10 . 1 1 69 69 GLU CB C 69 30.424 30.424 29.877 0.548 19806 5431 1 10 . 1 1 70 70 GLU N N 70 123.445 123.445 124.944 -1.499 19806 5432 1 10 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.620 0.077 19806 5433 1 10 . 1 1 70 70 GLU CA C 70 55.473 55.473 54.912 0.561 19806 5434 1 10 . 1 1 70 70 GLU CB C 70 33.162 33.162 31.997 1.165 19806 5435 1 10 . 1 1 71 71 ARG N N 71 122.150 122.150 119.765 2.385 19806 5436 1 10 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.792 0.359 19806 5437 1 10 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.608 -0.160 19806 5438 1 10 . 1 1 71 71 ARG CB C 71 31.703 31.703 32.179 -0.476 19806 5439 1 10 . 1 1 72 72 ILE N N 72 125.686 125.686 127.828 -2.142 19806 5440 1 10 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.421 0.175 19806 5441 1 10 . 1 1 72 72 ILE CA C 72 59.512 59.512 59.901 -0.389 19806 5442 1 10 . 1 1 72 72 ILE CB C 72 41.095 41.095 38.756 2.339 19806 5443 1 10 . 1 1 73 73 THR N N 73 121.600 121.600 124.263 -2.663 19806 5444 1 10 . 1 1 73 73 THR HA H 73 4.603 4.603 4.269 0.334 19806 5445 1 10 . 1 1 73 73 THR CA C 73 61.937 61.937 63.279 -1.342 19806 5446 1 10 . 1 1 73 73 THR CB C 73 68.669 68.669 68.156 0.513 19806 5447 1 10 . 1 1 74 74 GLN N N 74 124.607 124.607 127.561 -2.954 19806 5448 1 10 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.614 -0.033 19806 5449 1 10 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.871 -0.182 19806 5450 1 10 . 1 1 74 74 GLN CB C 74 29.490 29.490 30.112 -0.622 19806 5451 1 10 . 1 1 75 75 GLU N N 75 122.962 122.962 127.017 -4.055 19806 5452 1 10 . 1 1 75 75 GLU HA H 75 4.059 4.059 3.985 0.074 19806 5453 1 10 . 1 1 75 75 GLU CA C 75 58.845 58.845 59.071 -0.226 19806 5454 1 10 . 1 1 75 75 GLU CB C 75 29.573 29.573 29.547 0.026 19806 5455 1 10 . 1 1 76 76 GLU N N 76 115.466 115.466 117.036 -1.570 19806 5456 1 10 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.355 -0.047 19806 5457 1 10 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.137 0.640 19806 5458 1 10 . 1 1 76 76 GLU CB C 76 29.072 29.072 29.662 -0.590 19806 5459 1 10 . 1 1 77 77 GLY N N 77 106.771 106.771 105.917 0.854 19806 5460 1 10 . 1 1 77 77 GLY CA C 77 45.014 45.014 44.565 0.449 19806 5461 1 10 . 1 1 78 78 GLY N N 78 108.535 108.535 109.493 -0.958 19806 5462 1 10 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.636 0.071 19806 5463 1 10 . 1 1 79 79 ILE N N 79 121.066 121.066 121.903 -0.837 19806 5464 1 10 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.454 0.353 19806 5465 1 10 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.279 -0.936 19806 5466 1 10 . 1 1 79 79 ILE CB C 79 39.220 39.220 37.295 1.925 19806 5467 1 10 . 1 1 80 80 TYR N N 80 130.709 130.709 130.168 0.541 19806 5468 1 10 . 1 1 80 80 TYR HA H 80 4.264 4.264 3.103 1.161 19806 5469 1 10 . 1 1 80 80 TYR CA C 80 58.161 58.161 58.246 -0.085 19806 5470 1 10 . 1 1 80 80 TYR CB C 80 40.621 40.621 38.279 2.342 19806 5471 1 10 . 1 1 81 81 VAL N N 81 126.965 126.965 126.250 0.715 19806 5472 1 10 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.210 0.644 19806 5473 1 10 . 1 1 81 81 VAL CA C 81 60.457 60.457 61.084 -0.627 19806 5474 1 10 . 1 1 81 81 VAL CB C 81 35.004 35.004 36.055 -1.051 19806 5475 1 10 . 1 1 82 82 SER N N 82 120.914 120.914 118.301 2.613 19806 5476 1 10 . 1 1 82 82 SER HA H 82 5.185 5.185 4.828 0.357 19806 5477 1 10 . 1 1 82 82 SER CA C 82 55.260 55.260 57.924 -2.664 19806 5478 1 10 . 1 1 82 82 SER CB C 82 64.785 64.785 63.312 1.473 19806 5479 1 10 . 1 1 83 83 LYS N N 83 119.415 119.415 124.653 -5.238 19806 5480 1 10 . 1 1 83 83 LYS HA H 83 4.778 4.778 5.042 -0.264 19806 5481 1 10 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.555 0.204 19806 5482 1 10 . 1 1 83 83 LYS CB C 83 35.514 35.514 35.396 0.118 19806 5483 1 10 . 1 1 84 84 PHE N N 84 119.220 119.220 116.770 2.450 19806 5484 1 10 . 1 1 84 84 PHE HA H 84 5.441 5.441 5.450 -0.009 19806 5485 1 10 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.718 0.696 19806 5486 1 10 . 1 1 84 84 PHE CB C 84 37.523 37.523 39.143 -1.620 19806 5487 1 10 . 1 1 85 85 THR N N 85 119.257 119.257 115.538 3.719 19806 5488 1 10 . 1 1 85 85 THR HA H 85 4.057 4.057 4.301 -0.244 19806 5489 1 10 . 1 1 85 85 THR CA C 85 62.660 62.660 62.726 -0.066 19806 5490 1 10 . 1 1 85 85 THR CB C 85 67.698 67.698 69.512 -1.814 19806 5491 1 10 . 1 1 86 86 LEU N N 86 121.612 121.612 123.063 -1.451 19806 5492 1 10 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.662 -0.064 19806 5493 1 10 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.804 0.441 19806 5494 1 10 . 1 1 86 86 LEU CB C 86 44.657 44.657 44.419 0.238 19806 5495 1 10 . 1 1 87 87 ASN N N 87 127.684 127.684 122.003 5.681 19806 5496 1 10 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.725 0.286 19806 5497 1 10 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.009 -0.710 19806 5498 1 10 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.182 0.413 19806 5499 1 10 . 1 1 88 88 GLU N N 88 120.509 120.509 121.272 -0.763 19806 5500 1 10 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.715 0.142 19806 5501 1 10 . 1 1 88 88 GLU CA C 88 54.382 54.382 54.149 0.233 19806 5502 1 10 . 1 1 88 88 GLU CB C 88 29.808 29.808 30.279 -0.471 19806 5503 1 10 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.494 -0.113 19806 5504 1 10 . 1 1 89 89 PRO CA C 89 65.898 65.898 64.642 1.256 19806 5505 1 10 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.218 0.133 19806 5506 1 10 . 1 1 90 90 LYS N N 90 107.288 107.288 119.107 -11.819 19806 5507 1 10 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.610 0.074 19806 5508 1 10 . 1 1 90 90 LYS CA C 90 54.979 54.979 56.051 -1.073 19806 5509 1 10 . 1 1 90 90 LYS CB C 90 32.994 32.994 32.813 0.181 19806 5510 1 10 . 1 1 91 91 HIS N N 91 119.523 119.523 116.110 3.413 19806 5511 1 10 . 1 1 91 91 HIS HA H 91 5.777 5.777 4.959 0.818 19806 5512 1 10 . 1 1 91 91 HIS CA C 91 53.705 53.705 56.175 -2.470 19806 5513 1 10 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.583 -0.389 19806 5514 1 10 . 1 1 92 92 LYS N N 92 122.527 122.527 123.427 -0.900 19806 5515 1 10 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.790 0.339 19806 5516 1 10 . 1 1 92 92 LYS CA C 92 54.291 54.291 56.246 -1.955 19806 5517 1 10 . 1 1 92 92 LYS CB C 92 37.479 37.479 36.167 1.312 19806 5518 1 10 . 1 1 93 93 ILE N N 93 121.564 121.564 126.094 -4.530 19806 5519 1 10 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.535 0.775 19806 5520 1 10 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.821 0.316 19806 5521 1 10 . 1 1 93 93 ILE CB C 93 41.088 41.088 40.054 1.034 19806 5522 1 10 . 1 1 94 94 PHE N N 94 128.955 128.955 129.463 -0.508 19806 5523 1 10 . 1 1 94 94 PHE HA H 94 4.900 4.900 5.472 -0.572 19806 5524 1 10 . 1 1 94 94 PHE CA C 94 55.843 55.843 55.455 0.388 19806 5525 1 10 . 1 1 95 95 GLU N N 95 124.809 124.809 124.440 0.369 19806 5526 1 10 . 1 1 95 95 GLU HA H 95 5.418 5.418 4.912 0.506 19806 5527 1 10 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.378 1.103 19806 5528 1 10 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.441 1.719 19806 5529 1 10 . 1 1 96 96 ALA N N 96 123.759 123.759 121.030 2.729 19806 5530 1 10 . 1 1 96 96 ALA HA H 96 5.379 5.379 4.906 0.473 19806 5531 1 10 . 1 1 96 96 ALA CA C 96 49.541 49.541 51.696 -2.155 19806 5532 1 10 . 1 1 96 96 ALA CB C 96 23.830 23.830 21.421 2.409 19806 5533 1 10 . 1 1 97 97 GLY N N 97 106.592 106.592 110.836 -4.244 19806 5534 1 10 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.906 -0.471 19806 5535 1 10 . 1 1 98 98 TYR N N 98 119.250 119.250 118.719 0.531 19806 5536 1 10 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.174 0.644 19806 5537 1 10 . 1 1 98 98 TYR CA C 98 59.387 59.387 59.732 -0.345 19806 5538 1 10 . 1 1 98 98 TYR CB C 98 38.122 38.122 37.767 0.356 19806 5539 1 10 . 1 1 99 99 GLU N N 99 123.080 123.080 119.425 3.655 19806 5540 1 10 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.124 -0.115 19806 5541 1 10 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.337 0.071 19806 5542 1 10 . 1 1 99 99 GLU CB C 99 30.254 30.254 30.311 -0.057 19806 5543 1 10 . 1 1 100 100 GLU N N 100 116.459 116.459 115.862 0.597 19806 5544 1 10 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.451 -0.415 19806 5545 1 10 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.299 1.105 19806 5546 1 10 . 1 1 100 100 GLU CB C 100 27.576 27.576 30.839 -3.263 19806 5547 1 10 . 1 1 101 101 SER N N 101 113.069 113.069 114.856 -1.787 19806 5548 1 10 . 1 1 101 101 SER HA H 101 4.839 4.839 4.581 0.258 19806 5549 1 10 . 1 1 101 101 SER CA C 101 56.024 56.024 57.695 -1.671 19806 5550 1 10 . 1 1 101 101 SER CB C 101 64.806 64.806 64.065 0.741 19806 5551 1 10 . 1 1 102 102 GLU N N 102 120.439 120.439 120.002 0.437 19806 5552 1 10 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.494 -0.105 19806 5553 1 10 . 1 1 102 102 GLU CA C 102 55.804 55.804 55.268 0.536 19806 5554 1 10 . 1 1 102 102 GLU CB C 102 29.985 29.985 31.582 -1.597 19806 5555 1 10 . 1 1 103 103 VAL N N 103 118.899 118.899 117.080 1.819 19806 5556 1 10 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.232 -0.146 19806 5557 1 10 . 1 1 103 103 VAL CA C 103 62.699 62.699 62.767 -0.068 19806 5558 1 10 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.427 -0.166 19806 5559 1 10 . 1 1 104 104 ASP N N 104 120.965 120.965 121.739 -0.774 19806 5560 1 10 . 1 1 104 104 ASP HA H 104 5.003 5.003 4.995 0.008 19806 5561 1 10 . 1 1 104 104 ASP CA C 104 54.914 54.914 53.610 1.304 19806 5562 1 10 . 1 1 104 104 ASP CB C 104 42.791 42.791 43.715 -0.924 19806 5563 1 10 . 1 1 105 105 LEU N N 105 120.365 120.365 119.420 0.945 19806 5564 1 10 . 1 1 105 105 LEU HA H 105 5.295 5.295 4.944 0.351 19806 5565 1 10 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.925 -0.494 19806 5566 1 10 . 1 1 105 105 LEU CB C 105 46.001 46.001 45.833 0.168 19806 5567 1 10 . 1 1 106 106 ARG N N 106 126.289 126.289 124.099 2.190 19806 5568 1 10 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.027 0.798 19806 5569 1 10 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.592 0.080 19806 5570 1 10 . 1 1 106 106 ARG CB C 106 33.920 33.920 34.710 -0.790 19806 5571 1 10 . 1 1 107 107 VAL N N 107 126.145 126.145 122.213 3.932 19806 5572 1 10 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.409 0.270 19806 5573 1 10 . 1 1 107 107 VAL CA C 107 61.671 61.671 60.702 0.969 19806 5574 1 10 . 1 1 107 107 VAL CB C 107 35.350 35.350 35.408 -0.058 19806 5575 1 10 . 1 1 108 108 GLU N N 108 127.093 127.093 124.180 2.913 19806 5576 1 10 . 1 1 108 108 GLU HA H 108 5.267 5.267 5.199 0.068 19806 5577 1 10 . 1 1 108 108 GLU CA C 108 54.761 54.761 54.445 0.316 19806 5578 1 10 . 1 1 108 108 GLU CB C 108 32.567 32.567 34.022 -1.455 19806 5579 1 10 . 1 1 109 109 PHE N N 109 124.592 124.592 122.558 2.034 19806 5580 1 10 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.658 0.370 19806 5581 1 10 . 1 1 109 109 PHE CA C 109 55.945 55.945 56.427 -0.482 19806 5582 1 10 . 1 1 109 109 PHE CB C 109 43.099 43.099 41.725 1.374 19806 5583 1 10 . 1 1 110 110 GLU N N 110 122.143 122.143 122.429 -0.286 19806 5584 1 10 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.044 0.149 19806 5585 1 10 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.302 1.141 19806 5586 1 10 . 1 1 110 110 GLU CB C 110 35.816 35.816 34.094 1.722 19806 5587 1 10 . 1 1 111 111 LEU N N 111 129.616 129.616 126.362 3.254 19806 5588 1 10 . 1 1 111 111 LEU HA H 111 3.808 3.808 4.156 -0.348 19806 5589 1 10 . 1 1 111 111 LEU CA C 111 53.470 53.470 55.742 -2.272 19806 5590 1 10 . 1 1 111 111 LEU CB C 111 40.400 40.400 42.386 -1.986 19806 5591 1 10 . 1 1 112 112 GLN N N 112 124.742 124.742 121.392 3.350 19806 5592 1 10 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.481 -0.042 19806 5593 1 10 . 1 1 112 112 GLN CA C 112 55.802 55.802 53.219 2.583 19806 5594 1 10 . 1 1 112 112 GLN CB C 112 28.753 28.753 30.227 -1.474 19806 5595 1 10 . 1 1 113 113 ALA N N 113 121.195 121.195 123.472 -2.277 19806 5596 1 10 . 1 1 113 113 ALA HA H 113 4.048 4.048 3.939 0.109 19806 5597 1 10 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.889 -0.371 19806 5598 1 10 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.508 -0.309 19806 5599 1 10 . 1 1 114 114 ASP N N 114 114.525 114.525 116.032 -1.507 19806 5600 1 10 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.505 -0.106 19806 5601 1 10 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.448 -1.540 19806 5602 1 10 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.485 -1.427 19806 5603 1 10 . 1 1 115 115 GLY N N 115 107.526 107.526 106.362 1.164 19806 5604 1 10 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.029 0.755 19806 5605 1 10 . 1 1 116 116 LYS N N 116 118.818 118.818 119.466 -0.648 19806 5606 1 10 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.677 -0.227 19806 5607 1 10 . 1 1 116 116 LYS CA C 116 54.171 54.171 53.862 0.309 19806 5608 1 10 . 1 1 116 116 LYS CB C 116 35.039 35.039 35.325 -0.286 19806 5609 1 10 . 1 1 117 117 TRP N N 117 118.939 118.939 120.996 -2.057 19806 5610 1 10 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.877 -0.920 19806 5611 1 10 . 1 1 118 118 TYR N N 118 112.644 112.644 120.967 -8.323 19806 5612 1 10 . 1 1 118 118 TYR HA H 118 5.277 5.277 5.178 0.099 19806 5613 1 10 . 1 1 118 118 TYR CA C 118 56.219 56.219 56.546 -0.327 19806 5614 1 10 . 1 1 118 118 TYR CB C 118 43.282 43.282 42.129 1.153 19806 5615 1 10 . 1 1 119 119 VAL N N 119 119.842 119.842 122.042 -2.200 19806 5616 1 10 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.358 0.157 19806 5617 1 10 . 1 1 119 119 VAL CA C 119 62.442 62.442 65.065 -2.623 19806 5618 1 10 . 1 1 120 120 VAL N N 120 114.552 114.552 125.922 -11.370 19806 5619 1 10 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.483 0.255 19806 5620 1 10 . 1 1 120 120 VAL CA C 120 59.595 59.595 61.028 -1.433 19806 5621 1 10 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.178 -0.326 19806 5622 1 10 . 1 1 121 121 ASP N N 121 118.234 118.234 118.225 0.009 19806 5623 1 10 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.833 0.430 19806 5624 1 10 . 1 1 121 121 ASP CA C 121 53.663 53.663 54.375 -0.712 19806 5625 1 10 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.285 -0.398 19806 5626 1 10 . 1 1 122 122 CYS N N 122 121.036 121.036 126.897 -5.861 19806 5627 1 10 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.796 0.775 19806 5628 1 10 . 1 1 122 122 CYS CA C 122 57.052 57.052 58.178 -1.126 19806 5629 1 10 . 1 1 122 122 CYS CB C 122 30.834 30.834 28.350 2.484 19806 5630 1 10 . 1 1 123 123 TYR N N 123 127.672 127.672 127.498 0.174 19806 5631 1 10 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.858 0.152 19806 5632 1 10 . 1 1 123 123 TYR CA C 123 57.169 57.169 57.046 0.123 19806 5633 1 10 . 1 1 123 123 TYR CB C 123 41.408 41.408 42.104 -0.696 19806 5634 1 10 . 1 1 124 124 THR N N 124 120.833 120.833 117.297 3.536 19806 5635 1 10 . 1 1 124 124 THR HA H 124 4.987 4.987 4.455 0.532 19806 5636 1 10 . 1 1 124 124 THR CA C 124 57.153 57.153 61.064 -3.911 19806 5637 1 10 . 1 1 124 124 THR CB C 124 68.607 68.607 71.117 -2.510 19806 5638 1 10 . 1 1 125 125 GLY N N 125 114.347 114.347 111.029 3.318 19806 5639 1 10 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.766 -0.438 19806 5640 1 10 . 1 1 126 126 TRP N N 126 119.918 119.918 121.601 -1.683 19806 5641 1 10 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.059 0.011 19806 5642 1 10 . 1 1 126 126 TRP CA C 126 60.564 60.564 59.070 1.494 19806 5643 1 10 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.206 0.433 19806 5644 1 10 . 1 1 127 127 TYR N N 127 113.911 113.911 111.931 1.980 19806 5645 1 10 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.722 0.272 19806 5646 1 10 . 1 1 127 127 TYR CA C 127 53.384 53.384 57.886 -4.503 19806 5647 1 10 . 1 1 127 127 TYR CB C 127 38.584 38.584 39.772 -1.188 19806 5648 1 10 . 1 1 128 128 GLY N N 128 105.181 105.181 106.922 -1.741 19806 5649 1 10 . 1 1 128 128 GLY CA C 128 45.189 45.189 44.517 0.672 19806 5650 1 10 . 1 1 129 129 TYR N N 129 116.588 116.588 121.895 -5.307 19806 5651 1 10 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.241 0.423 19806 5652 1 10 . 1 1 129 129 TYR CA C 129 59.565 59.565 58.557 1.008 19806 5653 1 10 . 1 1 129 129 TYR CB C 129 38.853 38.853 35.730 3.123 19806 5654 1 10 . 1 1 130 130 ASP N N 130 115.195 115.195 120.805 -5.610 19806 5655 1 10 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.660 -0.275 19806 5656 1 10 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.407 -1.276 19806 5657 1 10 . 1 1 130 130 ASP CB C 130 38.685 38.685 42.384 -3.699 19806 5658 1 10 . 1 1 131 131 LEU N N 131 124.887 124.887 123.345 1.542 19806 5659 1 10 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.882 -0.401 19806 5660 1 10 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.418 1.187 19806 5661 1 10 . 1 1 131 131 LEU CB C 131 42.441 42.441 42.835 -0.394 19806 5662 1 10 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.549 0.134 19806 5663 1 10 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.890 65.175 19806 5664 1 10 . 1 1 132 132 PRO CB C 132 32.327 32.327 32.950 -0.623 19806 5665 1 10 . 1 1 133 133 ILE N N 133 123.765 123.765 120.127 3.638 19806 5666 1 10 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.771 -0.042 19806 5667 1 10 . 1 1 133 133 ILE CA C 133 64.860 64.860 62.976 1.884 19806 5668 1 10 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.041 0.022 19806 5669 1 10 . 1 1 134 134 GLY N N 134 107.030 107.030 106.622 0.408 19806 5670 1 10 . 1 1 134 134 GLY CA C 134 45.976 45.976 45.505 0.471 19806 5671 1 10 . 1 1 135 135 GLU N N 135 116.566 116.566 121.253 -4.687 19806 5672 1 10 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.405 0.259 19806 5673 1 10 . 1 1 135 135 GLU CA C 135 55.414 55.414 56.076 -0.662 19806 5674 1 10 . 1 1 135 135 GLU CB C 135 30.195 30.195 29.140 1.055 19806 5675 1 10 . 1 1 136 136 LEU N N 136 124.239 124.239 122.706 1.533 19806 5676 1 10 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.959 0.085 19806 5677 1 10 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.607 0.509 19806 5678 1 10 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.282 -0.275 19806 5679 1 10 . 1 1 137 137 LYS N N 137 117.225 117.225 117.638 -0.413 19806 5680 1 10 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.804 0.059 19806 5681 1 10 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.486 0.969 19806 5682 1 10 . 1 1 137 137 LYS CB C 137 31.203 31.203 30.856 0.347 19806 5683 1 10 . 1 1 138 138 GLN N N 138 118.718 118.718 119.477 -0.759 19806 5684 1 10 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.079 -0.027 19806 5685 1 10 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.618 -0.743 19806 5686 1 10 . 1 1 138 138 GLN CB C 138 28.235 28.235 27.820 0.415 19806 5687 1 10 . 1 1 139 139 THR N N 139 117.970 117.970 117.163 0.807 19806 5688 1 10 . 1 1 139 139 THR HA H 139 4.532 4.532 3.955 0.577 19806 5689 1 10 . 1 1 139 139 THR CA C 139 68.145 68.145 67.104 1.041 19806 5690 1 10 . 1 1 139 139 THR CB C 139 68.103 68.103 68.450 -0.347 19806 5691 1 10 . 1 1 140 140 ILE N N 140 120.391 120.391 122.021 -1.630 19806 5692 1 10 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.845 -0.118 19806 5693 1 10 . 1 1 140 140 ILE CA C 140 65.256 65.256 65.221 0.035 19806 5694 1 10 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.645 0.468 19806 5695 1 10 . 1 1 141 141 GLN N N 141 118.917 118.917 118.007 0.910 19806 5696 1 10 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.903 0.112 19806 5697 1 10 . 1 1 141 141 GLN CA C 141 58.371 58.371 58.973 -0.602 19806 5698 1 10 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.395 -1.048 19806 5699 1 10 . 1 1 142 142 ASN N N 142 119.936 119.936 117.654 2.282 19806 5700 1 10 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.645 -0.130 19806 5701 1 10 . 1 1 142 142 ASN CA C 142 55.799 55.799 56.158 -0.359 19806 5702 1 10 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.990 -1.360 19806 5703 1 10 . 1 1 143 143 VAL N N 143 123.195 123.195 119.897 3.298 19806 5704 1 10 . 1 1 143 143 VAL HA H 143 2.716 2.716 2.505 0.211 19806 5705 1 10 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.289 0.208 19806 5706 1 10 . 1 1 143 143 VAL CB C 143 30.989 30.989 30.855 0.134 19806 5707 1 10 . 1 1 144 144 LYS N N 144 120.348 120.348 117.837 2.511 19806 5708 1 10 . 1 1 144 144 LYS HA H 144 3.881 3.881 4.086 -0.205 19806 5709 1 10 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.432 0.691 19806 5710 1 10 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.021 -0.139 19806 5711 1 10 . 1 1 145 145 GLU N N 145 119.220 119.220 119.273 -0.053 19806 5712 1 10 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.049 0.134 19806 5713 1 10 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.255 -0.077 19806 5714 1 10 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.628 -0.557 19806 5715 1 10 . 1 1 146 146 GLU N N 146 121.420 121.420 119.016 2.404 19806 5716 1 10 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.087 0.190 19806 5717 1 10 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.358 -0.240 19806 5718 1 10 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.703 -1.361 19806 5719 1 10 . 1 1 147 147 ASN N N 147 119.197 119.197 117.154 2.043 19806 5720 1 10 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.601 -0.033 19806 5721 1 10 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.900 -1.749 19806 5722 1 10 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.849 -0.476 19806 5723 1 10 . 1 1 148 148 ALA N N 148 123.672 123.672 120.966 2.706 19806 5724 1 10 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.463 -0.340 19806 5725 1 10 . 1 1 148 148 ALA CA C 148 55.133 55.133 53.322 1.811 19806 5726 1 10 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.227 -0.620 19806 5727 1 10 . 1 1 149 149 ALA N N 149 119.979 119.979 122.531 -2.552 19806 5728 1 10 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.088 0.173 19806 5729 1 10 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.261 0.384 19806 5730 1 10 . 1 1 149 149 ALA CB C 149 17.738 17.738 19.142 -1.404 19806 5731 1 10 . 1 1 150 150 PHE N N 150 119.592 119.592 120.559 -0.967 19806 5732 1 10 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.118 0.106 19806 5733 1 10 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.121 -0.113 19806 5734 1 10 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.346 -0.284 19806 5735 1 10 . 1 1 151 151 LYS N N 151 116.869 116.869 115.998 0.871 19806 5736 1 10 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.041 -0.135 19806 5737 1 10 . 1 1 151 151 LYS CA C 151 58.770 58.770 57.949 0.821 19806 5738 1 10 . 1 1 151 151 LYS CB C 151 32.741 32.741 31.815 0.926 19806 5739 1 10 . 1 1 152 152 GLU N N 152 115.868 115.868 119.847 -3.979 19806 5740 1 10 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.117 -0.064 19806 5741 1 10 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.487 0.169 19806 5742 1 10 . 1 1 152 152 GLU CB C 152 29.753 29.753 30.156 -0.403 19806 5743 1 10 . 1 1 153 153 ILE N N 153 110.437 110.437 116.949 -6.512 19806 5744 1 10 . 1 1 153 153 ILE HA H 153 4.176 4.176 4.015 0.161 19806 5745 1 10 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.795 -1.762 19806 5746 1 10 . 1 1 153 153 ILE CB C 153 39.272 39.272 39.484 -0.212 19806 5747 1 10 . 1 1 154 154 HIS N N 154 117.779 117.779 117.532 0.247 19806 5748 1 10 . 1 1 154 154 HIS HA H 154 5.174 5.174 4.819 0.355 19806 5749 1 10 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.828 -1.212 19806 5750 1 10 . 1 1 154 154 HIS CB C 154 28.547 28.547 30.733 -2.186 19806 5751 1 11 . 1 1 3 3 SER N N 3 114.847 114.847 117.717 -2.870 19806 5752 1 11 . 1 1 3 3 SER HA H 3 4.463 4.463 4.668 -0.205 19806 5753 1 11 . 1 1 3 3 SER CA C 3 58.340 58.340 57.831 0.509 19806 5754 1 11 . 1 1 3 3 SER CB C 3 63.457 63.457 65.858 -2.401 19806 5755 1 11 . 1 1 4 4 GLU N N 4 121.498 121.498 120.737 0.761 19806 5756 1 11 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.585 -0.253 19806 5757 1 11 . 1 1 4 4 GLU CA C 4 56.443 56.443 55.236 1.207 19806 5758 1 11 . 1 1 4 4 GLU CB C 4 29.966 29.966 31.359 -1.393 19806 5759 1 11 . 1 1 5 5 LEU N N 5 121.589 121.589 121.983 -0.394 19806 5760 1 11 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.251 0.186 19806 5761 1 11 . 1 1 5 5 LEU CA C 5 55.019 55.019 55.947 -0.928 19806 5762 1 11 . 1 1 5 5 LEU CB C 5 42.243 42.243 42.253 -0.010 19806 5763 1 11 . 1 1 6 6 THR N N 6 113.708 113.708 113.976 -0.268 19806 5764 1 11 . 1 1 6 6 THR HA H 6 4.470 4.470 3.957 0.513 19806 5765 1 11 . 1 1 6 6 THR CA C 6 61.409 61.409 63.358 -1.948 19806 5766 1 11 . 1 1 6 6 THR CB C 6 69.544 69.544 68.567 0.977 19806 5767 1 11 . 1 1 7 7 THR N N 7 114.945 114.945 113.941 1.004 19806 5768 1 11 . 1 1 7 7 THR HA H 7 4.415 4.415 3.830 0.585 19806 5769 1 11 . 1 1 7 7 THR CA C 7 61.435 61.435 64.252 -2.817 19806 5770 1 11 . 1 1 7 7 THR CB C 7 69.506 69.506 68.578 0.928 19806 5771 1 11 . 1 1 8 8 GLN N N 8 121.368 121.368 120.124 1.244 19806 5772 1 11 . 1 1 8 8 GLN CA C 8 55.684 55.684 55.472 0.212 19806 5773 1 11 . 1 1 9 9 ASP N N 9 120.595 120.595 120.881 -0.286 19806 5774 1 11 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.629 0.018 19806 5775 1 11 . 1 1 9 9 ASP CA C 9 54.115 54.115 54.096 0.020 19806 5776 1 11 . 1 1 9 9 ASP CB C 9 41.328 41.328 41.381 -0.053 19806 5777 1 11 . 1 1 10 10 GLY N N 10 106.984 106.984 106.411 0.573 19806 5778 1 11 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.441 0.055 19806 5779 1 11 . 1 1 11 11 GLU N N 11 120.879 120.879 120.527 0.352 19806 5780 1 11 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.258 -0.069 19806 5781 1 11 . 1 1 11 11 GLU CA C 11 56.510 56.510 57.044 -0.534 19806 5782 1 11 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.397 1.672 19806 5783 1 11 . 1 1 12 12 ASP N N 12 126.686 126.686 123.611 3.075 19806 5784 1 11 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.521 0.229 19806 5785 1 11 . 1 1 12 12 ASP CA C 12 54.347 54.347 53.633 0.714 19806 5786 1 11 . 1 1 12 12 ASP CB C 12 42.771 42.771 41.941 0.830 19806 5787 1 11 . 1 1 13 13 PHE N N 13 128.055 128.055 120.632 7.423 19806 5788 1 11 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.448 -0.036 19806 5789 1 11 . 1 1 13 13 PHE CA C 13 62.551 62.551 61.721 0.830 19806 5790 1 11 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.605 0.228 19806 5791 1 11 . 1 1 14 14 LYS N N 14 117.498 117.498 117.633 -0.135 19806 5792 1 11 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.781 -0.200 19806 5793 1 11 . 1 1 14 14 LYS CA C 14 59.461 59.461 58.701 0.760 19806 5794 1 11 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.777 -0.433 19806 5795 1 11 . 1 1 15 15 SER N N 15 113.775 113.775 115.044 -1.269 19806 5796 1 11 . 1 1 15 15 SER HA H 15 4.167 4.167 4.131 0.036 19806 5797 1 11 . 1 1 15 15 SER CA C 15 61.099 61.099 62.196 -1.097 19806 5798 1 11 . 1 1 15 15 SER CB C 15 62.428 62.428 63.109 -0.681 19806 5799 1 11 . 1 1 16 16 PHE N N 16 122.292 122.292 120.028 2.264 19806 5800 1 11 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.497 -0.207 19806 5801 1 11 . 1 1 16 16 PHE CA C 16 59.773 59.773 59.406 0.367 19806 5802 1 11 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.592 -1.417 19806 5803 1 11 . 1 1 17 17 LEU N N 17 122.472 122.472 120.905 1.567 19806 5804 1 11 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.452 -0.602 19806 5805 1 11 . 1 1 17 17 LEU CA C 17 56.619 56.619 56.471 0.147 19806 5806 1 11 . 1 1 17 17 LEU CB C 17 40.462 40.462 39.972 0.490 19806 5807 1 11 . 1 1 18 18 ASP N N 18 117.331 117.331 121.074 -3.743 19806 5808 1 11 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.190 -0.075 19806 5809 1 11 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.289 -0.894 19806 5810 1 11 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.446 -0.093 19806 5811 1 11 . 1 1 19 19 LYS N N 19 120.032 120.032 118.700 1.332 19806 5812 1 11 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.952 -0.275 19806 5813 1 11 . 1 1 19 19 LYS CA C 19 59.067 59.067 58.778 0.289 19806 5814 1 11 . 1 1 19 19 LYS CB C 19 31.936 31.936 31.944 -0.008 19806 5815 1 11 . 1 1 20 20 PHE N N 20 119.607 119.607 120.582 -0.975 19806 5816 1 11 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.344 -0.235 19806 5817 1 11 . 1 1 20 20 PHE CA C 20 62.090 62.090 61.156 0.934 19806 5818 1 11 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.443 1.026 19806 5819 1 11 . 1 1 21 21 THR N N 21 101.473 101.473 110.356 -8.883 19806 5820 1 11 . 1 1 21 21 THR HA H 21 4.259 4.259 4.453 -0.194 19806 5821 1 11 . 1 1 21 21 THR CA C 21 61.774 61.774 62.377 -0.604 19806 5822 1 11 . 1 1 22 22 SER N N 22 111.453 111.453 115.281 -3.828 19806 5823 1 11 . 1 1 22 22 SER HA H 22 4.165 4.165 4.322 -0.157 19806 5824 1 11 . 1 1 22 22 SER CA C 22 58.215 58.215 58.492 -0.277 19806 5825 1 11 . 1 1 22 22 SER CB C 22 64.570 64.570 64.716 -0.145 19806 5826 1 11 . 1 1 23 23 SER N N 23 114.184 114.184 117.368 -3.184 19806 5827 1 11 . 1 1 23 23 SER HA H 23 4.764 4.764 5.148 -0.384 19806 5828 1 11 . 1 1 23 23 SER CA C 23 55.669 55.669 58.066 -2.397 19806 5829 1 11 . 1 1 23 23 SER CB C 23 64.011 64.011 64.475 -0.464 19806 5830 1 11 . 1 1 24 24 ALA N N 24 133.370 133.370 129.565 3.805 19806 5831 1 11 . 1 1 24 24 ALA HA H 24 3.956 3.956 3.703 0.253 19806 5832 1 11 . 1 1 24 24 ALA CA C 24 55.106 55.106 55.982 -0.876 19806 5833 1 11 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.122 0.713 19806 5834 1 11 . 1 1 25 25 ALA N N 25 117.430 117.430 119.288 -1.858 19806 5835 1 11 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.525 -0.208 19806 5836 1 11 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.082 1.119 19806 5837 1 11 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.449 -0.100 19806 5838 1 11 . 1 1 26 26 PHE N N 26 116.042 116.042 117.510 -1.468 19806 5839 1 11 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.528 -0.218 19806 5840 1 11 . 1 1 26 26 PHE CA C 26 60.759 60.759 59.234 1.525 19806 5841 1 11 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.959 -0.649 19806 5842 1 11 . 1 1 27 27 GLN N N 27 121.820 121.820 119.487 2.333 19806 5843 1 11 . 1 1 27 27 GLN HA H 27 3.391 3.391 4.038 -0.647 19806 5844 1 11 . 1 1 27 27 GLN CA C 27 60.094 60.094 58.972 1.122 19806 5845 1 11 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.474 -1.017 19806 5846 1 11 . 1 1 28 28 TYR N N 28 111.517 111.517 116.515 -4.998 19806 5847 1 11 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.728 0.402 19806 5848 1 11 . 1 1 28 28 TYR CA C 28 62.357 62.357 60.015 2.342 19806 5849 1 11 . 1 1 28 28 TYR CB C 28 38.568 38.568 38.044 0.524 19806 5850 1 11 . 1 1 29 29 THR N N 29 106.324 106.324 113.319 -6.995 19806 5851 1 11 . 1 1 29 29 THR HA H 29 4.489 4.489 4.305 0.184 19806 5852 1 11 . 1 1 29 29 THR CA C 29 63.765 63.765 61.530 2.235 19806 5853 1 11 . 1 1 29 29 THR CB C 29 69.568 69.568 67.070 2.498 19806 5854 1 11 . 1 1 30 30 ARG N N 30 117.696 117.696 119.421 -1.725 19806 5855 1 11 . 1 1 30 30 ARG HA H 30 4.701 4.701 4.340 0.361 19806 5856 1 11 . 1 1 30 30 ARG CA C 30 52.760 52.760 55.070 -2.310 19806 5857 1 11 . 1 1 30 30 ARG CB C 30 35.047 35.047 30.304 4.743 19806 5858 1 11 . 1 1 31 31 VAL N N 31 119.395 119.395 120.275 -0.880 19806 5859 1 11 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.779 -0.549 19806 5860 1 11 . 1 1 31 31 VAL CA C 31 61.191 61.191 61.049 0.142 19806 5861 1 11 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.613 -2.440 19806 5862 1 11 . 1 1 32 32 LYS N N 32 126.124 126.124 125.556 0.568 19806 5863 1 11 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.446 -0.262 19806 5864 1 11 . 1 1 32 32 LYS CA C 32 53.958 53.958 56.429 -2.471 19806 5865 1 11 . 1 1 32 32 LYS CB C 32 31.112 31.112 33.449 -2.337 19806 5866 1 11 . 1 1 33 33 PHE N N 33 119.303 119.303 118.981 0.322 19806 5867 1 11 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.927 -0.413 19806 5868 1 11 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.289 0.982 19806 5869 1 11 . 1 1 33 33 PHE CB C 33 40.378 40.378 40.355 0.022 19806 5870 1 11 . 1 1 34 34 PRO HA H 34 4.968 4.968 2.691 2.277 19806 5871 1 11 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.303 -0.670 19806 5872 1 11 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.466 1.266 19806 5873 1 11 . 1 1 35 35 LEU N N 35 120.016 120.016 119.170 0.846 19806 5874 1 11 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.555 -0.333 19806 5875 1 11 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.821 1.020 19806 5876 1 11 . 1 1 35 35 LEU CB C 35 41.244 41.244 44.524 -3.280 19806 5877 1 11 . 1 1 36 36 LYS N N 36 117.066 117.066 119.830 -2.764 19806 5878 1 11 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.199 -0.224 19806 5879 1 11 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.629 2.618 19806 5880 1 11 . 1 1 36 36 LYS CB C 36 32.832 32.832 32.778 0.054 19806 5881 1 11 . 1 1 37 37 THR N N 37 117.574 117.574 113.665 3.909 19806 5882 1 11 . 1 1 37 37 THR HA H 37 4.797 4.797 4.783 0.014 19806 5883 1 11 . 1 1 37 37 THR CA C 37 60.396 60.396 59.063 1.333 19806 5884 1 11 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.657 0.362 19806 5885 1 11 . 1 1 38 38 PRO CA C 38 61.923 61.923 61.797 0.126 19806 5886 1 11 . 1 1 38 38 PRO CB C 38 32.631 32.631 33.263 -0.632 19806 5887 1 11 . 1 1 39 39 ILE N N 39 119.949 119.949 116.402 3.547 19806 5888 1 11 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.163 0.076 19806 5889 1 11 . 1 1 39 39 ILE CA C 39 62.133 62.133 62.443 -0.310 19806 5890 1 11 . 1 1 40 40 THR N N 40 123.962 123.962 112.078 11.884 19806 5891 1 11 . 1 1 40 40 THR HA H 40 5.057 5.057 3.908 1.149 19806 5892 1 11 . 1 1 40 40 THR CA C 40 62.262 62.262 63.184 -0.922 19806 5893 1 11 . 1 1 40 40 THR CB C 40 69.891 69.891 67.001 2.890 19806 5894 1 11 . 1 1 41 41 LEU N N 41 125.633 125.633 123.014 2.619 19806 5895 1 11 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.596 0.506 19806 5896 1 11 . 1 1 41 41 LEU CA C 41 52.638 52.638 53.670 -1.032 19806 5897 1 11 . 1 1 41 41 LEU CB C 41 45.180 45.180 43.058 2.122 19806 5898 1 11 . 1 1 42 42 LEU N N 42 120.788 120.788 126.174 -5.386 19806 5899 1 11 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.357 0.391 19806 5900 1 11 . 1 1 42 42 LEU CA C 42 53.724 53.724 55.114 -1.390 19806 5901 1 11 . 1 1 42 42 LEU CB C 42 44.384 44.384 42.278 2.107 19806 5902 1 11 . 1 1 43 43 ALA N N 43 123.073 123.073 130.242 -7.169 19806 5903 1 11 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.262 0.168 19806 5904 1 11 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.580 -1.292 19806 5905 1 11 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.408 0.606 19806 5906 1 11 . 1 1 44 44 ASP N N 44 118.196 118.196 118.376 -0.180 19806 5907 1 11 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.388 0.038 19806 5908 1 11 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.975 -0.947 19806 5909 1 11 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.513 -0.303 19806 5910 1 11 . 1 1 45 45 ASP N N 45 115.018 115.018 117.588 -2.570 19806 5911 1 11 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.525 -0.056 19806 5912 1 11 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.406 -0.612 19806 5913 1 11 . 1 1 45 45 ASP CB C 45 39.864 39.864 40.886 -1.022 19806 5914 1 11 . 1 1 46 46 GLY N N 46 107.499 107.499 107.419 0.080 19806 5915 1 11 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.749 0.165 19806 5916 1 11 . 1 1 47 47 GLU N N 47 117.331 117.331 115.878 1.453 19806 5917 1 11 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.378 0.153 19806 5918 1 11 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.204 0.734 19806 5919 1 11 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.107 3.026 19806 5920 1 11 . 1 1 48 48 THR N N 48 118.462 118.462 119.496 -1.034 19806 5921 1 11 . 1 1 48 48 THR HA H 48 4.243 4.243 4.243 0.000 19806 5922 1 11 . 1 1 48 48 THR CA C 48 62.834 62.834 63.428 -0.594 19806 5923 1 11 . 1 1 48 48 THR CB C 48 68.649 68.649 68.609 0.040 19806 5924 1 11 . 1 1 49 49 GLU N N 49 123.834 123.834 127.830 -3.996 19806 5925 1 11 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.304 0.641 19806 5926 1 11 . 1 1 49 49 GLU CA C 49 55.358 55.358 56.071 -0.713 19806 5927 1 11 . 1 1 49 49 GLU CB C 49 31.395 31.395 30.014 1.381 19806 5928 1 11 . 1 1 50 50 LYS N N 50 122.868 122.868 128.462 -5.594 19806 5929 1 11 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.522 0.119 19806 5930 1 11 . 1 1 50 50 LYS CA C 50 54.111 54.111 54.755 -0.644 19806 5931 1 11 . 1 1 50 50 LYS CB C 50 35.312 35.312 33.897 1.415 19806 5932 1 11 . 1 1 51 51 THR N N 51 111.386 111.386 115.996 -4.610 19806 5933 1 11 . 1 1 51 51 THR HA H 51 5.619 5.619 4.359 1.260 19806 5934 1 11 . 1 1 51 51 THR CA C 51 58.980 58.980 61.525 -2.545 19806 5935 1 11 . 1 1 51 51 THR CB C 51 71.277 71.277 69.442 1.835 19806 5936 1 11 . 1 1 52 52 PHE N N 52 120.631 120.631 117.889 2.742 19806 5937 1 11 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.835 0.128 19806 5938 1 11 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.320 -1.191 19806 5939 1 11 . 1 1 52 52 PHE CB C 52 41.049 41.049 40.433 0.616 19806 5940 1 11 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.685 -0.237 19806 5941 1 11 . 1 1 53 53 PRO CA C 53 62.489 62.489 62.939 -0.450 19806 5942 1 11 . 1 1 53 53 PRO CB C 53 32.240 32.240 32.329 -0.089 19806 5943 1 11 . 1 1 54 54 PHE N N 54 128.034 128.034 122.488 5.546 19806 5944 1 11 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.652 0.176 19806 5945 1 11 . 1 1 54 54 PHE CA C 54 55.509 55.509 58.063 -2.554 19806 5946 1 11 . 1 1 54 54 PHE CB C 54 37.028 37.028 41.301 -4.273 19806 5947 1 11 . 1 1 55 55 THR N N 55 111.757 111.757 114.717 -2.960 19806 5948 1 11 . 1 1 55 55 THR HA H 55 4.413 4.413 4.189 0.224 19806 5949 1 11 . 1 1 55 55 THR CA C 55 60.578 60.578 59.721 0.857 19806 5950 1 11 . 1 1 55 55 THR CB C 55 69.447 69.447 71.395 -1.948 19806 5951 1 11 . 1 1 56 56 LYS N N 56 118.734 118.734 121.077 -2.343 19806 5952 1 11 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.063 -1.581 19806 5953 1 11 . 1 1 56 56 LYS CA C 56 59.381 59.381 58.605 0.776 19806 5954 1 11 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.214 1.036 19806 5955 1 11 . 1 1 57 57 GLU N N 57 119.675 119.675 118.407 1.268 19806 5956 1 11 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.041 0.228 19806 5957 1 11 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.925 -1.774 19806 5958 1 11 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.248 -2.298 19806 5959 1 11 . 1 1 58 58 LYS N N 58 114.700 114.700 116.661 -1.961 19806 5960 1 11 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.341 -0.029 19806 5961 1 11 . 1 1 58 58 LYS CA C 58 55.595 55.595 55.360 0.235 19806 5962 1 11 . 1 1 58 58 LYS CB C 58 32.011 32.011 32.124 -0.113 19806 5963 1 11 . 1 1 59 59 TRP N N 59 118.204 118.204 123.537 -5.333 19806 5964 1 11 . 1 1 59 59 TRP HA H 59 5.099 5.099 4.965 0.134 19806 5965 1 11 . 1 1 59 59 TRP CA C 59 55.577 55.577 54.594 0.983 19806 5966 1 11 . 1 1 59 59 TRP CB C 59 32.037 32.037 29.416 2.621 19806 5967 1 11 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.392 -0.129 19806 5968 1 11 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.566 -2.845 19806 5969 1 11 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.338 -2.489 19806 5970 1 11 . 1 1 61 61 LEU N N 61 123.758 123.758 125.343 -1.585 19806 5971 1 11 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.317 -0.678 19806 5972 1 11 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.177 0.698 19806 5973 1 11 . 1 1 61 61 LEU CB C 61 40.815 40.815 40.325 0.490 19806 5974 1 11 . 1 1 62 62 LEU N N 62 124.052 124.052 124.504 -0.452 19806 5975 1 11 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.349 0.006 19806 5976 1 11 . 1 1 62 62 LEU CA C 62 53.992 53.992 55.498 -1.506 19806 5977 1 11 . 1 1 62 62 LEU CB C 62 44.686 44.686 42.877 1.809 19806 5978 1 11 . 1 1 63 63 ASP N N 63 117.271 117.271 119.029 -1.758 19806 5979 1 11 . 1 1 63 63 ASP HA H 63 5.033 5.033 5.104 -0.071 19806 5980 1 11 . 1 1 63 63 ASP CA C 63 51.101 51.101 52.634 -1.533 19806 5981 1 11 . 1 1 63 63 ASP CB C 63 43.345 43.345 44.186 -0.841 19806 5982 1 11 . 1 1 64 64 SER N N 64 112.856 112.856 115.710 -2.854 19806 5983 1 11 . 1 1 64 64 SER HA H 64 3.865 3.865 4.223 -0.358 19806 5984 1 11 . 1 1 64 64 SER CA C 64 60.910 60.910 61.485 -0.575 19806 5985 1 11 . 1 1 64 64 SER CB C 64 62.378 62.378 63.125 -0.747 19806 5986 1 11 . 1 1 65 65 GLU N N 65 120.070 120.070 120.069 0.001 19806 5987 1 11 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.154 -0.136 19806 5988 1 11 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.872 -0.529 19806 5989 1 11 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.153 -0.266 19806 5990 1 11 . 1 1 66 66 THR N N 66 115.852 115.852 114.704 1.148 19806 5991 1 11 . 1 1 66 66 THR HA H 66 3.991 3.991 4.338 -0.347 19806 5992 1 11 . 1 1 66 66 THR CA C 66 65.804 65.804 64.234 1.570 19806 5993 1 11 . 1 1 66 66 THR CB C 66 68.451 68.451 69.437 -0.986 19806 5994 1 11 . 1 1 67 67 MET N N 67 113.585 113.585 120.293 -6.708 19806 5995 1 11 . 1 1 67 67 MET HA H 67 4.267 4.267 4.032 0.235 19806 5996 1 11 . 1 1 67 67 MET CA C 67 52.135 52.135 54.601 -2.466 19806 5997 1 11 . 1 1 67 67 MET CB C 67 28.963 28.963 32.974 -4.011 19806 5998 1 11 . 1 1 68 68 LYS N N 68 118.462 118.462 121.050 -2.588 19806 5999 1 11 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.555 -0.185 19806 6000 1 11 . 1 1 68 68 LYS CA C 68 55.482 55.482 54.864 0.618 19806 6001 1 11 . 1 1 68 68 LYS CB C 68 34.179 34.179 34.734 -0.555 19806 6002 1 11 . 1 1 69 69 GLU N N 69 121.700 121.700 120.111 1.589 19806 6003 1 11 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.774 -0.250 19806 6004 1 11 . 1 1 69 69 GLU CA C 69 55.942 55.942 55.356 0.586 19806 6005 1 11 . 1 1 69 69 GLU CB C 69 30.424 30.424 32.228 -1.804 19806 6006 1 11 . 1 1 70 70 GLU N N 70 123.445 123.445 122.108 1.337 19806 6007 1 11 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.586 0.111 19806 6008 1 11 . 1 1 70 70 GLU CA C 70 55.473 55.473 55.224 0.249 19806 6009 1 11 . 1 1 70 70 GLU CB C 70 33.162 33.162 32.694 0.468 19806 6010 1 11 . 1 1 71 71 ARG N N 71 122.150 122.150 120.766 1.384 19806 6011 1 11 . 1 1 71 71 ARG HA H 71 5.151 5.151 5.065 0.086 19806 6012 1 11 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.435 0.013 19806 6013 1 11 . 1 1 71 71 ARG CB C 71 31.703 31.703 32.506 -0.803 19806 6014 1 11 . 1 1 72 72 ILE N N 72 125.686 125.686 128.340 -2.654 19806 6015 1 11 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.392 0.204 19806 6016 1 11 . 1 1 72 72 ILE CA C 72 59.512 59.512 60.653 -1.141 19806 6017 1 11 . 1 1 72 72 ILE CB C 72 41.095 41.095 38.169 2.926 19806 6018 1 11 . 1 1 73 73 THR N N 73 121.600 121.600 122.684 -1.084 19806 6019 1 11 . 1 1 73 73 THR HA H 73 4.603 4.603 4.491 0.112 19806 6020 1 11 . 1 1 73 73 THR CA C 73 61.937 61.937 62.098 -0.161 19806 6021 1 11 . 1 1 73 73 THR CB C 73 68.669 68.669 69.121 -0.452 19806 6022 1 11 . 1 1 74 74 GLN N N 74 124.607 124.607 125.112 -0.505 19806 6023 1 11 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.604 -0.023 19806 6024 1 11 . 1 1 74 74 GLN CA C 74 54.689 54.689 55.158 -0.469 19806 6025 1 11 . 1 1 74 74 GLN CB C 74 29.490 29.490 31.174 -1.684 19806 6026 1 11 . 1 1 75 75 GLU N N 75 122.962 122.962 120.013 2.949 19806 6027 1 11 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.388 -0.329 19806 6028 1 11 . 1 1 75 75 GLU CA C 75 58.845 58.845 56.950 1.895 19806 6029 1 11 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.153 -0.580 19806 6030 1 11 . 1 1 76 76 GLU N N 76 115.466 115.466 120.414 -4.948 19806 6031 1 11 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.461 -0.153 19806 6032 1 11 . 1 1 76 76 GLU CA C 76 56.777 56.777 55.930 0.847 19806 6033 1 11 . 1 1 76 76 GLU CB C 76 29.072 29.072 30.476 -1.404 19806 6034 1 11 . 1 1 77 77 GLY N N 77 106.771 106.771 108.348 -1.577 19806 6035 1 11 . 1 1 77 77 GLY CA C 77 45.014 45.014 44.973 0.041 19806 6036 1 11 . 1 1 78 78 GLY N N 78 108.535 108.535 107.936 0.599 19806 6037 1 11 . 1 1 78 78 GLY CA C 78 44.707 44.707 45.022 -0.315 19806 6038 1 11 . 1 1 79 79 ILE N N 79 121.066 121.066 121.000 0.066 19806 6039 1 11 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.420 0.387 19806 6040 1 11 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.535 -1.192 19806 6041 1 11 . 1 1 79 79 ILE CB C 79 39.220 39.220 38.004 1.216 19806 6042 1 11 . 1 1 80 80 TYR N N 80 130.709 130.709 129.900 0.809 19806 6043 1 11 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.411 -0.147 19806 6044 1 11 . 1 1 80 80 TYR CA C 80 58.161 58.161 58.913 -0.752 19806 6045 1 11 . 1 1 80 80 TYR CB C 80 40.621 40.621 40.045 0.576 19806 6046 1 11 . 1 1 81 81 VAL N N 81 126.965 126.965 125.792 1.173 19806 6047 1 11 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.543 0.311 19806 6048 1 11 . 1 1 81 81 VAL CA C 81 60.457 60.457 61.375 -0.918 19806 6049 1 11 . 1 1 81 81 VAL CB C 81 35.004 35.004 34.940 0.064 19806 6050 1 11 . 1 1 82 82 SER N N 82 120.914 120.914 121.801 -0.887 19806 6051 1 11 . 1 1 82 82 SER HA H 82 5.185 5.185 5.271 -0.086 19806 6052 1 11 . 1 1 82 82 SER CA C 82 55.260 55.260 56.735 -1.475 19806 6053 1 11 . 1 1 82 82 SER CB C 82 64.785 64.785 65.043 -0.258 19806 6054 1 11 . 1 1 83 83 LYS N N 83 119.415 119.415 121.813 -2.398 19806 6055 1 11 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.615 0.163 19806 6056 1 11 . 1 1 83 83 LYS CA C 83 54.759 54.759 55.590 -0.832 19806 6057 1 11 . 1 1 83 83 LYS CB C 83 35.514 35.514 35.421 0.093 19806 6058 1 11 . 1 1 84 84 PHE N N 84 119.220 119.220 118.332 0.888 19806 6059 1 11 . 1 1 84 84 PHE HA H 84 5.441 5.441 5.124 0.317 19806 6060 1 11 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.242 1.172 19806 6061 1 11 . 1 1 84 84 PHE CB C 84 37.523 37.523 38.773 -1.250 19806 6062 1 11 . 1 1 85 85 THR N N 85 119.257 119.257 114.429 4.828 19806 6063 1 11 . 1 1 85 85 THR HA H 85 4.057 4.057 4.205 -0.148 19806 6064 1 11 . 1 1 85 85 THR CA C 85 62.660 62.660 63.353 -0.693 19806 6065 1 11 . 1 1 85 85 THR CB C 85 67.698 67.698 69.490 -1.792 19806 6066 1 11 . 1 1 86 86 LEU N N 86 121.612 121.612 121.768 -0.156 19806 6067 1 11 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.701 -0.103 19806 6068 1 11 . 1 1 86 86 LEU CA C 86 55.245 55.245 55.135 0.110 19806 6069 1 11 . 1 1 86 86 LEU CB C 86 44.657 44.657 45.057 -0.400 19806 6070 1 11 . 1 1 87 87 ASN N N 87 127.684 127.684 121.906 5.778 19806 6071 1 11 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.772 0.239 19806 6072 1 11 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.554 -1.255 19806 6073 1 11 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.988 -0.393 19806 6074 1 11 . 1 1 88 88 GLU N N 88 120.509 120.509 121.769 -1.260 19806 6075 1 11 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.457 0.400 19806 6076 1 11 . 1 1 88 88 GLU CA C 88 54.382 54.382 55.765 -1.383 19806 6077 1 11 . 1 1 88 88 GLU CB C 88 29.808 29.808 30.145 -0.337 19806 6078 1 11 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.614 -0.233 19806 6079 1 11 . 1 1 89 89 PRO CA C 89 65.898 65.898 65.056 0.842 19806 6080 1 11 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.319 0.032 19806 6081 1 11 . 1 1 90 90 LYS N N 90 107.288 107.288 113.575 -6.287 19806 6082 1 11 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.596 0.088 19806 6083 1 11 . 1 1 90 90 LYS CA C 90 54.979 54.979 56.033 -1.054 19806 6084 1 11 . 1 1 90 90 LYS CB C 90 32.994 32.994 33.558 -0.564 19806 6085 1 11 . 1 1 91 91 HIS N N 91 119.523 119.523 119.629 -0.106 19806 6086 1 11 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.272 0.505 19806 6087 1 11 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.886 -1.181 19806 6088 1 11 . 1 1 91 91 HIS CB C 91 32.194 32.194 31.554 0.640 19806 6089 1 11 . 1 1 92 92 LYS N N 92 122.527 122.527 127.793 -5.266 19806 6090 1 11 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.950 0.179 19806 6091 1 11 . 1 1 92 92 LYS CA C 92 54.291 54.291 54.796 -0.505 19806 6092 1 11 . 1 1 92 92 LYS CB C 92 37.479 37.479 31.619 5.861 19806 6093 1 11 . 1 1 93 93 ILE N N 93 121.564 121.564 122.998 -1.434 19806 6094 1 11 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.102 1.208 19806 6095 1 11 . 1 1 93 93 ILE CA C 93 61.137 61.137 62.542 -1.405 19806 6096 1 11 . 1 1 93 93 ILE CB C 93 41.088 41.088 38.338 2.750 19806 6097 1 11 . 1 1 94 94 PHE N N 94 128.955 128.955 129.455 -0.500 19806 6098 1 11 . 1 1 94 94 PHE HA H 94 4.900 4.900 5.308 -0.408 19806 6099 1 11 . 1 1 94 94 PHE CA C 94 55.843 55.843 56.100 -0.257 19806 6100 1 11 . 1 1 95 95 GLU N N 95 124.809 124.809 124.241 0.568 19806 6101 1 11 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.092 0.326 19806 6102 1 11 . 1 1 95 95 GLU CA C 95 54.481 54.481 54.101 0.380 19806 6103 1 11 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.941 1.219 19806 6104 1 11 . 1 1 96 96 ALA N N 96 123.759 123.759 121.751 2.008 19806 6105 1 11 . 1 1 96 96 ALA HA H 96 5.379 5.379 5.168 0.211 19806 6106 1 11 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.912 -1.371 19806 6107 1 11 . 1 1 96 96 ALA CB C 96 23.830 23.830 22.164 1.666 19806 6108 1 11 . 1 1 97 97 GLY N N 97 106.592 106.592 109.316 -2.724 19806 6109 1 11 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.356 0.079 19806 6110 1 11 . 1 1 98 98 TYR N N 98 119.250 119.250 118.823 0.427 19806 6111 1 11 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.689 0.129 19806 6112 1 11 . 1 1 98 98 TYR CA C 98 59.387 59.387 57.708 1.679 19806 6113 1 11 . 1 1 98 98 TYR CB C 98 38.122 38.122 40.275 -2.153 19806 6114 1 11 . 1 1 99 99 GLU N N 99 123.080 123.080 123.642 -0.562 19806 6115 1 11 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.103 -0.094 19806 6116 1 11 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.583 -0.174 19806 6117 1 11 . 1 1 99 99 GLU CB C 99 30.254 30.254 29.814 0.439 19806 6118 1 11 . 1 1 100 100 GLU N N 100 116.459 116.459 115.762 0.697 19806 6119 1 11 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.504 -0.468 19806 6120 1 11 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.338 1.066 19806 6121 1 11 . 1 1 100 100 GLU CB C 100 27.576 27.576 30.952 -3.376 19806 6122 1 11 . 1 1 101 101 SER N N 101 113.069 113.069 115.027 -1.958 19806 6123 1 11 . 1 1 101 101 SER HA H 101 4.839 4.839 4.675 0.164 19806 6124 1 11 . 1 1 101 101 SER CA C 101 56.024 56.024 57.259 -1.235 19806 6125 1 11 . 1 1 101 101 SER CB C 101 64.806 64.806 64.684 0.122 19806 6126 1 11 . 1 1 102 102 GLU N N 102 120.439 120.439 120.224 0.215 19806 6127 1 11 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.478 -0.089 19806 6128 1 11 . 1 1 102 102 GLU CA C 102 55.804 55.804 55.592 0.212 19806 6129 1 11 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.761 -0.775 19806 6130 1 11 . 1 1 103 103 VAL N N 103 118.899 118.899 114.701 4.198 19806 6131 1 11 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.267 -0.181 19806 6132 1 11 . 1 1 103 103 VAL CA C 103 62.699 62.699 61.580 1.119 19806 6133 1 11 . 1 1 103 103 VAL CB C 103 32.261 32.261 33.149 -0.888 19806 6134 1 11 . 1 1 104 104 ASP N N 104 120.965 120.965 121.277 -0.312 19806 6135 1 11 . 1 1 104 104 ASP HA H 104 5.003 5.003 4.916 0.087 19806 6136 1 11 . 1 1 104 104 ASP CA C 104 54.914 54.914 53.920 0.994 19806 6137 1 11 . 1 1 104 104 ASP CB C 104 42.791 42.791 43.396 -0.605 19806 6138 1 11 . 1 1 105 105 LEU N N 105 120.365 120.365 119.099 1.266 19806 6139 1 11 . 1 1 105 105 LEU HA H 105 5.295 5.295 5.148 0.147 19806 6140 1 11 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.945 -0.514 19806 6141 1 11 . 1 1 105 105 LEU CB C 105 46.001 46.001 44.832 1.169 19806 6142 1 11 . 1 1 106 106 ARG N N 106 126.289 126.289 125.563 0.726 19806 6143 1 11 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.109 0.716 19806 6144 1 11 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.785 -0.113 19806 6145 1 11 . 1 1 106 106 ARG CB C 106 33.920 33.920 33.316 0.604 19806 6146 1 11 . 1 1 107 107 VAL N N 107 126.145 126.145 122.246 3.899 19806 6147 1 11 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.420 0.259 19806 6148 1 11 . 1 1 107 107 VAL CA C 107 61.671 61.671 61.280 0.391 19806 6149 1 11 . 1 1 107 107 VAL CB C 107 35.350 35.350 35.405 -0.055 19806 6150 1 11 . 1 1 108 108 GLU N N 108 127.093 127.093 122.925 4.168 19806 6151 1 11 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.949 0.318 19806 6152 1 11 . 1 1 108 108 GLU CA C 108 54.761 54.761 54.124 0.637 19806 6153 1 11 . 1 1 108 108 GLU CB C 108 32.567 32.567 34.428 -1.861 19806 6154 1 11 . 1 1 109 109 PHE N N 109 124.592 124.592 117.945 6.647 19806 6155 1 11 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.266 0.762 19806 6156 1 11 . 1 1 109 109 PHE CA C 109 55.945 55.945 57.523 -1.578 19806 6157 1 11 . 1 1 109 109 PHE CB C 109 43.099 43.099 41.710 1.389 19806 6158 1 11 . 1 1 110 110 GLU N N 110 122.143 122.143 123.545 -1.402 19806 6159 1 11 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.093 0.100 19806 6160 1 11 . 1 1 110 110 GLU CA C 110 55.443 55.443 55.299 0.144 19806 6161 1 11 . 1 1 110 110 GLU CB C 110 35.816 35.816 31.869 3.947 19806 6162 1 11 . 1 1 111 111 LEU N N 111 129.616 129.616 126.677 2.939 19806 6163 1 11 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.461 0.347 19806 6164 1 11 . 1 1 111 111 LEU CA C 111 53.470 53.470 54.395 -0.924 19806 6165 1 11 . 1 1 111 111 LEU CB C 111 40.400 40.400 40.654 -0.254 19806 6166 1 11 . 1 1 112 112 GLN N N 112 124.742 124.742 124.889 -0.147 19806 6167 1 11 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.358 0.081 19806 6168 1 11 . 1 1 112 112 GLN CA C 112 55.802 55.802 54.497 1.305 19806 6169 1 11 . 1 1 112 112 GLN CB C 112 28.753 28.753 30.019 -1.266 19806 6170 1 11 . 1 1 113 113 ALA N N 113 121.195 121.195 124.491 -3.296 19806 6171 1 11 . 1 1 113 113 ALA HA H 113 4.048 4.048 3.941 0.107 19806 6172 1 11 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.346 0.172 19806 6173 1 11 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.302 -0.103 19806 6174 1 11 . 1 1 114 114 ASP N N 114 114.525 114.525 118.297 -3.772 19806 6175 1 11 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.448 -0.049 19806 6176 1 11 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.084 -1.176 19806 6177 1 11 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.822 -1.764 19806 6178 1 11 . 1 1 115 115 GLY N N 115 107.526 107.526 106.177 1.349 19806 6179 1 11 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.193 0.591 19806 6180 1 11 . 1 1 116 116 LYS N N 116 118.818 118.818 120.402 -1.584 19806 6181 1 11 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.771 -0.321 19806 6182 1 11 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.206 -0.035 19806 6183 1 11 . 1 1 116 116 LYS CB C 116 35.039 35.039 35.736 -0.697 19806 6184 1 11 . 1 1 117 117 TRP N N 117 118.939 118.939 123.796 -4.857 19806 6185 1 11 . 1 1 117 117 TRP CA C 117 56.956 56.956 56.901 0.055 19806 6186 1 11 . 1 1 118 118 TYR N N 118 112.644 112.644 119.674 -7.030 19806 6187 1 11 . 1 1 118 118 TYR HA H 118 5.277 5.277 5.067 0.210 19806 6188 1 11 . 1 1 118 118 TYR CA C 118 56.219 56.219 57.041 -0.822 19806 6189 1 11 . 1 1 118 118 TYR CB C 118 43.282 43.282 41.809 1.473 19806 6190 1 11 . 1 1 119 119 VAL N N 119 119.842 119.842 121.371 -1.529 19806 6191 1 11 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.230 0.285 19806 6192 1 11 . 1 1 119 119 VAL CA C 119 62.442 62.442 63.585 -1.143 19806 6193 1 11 . 1 1 120 120 VAL N N 120 114.552 114.552 114.228 0.324 19806 6194 1 11 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.626 0.112 19806 6195 1 11 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.989 -1.395 19806 6196 1 11 . 1 1 120 120 VAL CB C 120 32.852 32.852 32.986 -0.134 19806 6197 1 11 . 1 1 121 121 ASP N N 121 118.234 118.234 119.593 -1.359 19806 6198 1 11 . 1 1 121 121 ASP HA H 121 5.263 5.263 5.253 0.010 19806 6199 1 11 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.763 -0.100 19806 6200 1 11 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.421 -0.534 19806 6201 1 11 . 1 1 122 122 CYS N N 122 121.036 121.036 118.655 2.381 19806 6202 1 11 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.757 0.814 19806 6203 1 11 . 1 1 122 122 CYS CA C 122 57.052 57.052 56.997 0.055 19806 6204 1 11 . 1 1 122 122 CYS CB C 122 30.834 30.834 27.986 2.848 19806 6205 1 11 . 1 1 123 123 TYR N N 123 127.672 127.672 124.301 3.371 19806 6206 1 11 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.483 0.527 19806 6207 1 11 . 1 1 123 123 TYR CA C 123 57.169 57.169 59.449 -2.280 19806 6208 1 11 . 1 1 123 123 TYR CB C 123 41.408 41.408 39.503 1.905 19806 6209 1 11 . 1 1 124 124 THR N N 124 120.833 120.833 121.982 -1.149 19806 6210 1 11 . 1 1 124 124 THR HA H 124 4.987 4.987 4.859 0.128 19806 6211 1 11 . 1 1 124 124 THR CA C 124 57.153 57.153 60.022 -2.869 19806 6212 1 11 . 1 1 124 124 THR CB C 124 68.607 68.607 71.059 -2.452 19806 6213 1 11 . 1 1 125 125 GLY N N 125 114.347 114.347 113.095 1.252 19806 6214 1 11 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.924 -0.596 19806 6215 1 11 . 1 1 126 126 TRP N N 126 119.918 119.918 121.883 -1.965 19806 6216 1 11 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.059 0.011 19806 6217 1 11 . 1 1 126 126 TRP CA C 126 60.564 60.564 59.446 1.118 19806 6218 1 11 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.347 0.292 19806 6219 1 11 . 1 1 127 127 TYR N N 127 113.911 113.911 114.140 -0.229 19806 6220 1 11 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.773 0.221 19806 6221 1 11 . 1 1 127 127 TYR CA C 127 53.384 53.384 57.459 -4.075 19806 6222 1 11 . 1 1 127 127 TYR CB C 127 38.584 38.584 37.978 0.605 19806 6223 1 11 . 1 1 128 128 GLY N N 128 105.181 105.181 107.161 -1.980 19806 6224 1 11 . 1 1 128 128 GLY CA C 128 45.189 45.189 43.901 1.288 19806 6225 1 11 . 1 1 129 129 TYR N N 129 116.588 116.588 118.998 -2.410 19806 6226 1 11 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.534 0.130 19806 6227 1 11 . 1 1 129 129 TYR CA C 129 59.565 59.565 59.877 -0.312 19806 6228 1 11 . 1 1 129 129 TYR CB C 129 38.853 38.853 38.532 0.321 19806 6229 1 11 . 1 1 130 130 ASP N N 130 115.195 115.195 117.747 -2.552 19806 6230 1 11 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.666 -0.281 19806 6231 1 11 . 1 1 130 130 ASP CA C 130 53.130 53.130 55.437 -2.307 19806 6232 1 11 . 1 1 130 130 ASP CB C 130 38.685 38.685 41.556 -2.871 19806 6233 1 11 . 1 1 131 131 LEU N N 131 124.887 124.887 121.301 3.586 19806 6234 1 11 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.887 -0.406 19806 6235 1 11 . 1 1 131 131 LEU CA C 131 53.605 53.605 51.752 1.853 19806 6236 1 11 . 1 1 131 131 LEU CB C 131 42.441 42.441 44.066 -1.625 19806 6237 1 11 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.762 -0.079 19806 6238 1 11 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.536 65.529 19806 6239 1 11 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.257 -0.930 19806 6240 1 11 . 1 1 133 133 ILE N N 133 123.765 123.765 120.843 2.922 19806 6241 1 11 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.907 -0.178 19806 6242 1 11 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.265 1.595 19806 6243 1 11 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.177 -0.114 19806 6244 1 11 . 1 1 134 134 GLY N N 134 107.030 107.030 104.521 2.509 19806 6245 1 11 . 1 1 134 134 GLY CA C 134 45.976 45.976 44.680 1.296 19806 6246 1 11 . 1 1 135 135 GLU N N 135 116.566 116.566 119.877 -3.311 19806 6247 1 11 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.568 0.096 19806 6248 1 11 . 1 1 135 135 GLU CA C 135 55.414 55.414 56.245 -0.831 19806 6249 1 11 . 1 1 135 135 GLU CB C 135 30.195 30.195 30.380 -0.185 19806 6250 1 11 . 1 1 136 136 LEU N N 136 124.239 124.239 121.773 2.466 19806 6251 1 11 . 1 1 136 136 LEU HA H 136 4.044 4.044 4.001 0.043 19806 6252 1 11 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.770 0.346 19806 6253 1 11 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.740 -0.733 19806 6254 1 11 . 1 1 137 137 LYS N N 137 117.225 117.225 115.576 1.649 19806 6255 1 11 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.782 0.081 19806 6256 1 11 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.120 1.335 19806 6257 1 11 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.258 -0.055 19806 6258 1 11 . 1 1 138 138 GLN N N 138 118.718 118.718 119.544 -0.826 19806 6259 1 11 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.148 -0.096 19806 6260 1 11 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.398 -0.523 19806 6261 1 11 . 1 1 138 138 GLN CB C 138 28.235 28.235 28.424 -0.189 19806 6262 1 11 . 1 1 139 139 THR N N 139 117.970 117.970 117.982 -0.012 19806 6263 1 11 . 1 1 139 139 THR HA H 139 4.532 4.532 3.860 0.672 19806 6264 1 11 . 1 1 139 139 THR CA C 139 68.145 68.145 66.831 1.314 19806 6265 1 11 . 1 1 139 139 THR CB C 139 68.103 68.103 68.453 -0.350 19806 6266 1 11 . 1 1 140 140 ILE N N 140 120.391 120.391 120.972 -0.581 19806 6267 1 11 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.912 -0.185 19806 6268 1 11 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.431 0.824 19806 6269 1 11 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.528 0.585 19806 6270 1 11 . 1 1 141 141 GLN N N 141 118.917 118.917 118.694 0.223 19806 6271 1 11 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.899 0.116 19806 6272 1 11 . 1 1 141 141 GLN CA C 141 58.371 58.371 59.097 -0.726 19806 6273 1 11 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.162 -0.815 19806 6274 1 11 . 1 1 142 142 ASN N N 142 119.936 119.936 117.722 2.214 19806 6275 1 11 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.620 -0.105 19806 6276 1 11 . 1 1 142 142 ASN CA C 142 55.799 55.799 56.014 -0.215 19806 6277 1 11 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.496 -0.866 19806 6278 1 11 . 1 1 143 143 VAL N N 143 123.195 123.195 119.301 3.894 19806 6279 1 11 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.378 -0.662 19806 6280 1 11 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.094 0.404 19806 6281 1 11 . 1 1 143 143 VAL CB C 143 30.989 30.989 31.226 -0.237 19806 6282 1 11 . 1 1 144 144 LYS N N 144 120.348 120.348 118.646 1.702 19806 6283 1 11 . 1 1 144 144 LYS HA H 144 3.881 3.881 3.964 -0.083 19806 6284 1 11 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.544 0.579 19806 6285 1 11 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.154 -0.272 19806 6286 1 11 . 1 1 145 145 GLU N N 145 119.220 119.220 118.210 1.010 19806 6287 1 11 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.207 -0.024 19806 6288 1 11 . 1 1 145 145 GLU CA C 145 59.178 59.178 58.842 0.336 19806 6289 1 11 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.958 -0.887 19806 6290 1 11 . 1 1 146 146 GLU N N 146 121.420 121.420 120.132 1.288 19806 6291 1 11 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.047 0.230 19806 6292 1 11 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.625 -0.507 19806 6293 1 11 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.358 -1.016 19806 6294 1 11 . 1 1 147 147 ASN N N 147 119.197 119.197 116.582 2.615 19806 6295 1 11 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.578 -0.010 19806 6296 1 11 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.450 -1.299 19806 6297 1 11 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.935 -0.562 19806 6298 1 11 . 1 1 148 148 ALA N N 148 123.672 123.672 123.083 0.589 19806 6299 1 11 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.349 -0.226 19806 6300 1 11 . 1 1 148 148 ALA CA C 148 55.133 55.133 54.888 0.245 19806 6301 1 11 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.362 -0.755 19806 6302 1 11 . 1 1 149 149 ALA N N 149 119.979 119.979 122.184 -2.205 19806 6303 1 11 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.103 0.158 19806 6304 1 11 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.947 -0.301 19806 6305 1 11 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.347 -0.609 19806 6306 1 11 . 1 1 150 150 PHE N N 150 119.592 119.592 119.526 0.066 19806 6307 1 11 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.199 0.025 19806 6308 1 11 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.168 -0.160 19806 6309 1 11 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.412 -0.350 19806 6310 1 11 . 1 1 151 151 LYS N N 151 116.869 116.869 118.815 -1.946 19806 6311 1 11 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.248 -0.342 19806 6312 1 11 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.860 -0.090 19806 6313 1 11 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.141 0.600 19806 6314 1 11 . 1 1 152 152 GLU N N 152 115.868 115.868 119.593 -3.725 19806 6315 1 11 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.171 -0.118 19806 6316 1 11 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.566 0.090 19806 6317 1 11 . 1 1 152 152 GLU CB C 152 29.753 29.753 29.742 0.011 19806 6318 1 11 . 1 1 153 153 ILE N N 153 110.437 110.437 117.498 -7.061 19806 6319 1 11 . 1 1 153 153 ILE HA H 153 4.176 4.176 4.033 0.143 19806 6320 1 11 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.438 -1.404 19806 6321 1 11 . 1 1 153 153 ILE CB C 153 39.272 39.272 40.131 -0.859 19806 6322 1 11 . 1 1 154 154 HIS N N 154 117.779 117.779 118.114 -0.335 19806 6323 1 11 . 1 1 154 154 HIS HA H 154 5.174 5.174 5.142 0.032 19806 6324 1 11 . 1 1 154 154 HIS CA C 154 51.616 51.616 53.492 -1.876 19806 6325 1 11 . 1 1 154 154 HIS CB C 154 28.547 28.547 30.484 -1.937 19806 6326 1 12 . 1 1 3 3 SER N N 3 114.847 114.847 115.461 -0.614 19806 6327 1 12 . 1 1 3 3 SER HA H 3 4.463 4.463 4.955 -0.492 19806 6328 1 12 . 1 1 3 3 SER CA C 3 58.340 58.340 57.718 0.622 19806 6329 1 12 . 1 1 3 3 SER CB C 3 63.457 63.457 66.072 -2.615 19806 6330 1 12 . 1 1 4 4 GLU N N 4 121.498 121.498 121.349 0.149 19806 6331 1 12 . 1 1 4 4 GLU HA H 4 4.332 4.332 5.079 -0.747 19806 6332 1 12 . 1 1 4 4 GLU CA C 4 56.443 56.443 55.819 0.624 19806 6333 1 12 . 1 1 4 4 GLU CB C 4 29.966 29.966 31.332 -1.366 19806 6334 1 12 . 1 1 5 5 LEU N N 5 121.589 121.589 123.831 -2.242 19806 6335 1 12 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.822 -0.385 19806 6336 1 12 . 1 1 5 5 LEU CA C 5 55.019 55.019 54.433 0.586 19806 6337 1 12 . 1 1 5 5 LEU CB C 5 42.243 42.243 44.775 -2.532 19806 6338 1 12 . 1 1 6 6 THR N N 6 113.708 113.708 112.633 1.075 19806 6339 1 12 . 1 1 6 6 THR HA H 6 4.470 4.470 4.996 -0.526 19806 6340 1 12 . 1 1 6 6 THR CA C 6 61.409 61.409 61.403 0.006 19806 6341 1 12 . 1 1 6 6 THR CB C 6 69.544 69.544 71.021 -1.477 19806 6342 1 12 . 1 1 7 7 THR N N 7 114.945 114.945 112.970 1.975 19806 6343 1 12 . 1 1 7 7 THR HA H 7 4.415 4.415 4.463 -0.048 19806 6344 1 12 . 1 1 7 7 THR CA C 7 61.435 61.435 61.100 0.335 19806 6345 1 12 . 1 1 7 7 THR CB C 7 69.506 69.506 70.290 -0.784 19806 6346 1 12 . 1 1 8 8 GLN N N 8 121.368 121.368 120.338 1.030 19806 6347 1 12 . 1 1 8 8 GLN CA C 8 55.684 55.684 55.718 -0.034 19806 6348 1 12 . 1 1 9 9 ASP N N 9 120.595 120.595 119.214 1.381 19806 6349 1 12 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.509 0.138 19806 6350 1 12 . 1 1 9 9 ASP CA C 9 54.115 54.115 53.858 0.257 19806 6351 1 12 . 1 1 9 9 ASP CB C 9 41.328 41.328 40.894 0.434 19806 6352 1 12 . 1 1 10 10 GLY N N 10 106.984 106.984 105.584 1.400 19806 6353 1 12 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.426 0.069 19806 6354 1 12 . 1 1 11 11 GLU N N 11 120.879 120.879 119.567 1.312 19806 6355 1 12 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.378 -0.189 19806 6356 1 12 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.285 0.225 19806 6357 1 12 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.169 1.900 19806 6358 1 12 . 1 1 12 12 ASP N N 12 126.686 126.686 121.483 5.203 19806 6359 1 12 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.963 -0.213 19806 6360 1 12 . 1 1 12 12 ASP CA C 12 54.347 54.347 52.330 2.017 19806 6361 1 12 . 1 1 12 12 ASP CB C 12 42.771 42.771 41.989 0.782 19806 6362 1 12 . 1 1 13 13 PHE N N 13 128.055 128.055 120.793 7.262 19806 6363 1 12 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.321 0.091 19806 6364 1 12 . 1 1 13 13 PHE CA C 13 62.551 62.551 61.640 0.911 19806 6365 1 12 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.974 -0.141 19806 6366 1 12 . 1 1 14 14 LYS N N 14 117.498 117.498 117.761 -0.263 19806 6367 1 12 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.713 -0.132 19806 6368 1 12 . 1 1 14 14 LYS CA C 14 59.461 59.461 59.478 -0.017 19806 6369 1 12 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.436 -0.093 19806 6370 1 12 . 1 1 15 15 SER N N 15 113.775 113.775 113.497 0.278 19806 6371 1 12 . 1 1 15 15 SER HA H 15 4.167 4.167 4.167 0.000 19806 6372 1 12 . 1 1 15 15 SER CA C 15 61.099 61.099 61.120 -0.021 19806 6373 1 12 . 1 1 15 15 SER CB C 15 62.428 62.428 62.723 -0.295 19806 6374 1 12 . 1 1 16 16 PHE N N 16 122.292 122.292 118.302 3.990 19806 6375 1 12 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.558 -0.268 19806 6376 1 12 . 1 1 16 16 PHE CA C 16 59.773 59.773 59.073 0.700 19806 6377 1 12 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.443 -1.268 19806 6378 1 12 . 1 1 17 17 LEU N N 17 122.472 122.472 122.112 0.360 19806 6379 1 12 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.615 -0.765 19806 6380 1 12 . 1 1 17 17 LEU CA C 17 56.619 56.619 57.401 -0.782 19806 6381 1 12 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.219 0.243 19806 6382 1 12 . 1 1 18 18 ASP N N 18 117.331 117.331 119.405 -2.074 19806 6383 1 12 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.346 -0.231 19806 6384 1 12 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.678 -1.283 19806 6385 1 12 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.282 0.071 19806 6386 1 12 . 1 1 19 19 LYS N N 19 120.032 120.032 119.558 0.474 19806 6387 1 12 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.890 -0.213 19806 6388 1 12 . 1 1 19 19 LYS CA C 19 59.067 59.067 58.918 0.149 19806 6389 1 12 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.101 -0.165 19806 6390 1 12 . 1 1 20 20 PHE N N 20 119.607 119.607 119.445 0.162 19806 6391 1 12 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.365 -0.256 19806 6392 1 12 . 1 1 20 20 PHE CA C 20 62.090 62.090 60.793 1.297 19806 6393 1 12 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.338 1.131 19806 6394 1 12 . 1 1 21 21 THR N N 21 101.473 101.473 111.186 -9.713 19806 6395 1 12 . 1 1 21 21 THR HA H 21 4.259 4.259 4.043 0.216 19806 6396 1 12 . 1 1 21 21 THR CA C 21 61.774 61.774 65.052 -3.278 19806 6397 1 12 . 1 1 22 22 SER N N 22 111.453 111.453 115.290 -3.837 19806 6398 1 12 . 1 1 22 22 SER HA H 22 4.165 4.165 4.675 -0.510 19806 6399 1 12 . 1 1 22 22 SER CA C 22 58.215 58.215 58.215 0.000 19806 6400 1 12 . 1 1 22 22 SER CB C 22 64.570 64.570 64.743 -0.173 19806 6401 1 12 . 1 1 23 23 SER N N 23 114.184 114.184 116.700 -2.516 19806 6402 1 12 . 1 1 23 23 SER HA H 23 4.764 4.764 4.957 -0.193 19806 6403 1 12 . 1 1 23 23 SER CA C 23 55.669 55.669 58.188 -2.519 19806 6404 1 12 . 1 1 23 23 SER CB C 23 64.011 64.011 64.516 -0.505 19806 6405 1 12 . 1 1 24 24 ALA N N 24 133.370 133.370 131.070 2.300 19806 6406 1 12 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.113 -0.157 19806 6407 1 12 . 1 1 24 24 ALA CA C 24 55.106 55.106 55.401 -0.295 19806 6408 1 12 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.313 0.522 19806 6409 1 12 . 1 1 25 25 ALA N N 25 117.430 117.430 119.921 -2.491 19806 6410 1 12 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.267 0.050 19806 6411 1 12 . 1 1 25 25 ALA CA C 25 55.201 55.201 53.933 1.268 19806 6412 1 12 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.105 0.244 19806 6413 1 12 . 1 1 26 26 PHE N N 26 116.042 116.042 118.047 -2.005 19806 6414 1 12 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.227 0.083 19806 6415 1 12 . 1 1 26 26 PHE CA C 26 60.759 60.759 61.341 -0.582 19806 6416 1 12 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.484 -0.174 19806 6417 1 12 . 1 1 27 27 GLN N N 27 121.820 121.820 119.522 2.298 19806 6418 1 12 . 1 1 27 27 GLN HA H 27 3.391 3.391 4.056 -0.665 19806 6419 1 12 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.313 0.781 19806 6420 1 12 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.402 -0.945 19806 6421 1 12 . 1 1 28 28 TYR N N 28 111.517 111.517 116.579 -5.062 19806 6422 1 12 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.557 0.573 19806 6423 1 12 . 1 1 28 28 TYR CA C 28 62.357 62.357 60.256 2.101 19806 6424 1 12 . 1 1 28 28 TYR CB C 28 38.568 38.568 38.189 0.379 19806 6425 1 12 . 1 1 29 29 THR N N 29 106.324 106.324 111.780 -5.456 19806 6426 1 12 . 1 1 29 29 THR HA H 29 4.489 4.489 4.220 0.269 19806 6427 1 12 . 1 1 29 29 THR CA C 29 63.765 63.765 61.597 2.168 19806 6428 1 12 . 1 1 29 29 THR CB C 29 69.568 69.568 67.657 1.911 19806 6429 1 12 . 1 1 30 30 ARG N N 30 117.696 117.696 120.771 -3.075 19806 6430 1 12 . 1 1 30 30 ARG HA H 30 4.701 4.701 4.249 0.452 19806 6431 1 12 . 1 1 30 30 ARG CA C 30 52.760 52.760 55.589 -2.829 19806 6432 1 12 . 1 1 30 30 ARG CB C 30 35.047 35.047 31.868 3.179 19806 6433 1 12 . 1 1 31 31 VAL N N 31 119.395 119.395 120.116 -0.721 19806 6434 1 12 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.436 -0.206 19806 6435 1 12 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.979 0.212 19806 6436 1 12 . 1 1 31 31 VAL CB C 31 32.173 32.173 33.839 -1.666 19806 6437 1 12 . 1 1 32 32 LYS N N 32 126.124 126.124 126.444 -0.320 19806 6438 1 12 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.462 -0.278 19806 6439 1 12 . 1 1 32 32 LYS CA C 32 53.958 53.958 56.700 -2.742 19806 6440 1 12 . 1 1 32 32 LYS CB C 32 31.112 31.112 33.660 -2.548 19806 6441 1 12 . 1 1 33 33 PHE N N 33 119.303 119.303 118.991 0.312 19806 6442 1 12 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.846 -0.332 19806 6443 1 12 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.340 0.932 19806 6444 1 12 . 1 1 33 33 PHE CB C 33 40.378 40.378 41.027 -0.649 19806 6445 1 12 . 1 1 34 34 PRO HA H 34 4.968 4.968 2.652 2.316 19806 6446 1 12 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.015 -0.382 19806 6447 1 12 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.116 1.616 19806 6448 1 12 . 1 1 35 35 LEU N N 35 120.016 120.016 117.819 2.197 19806 6449 1 12 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.573 -0.351 19806 6450 1 12 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.609 1.231 19806 6451 1 12 . 1 1 35 35 LEU CB C 35 41.244 41.244 43.435 -2.192 19806 6452 1 12 . 1 1 36 36 LYS N N 36 117.066 117.066 119.866 -2.800 19806 6453 1 12 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.220 -0.245 19806 6454 1 12 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.918 2.329 19806 6455 1 12 . 1 1 36 36 LYS CB C 36 32.832 32.832 32.929 -0.097 19806 6456 1 12 . 1 1 37 37 THR N N 37 117.574 117.574 117.737 -0.163 19806 6457 1 12 . 1 1 37 37 THR HA H 37 4.797 4.797 4.724 0.073 19806 6458 1 12 . 1 1 37 37 THR CA C 37 60.396 60.396 58.483 1.913 19806 6459 1 12 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.517 0.502 19806 6460 1 12 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.383 -0.460 19806 6461 1 12 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.704 -0.073 19806 6462 1 12 . 1 1 39 39 ILE N N 39 119.949 119.949 120.017 -0.068 19806 6463 1 12 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.400 -0.161 19806 6464 1 12 . 1 1 39 39 ILE CA C 39 62.133 62.133 62.859 -0.726 19806 6465 1 12 . 1 1 40 40 THR N N 40 123.962 123.962 125.144 -1.182 19806 6466 1 12 . 1 1 40 40 THR HA H 40 5.057 5.057 5.102 -0.045 19806 6467 1 12 . 1 1 40 40 THR CA C 40 62.262 62.262 61.757 0.506 19806 6468 1 12 . 1 1 40 40 THR CB C 40 69.891 69.891 69.894 -0.003 19806 6469 1 12 . 1 1 41 41 LEU N N 41 125.633 125.633 127.629 -1.996 19806 6470 1 12 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.880 0.222 19806 6471 1 12 . 1 1 41 41 LEU CA C 41 52.638 52.638 53.646 -1.008 19806 6472 1 12 . 1 1 41 41 LEU CB C 41 45.180 45.180 44.297 0.883 19806 6473 1 12 . 1 1 42 42 LEU N N 42 120.788 120.788 126.178 -5.390 19806 6474 1 12 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.654 0.094 19806 6475 1 12 . 1 1 42 42 LEU CA C 42 53.724 53.724 53.041 0.683 19806 6476 1 12 . 1 1 42 42 LEU CB C 42 44.384 44.384 39.429 4.955 19806 6477 1 12 . 1 1 43 43 ALA N N 43 123.073 123.073 124.401 -1.328 19806 6478 1 12 . 1 1 43 43 ALA HA H 43 4.430 4.430 3.999 0.431 19806 6479 1 12 . 1 1 43 43 ALA CA C 43 51.288 51.288 53.574 -2.286 19806 6480 1 12 . 1 1 43 43 ALA CB C 43 20.014 20.014 18.042 1.972 19806 6481 1 12 . 1 1 44 44 ASP N N 44 118.196 118.196 119.327 -1.131 19806 6482 1 12 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.664 -0.238 19806 6483 1 12 . 1 1 44 44 ASP CA C 44 56.028 56.028 55.582 0.446 19806 6484 1 12 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.378 -0.168 19806 6485 1 12 . 1 1 45 45 ASP N N 45 115.018 115.018 118.051 -3.033 19806 6486 1 12 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.917 -0.448 19806 6487 1 12 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.677 -0.883 19806 6488 1 12 . 1 1 45 45 ASP CB C 45 39.864 39.864 43.945 -4.081 19806 6489 1 12 . 1 1 46 46 GLY N N 46 107.499 107.499 106.218 1.281 19806 6490 1 12 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.372 0.542 19806 6491 1 12 . 1 1 47 47 GLU N N 47 117.331 117.331 118.840 -1.509 19806 6492 1 12 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.683 -0.152 19806 6493 1 12 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.462 0.476 19806 6494 1 12 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.636 2.497 19806 6495 1 12 . 1 1 48 48 THR N N 48 118.462 118.462 114.918 3.544 19806 6496 1 12 . 1 1 48 48 THR HA H 48 4.243 4.243 4.485 -0.242 19806 6497 1 12 . 1 1 48 48 THR CA C 48 62.834 62.834 61.941 0.893 19806 6498 1 12 . 1 1 48 48 THR CB C 48 68.649 68.649 70.799 -2.150 19806 6499 1 12 . 1 1 49 49 GLU N N 49 123.834 123.834 125.589 -1.755 19806 6500 1 12 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.250 0.695 19806 6501 1 12 . 1 1 49 49 GLU CA C 49 55.358 55.358 56.699 -1.341 19806 6502 1 12 . 1 1 49 49 GLU CB C 49 31.395 31.395 29.396 1.999 19806 6503 1 12 . 1 1 50 50 LYS N N 50 122.868 122.868 127.851 -4.983 19806 6504 1 12 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.663 -0.022 19806 6505 1 12 . 1 1 50 50 LYS CA C 50 54.111 54.111 55.109 -0.998 19806 6506 1 12 . 1 1 50 50 LYS CB C 50 35.312 35.312 33.938 1.374 19806 6507 1 12 . 1 1 51 51 THR N N 51 111.386 111.386 115.992 -4.606 19806 6508 1 12 . 1 1 51 51 THR HA H 51 5.619 5.619 5.446 0.173 19806 6509 1 12 . 1 1 51 51 THR CA C 51 58.980 58.980 61.021 -2.041 19806 6510 1 12 . 1 1 51 51 THR CB C 51 71.277 71.277 69.996 1.281 19806 6511 1 12 . 1 1 52 52 PHE N N 52 120.631 120.631 119.157 1.474 19806 6512 1 12 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.944 0.019 19806 6513 1 12 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.751 -1.622 19806 6514 1 12 . 1 1 52 52 PHE CB C 52 41.049 41.049 42.014 -0.966 19806 6515 1 12 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.592 -0.144 19806 6516 1 12 . 1 1 53 53 PRO CA C 53 62.489 62.489 62.933 -0.444 19806 6517 1 12 . 1 1 53 53 PRO CB C 53 32.240 32.240 32.298 -0.058 19806 6518 1 12 . 1 1 54 54 PHE N N 54 128.034 128.034 123.623 4.411 19806 6519 1 12 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.782 0.046 19806 6520 1 12 . 1 1 54 54 PHE CA C 54 55.509 55.509 57.158 -1.649 19806 6521 1 12 . 1 1 54 54 PHE CB C 54 37.028 37.028 40.739 -3.711 19806 6522 1 12 . 1 1 55 55 THR N N 55 111.757 111.757 117.004 -5.247 19806 6523 1 12 . 1 1 55 55 THR HA H 55 4.413 4.413 4.535 -0.122 19806 6524 1 12 . 1 1 55 55 THR CA C 55 60.578 60.578 59.449 1.129 19806 6525 1 12 . 1 1 55 55 THR CB C 55 69.447 69.447 71.627 -2.180 19806 6526 1 12 . 1 1 56 56 LYS N N 56 118.734 118.734 121.065 -2.331 19806 6527 1 12 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.032 -1.550 19806 6528 1 12 . 1 1 56 56 LYS CA C 56 59.381 59.381 58.970 0.411 19806 6529 1 12 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.875 1.375 19806 6530 1 12 . 1 1 57 57 GLU N N 57 119.675 119.675 118.163 1.512 19806 6531 1 12 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.101 0.168 19806 6532 1 12 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.736 -1.583 19806 6533 1 12 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.395 -2.445 19806 6534 1 12 . 1 1 58 58 LYS N N 58 114.700 114.700 119.504 -4.804 19806 6535 1 12 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.236 0.076 19806 6536 1 12 . 1 1 58 58 LYS CA C 58 55.595 55.595 55.815 -0.220 19806 6537 1 12 . 1 1 58 58 LYS CB C 58 32.011 32.011 30.801 1.210 19806 6538 1 12 . 1 1 59 59 TRP N N 59 118.204 118.204 124.019 -5.815 19806 6539 1 12 . 1 1 59 59 TRP HA H 59 5.099 5.099 4.956 0.143 19806 6540 1 12 . 1 1 59 59 TRP CA C 59 55.577 55.577 54.398 1.179 19806 6541 1 12 . 1 1 59 59 TRP CB C 59 32.037 32.037 30.623 1.414 19806 6542 1 12 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.587 -0.324 19806 6543 1 12 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.372 -2.651 19806 6544 1 12 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.340 -2.491 19806 6545 1 12 . 1 1 61 61 LEU N N 61 123.758 123.758 125.133 -1.375 19806 6546 1 12 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.355 -0.716 19806 6547 1 12 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.313 0.562 19806 6548 1 12 . 1 1 61 61 LEU CB C 61 40.815 40.815 40.913 -0.097 19806 6549 1 12 . 1 1 62 62 LEU N N 62 124.052 124.052 126.597 -2.545 19806 6550 1 12 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.233 0.122 19806 6551 1 12 . 1 1 62 62 LEU CA C 62 53.992 53.992 55.289 -1.297 19806 6552 1 12 . 1 1 62 62 LEU CB C 62 44.686 44.686 43.361 1.325 19806 6553 1 12 . 1 1 63 63 ASP N N 63 117.271 117.271 115.653 1.618 19806 6554 1 12 . 1 1 63 63 ASP HA H 63 5.033 5.033 4.766 0.267 19806 6555 1 12 . 1 1 63 63 ASP CA C 63 51.101 51.101 52.369 -1.268 19806 6556 1 12 . 1 1 63 63 ASP CB C 63 43.345 43.345 43.172 0.173 19806 6557 1 12 . 1 1 64 64 SER N N 64 112.856 112.856 114.927 -2.071 19806 6558 1 12 . 1 1 64 64 SER HA H 64 3.865 3.865 4.243 -0.378 19806 6559 1 12 . 1 1 64 64 SER CA C 64 60.910 60.910 61.702 -0.792 19806 6560 1 12 . 1 1 64 64 SER CB C 64 62.378 62.378 63.207 -0.829 19806 6561 1 12 . 1 1 65 65 GLU N N 65 120.070 120.070 119.584 0.486 19806 6562 1 12 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.487 -0.469 19806 6563 1 12 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.419 -0.076 19806 6564 1 12 . 1 1 65 65 GLU CB C 65 28.887 28.887 30.288 -1.401 19806 6565 1 12 . 1 1 66 66 THR N N 66 115.852 115.852 115.476 0.376 19806 6566 1 12 . 1 1 66 66 THR HA H 66 3.991 3.991 4.268 -0.277 19806 6567 1 12 . 1 1 66 66 THR CA C 66 65.804 65.804 64.681 1.123 19806 6568 1 12 . 1 1 66 66 THR CB C 66 68.451 68.451 69.061 -0.610 19806 6569 1 12 . 1 1 67 67 MET N N 67 113.585 113.585 118.578 -4.993 19806 6570 1 12 . 1 1 67 67 MET HA H 67 4.267 4.267 4.425 -0.158 19806 6571 1 12 . 1 1 67 67 MET CA C 67 52.135 52.135 54.306 -2.171 19806 6572 1 12 . 1 1 67 67 MET CB C 67 28.963 28.963 32.077 -3.114 19806 6573 1 12 . 1 1 68 68 LYS N N 68 118.462 118.462 120.305 -1.843 19806 6574 1 12 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.408 -0.038 19806 6575 1 12 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.750 -0.268 19806 6576 1 12 . 1 1 68 68 LYS CB C 68 34.179 34.179 33.148 1.031 19806 6577 1 12 . 1 1 69 69 GLU N N 69 121.700 121.700 122.807 -1.107 19806 6578 1 12 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.839 -0.315 19806 6579 1 12 . 1 1 69 69 GLU CA C 69 55.942 55.942 56.057 -0.115 19806 6580 1 12 . 1 1 69 69 GLU CB C 69 30.424 30.424 30.661 -0.237 19806 6581 1 12 . 1 1 70 70 GLU N N 70 123.445 123.445 125.514 -2.069 19806 6582 1 12 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.710 -0.013 19806 6583 1 12 . 1 1 70 70 GLU CA C 70 55.473 55.473 54.826 0.647 19806 6584 1 12 . 1 1 70 70 GLU CB C 70 33.162 33.162 33.175 -0.013 19806 6585 1 12 . 1 1 71 71 ARG N N 71 122.150 122.150 121.243 0.907 19806 6586 1 12 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.908 0.243 19806 6587 1 12 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.513 -0.065 19806 6588 1 12 . 1 1 71 71 ARG CB C 71 31.703 31.703 32.204 -0.501 19806 6589 1 12 . 1 1 72 72 ILE N N 72 125.686 125.686 129.720 -4.034 19806 6590 1 12 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.422 0.174 19806 6591 1 12 . 1 1 72 72 ILE CA C 72 59.512 59.512 59.619 -0.107 19806 6592 1 12 . 1 1 72 72 ILE CB C 72 41.095 41.095 38.299 2.796 19806 6593 1 12 . 1 1 73 73 THR N N 73 121.600 121.600 123.854 -2.254 19806 6594 1 12 . 1 1 73 73 THR HA H 73 4.603 4.603 4.243 0.360 19806 6595 1 12 . 1 1 73 73 THR CA C 73 61.937 61.937 63.578 -1.641 19806 6596 1 12 . 1 1 73 73 THR CB C 73 68.669 68.669 68.751 -0.082 19806 6597 1 12 . 1 1 74 74 GLN N N 74 124.607 124.607 126.227 -1.620 19806 6598 1 12 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.641 -0.060 19806 6599 1 12 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.124 0.565 19806 6600 1 12 . 1 1 74 74 GLN CB C 74 29.490 29.490 31.716 -2.226 19806 6601 1 12 . 1 1 75 75 GLU N N 75 122.962 122.962 118.197 4.765 19806 6602 1 12 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.427 -0.368 19806 6603 1 12 . 1 1 75 75 GLU CA C 75 58.845 58.845 56.880 1.964 19806 6604 1 12 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.256 -0.683 19806 6605 1 12 . 1 1 76 76 GLU N N 76 115.466 115.466 120.054 -4.588 19806 6606 1 12 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.224 0.084 19806 6607 1 12 . 1 1 76 76 GLU CA C 76 56.777 56.777 57.678 -0.901 19806 6608 1 12 . 1 1 76 76 GLU CB C 76 29.072 29.072 29.735 -0.663 19806 6609 1 12 . 1 1 77 77 GLY N N 77 106.771 106.771 106.229 0.542 19806 6610 1 12 . 1 1 77 77 GLY CA C 77 45.014 45.014 44.514 0.499 19806 6611 1 12 . 1 1 78 78 GLY N N 78 108.535 108.535 107.606 0.929 19806 6612 1 12 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.449 0.258 19806 6613 1 12 . 1 1 79 79 ILE N N 79 121.066 121.066 121.811 -0.745 19806 6614 1 12 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.545 0.262 19806 6615 1 12 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.534 -1.191 19806 6616 1 12 . 1 1 79 79 ILE CB C 79 39.220 39.220 37.665 1.555 19806 6617 1 12 . 1 1 80 80 TYR N N 80 130.709 130.709 129.740 0.969 19806 6618 1 12 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.376 -0.112 19806 6619 1 12 . 1 1 80 80 TYR CA C 80 58.161 58.161 59.024 -0.863 19806 6620 1 12 . 1 1 80 80 TYR CB C 80 40.621 40.621 39.297 1.324 19806 6621 1 12 . 1 1 81 81 VAL N N 81 126.965 126.965 125.180 1.785 19806 6622 1 12 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.646 0.208 19806 6623 1 12 . 1 1 81 81 VAL CA C 81 60.457 60.457 60.419 0.038 19806 6624 1 12 . 1 1 81 81 VAL CB C 81 35.004 35.004 36.480 -1.476 19806 6625 1 12 . 1 1 82 82 SER N N 82 120.914 120.914 117.113 3.801 19806 6626 1 12 . 1 1 82 82 SER HA H 82 5.185 5.185 5.228 -0.043 19806 6627 1 12 . 1 1 82 82 SER CA C 82 55.260 55.260 57.175 -1.915 19806 6628 1 12 . 1 1 82 82 SER CB C 82 64.785 64.785 64.122 0.663 19806 6629 1 12 . 1 1 83 83 LYS N N 83 119.415 119.415 122.082 -2.667 19806 6630 1 12 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.924 -0.146 19806 6631 1 12 . 1 1 83 83 LYS CA C 83 54.759 54.759 55.117 -0.359 19806 6632 1 12 . 1 1 83 83 LYS CB C 83 35.514 35.514 34.948 0.566 19806 6633 1 12 . 1 1 84 84 PHE N N 84 119.220 119.220 118.485 0.735 19806 6634 1 12 . 1 1 84 84 PHE HA H 84 5.441 5.441 5.228 0.213 19806 6635 1 12 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.413 1.001 19806 6636 1 12 . 1 1 84 84 PHE CB C 84 37.523 37.523 37.934 -0.411 19806 6637 1 12 . 1 1 85 85 THR N N 85 119.257 119.257 115.956 3.301 19806 6638 1 12 . 1 1 85 85 THR HA H 85 4.057 4.057 4.129 -0.072 19806 6639 1 12 . 1 1 85 85 THR CA C 85 62.660 62.660 62.572 0.088 19806 6640 1 12 . 1 1 85 85 THR CB C 85 67.698 67.698 69.234 -1.536 19806 6641 1 12 . 1 1 86 86 LEU N N 86 121.612 121.612 121.140 0.472 19806 6642 1 12 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.588 0.010 19806 6643 1 12 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.764 0.481 19806 6644 1 12 . 1 1 86 86 LEU CB C 86 44.657 44.657 45.031 -0.374 19806 6645 1 12 . 1 1 87 87 ASN N N 87 127.684 127.684 120.323 7.361 19806 6646 1 12 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.848 0.163 19806 6647 1 12 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.574 -1.275 19806 6648 1 12 . 1 1 87 87 ASN CB C 87 38.595 38.595 39.005 -0.410 19806 6649 1 12 . 1 1 88 88 GLU N N 88 120.509 120.509 121.440 -0.931 19806 6650 1 12 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.458 0.399 19806 6651 1 12 . 1 1 88 88 GLU CA C 88 54.382 54.382 55.437 -1.055 19806 6652 1 12 . 1 1 88 88 GLU CB C 88 29.808 29.808 30.190 -0.382 19806 6653 1 12 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.553 -0.172 19806 6654 1 12 . 1 1 89 89 PRO CA C 89 65.898 65.898 64.938 0.960 19806 6655 1 12 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.297 0.054 19806 6656 1 12 . 1 1 90 90 LYS N N 90 107.288 107.288 115.171 -7.883 19806 6657 1 12 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.520 0.164 19806 6658 1 12 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.447 -0.468 19806 6659 1 12 . 1 1 90 90 LYS CB C 90 32.994 32.994 32.996 -0.002 19806 6660 1 12 . 1 1 91 91 HIS N N 91 119.523 119.523 118.389 1.134 19806 6661 1 12 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.477 0.300 19806 6662 1 12 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.614 -0.909 19806 6663 1 12 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.183 0.011 19806 6664 1 12 . 1 1 92 92 LYS N N 92 122.527 122.527 125.230 -2.703 19806 6665 1 12 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.792 0.337 19806 6666 1 12 . 1 1 92 92 LYS CA C 92 54.291 54.291 54.934 -0.643 19806 6667 1 12 . 1 1 92 92 LYS CB C 92 37.479 37.479 37.008 0.471 19806 6668 1 12 . 1 1 93 93 ILE N N 93 121.564 121.564 121.810 -0.246 19806 6669 1 12 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.713 0.597 19806 6670 1 12 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.539 0.598 19806 6671 1 12 . 1 1 93 93 ILE CB C 93 41.088 41.088 41.953 -0.864 19806 6672 1 12 . 1 1 94 94 PHE N N 94 128.955 128.955 126.908 2.047 19806 6673 1 12 . 1 1 94 94 PHE HA H 94 4.900 4.900 5.202 -0.302 19806 6674 1 12 . 1 1 94 94 PHE CA C 94 55.843 55.843 55.308 0.535 19806 6675 1 12 . 1 1 95 95 GLU N N 95 124.809 124.809 128.108 -3.299 19806 6676 1 12 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.291 0.127 19806 6677 1 12 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.357 1.124 19806 6678 1 12 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.925 1.235 19806 6679 1 12 . 1 1 96 96 ALA N N 96 123.759 123.759 126.829 -3.070 19806 6680 1 12 . 1 1 96 96 ALA HA H 96 5.379 5.379 4.944 0.435 19806 6681 1 12 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.615 -1.074 19806 6682 1 12 . 1 1 96 96 ALA CB C 96 23.830 23.830 20.498 3.332 19806 6683 1 12 . 1 1 97 97 GLY N N 97 106.592 106.592 110.309 -3.717 19806 6684 1 12 . 1 1 97 97 GLY CA C 97 45.435 45.435 44.969 0.466 19806 6685 1 12 . 1 1 98 98 TYR N N 98 119.250 119.250 119.338 -0.088 19806 6686 1 12 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.711 0.107 19806 6687 1 12 . 1 1 98 98 TYR CA C 98 59.387 59.387 58.747 0.640 19806 6688 1 12 . 1 1 98 98 TYR CB C 98 38.122 38.122 38.945 -0.823 19806 6689 1 12 . 1 1 99 99 GLU N N 99 123.080 123.080 122.587 0.493 19806 6690 1 12 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.142 -0.133 19806 6691 1 12 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.227 0.182 19806 6692 1 12 . 1 1 99 99 GLU CB C 99 30.254 30.254 30.011 0.243 19806 6693 1 12 . 1 1 100 100 GLU N N 100 116.459 116.459 116.366 0.093 19806 6694 1 12 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.529 -0.493 19806 6695 1 12 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.043 1.361 19806 6696 1 12 . 1 1 100 100 GLU CB C 100 27.576 27.576 28.806 -1.230 19806 6697 1 12 . 1 1 101 101 SER N N 101 113.069 113.069 115.881 -2.812 19806 6698 1 12 . 1 1 101 101 SER HA H 101 4.839 4.839 4.702 0.137 19806 6699 1 12 . 1 1 101 101 SER CA C 101 56.024 56.024 57.683 -1.659 19806 6700 1 12 . 1 1 101 101 SER CB C 101 64.806 64.806 64.756 0.050 19806 6701 1 12 . 1 1 102 102 GLU N N 102 120.439 120.439 121.745 -1.306 19806 6702 1 12 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.742 -0.353 19806 6703 1 12 . 1 1 102 102 GLU CA C 102 55.804 55.804 55.414 0.390 19806 6704 1 12 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.666 -0.681 19806 6705 1 12 . 1 1 103 103 VAL N N 103 118.899 118.899 118.756 0.143 19806 6706 1 12 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.066 0.020 19806 6707 1 12 . 1 1 103 103 VAL CA C 103 62.699 62.699 62.182 0.517 19806 6708 1 12 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.719 -0.458 19806 6709 1 12 . 1 1 104 104 ASP N N 104 120.965 120.965 119.287 1.678 19806 6710 1 12 . 1 1 104 104 ASP HA H 104 5.003 5.003 4.899 0.104 19806 6711 1 12 . 1 1 104 104 ASP CA C 104 54.914 54.914 55.237 -0.323 19806 6712 1 12 . 1 1 104 104 ASP CB C 104 42.791 42.791 44.236 -1.445 19806 6713 1 12 . 1 1 105 105 LEU N N 105 120.365 120.365 120.362 0.003 19806 6714 1 12 . 1 1 105 105 LEU HA H 105 5.295 5.295 4.848 0.447 19806 6715 1 12 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.402 0.029 19806 6716 1 12 . 1 1 105 105 LEU CB C 105 46.001 46.001 43.910 2.091 19806 6717 1 12 . 1 1 106 106 ARG N N 106 126.289 126.289 126.259 0.030 19806 6718 1 12 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.076 0.749 19806 6719 1 12 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.138 0.534 19806 6720 1 12 . 1 1 106 106 ARG CB C 106 33.920 33.920 31.154 2.766 19806 6721 1 12 . 1 1 107 107 VAL N N 107 126.145 126.145 124.706 1.439 19806 6722 1 12 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.331 0.348 19806 6723 1 12 . 1 1 107 107 VAL CA C 107 61.671 61.671 60.793 0.878 19806 6724 1 12 . 1 1 107 107 VAL CB C 107 35.350 35.350 34.162 1.188 19806 6725 1 12 . 1 1 108 108 GLU N N 108 127.093 127.093 126.132 0.961 19806 6726 1 12 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.949 0.318 19806 6727 1 12 . 1 1 108 108 GLU CA C 108 54.761 54.761 54.578 0.184 19806 6728 1 12 . 1 1 108 108 GLU CB C 108 32.567 32.567 33.579 -1.012 19806 6729 1 12 . 1 1 109 109 PHE N N 109 124.592 124.592 121.411 3.181 19806 6730 1 12 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.088 0.940 19806 6731 1 12 . 1 1 109 109 PHE CA C 109 55.945 55.945 56.623 -0.678 19806 6732 1 12 . 1 1 109 109 PHE CB C 109 43.099 43.099 42.402 0.697 19806 6733 1 12 . 1 1 110 110 GLU N N 110 122.143 122.143 120.740 1.403 19806 6734 1 12 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.628 -0.435 19806 6735 1 12 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.085 1.358 19806 6736 1 12 . 1 1 110 110 GLU CB C 110 35.816 35.816 34.595 1.221 19806 6737 1 12 . 1 1 111 111 LEU N N 111 129.616 129.616 122.148 7.468 19806 6738 1 12 . 1 1 111 111 LEU HA H 111 3.808 3.808 4.161 -0.353 19806 6739 1 12 . 1 1 111 111 LEU CA C 111 53.470 53.470 53.748 -0.278 19806 6740 1 12 . 1 1 111 111 LEU CB C 111 40.400 40.400 42.820 -2.420 19806 6741 1 12 . 1 1 112 112 GLN N N 112 124.742 124.742 125.775 -1.033 19806 6742 1 12 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.313 0.126 19806 6743 1 12 . 1 1 112 112 GLN CA C 112 55.802 55.802 54.143 1.659 19806 6744 1 12 . 1 1 112 112 GLN CB C 112 28.753 28.753 30.044 -1.291 19806 6745 1 12 . 1 1 113 113 ALA N N 113 121.195 121.195 126.127 -4.932 19806 6746 1 12 . 1 1 113 113 ALA HA H 113 4.048 4.048 4.035 0.013 19806 6747 1 12 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.043 0.475 19806 6748 1 12 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.041 0.158 19806 6749 1 12 . 1 1 114 114 ASP N N 114 114.525 114.525 118.562 -4.037 19806 6750 1 12 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.503 -0.103 19806 6751 1 12 . 1 1 114 114 ASP CA C 114 52.908 52.908 53.453 -0.545 19806 6752 1 12 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.713 -1.655 19806 6753 1 12 . 1 1 115 115 GLY N N 115 107.526 107.526 107.470 0.056 19806 6754 1 12 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.547 0.237 19806 6755 1 12 . 1 1 116 116 LYS N N 116 118.818 118.818 118.836 -0.018 19806 6756 1 12 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.767 -0.317 19806 6757 1 12 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.116 0.055 19806 6758 1 12 . 1 1 116 116 LYS CB C 116 35.039 35.039 36.538 -1.499 19806 6759 1 12 . 1 1 117 117 TRP N N 117 118.939 118.939 122.737 -3.798 19806 6760 1 12 . 1 1 117 117 TRP CA C 117 56.956 56.956 56.932 0.024 19806 6761 1 12 . 1 1 118 118 TYR N N 118 112.644 112.644 122.551 -9.907 19806 6762 1 12 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.734 0.543 19806 6763 1 12 . 1 1 118 118 TYR CA C 118 56.219 56.219 55.493 0.726 19806 6764 1 12 . 1 1 118 118 TYR CB C 118 43.282 43.282 39.124 4.158 19806 6765 1 12 . 1 1 119 119 VAL N N 119 119.842 119.842 124.326 -4.484 19806 6766 1 12 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.328 0.187 19806 6767 1 12 . 1 1 119 119 VAL CA C 119 62.442 62.442 63.501 -1.059 19806 6768 1 12 . 1 1 120 120 VAL N N 120 114.552 114.552 120.437 -5.885 19806 6769 1 12 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.433 0.305 19806 6770 1 12 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.884 -1.289 19806 6771 1 12 . 1 1 120 120 VAL CB C 120 32.852 32.852 31.931 0.921 19806 6772 1 12 . 1 1 121 121 ASP N N 121 118.234 118.234 119.389 -1.155 19806 6773 1 12 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.744 0.519 19806 6774 1 12 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.870 -0.207 19806 6775 1 12 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.073 -0.186 19806 6776 1 12 . 1 1 122 122 CYS N N 122 121.036 121.036 123.612 -2.576 19806 6777 1 12 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.717 0.854 19806 6778 1 12 . 1 1 122 122 CYS CA C 122 57.052 57.052 58.417 -1.365 19806 6779 1 12 . 1 1 122 122 CYS CB C 122 30.834 30.834 27.636 3.198 19806 6780 1 12 . 1 1 123 123 TYR N N 123 127.672 127.672 128.158 -0.486 19806 6781 1 12 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.818 0.192 19806 6782 1 12 . 1 1 123 123 TYR CA C 123 57.169 57.169 58.180 -1.011 19806 6783 1 12 . 1 1 123 123 TYR CB C 123 41.408 41.408 42.774 -1.366 19806 6784 1 12 . 1 1 124 124 THR N N 124 120.833 120.833 121.481 -0.648 19806 6785 1 12 . 1 1 124 124 THR HA H 124 4.987 4.987 4.450 0.537 19806 6786 1 12 . 1 1 124 124 THR CA C 124 57.153 57.153 61.459 -4.306 19806 6787 1 12 . 1 1 124 124 THR CB C 124 68.607 68.607 69.080 -0.473 19806 6788 1 12 . 1 1 125 125 GLY N N 125 114.347 114.347 109.887 4.460 19806 6789 1 12 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.290 0.038 19806 6790 1 12 . 1 1 126 126 TRP N N 126 119.918 119.918 122.444 -2.526 19806 6791 1 12 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.048 0.022 19806 6792 1 12 . 1 1 126 126 TRP CA C 126 60.564 60.564 59.155 1.409 19806 6793 1 12 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.265 0.374 19806 6794 1 12 . 1 1 127 127 TYR N N 127 113.911 113.911 113.233 0.678 19806 6795 1 12 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.782 0.212 19806 6796 1 12 . 1 1 127 127 TYR CA C 127 53.384 53.384 57.584 -4.200 19806 6797 1 12 . 1 1 127 127 TYR CB C 127 38.584 38.584 38.520 0.064 19806 6798 1 12 . 1 1 128 128 GLY N N 128 105.181 105.181 107.790 -2.609 19806 6799 1 12 . 1 1 128 128 GLY CA C 128 45.189 45.189 44.107 1.082 19806 6800 1 12 . 1 1 129 129 TYR N N 129 116.588 116.588 116.728 -0.140 19806 6801 1 12 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.724 -0.060 19806 6802 1 12 . 1 1 129 129 TYR CA C 129 59.565 59.565 57.224 2.341 19806 6803 1 12 . 1 1 129 129 TYR CB C 129 38.853 38.853 37.483 1.370 19806 6804 1 12 . 1 1 130 130 ASP N N 130 115.195 115.195 119.443 -4.248 19806 6805 1 12 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.727 -0.342 19806 6806 1 12 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.982 -1.852 19806 6807 1 12 . 1 1 130 130 ASP CB C 130 38.685 38.685 41.301 -2.616 19806 6808 1 12 . 1 1 131 131 LEU N N 131 124.887 124.887 120.351 4.536 19806 6809 1 12 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.867 -0.386 19806 6810 1 12 . 1 1 131 131 LEU CA C 131 53.605 53.605 51.921 1.684 19806 6811 1 12 . 1 1 131 131 LEU CB C 131 42.441 42.441 45.593 -3.152 19806 6812 1 12 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.924 -0.241 19806 6813 1 12 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.813 65.251 19806 6814 1 12 . 1 1 132 132 PRO CB C 132 32.327 32.327 32.892 -0.566 19806 6815 1 12 . 1 1 133 133 ILE N N 133 123.765 123.765 119.974 3.791 19806 6816 1 12 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.844 -0.115 19806 6817 1 12 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.079 1.781 19806 6818 1 12 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.100 -0.037 19806 6819 1 12 . 1 1 134 134 GLY N N 134 107.030 107.030 105.184 1.846 19806 6820 1 12 . 1 1 134 134 GLY CA C 134 45.976 45.976 44.816 1.160 19806 6821 1 12 . 1 1 135 135 GLU N N 135 116.566 116.566 120.299 -3.733 19806 6822 1 12 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.564 0.100 19806 6823 1 12 . 1 1 135 135 GLU CA C 135 55.414 55.414 56.341 -0.927 19806 6824 1 12 . 1 1 135 135 GLU CB C 135 30.195 30.195 30.298 -0.103 19806 6825 1 12 . 1 1 136 136 LEU N N 136 124.239 124.239 121.444 2.795 19806 6826 1 12 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.849 0.195 19806 6827 1 12 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.785 0.331 19806 6828 1 12 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.519 -0.512 19806 6829 1 12 . 1 1 137 137 LYS N N 137 117.225 117.225 115.810 1.415 19806 6830 1 12 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.746 0.117 19806 6831 1 12 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.178 1.277 19806 6832 1 12 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.116 0.087 19806 6833 1 12 . 1 1 138 138 GLN N N 138 118.718 118.718 119.728 -1.010 19806 6834 1 12 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.035 0.017 19806 6835 1 12 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.920 -1.045 19806 6836 1 12 . 1 1 138 138 GLN CB C 138 28.235 28.235 28.335 -0.100 19806 6837 1 12 . 1 1 139 139 THR N N 139 117.970 117.970 116.861 1.109 19806 6838 1 12 . 1 1 139 139 THR HA H 139 4.532 4.532 3.775 0.757 19806 6839 1 12 . 1 1 139 139 THR CA C 139 68.145 68.145 67.258 0.887 19806 6840 1 12 . 1 1 139 139 THR CB C 139 68.103 68.103 68.214 -0.111 19806 6841 1 12 . 1 1 140 140 ILE N N 140 120.391 120.391 120.146 0.245 19806 6842 1 12 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.684 0.043 19806 6843 1 12 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.850 0.406 19806 6844 1 12 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.168 0.945 19806 6845 1 12 . 1 1 141 141 GLN N N 141 118.917 118.917 118.616 0.301 19806 6846 1 12 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.957 0.058 19806 6847 1 12 . 1 1 141 141 GLN CA C 141 58.371 58.371 58.843 -0.472 19806 6848 1 12 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.322 -0.975 19806 6849 1 12 . 1 1 142 142 ASN N N 142 119.936 119.936 118.655 1.281 19806 6850 1 12 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.623 -0.108 19806 6851 1 12 . 1 1 142 142 ASN CA C 142 55.799 55.799 56.151 -0.352 19806 6852 1 12 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.465 -0.835 19806 6853 1 12 . 1 1 143 143 VAL N N 143 123.195 123.195 119.279 3.916 19806 6854 1 12 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.493 -0.777 19806 6855 1 12 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.457 0.040 19806 6856 1 12 . 1 1 143 143 VAL CB C 143 30.989 30.989 31.202 -0.213 19806 6857 1 12 . 1 1 144 144 LYS N N 144 120.348 120.348 118.956 1.392 19806 6858 1 12 . 1 1 144 144 LYS HA H 144 3.881 3.881 4.039 -0.158 19806 6859 1 12 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.865 0.258 19806 6860 1 12 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.111 -0.229 19806 6861 1 12 . 1 1 145 145 GLU N N 145 119.220 119.220 119.872 -0.652 19806 6862 1 12 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.043 0.140 19806 6863 1 12 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.307 -0.129 19806 6864 1 12 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.376 -0.305 19806 6865 1 12 . 1 1 146 146 GLU N N 146 121.420 121.420 119.467 1.953 19806 6866 1 12 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.104 0.173 19806 6867 1 12 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.303 -0.185 19806 6868 1 12 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.672 -1.330 19806 6869 1 12 . 1 1 147 147 ASN N N 147 119.197 119.197 118.402 0.795 19806 6870 1 12 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.557 0.011 19806 6871 1 12 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.968 -1.817 19806 6872 1 12 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.942 -0.569 19806 6873 1 12 . 1 1 148 148 ALA N N 148 123.672 123.672 121.464 2.208 19806 6874 1 12 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.279 -0.156 19806 6875 1 12 . 1 1 148 148 ALA CA C 148 55.133 55.133 54.486 0.647 19806 6876 1 12 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.279 -0.672 19806 6877 1 12 . 1 1 149 149 ALA N N 149 119.979 119.979 120.973 -0.994 19806 6878 1 12 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.199 0.062 19806 6879 1 12 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.325 0.320 19806 6880 1 12 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.772 -1.034 19806 6881 1 12 . 1 1 150 150 PHE N N 150 119.592 119.592 120.976 -1.384 19806 6882 1 12 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.161 0.063 19806 6883 1 12 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.542 -0.534 19806 6884 1 12 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.432 -0.370 19806 6885 1 12 . 1 1 151 151 LYS N N 151 116.869 116.869 118.046 -1.177 19806 6886 1 12 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.117 -0.211 19806 6887 1 12 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.662 0.108 19806 6888 1 12 . 1 1 151 151 LYS CB C 151 32.741 32.741 31.948 0.793 19806 6889 1 12 . 1 1 152 152 GLU N N 152 115.868 115.868 119.253 -3.385 19806 6890 1 12 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.163 -0.110 19806 6891 1 12 . 1 1 152 152 GLU CA C 152 58.656 58.656 57.933 0.723 19806 6892 1 12 . 1 1 152 152 GLU CB C 152 29.753 29.753 29.870 -0.117 19806 6893 1 12 . 1 1 153 153 ILE N N 153 110.437 110.437 117.962 -7.525 19806 6894 1 12 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.905 0.271 19806 6895 1 12 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.239 -1.204 19806 6896 1 12 . 1 1 153 153 ILE CB C 153 39.272 39.272 39.968 -0.696 19806 6897 1 12 . 1 1 154 154 HIS N N 154 117.779 117.779 117.070 0.709 19806 6898 1 12 . 1 1 154 154 HIS HA H 154 5.174 5.174 4.921 0.253 19806 6899 1 12 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.693 -1.077 19806 6900 1 12 . 1 1 154 154 HIS CB C 154 28.547 28.547 29.749 -1.202 19806 6901 1 13 . 1 1 3 3 SER N N 3 114.847 114.847 114.866 -0.019 19806 6902 1 13 . 1 1 3 3 SER HA H 3 4.463 4.463 4.569 -0.106 19806 6903 1 13 . 1 1 3 3 SER CA C 3 58.340 58.340 58.370 -0.030 19806 6904 1 13 . 1 1 3 3 SER CB C 3 63.457 63.457 64.381 -0.924 19806 6905 1 13 . 1 1 4 4 GLU N N 4 121.498 121.498 121.649 -0.151 19806 6906 1 13 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.787 -0.455 19806 6907 1 13 . 1 1 4 4 GLU CA C 4 56.443 56.443 56.235 0.208 19806 6908 1 13 . 1 1 4 4 GLU CB C 4 29.966 29.966 31.367 -1.401 19806 6909 1 13 . 1 1 5 5 LEU N N 5 121.589 121.589 121.886 -0.297 19806 6910 1 13 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.475 -0.038 19806 6911 1 13 . 1 1 5 5 LEU CA C 5 55.019 55.019 54.973 0.046 19806 6912 1 13 . 1 1 5 5 LEU CB C 5 42.243 42.243 43.513 -1.270 19806 6913 1 13 . 1 1 6 6 THR N N 6 113.708 113.708 114.699 -0.991 19806 6914 1 13 . 1 1 6 6 THR HA H 6 4.470 4.470 4.140 0.330 19806 6915 1 13 . 1 1 6 6 THR CA C 6 61.409 61.409 63.232 -1.823 19806 6916 1 13 . 1 1 6 6 THR CB C 6 69.544 69.544 69.276 0.268 19806 6917 1 13 . 1 1 7 7 THR N N 7 114.945 114.945 112.873 2.072 19806 6918 1 13 . 1 1 7 7 THR HA H 7 4.415 4.415 4.606 -0.191 19806 6919 1 13 . 1 1 7 7 THR CA C 7 61.435 61.435 61.955 -0.520 19806 6920 1 13 . 1 1 7 7 THR CB C 7 69.506 69.506 70.334 -0.828 19806 6921 1 13 . 1 1 8 8 GLN N N 8 121.368 121.368 124.315 -2.947 19806 6922 1 13 . 1 1 8 8 GLN CA C 8 55.684 55.684 57.971 -2.288 19806 6923 1 13 . 1 1 9 9 ASP N N 9 120.595 120.595 116.759 3.836 19806 6924 1 13 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.724 -0.077 19806 6925 1 13 . 1 1 9 9 ASP CA C 9 54.115 54.115 53.613 0.502 19806 6926 1 13 . 1 1 9 9 ASP CB C 9 41.328 41.328 41.905 -0.577 19806 6927 1 13 . 1 1 10 10 GLY N N 10 106.984 106.984 106.722 0.262 19806 6928 1 13 . 1 1 10 10 GLY CA C 10 44.495 44.495 45.107 -0.612 19806 6929 1 13 . 1 1 11 11 GLU N N 11 120.879 120.879 120.486 0.393 19806 6930 1 13 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.277 -0.088 19806 6931 1 13 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.623 -0.113 19806 6932 1 13 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.442 1.627 19806 6933 1 13 . 1 1 12 12 ASP N N 12 126.686 126.686 123.091 3.595 19806 6934 1 13 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.787 -0.037 19806 6935 1 13 . 1 1 12 12 ASP CA C 12 54.347 54.347 54.418 -0.071 19806 6936 1 13 . 1 1 12 12 ASP CB C 12 42.771 42.771 42.498 0.273 19806 6937 1 13 . 1 1 13 13 PHE N N 13 128.055 128.055 119.566 8.489 19806 6938 1 13 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.466 -0.054 19806 6939 1 13 . 1 1 13 13 PHE CA C 13 62.551 62.551 59.300 3.251 19806 6940 1 13 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.305 0.528 19806 6941 1 13 . 1 1 14 14 LYS N N 14 117.498 117.498 119.464 -1.966 19806 6942 1 13 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.801 -0.220 19806 6943 1 13 . 1 1 14 14 LYS CA C 14 59.461 59.461 58.474 0.987 19806 6944 1 13 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.419 -0.075 19806 6945 1 13 . 1 1 15 15 SER N N 15 113.775 113.775 111.431 2.344 19806 6946 1 13 . 1 1 15 15 SER HA H 15 4.167 4.167 4.368 -0.201 19806 6947 1 13 . 1 1 15 15 SER CA C 15 61.099 61.099 59.988 1.111 19806 6948 1 13 . 1 1 15 15 SER CB C 15 62.428 62.428 62.690 -0.262 19806 6949 1 13 . 1 1 16 16 PHE N N 16 122.292 122.292 114.651 7.641 19806 6950 1 13 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.730 -0.440 19806 6951 1 13 . 1 1 16 16 PHE CA C 16 59.773 59.773 57.228 2.545 19806 6952 1 13 . 1 1 16 16 PHE CB C 16 37.175 37.175 39.567 -2.392 19806 6953 1 13 . 1 1 17 17 LEU N N 17 122.472 122.472 123.859 -1.387 19806 6954 1 13 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.630 -0.779 19806 6955 1 13 . 1 1 17 17 LEU CA C 17 56.619 56.619 58.109 -1.490 19806 6956 1 13 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.901 -0.439 19806 6957 1 13 . 1 1 18 18 ASP N N 18 117.331 117.331 118.141 -0.810 19806 6958 1 13 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.181 -0.066 19806 6959 1 13 . 1 1 18 18 ASP CA C 18 56.395 56.395 56.828 -0.433 19806 6960 1 13 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.609 -0.256 19806 6961 1 13 . 1 1 19 19 LYS N N 19 120.032 120.032 119.962 0.070 19806 6962 1 13 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.853 -0.176 19806 6963 1 13 . 1 1 19 19 LYS CA C 19 59.067 59.067 59.660 -0.592 19806 6964 1 13 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.391 -0.455 19806 6965 1 13 . 1 1 20 20 PHE N N 20 119.607 119.607 117.556 2.051 19806 6966 1 13 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.564 -0.455 19806 6967 1 13 . 1 1 20 20 PHE CA C 20 62.090 62.090 60.013 2.078 19806 6968 1 13 . 1 1 20 20 PHE CB C 20 40.469 40.469 38.724 1.745 19806 6969 1 13 . 1 1 21 21 THR N N 21 101.473 101.473 110.666 -9.193 19806 6970 1 13 . 1 1 21 21 THR HA H 21 4.259 4.259 3.556 0.703 19806 6971 1 13 . 1 1 21 21 THR CA C 21 61.774 61.774 63.537 -1.763 19806 6972 1 13 . 1 1 22 22 SER N N 22 111.453 111.453 116.014 -4.561 19806 6973 1 13 . 1 1 22 22 SER HA H 22 4.165 4.165 4.281 -0.116 19806 6974 1 13 . 1 1 22 22 SER CA C 22 58.215 58.215 57.313 0.902 19806 6975 1 13 . 1 1 22 22 SER CB C 22 64.570 64.570 64.249 0.321 19806 6976 1 13 . 1 1 23 23 SER N N 23 114.184 114.184 116.138 -1.954 19806 6977 1 13 . 1 1 23 23 SER HA H 23 4.764 4.764 5.227 -0.463 19806 6978 1 13 . 1 1 23 23 SER CA C 23 55.669 55.669 57.526 -1.857 19806 6979 1 13 . 1 1 23 23 SER CB C 23 64.011 64.011 64.094 -0.083 19806 6980 1 13 . 1 1 24 24 ALA N N 24 133.370 133.370 129.374 3.996 19806 6981 1 13 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.334 -0.378 19806 6982 1 13 . 1 1 24 24 ALA CA C 24 55.106 55.106 56.037 -0.931 19806 6983 1 13 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.181 0.653 19806 6984 1 13 . 1 1 25 25 ALA N N 25 117.430 117.430 119.827 -2.397 19806 6985 1 13 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.427 -0.110 19806 6986 1 13 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.301 0.900 19806 6987 1 13 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.354 -0.005 19806 6988 1 13 . 1 1 26 26 PHE N N 26 116.042 116.042 117.483 -1.441 19806 6989 1 13 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.809 -0.499 19806 6990 1 13 . 1 1 26 26 PHE CA C 26 60.759 60.759 59.640 1.119 19806 6991 1 13 . 1 1 26 26 PHE CB C 26 39.310 39.310 40.322 -1.012 19806 6992 1 13 . 1 1 27 27 GLN N N 27 121.820 121.820 120.653 1.167 19806 6993 1 13 . 1 1 27 27 GLN HA H 27 3.391 3.391 4.142 -0.751 19806 6994 1 13 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.684 0.410 19806 6995 1 13 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.691 -1.234 19806 6996 1 13 . 1 1 28 28 TYR N N 28 111.517 111.517 115.664 -4.147 19806 6997 1 13 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.923 0.207 19806 6998 1 13 . 1 1 28 28 TYR CA C 28 62.357 62.357 59.119 3.238 19806 6999 1 13 . 1 1 28 28 TYR CB C 28 38.568 38.568 37.795 0.773 19806 7000 1 13 . 1 1 29 29 THR N N 29 106.324 106.324 110.236 -3.912 19806 7001 1 13 . 1 1 29 29 THR HA H 29 4.489 4.489 4.445 0.044 19806 7002 1 13 . 1 1 29 29 THR CA C 29 63.765 63.765 62.705 1.060 19806 7003 1 13 . 1 1 29 29 THR CB C 29 69.568 69.568 69.345 0.223 19806 7004 1 13 . 1 1 30 30 ARG N N 30 117.696 117.696 121.340 -3.644 19806 7005 1 13 . 1 1 30 30 ARG HA H 30 4.701 4.701 4.946 -0.245 19806 7006 1 13 . 1 1 30 30 ARG CA C 30 52.760 52.760 55.709 -2.949 19806 7007 1 13 . 1 1 30 30 ARG CB C 30 35.047 35.047 32.187 2.860 19806 7008 1 13 . 1 1 31 31 VAL N N 31 119.395 119.395 118.720 0.675 19806 7009 1 13 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.624 -0.394 19806 7010 1 13 . 1 1 31 31 VAL CA C 31 61.191 61.191 59.914 1.277 19806 7011 1 13 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.158 -1.985 19806 7012 1 13 . 1 1 32 32 LYS N N 32 126.124 126.124 123.316 2.808 19806 7013 1 13 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.444 -0.260 19806 7014 1 13 . 1 1 32 32 LYS CA C 32 53.958 53.958 54.126 -0.168 19806 7015 1 13 . 1 1 32 32 LYS CB C 32 31.112 31.112 35.769 -4.657 19806 7016 1 13 . 1 1 33 33 PHE N N 33 119.303 119.303 120.153 -0.850 19806 7017 1 13 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.736 -0.222 19806 7018 1 13 . 1 1 33 33 PHE CA C 33 56.272 56.272 54.959 1.313 19806 7019 1 13 . 1 1 33 33 PHE CB C 33 40.378 40.378 40.276 0.102 19806 7020 1 13 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.702 0.266 19806 7021 1 13 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.554 -0.922 19806 7022 1 13 . 1 1 34 34 PRO CB C 34 33.732 33.732 33.023 0.709 19806 7023 1 13 . 1 1 35 35 LEU N N 35 120.016 120.016 118.225 1.791 19806 7024 1 13 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.325 -0.103 19806 7025 1 13 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.774 1.066 19806 7026 1 13 . 1 1 35 35 LEU CB C 35 41.244 41.244 42.844 -1.600 19806 7027 1 13 . 1 1 36 36 LYS N N 36 117.066 117.066 118.675 -1.609 19806 7028 1 13 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.370 -0.395 19806 7029 1 13 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.837 2.410 19806 7030 1 13 . 1 1 36 36 LYS CB C 36 32.832 32.832 33.247 -0.415 19806 7031 1 13 . 1 1 37 37 THR N N 37 117.574 117.574 118.850 -1.276 19806 7032 1 13 . 1 1 37 37 THR HA H 37 4.797 4.797 4.861 -0.064 19806 7033 1 13 . 1 1 37 37 THR CA C 37 60.396 60.396 59.940 0.456 19806 7034 1 13 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.862 0.157 19806 7035 1 13 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.344 -0.421 19806 7036 1 13 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.837 -0.206 19806 7037 1 13 . 1 1 39 39 ILE N N 39 119.949 119.949 119.462 0.487 19806 7038 1 13 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.475 -0.236 19806 7039 1 13 . 1 1 39 39 ILE CA C 39 62.133 62.133 60.853 1.280 19806 7040 1 13 . 1 1 40 40 THR N N 40 123.962 123.962 125.305 -1.343 19806 7041 1 13 . 1 1 40 40 THR HA H 40 5.057 5.057 5.087 -0.030 19806 7042 1 13 . 1 1 40 40 THR CA C 40 62.262 62.262 62.155 0.107 19806 7043 1 13 . 1 1 40 40 THR CB C 40 69.891 69.891 70.006 -0.115 19806 7044 1 13 . 1 1 41 41 LEU N N 41 125.633 125.633 126.995 -1.362 19806 7045 1 13 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.786 0.316 19806 7046 1 13 . 1 1 41 41 LEU CA C 41 52.638 52.638 53.355 -0.717 19806 7047 1 13 . 1 1 41 41 LEU CB C 41 45.180 45.180 44.907 0.273 19806 7048 1 13 . 1 1 42 42 LEU N N 42 120.788 120.788 122.955 -2.167 19806 7049 1 13 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.740 0.008 19806 7050 1 13 . 1 1 42 42 LEU CA C 42 53.724 53.724 54.296 -0.572 19806 7051 1 13 . 1 1 42 42 LEU CB C 42 44.384 44.384 43.357 1.027 19806 7052 1 13 . 1 1 43 43 ALA N N 43 123.073 123.073 129.427 -6.354 19806 7053 1 13 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.238 0.192 19806 7054 1 13 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.720 -1.432 19806 7055 1 13 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.257 0.757 19806 7056 1 13 . 1 1 44 44 ASP N N 44 118.196 118.196 117.586 0.610 19806 7057 1 13 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.377 0.050 19806 7058 1 13 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.989 -0.961 19806 7059 1 13 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.892 -0.682 19806 7060 1 13 . 1 1 45 45 ASP N N 45 115.018 115.018 116.570 -1.552 19806 7061 1 13 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.496 -0.027 19806 7062 1 13 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.616 -0.822 19806 7063 1 13 . 1 1 45 45 ASP CB C 45 39.864 39.864 40.563 -0.699 19806 7064 1 13 . 1 1 46 46 GLY N N 46 107.499 107.499 107.009 0.490 19806 7065 1 13 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.537 0.377 19806 7066 1 13 . 1 1 47 47 GLU N N 47 117.331 117.331 118.588 -1.257 19806 7067 1 13 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.602 -0.071 19806 7068 1 13 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.068 0.870 19806 7069 1 13 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.613 2.520 19806 7070 1 13 . 1 1 48 48 THR N N 48 118.462 118.462 116.185 2.277 19806 7071 1 13 . 1 1 48 48 THR HA H 48 4.243 4.243 4.441 -0.198 19806 7072 1 13 . 1 1 48 48 THR CA C 48 62.834 62.834 62.165 0.669 19806 7073 1 13 . 1 1 48 48 THR CB C 48 68.649 68.649 70.322 -1.673 19806 7074 1 13 . 1 1 49 49 GLU N N 49 123.834 123.834 127.604 -3.770 19806 7075 1 13 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.437 0.508 19806 7076 1 13 . 1 1 49 49 GLU CA C 49 55.358 55.358 56.945 -1.587 19806 7077 1 13 . 1 1 49 49 GLU CB C 49 31.395 31.395 29.854 1.541 19806 7078 1 13 . 1 1 50 50 LYS N N 50 122.868 122.868 127.747 -4.879 19806 7079 1 13 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.458 0.183 19806 7080 1 13 . 1 1 50 50 LYS CA C 50 54.111 54.111 55.201 -1.090 19806 7081 1 13 . 1 1 50 50 LYS CB C 50 35.312 35.312 33.396 1.916 19806 7082 1 13 . 1 1 51 51 THR N N 51 111.386 111.386 117.617 -6.231 19806 7083 1 13 . 1 1 51 51 THR HA H 51 5.619 5.619 5.077 0.542 19806 7084 1 13 . 1 1 51 51 THR CA C 51 58.980 58.980 61.335 -2.355 19806 7085 1 13 . 1 1 51 51 THR CB C 51 71.277 71.277 69.015 2.262 19806 7086 1 13 . 1 1 52 52 PHE N N 52 120.631 120.631 126.466 -5.835 19806 7087 1 13 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.780 0.183 19806 7088 1 13 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.538 -1.409 19806 7089 1 13 . 1 1 52 52 PHE CB C 52 41.049 41.049 39.823 1.226 19806 7090 1 13 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.305 0.143 19806 7091 1 13 . 1 1 53 53 PRO CA C 53 62.489 62.489 62.275 0.214 19806 7092 1 13 . 1 1 53 53 PRO CB C 53 32.240 32.240 31.997 0.243 19806 7093 1 13 . 1 1 54 54 PHE N N 54 128.034 128.034 119.414 8.620 19806 7094 1 13 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.673 0.155 19806 7095 1 13 . 1 1 54 54 PHE CA C 54 55.509 55.509 54.617 0.892 19806 7096 1 13 . 1 1 54 54 PHE CB C 54 37.028 37.028 36.595 0.433 19806 7097 1 13 . 1 1 55 55 THR N N 55 111.757 111.757 113.156 -1.399 19806 7098 1 13 . 1 1 55 55 THR HA H 55 4.413 4.413 4.247 0.166 19806 7099 1 13 . 1 1 55 55 THR CA C 55 60.578 60.578 60.728 -0.150 19806 7100 1 13 . 1 1 55 55 THR CB C 55 69.447 69.447 70.505 -1.058 19806 7101 1 13 . 1 1 56 56 LYS N N 56 118.734 118.734 119.331 -0.597 19806 7102 1 13 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.133 -1.651 19806 7103 1 13 . 1 1 56 56 LYS CA C 56 59.381 59.381 59.052 0.329 19806 7104 1 13 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.857 1.393 19806 7105 1 13 . 1 1 57 57 GLU N N 57 119.675 119.675 119.482 0.193 19806 7106 1 13 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.172 0.097 19806 7107 1 13 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.919 -1.767 19806 7108 1 13 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.911 -2.961 19806 7109 1 13 . 1 1 58 58 LYS N N 58 114.700 114.700 118.923 -4.223 19806 7110 1 13 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.274 0.038 19806 7111 1 13 . 1 1 58 58 LYS CA C 58 55.595 55.595 55.164 0.431 19806 7112 1 13 . 1 1 58 58 LYS CB C 58 32.011 32.011 30.360 1.651 19806 7113 1 13 . 1 1 59 59 TRP N N 59 118.204 118.204 125.512 -7.308 19806 7114 1 13 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.102 -0.003 19806 7115 1 13 . 1 1 59 59 TRP CA C 59 55.577 55.577 55.356 0.221 19806 7116 1 13 . 1 1 59 59 TRP CB C 59 32.037 32.037 30.322 1.715 19806 7117 1 13 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.427 -0.164 19806 7118 1 13 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.574 -2.853 19806 7119 1 13 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.343 -2.494 19806 7120 1 13 . 1 1 61 61 LEU N N 61 123.758 123.758 124.713 -0.955 19806 7121 1 13 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.328 -0.689 19806 7122 1 13 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.354 0.521 19806 7123 1 13 . 1 1 61 61 LEU CB C 61 40.815 40.815 41.393 -0.578 19806 7124 1 13 . 1 1 62 62 LEU N N 62 124.052 124.052 125.351 -1.299 19806 7125 1 13 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.243 0.112 19806 7126 1 13 . 1 1 62 62 LEU CA C 62 53.992 53.992 54.526 -0.534 19806 7127 1 13 . 1 1 62 62 LEU CB C 62 44.686 44.686 43.042 1.643 19806 7128 1 13 . 1 1 63 63 ASP N N 63 117.271 117.271 116.417 0.854 19806 7129 1 13 . 1 1 63 63 ASP HA H 63 5.033 5.033 4.732 0.301 19806 7130 1 13 . 1 1 63 63 ASP CA C 63 51.101 51.101 52.820 -1.719 19806 7131 1 13 . 1 1 63 63 ASP CB C 63 43.345 43.345 43.086 0.260 19806 7132 1 13 . 1 1 64 64 SER N N 64 112.856 112.856 113.518 -0.662 19806 7133 1 13 . 1 1 64 64 SER HA H 64 3.865 3.865 4.378 -0.513 19806 7134 1 13 . 1 1 64 64 SER CA C 64 60.910 60.910 61.903 -0.993 19806 7135 1 13 . 1 1 64 64 SER CB C 64 62.378 62.378 63.545 -1.167 19806 7136 1 13 . 1 1 65 65 GLU N N 65 120.070 120.070 120.985 -0.915 19806 7137 1 13 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.288 -0.270 19806 7138 1 13 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.039 0.304 19806 7139 1 13 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.714 -0.827 19806 7140 1 13 . 1 1 66 66 THR N N 66 115.852 115.852 113.905 1.947 19806 7141 1 13 . 1 1 66 66 THR HA H 66 3.991 3.991 4.247 -0.256 19806 7142 1 13 . 1 1 66 66 THR CA C 66 65.804 65.804 64.974 0.830 19806 7143 1 13 . 1 1 66 66 THR CB C 66 68.451 68.451 69.172 -0.721 19806 7144 1 13 . 1 1 67 67 MET N N 67 113.585 113.585 121.228 -7.643 19806 7145 1 13 . 1 1 67 67 MET HA H 67 4.267 4.267 4.689 -0.422 19806 7146 1 13 . 1 1 67 67 MET CA C 67 52.135 52.135 53.482 -1.347 19806 7147 1 13 . 1 1 67 67 MET CB C 67 28.963 28.963 30.142 -1.179 19806 7148 1 13 . 1 1 68 68 LYS N N 68 118.462 118.462 121.532 -3.070 19806 7149 1 13 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.599 -0.229 19806 7150 1 13 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.299 0.183 19806 7151 1 13 . 1 1 68 68 LYS CB C 68 34.179 34.179 35.071 -0.892 19806 7152 1 13 . 1 1 69 69 GLU N N 69 121.700 121.700 124.197 -2.497 19806 7153 1 13 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.808 -0.284 19806 7154 1 13 . 1 1 69 69 GLU CA C 69 55.942 55.942 56.289 -0.347 19806 7155 1 13 . 1 1 69 69 GLU CB C 69 30.424 30.424 30.797 -0.373 19806 7156 1 13 . 1 1 70 70 GLU N N 70 123.445 123.445 125.652 -2.207 19806 7157 1 13 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.609 0.088 19806 7158 1 13 . 1 1 70 70 GLU CA C 70 55.473 55.473 55.467 0.006 19806 7159 1 13 . 1 1 70 70 GLU CB C 70 33.162 33.162 32.963 0.199 19806 7160 1 13 . 1 1 71 71 ARG N N 71 122.150 122.150 123.642 -1.492 19806 7161 1 13 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.773 0.378 19806 7162 1 13 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.225 0.223 19806 7163 1 13 . 1 1 71 71 ARG CB C 71 31.703 31.703 30.378 1.325 19806 7164 1 13 . 1 1 72 72 ILE N N 72 125.686 125.686 125.761 -0.075 19806 7165 1 13 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.020 0.576 19806 7166 1 13 . 1 1 72 72 ILE CA C 72 59.512 59.512 61.432 -1.920 19806 7167 1 13 . 1 1 72 72 ILE CB C 72 41.095 41.095 37.310 3.785 19806 7168 1 13 . 1 1 73 73 THR N N 73 121.600 121.600 123.427 -1.827 19806 7169 1 13 . 1 1 73 73 THR HA H 73 4.603 4.603 4.296 0.307 19806 7170 1 13 . 1 1 73 73 THR CA C 73 61.937 61.937 62.496 -0.559 19806 7171 1 13 . 1 1 73 73 THR CB C 73 68.669 68.669 68.954 -0.285 19806 7172 1 13 . 1 1 74 74 GLN N N 74 124.607 124.607 126.780 -2.173 19806 7173 1 13 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.611 -0.030 19806 7174 1 13 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.109 0.580 19806 7175 1 13 . 1 1 74 74 GLN CB C 74 29.490 29.490 31.447 -1.957 19806 7176 1 13 . 1 1 75 75 GLU N N 75 122.962 122.962 119.256 3.706 19806 7177 1 13 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.433 -0.374 19806 7178 1 13 . 1 1 75 75 GLU CA C 75 58.845 58.845 56.653 2.192 19806 7179 1 13 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.207 -0.634 19806 7180 1 13 . 1 1 76 76 GLU N N 76 115.466 115.466 119.348 -3.882 19806 7181 1 13 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.526 -0.218 19806 7182 1 13 . 1 1 76 76 GLU CA C 76 56.777 56.777 55.860 0.917 19806 7183 1 13 . 1 1 76 76 GLU CB C 76 29.072 29.072 29.791 -0.719 19806 7184 1 13 . 1 1 77 77 GLY N N 77 106.771 106.771 107.354 -0.583 19806 7185 1 13 . 1 1 77 77 GLY CA C 77 45.014 45.014 45.228 -0.214 19806 7186 1 13 . 1 1 78 78 GLY N N 78 108.535 108.535 107.906 0.629 19806 7187 1 13 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.824 -0.117 19806 7188 1 13 . 1 1 79 79 ILE N N 79 121.066 121.066 121.797 -0.731 19806 7189 1 13 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.484 0.323 19806 7190 1 13 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.634 -1.291 19806 7191 1 13 . 1 1 79 79 ILE CB C 79 39.220 39.220 37.770 1.450 19806 7192 1 13 . 1 1 80 80 TYR N N 80 130.709 130.709 130.584 0.125 19806 7193 1 13 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.509 -0.245 19806 7194 1 13 . 1 1 80 80 TYR CA C 80 58.161 58.161 58.788 -0.626 19806 7195 1 13 . 1 1 80 80 TYR CB C 80 40.621 40.621 38.674 1.947 19806 7196 1 13 . 1 1 81 81 VAL N N 81 126.965 126.965 126.087 0.878 19806 7197 1 13 . 1 1 81 81 VAL HA H 81 4.854 4.854 5.014 -0.160 19806 7198 1 13 . 1 1 81 81 VAL CA C 81 60.457 60.457 59.204 1.253 19806 7199 1 13 . 1 1 81 81 VAL CB C 81 35.004 35.004 36.120 -1.115 19806 7200 1 13 . 1 1 82 82 SER N N 82 120.914 120.914 123.147 -2.233 19806 7201 1 13 . 1 1 82 82 SER HA H 82 5.185 5.185 5.074 0.111 19806 7202 1 13 . 1 1 82 82 SER CA C 82 55.260 55.260 57.331 -2.071 19806 7203 1 13 . 1 1 82 82 SER CB C 82 64.785 64.785 63.575 1.210 19806 7204 1 13 . 1 1 83 83 LYS N N 83 119.415 119.415 123.195 -3.780 19806 7205 1 13 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.897 -0.119 19806 7206 1 13 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.728 0.030 19806 7207 1 13 . 1 1 83 83 LYS CB C 83 35.514 35.514 35.766 -0.252 19806 7208 1 13 . 1 1 84 84 PHE N N 84 119.220 119.220 119.207 0.013 19806 7209 1 13 . 1 1 84 84 PHE HA H 84 5.441 5.441 5.330 0.111 19806 7210 1 13 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.846 0.568 19806 7211 1 13 . 1 1 84 84 PHE CB C 84 37.523 37.523 40.244 -2.721 19806 7212 1 13 . 1 1 85 85 THR N N 85 119.257 119.257 116.185 3.072 19806 7213 1 13 . 1 1 85 85 THR HA H 85 4.057 4.057 4.179 -0.122 19806 7214 1 13 . 1 1 85 85 THR CA C 85 62.660 62.660 64.036 -1.376 19806 7215 1 13 . 1 1 85 85 THR CB C 85 67.698 67.698 69.637 -1.939 19806 7216 1 13 . 1 1 86 86 LEU N N 86 121.612 121.612 121.803 -0.191 19806 7217 1 13 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.649 -0.051 19806 7218 1 13 . 1 1 86 86 LEU CA C 86 55.245 55.245 55.223 0.022 19806 7219 1 13 . 1 1 86 86 LEU CB C 86 44.657 44.657 45.171 -0.514 19806 7220 1 13 . 1 1 87 87 ASN N N 87 127.684 127.684 123.757 3.927 19806 7221 1 13 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.814 0.197 19806 7222 1 13 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.444 -1.145 19806 7223 1 13 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.842 -0.247 19806 7224 1 13 . 1 1 88 88 GLU N N 88 120.509 120.509 121.803 -1.294 19806 7225 1 13 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.735 0.122 19806 7226 1 13 . 1 1 88 88 GLU CA C 88 54.382 54.382 53.809 0.573 19806 7227 1 13 . 1 1 88 88 GLU CB C 88 29.808 29.808 31.128 -1.320 19806 7228 1 13 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.281 0.100 19806 7229 1 13 . 1 1 89 89 PRO CA C 89 65.898 65.898 65.303 0.595 19806 7230 1 13 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.067 0.284 19806 7231 1 13 . 1 1 90 90 LYS N N 90 107.288 107.288 114.956 -7.668 19806 7232 1 13 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.367 0.317 19806 7233 1 13 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.473 -0.494 19806 7234 1 13 . 1 1 90 90 LYS CB C 90 32.994 32.994 33.137 -0.143 19806 7235 1 13 . 1 1 91 91 HIS N N 91 119.523 119.523 118.275 1.248 19806 7236 1 13 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.654 0.123 19806 7237 1 13 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.290 -0.585 19806 7238 1 13 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.887 -0.693 19806 7239 1 13 . 1 1 92 92 LYS N N 92 122.527 122.527 127.048 -4.521 19806 7240 1 13 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.812 0.317 19806 7241 1 13 . 1 1 92 92 LYS CA C 92 54.291 54.291 55.924 -1.633 19806 7242 1 13 . 1 1 92 92 LYS CB C 92 37.479 37.479 36.501 0.979 19806 7243 1 13 . 1 1 93 93 ILE N N 93 121.564 121.564 126.821 -5.257 19806 7244 1 13 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.312 0.998 19806 7245 1 13 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.817 0.320 19806 7246 1 13 . 1 1 93 93 ILE CB C 93 41.088 41.088 40.120 0.968 19806 7247 1 13 . 1 1 94 94 PHE N N 94 128.955 128.955 130.131 -1.176 19806 7248 1 13 . 1 1 94 94 PHE HA H 94 4.900 4.900 4.703 0.197 19806 7249 1 13 . 1 1 94 94 PHE CA C 94 55.843 55.843 54.435 1.407 19806 7250 1 13 . 1 1 95 95 GLU N N 95 124.809 124.809 125.695 -0.886 19806 7251 1 13 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.093 0.325 19806 7252 1 13 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.221 1.260 19806 7253 1 13 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.098 2.062 19806 7254 1 13 . 1 1 96 96 ALA N N 96 123.759 123.759 120.988 2.771 19806 7255 1 13 . 1 1 96 96 ALA HA H 96 5.379 5.379 5.127 0.252 19806 7256 1 13 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.415 -0.874 19806 7257 1 13 . 1 1 96 96 ALA CB C 96 23.830 23.830 22.102 1.728 19806 7258 1 13 . 1 1 97 97 GLY N N 97 106.592 106.592 107.601 -1.009 19806 7259 1 13 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.336 0.099 19806 7260 1 13 . 1 1 98 98 TYR N N 98 119.250 119.250 119.666 -0.416 19806 7261 1 13 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.672 0.146 19806 7262 1 13 . 1 1 98 98 TYR CA C 98 59.387 59.387 57.955 1.432 19806 7263 1 13 . 1 1 98 98 TYR CB C 98 38.122 38.122 38.372 -0.250 19806 7264 1 13 . 1 1 99 99 GLU N N 99 123.080 123.080 125.240 -2.160 19806 7265 1 13 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.027 -0.018 19806 7266 1 13 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.938 -0.529 19806 7267 1 13 . 1 1 99 99 GLU CB C 99 30.254 30.254 29.853 0.401 19806 7268 1 13 . 1 1 100 100 GLU N N 100 116.459 116.459 117.207 -0.748 19806 7269 1 13 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.550 -0.514 19806 7270 1 13 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.112 1.292 19806 7271 1 13 . 1 1 100 100 GLU CB C 100 27.576 27.576 29.939 -2.363 19806 7272 1 13 . 1 1 101 101 SER N N 101 113.069 113.069 115.144 -2.075 19806 7273 1 13 . 1 1 101 101 SER HA H 101 4.839 4.839 4.640 0.199 19806 7274 1 13 . 1 1 101 101 SER CA C 101 56.024 56.024 57.119 -1.095 19806 7275 1 13 . 1 1 101 101 SER CB C 101 64.806 64.806 64.812 -0.006 19806 7276 1 13 . 1 1 102 102 GLU N N 102 120.439 120.439 121.272 -0.833 19806 7277 1 13 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.431 -0.042 19806 7278 1 13 . 1 1 102 102 GLU CA C 102 55.804 55.804 56.221 -0.417 19806 7279 1 13 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.059 -0.074 19806 7280 1 13 . 1 1 103 103 VAL N N 103 118.899 118.899 115.281 3.618 19806 7281 1 13 . 1 1 103 103 VAL HA H 103 4.086 4.086 3.981 0.105 19806 7282 1 13 . 1 1 103 103 VAL CA C 103 62.699 62.699 61.956 0.743 19806 7283 1 13 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.357 -0.096 19806 7284 1 13 . 1 1 104 104 ASP N N 104 120.965 120.965 119.145 1.820 19806 7285 1 13 . 1 1 104 104 ASP HA H 104 5.003 5.003 4.955 0.048 19806 7286 1 13 . 1 1 104 104 ASP CA C 104 54.914 54.914 53.850 1.064 19806 7287 1 13 . 1 1 104 104 ASP CB C 104 42.791 42.791 44.032 -1.241 19806 7288 1 13 . 1 1 105 105 LEU N N 105 120.365 120.365 119.657 0.708 19806 7289 1 13 . 1 1 105 105 LEU HA H 105 5.295 5.295 4.944 0.351 19806 7290 1 13 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.652 -0.221 19806 7291 1 13 . 1 1 105 105 LEU CB C 105 46.001 46.001 45.280 0.721 19806 7292 1 13 . 1 1 106 106 ARG N N 106 126.289 126.289 126.591 -0.302 19806 7293 1 13 . 1 1 106 106 ARG HA H 106 5.825 5.825 4.939 0.886 19806 7294 1 13 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.299 0.373 19806 7295 1 13 . 1 1 106 106 ARG CB C 106 33.920 33.920 32.980 0.940 19806 7296 1 13 . 1 1 107 107 VAL N N 107 126.145 126.145 124.256 1.889 19806 7297 1 13 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.503 0.176 19806 7298 1 13 . 1 1 107 107 VAL CA C 107 61.671 61.671 60.606 1.065 19806 7299 1 13 . 1 1 107 107 VAL CB C 107 35.350 35.350 33.167 2.183 19806 7300 1 13 . 1 1 108 108 GLU N N 108 127.093 127.093 125.754 1.339 19806 7301 1 13 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.652 0.615 19806 7302 1 13 . 1 1 108 108 GLU CA C 108 54.761 54.761 54.172 0.589 19806 7303 1 13 . 1 1 108 108 GLU CB C 108 32.567 32.567 34.051 -1.484 19806 7304 1 13 . 1 1 109 109 PHE N N 109 124.592 124.592 120.434 4.158 19806 7305 1 13 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.210 0.818 19806 7306 1 13 . 1 1 109 109 PHE CA C 109 55.945 55.945 56.421 -0.476 19806 7307 1 13 . 1 1 109 109 PHE CB C 109 43.099 43.099 42.103 0.996 19806 7308 1 13 . 1 1 110 110 GLU N N 110 122.143 122.143 122.597 -0.454 19806 7309 1 13 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.273 -0.080 19806 7310 1 13 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.562 0.881 19806 7311 1 13 . 1 1 110 110 GLU CB C 110 35.816 35.816 34.071 1.745 19806 7312 1 13 . 1 1 111 111 LEU N N 111 129.616 129.616 126.924 2.692 19806 7313 1 13 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.775 0.033 19806 7314 1 13 . 1 1 111 111 LEU CA C 111 53.470 53.470 55.186 -1.716 19806 7315 1 13 . 1 1 111 111 LEU CB C 111 40.400 40.400 41.828 -1.428 19806 7316 1 13 . 1 1 112 112 GLN N N 112 124.742 124.742 125.959 -1.217 19806 7317 1 13 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.401 0.038 19806 7318 1 13 . 1 1 112 112 GLN CA C 112 55.802 55.802 53.658 2.143 19806 7319 1 13 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.761 -1.008 19806 7320 1 13 . 1 1 113 113 ALA N N 113 121.195 121.195 123.417 -2.222 19806 7321 1 13 . 1 1 113 113 ALA HA H 113 4.048 4.048 4.036 0.012 19806 7322 1 13 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.038 0.481 19806 7323 1 13 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.474 -0.275 19806 7324 1 13 . 1 1 114 114 ASP N N 114 114.525 114.525 117.875 -3.350 19806 7325 1 13 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.478 -0.079 19806 7326 1 13 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.459 -1.552 19806 7327 1 13 . 1 1 114 114 ASP CB C 114 39.058 39.058 41.218 -2.160 19806 7328 1 13 . 1 1 115 115 GLY N N 115 107.526 107.526 107.205 0.321 19806 7329 1 13 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.640 0.144 19806 7330 1 13 . 1 1 116 116 LYS N N 116 118.818 118.818 118.503 0.315 19806 7331 1 13 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.328 0.122 19806 7332 1 13 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.435 -0.264 19806 7333 1 13 . 1 1 116 116 LYS CB C 116 35.039 35.039 33.111 1.928 19806 7334 1 13 . 1 1 117 117 TRP N N 117 118.939 118.939 121.826 -2.887 19806 7335 1 13 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.806 -0.850 19806 7336 1 13 . 1 1 118 118 TYR N N 118 112.644 112.644 122.638 -9.994 19806 7337 1 13 . 1 1 118 118 TYR HA H 118 5.277 5.277 5.006 0.271 19806 7338 1 13 . 1 1 118 118 TYR CA C 118 56.219 56.219 55.369 0.850 19806 7339 1 13 . 1 1 118 118 TYR CB C 118 43.282 43.282 41.359 1.923 19806 7340 1 13 . 1 1 119 119 VAL N N 119 119.842 119.842 122.791 -2.949 19806 7341 1 13 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.459 0.056 19806 7342 1 13 . 1 1 119 119 VAL CA C 119 62.442 62.442 64.400 -1.958 19806 7343 1 13 . 1 1 120 120 VAL N N 120 114.552 114.552 115.580 -1.028 19806 7344 1 13 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.548 0.190 19806 7345 1 13 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.549 -0.954 19806 7346 1 13 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.254 -0.402 19806 7347 1 13 . 1 1 121 121 ASP N N 121 118.234 118.234 119.392 -1.158 19806 7348 1 13 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.851 0.412 19806 7349 1 13 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.776 -0.114 19806 7350 1 13 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.681 -0.794 19806 7351 1 13 . 1 1 122 122 CYS N N 122 121.036 121.036 124.316 -3.280 19806 7352 1 13 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.682 0.889 19806 7353 1 13 . 1 1 122 122 CYS CA C 122 57.052 57.052 58.520 -1.468 19806 7354 1 13 . 1 1 122 122 CYS CB C 122 30.834 30.834 27.687 3.147 19806 7355 1 13 . 1 1 123 123 TYR N N 123 127.672 127.672 125.347 2.325 19806 7356 1 13 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.834 0.176 19806 7357 1 13 . 1 1 123 123 TYR CA C 123 57.169 57.169 58.471 -1.302 19806 7358 1 13 . 1 1 123 123 TYR CB C 123 41.408 41.408 42.618 -1.210 19806 7359 1 13 . 1 1 124 124 THR N N 124 120.833 120.833 122.708 -1.875 19806 7360 1 13 . 1 1 124 124 THR HA H 124 4.987 4.987 4.560 0.427 19806 7361 1 13 . 1 1 124 124 THR CA C 124 57.153 57.153 61.279 -4.126 19806 7362 1 13 . 1 1 124 124 THR CB C 124 68.607 68.607 69.246 -0.639 19806 7363 1 13 . 1 1 125 125 GLY N N 125 114.347 114.347 110.127 4.220 19806 7364 1 13 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.059 0.269 19806 7365 1 13 . 1 1 126 126 TRP N N 126 119.918 119.918 122.896 -2.978 19806 7366 1 13 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.025 0.045 19806 7367 1 13 . 1 1 126 126 TRP CA C 126 60.564 60.564 59.459 1.105 19806 7368 1 13 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.446 0.193 19806 7369 1 13 . 1 1 127 127 TYR N N 127 113.911 113.911 111.972 1.939 19806 7370 1 13 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.690 0.304 19806 7371 1 13 . 1 1 127 127 TYR CA C 127 53.384 53.384 57.776 -4.392 19806 7372 1 13 . 1 1 127 127 TYR CB C 127 38.584 38.584 38.395 0.189 19806 7373 1 13 . 1 1 128 128 GLY N N 128 105.181 105.181 106.568 -1.387 19806 7374 1 13 . 1 1 128 128 GLY CA C 128 45.189 45.189 44.747 0.442 19806 7375 1 13 . 1 1 129 129 TYR N N 129 116.588 116.588 122.265 -5.677 19806 7376 1 13 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.140 0.524 19806 7377 1 13 . 1 1 129 129 TYR CA C 129 59.565 59.565 59.950 -0.385 19806 7378 1 13 . 1 1 129 129 TYR CB C 129 38.853 38.853 36.861 1.992 19806 7379 1 13 . 1 1 130 130 ASP N N 130 115.195 115.195 119.531 -4.336 19806 7380 1 13 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.505 -0.120 19806 7381 1 13 . 1 1 130 130 ASP CA C 130 53.130 53.130 55.892 -2.762 19806 7382 1 13 . 1 1 130 130 ASP CB C 130 38.685 38.685 41.693 -3.008 19806 7383 1 13 . 1 1 131 131 LEU N N 131 124.887 124.887 117.672 7.215 19806 7384 1 13 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.934 -0.453 19806 7385 1 13 . 1 1 131 131 LEU CA C 131 53.605 53.605 51.761 1.844 19806 7386 1 13 . 1 1 131 131 LEU CB C 131 42.441 42.441 42.691 -0.250 19806 7387 1 13 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.735 -0.052 19806 7388 1 13 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.388 65.677 19806 7389 1 13 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.802 -1.475 19806 7390 1 13 . 1 1 133 133 ILE N N 133 123.765 123.765 120.231 3.534 19806 7391 1 13 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.690 0.039 19806 7392 1 13 . 1 1 133 133 ILE CA C 133 64.860 64.860 64.037 0.824 19806 7393 1 13 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.331 -0.268 19806 7394 1 13 . 1 1 134 134 GLY N N 134 107.030 107.030 106.515 0.515 19806 7395 1 13 . 1 1 134 134 GLY CA C 134 45.976 45.976 46.448 -0.472 19806 7396 1 13 . 1 1 135 135 GLU N N 135 116.566 116.566 121.228 -4.662 19806 7397 1 13 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.266 0.398 19806 7398 1 13 . 1 1 135 135 GLU CA C 135 55.414 55.414 56.996 -1.583 19806 7399 1 13 . 1 1 135 135 GLU CB C 135 30.195 30.195 28.705 1.490 19806 7400 1 13 . 1 1 136 136 LEU N N 136 124.239 124.239 122.739 1.500 19806 7401 1 13 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.917 0.127 19806 7402 1 13 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.592 0.524 19806 7403 1 13 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.320 -0.313 19806 7404 1 13 . 1 1 137 137 LYS N N 137 117.225 117.225 117.103 0.122 19806 7405 1 13 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.781 0.082 19806 7406 1 13 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.280 1.175 19806 7407 1 13 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.269 -0.066 19806 7408 1 13 . 1 1 138 138 GLN N N 138 118.718 118.718 119.274 -0.556 19806 7409 1 13 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.172 -0.120 19806 7410 1 13 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.206 -0.331 19806 7411 1 13 . 1 1 138 138 GLN CB C 138 28.235 28.235 28.010 0.225 19806 7412 1 13 . 1 1 139 139 THR N N 139 117.970 117.970 118.067 -0.097 19806 7413 1 13 . 1 1 139 139 THR HA H 139 4.532 4.532 3.951 0.581 19806 7414 1 13 . 1 1 139 139 THR CA C 139 68.145 68.145 67.038 1.107 19806 7415 1 13 . 1 1 139 139 THR CB C 139 68.103 68.103 68.542 -0.439 19806 7416 1 13 . 1 1 140 140 ILE N N 140 120.391 120.391 121.209 -0.818 19806 7417 1 13 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.954 -0.227 19806 7418 1 13 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.729 0.527 19806 7419 1 13 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.920 0.193 19806 7420 1 13 . 1 1 141 141 GLN N N 141 118.917 118.917 118.355 0.562 19806 7421 1 13 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.921 0.094 19806 7422 1 13 . 1 1 141 141 GLN CA C 141 58.371 58.371 58.276 0.095 19806 7423 1 13 . 1 1 141 141 GLN CB C 141 27.347 27.347 27.868 -0.521 19806 7424 1 13 . 1 1 142 142 ASN N N 142 119.936 119.936 118.325 1.611 19806 7425 1 13 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.627 -0.112 19806 7426 1 13 . 1 1 142 142 ASN CA C 142 55.799 55.799 56.358 -0.559 19806 7427 1 13 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.428 -0.798 19806 7428 1 13 . 1 1 143 143 VAL N N 143 123.195 123.195 118.476 4.719 19806 7429 1 13 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.366 -0.650 19806 7430 1 13 . 1 1 143 143 VAL CA C 143 66.497 66.497 65.511 0.986 19806 7431 1 13 . 1 1 143 143 VAL CB C 143 30.989 30.989 30.628 0.361 19806 7432 1 13 . 1 1 144 144 LYS N N 144 120.348 120.348 120.280 0.068 19806 7433 1 13 . 1 1 144 144 LYS HA H 144 3.881 3.881 3.982 -0.101 19806 7434 1 13 . 1 1 144 144 LYS CA C 144 60.123 60.123 60.058 0.065 19806 7435 1 13 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.195 -0.313 19806 7436 1 13 . 1 1 145 145 GLU N N 145 119.220 119.220 118.870 0.350 19806 7437 1 13 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.120 0.063 19806 7438 1 13 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.137 0.041 19806 7439 1 13 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.526 -0.455 19806 7440 1 13 . 1 1 146 146 GLU N N 146 121.420 121.420 120.681 0.739 19806 7441 1 13 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.092 0.185 19806 7442 1 13 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.517 -0.399 19806 7443 1 13 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.591 -1.249 19806 7444 1 13 . 1 1 147 147 ASN N N 147 119.197 119.197 116.718 2.479 19806 7445 1 13 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.625 -0.057 19806 7446 1 13 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.674 -1.523 19806 7447 1 13 . 1 1 147 147 ASN CB C 147 37.373 37.373 38.146 -0.773 19806 7448 1 13 . 1 1 148 148 ALA N N 148 123.672 123.672 121.720 1.952 19806 7449 1 13 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.399 -0.276 19806 7450 1 13 . 1 1 148 148 ALA CA C 148 55.133 55.133 54.309 0.824 19806 7451 1 13 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.455 -0.848 19806 7452 1 13 . 1 1 149 149 ALA N N 149 119.979 119.979 122.357 -2.378 19806 7453 1 13 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.086 0.175 19806 7454 1 13 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.653 -0.008 19806 7455 1 13 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.789 -1.051 19806 7456 1 13 . 1 1 150 150 PHE N N 150 119.592 119.592 120.257 -0.665 19806 7457 1 13 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.131 0.093 19806 7458 1 13 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.728 -0.720 19806 7459 1 13 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.321 -0.259 19806 7460 1 13 . 1 1 151 151 LYS N N 151 116.869 116.869 118.379 -1.510 19806 7461 1 13 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.255 -0.349 19806 7462 1 13 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.449 0.321 19806 7463 1 13 . 1 1 151 151 LYS CB C 151 32.741 32.741 31.982 0.759 19806 7464 1 13 . 1 1 152 152 GLU N N 152 115.868 115.868 119.086 -3.218 19806 7465 1 13 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.112 -0.059 19806 7466 1 13 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.675 -0.019 19806 7467 1 13 . 1 1 152 152 GLU CB C 152 29.753 29.753 30.064 -0.311 19806 7468 1 13 . 1 1 153 153 ILE N N 153 110.437 110.437 117.445 -7.008 19806 7469 1 13 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.792 0.384 19806 7470 1 13 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.326 -1.292 19806 7471 1 13 . 1 1 153 153 ILE CB C 153 39.272 39.272 39.317 -0.045 19806 7472 1 13 . 1 1 154 154 HIS N N 154 117.779 117.779 116.205 1.574 19806 7473 1 13 . 1 1 154 154 HIS HA H 154 5.174 5.174 5.013 0.161 19806 7474 1 13 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.548 -0.932 19806 7475 1 13 . 1 1 154 154 HIS CB C 154 28.547 28.547 29.518 -0.971 19806 7476 1 14 . 1 1 3 3 SER N N 3 114.847 114.847 116.354 -1.507 19806 7477 1 14 . 1 1 3 3 SER HA H 3 4.463 4.463 4.377 0.086 19806 7478 1 14 . 1 1 3 3 SER CA C 3 58.340 58.340 59.139 -0.799 19806 7479 1 14 . 1 1 3 3 SER CB C 3 63.457 63.457 63.913 -0.456 19806 7480 1 14 . 1 1 4 4 GLU N N 4 121.498 121.498 117.932 3.566 19806 7481 1 14 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.108 0.224 19806 7482 1 14 . 1 1 4 4 GLU CA C 4 56.443 56.443 57.072 -0.629 19806 7483 1 14 . 1 1 4 4 GLU CB C 4 29.966 29.966 29.690 0.276 19806 7484 1 14 . 1 1 5 5 LEU N N 5 121.589 121.589 120.018 1.571 19806 7485 1 14 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.862 -0.425 19806 7486 1 14 . 1 1 5 5 LEU CA C 5 55.019 55.019 53.921 1.098 19806 7487 1 14 . 1 1 5 5 LEU CB C 5 42.243 42.243 40.470 1.773 19806 7488 1 14 . 1 1 6 6 THR N N 6 113.708 113.708 113.498 0.210 19806 7489 1 14 . 1 1 6 6 THR HA H 6 4.470 4.470 4.121 0.349 19806 7490 1 14 . 1 1 6 6 THR CA C 6 61.409 61.409 63.173 -1.764 19806 7491 1 14 . 1 1 6 6 THR CB C 6 69.544 69.544 68.596 0.948 19806 7492 1 14 . 1 1 7 7 THR N N 7 114.945 114.945 110.531 4.414 19806 7493 1 14 . 1 1 7 7 THR HA H 7 4.415 4.415 4.508 -0.093 19806 7494 1 14 . 1 1 7 7 THR CA C 7 61.435 61.435 61.789 -0.354 19806 7495 1 14 . 1 1 7 7 THR CB C 7 69.506 69.506 69.533 -0.027 19806 7496 1 14 . 1 1 8 8 GLN N N 8 121.368 121.368 121.619 -0.251 19806 7497 1 14 . 1 1 8 8 GLN CA C 8 55.684 55.684 56.069 -0.385 19806 7498 1 14 . 1 1 9 9 ASP N N 9 120.595 120.595 120.755 -0.160 19806 7499 1 14 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.574 0.073 19806 7500 1 14 . 1 1 9 9 ASP CA C 9 54.115 54.115 53.902 0.213 19806 7501 1 14 . 1 1 9 9 ASP CB C 9 41.328 41.328 40.960 0.368 19806 7502 1 14 . 1 1 10 10 GLY N N 10 106.984 106.984 106.707 0.277 19806 7503 1 14 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.359 0.135 19806 7504 1 14 . 1 1 11 11 GLU N N 11 120.879 120.879 120.530 0.349 19806 7505 1 14 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.183 0.006 19806 7506 1 14 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.791 -0.281 19806 7507 1 14 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.154 1.915 19806 7508 1 14 . 1 1 12 12 ASP N N 12 126.686 126.686 124.372 2.314 19806 7509 1 14 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.569 0.181 19806 7510 1 14 . 1 1 12 12 ASP CA C 12 54.347 54.347 55.261 -0.914 19806 7511 1 14 . 1 1 12 12 ASP CB C 12 42.771 42.771 41.762 1.009 19806 7512 1 14 . 1 1 13 13 PHE N N 13 128.055 128.055 121.490 6.565 19806 7513 1 14 . 1 1 13 13 PHE HA H 13 3.412 3.412 4.236 -0.824 19806 7514 1 14 . 1 1 13 13 PHE CA C 13 62.551 62.551 60.066 2.485 19806 7515 1 14 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.467 0.366 19806 7516 1 14 . 1 1 14 14 LYS N N 14 117.498 117.498 119.068 -1.570 19806 7517 1 14 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.820 -0.239 19806 7518 1 14 . 1 1 14 14 LYS CA C 14 59.461 59.461 57.993 1.468 19806 7519 1 14 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.502 -0.158 19806 7520 1 14 . 1 1 15 15 SER N N 15 113.775 113.775 115.520 -1.745 19806 7521 1 14 . 1 1 15 15 SER HA H 15 4.167 4.167 4.025 0.142 19806 7522 1 14 . 1 1 15 15 SER CA C 15 61.099 61.099 61.570 -0.471 19806 7523 1 14 . 1 1 15 15 SER CB C 15 62.428 62.428 62.857 -0.429 19806 7524 1 14 . 1 1 16 16 PHE N N 16 122.292 122.292 120.164 2.128 19806 7525 1 14 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.600 -0.310 19806 7526 1 14 . 1 1 16 16 PHE CA C 16 59.773 59.773 60.100 -0.327 19806 7527 1 14 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.452 -1.277 19806 7528 1 14 . 1 1 17 17 LEU N N 17 122.472 122.472 121.608 0.864 19806 7529 1 14 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.510 -0.660 19806 7530 1 14 . 1 1 17 17 LEU CA C 17 56.619 56.619 56.884 -0.265 19806 7531 1 14 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.283 0.179 19806 7532 1 14 . 1 1 18 18 ASP N N 18 117.331 117.331 121.092 -3.761 19806 7533 1 14 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.181 -0.066 19806 7534 1 14 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.204 -0.809 19806 7535 1 14 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.693 -0.340 19806 7536 1 14 . 1 1 19 19 LYS N N 19 120.032 120.032 119.350 0.682 19806 7537 1 14 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.997 -0.320 19806 7538 1 14 . 1 1 19 19 LYS CA C 19 59.067 59.067 59.047 0.020 19806 7539 1 14 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.498 -0.562 19806 7540 1 14 . 1 1 20 20 PHE N N 20 119.607 119.607 121.515 -1.908 19806 7541 1 14 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.192 -0.083 19806 7542 1 14 . 1 1 20 20 PHE CA C 20 62.090 62.090 60.905 1.185 19806 7543 1 14 . 1 1 20 20 PHE CB C 20 40.469 40.469 38.727 1.742 19806 7544 1 14 . 1 1 21 21 THR N N 21 101.473 101.473 107.985 -6.512 19806 7545 1 14 . 1 1 21 21 THR HA H 21 4.259 4.259 3.618 0.641 19806 7546 1 14 . 1 1 21 21 THR CA C 21 61.774 61.774 63.311 -1.537 19806 7547 1 14 . 1 1 22 22 SER N N 22 111.453 111.453 114.733 -3.280 19806 7548 1 14 . 1 1 22 22 SER HA H 22 4.165 4.165 4.650 -0.485 19806 7549 1 14 . 1 1 22 22 SER CA C 22 58.215 58.215 57.632 0.583 19806 7550 1 14 . 1 1 22 22 SER CB C 22 64.570 64.570 64.264 0.306 19806 7551 1 14 . 1 1 23 23 SER N N 23 114.184 114.184 115.064 -0.880 19806 7552 1 14 . 1 1 23 23 SER HA H 23 4.764 4.764 5.082 -0.318 19806 7553 1 14 . 1 1 23 23 SER CA C 23 55.669 55.669 57.118 -1.449 19806 7554 1 14 . 1 1 23 23 SER CB C 23 64.011 64.011 64.872 -0.861 19806 7555 1 14 . 1 1 24 24 ALA N N 24 133.370 133.370 126.275 7.095 19806 7556 1 14 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.457 -0.501 19806 7557 1 14 . 1 1 24 24 ALA CA C 24 55.106 55.106 54.099 1.007 19806 7558 1 14 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.712 0.123 19806 7559 1 14 . 1 1 25 25 ALA N N 25 117.430 117.430 121.961 -4.531 19806 7560 1 14 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.311 0.006 19806 7561 1 14 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.758 0.443 19806 7562 1 14 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.352 -0.003 19806 7563 1 14 . 1 1 26 26 PHE N N 26 116.042 116.042 117.369 -1.327 19806 7564 1 14 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.392 -0.082 19806 7565 1 14 . 1 1 26 26 PHE CA C 26 60.759 60.759 60.455 0.304 19806 7566 1 14 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.160 0.150 19806 7567 1 14 . 1 1 27 27 GLN N N 27 121.820 121.820 119.159 2.661 19806 7568 1 14 . 1 1 27 27 GLN HA H 27 3.391 3.391 4.019 -0.628 19806 7569 1 14 . 1 1 27 27 GLN CA C 27 60.094 60.094 58.492 1.602 19806 7570 1 14 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.644 -1.187 19806 7571 1 14 . 1 1 28 28 TYR N N 28 111.517 111.517 117.342 -5.825 19806 7572 1 14 . 1 1 28 28 TYR HA H 28 4.130 4.130 4.013 0.117 19806 7573 1 14 . 1 1 28 28 TYR CA C 28 62.357 62.357 59.910 2.447 19806 7574 1 14 . 1 1 28 28 TYR CB C 28 38.568 38.568 38.590 -0.022 19806 7575 1 14 . 1 1 29 29 THR N N 29 106.324 106.324 114.835 -8.511 19806 7576 1 14 . 1 1 29 29 THR HA H 29 4.489 4.489 4.343 0.146 19806 7577 1 14 . 1 1 29 29 THR CA C 29 63.765 63.765 62.180 1.585 19806 7578 1 14 . 1 1 29 29 THR CB C 29 69.568 69.568 67.087 2.482 19806 7579 1 14 . 1 1 30 30 ARG N N 30 117.696 117.696 119.112 -1.416 19806 7580 1 14 . 1 1 30 30 ARG HA H 30 4.701 4.701 3.553 1.148 19806 7581 1 14 . 1 1 30 30 ARG CA C 30 52.760 52.760 54.880 -2.120 19806 7582 1 14 . 1 1 30 30 ARG CB C 30 35.047 35.047 30.885 4.162 19806 7583 1 14 . 1 1 31 31 VAL N N 31 119.395 119.395 119.724 -0.329 19806 7584 1 14 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.792 -0.562 19806 7585 1 14 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.520 0.671 19806 7586 1 14 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.770 -2.597 19806 7587 1 14 . 1 1 32 32 LYS N N 32 126.124 126.124 127.369 -1.245 19806 7588 1 14 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.521 -0.337 19806 7589 1 14 . 1 1 32 32 LYS CA C 32 53.958 53.958 55.129 -1.171 19806 7590 1 14 . 1 1 32 32 LYS CB C 32 31.112 31.112 33.600 -2.488 19806 7591 1 14 . 1 1 33 33 PHE N N 33 119.303 119.303 118.721 0.582 19806 7592 1 14 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.858 -0.344 19806 7593 1 14 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.452 0.820 19806 7594 1 14 . 1 1 33 33 PHE CB C 33 40.378 40.378 40.468 -0.090 19806 7595 1 14 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.925 0.043 19806 7596 1 14 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.742 -1.109 19806 7597 1 14 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.799 0.933 19806 7598 1 14 . 1 1 35 35 LEU N N 35 120.016 120.016 117.038 2.978 19806 7599 1 14 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.347 -0.125 19806 7600 1 14 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.242 1.598 19806 7601 1 14 . 1 1 35 35 LEU CB C 35 41.244 41.244 43.755 -2.511 19806 7602 1 14 . 1 1 36 36 LYS N N 36 117.066 117.066 119.314 -2.248 19806 7603 1 14 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.267 -0.292 19806 7604 1 14 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.883 2.364 19806 7605 1 14 . 1 1 36 36 LYS CB C 36 32.832 32.832 32.932 -0.100 19806 7606 1 14 . 1 1 37 37 THR N N 37 117.574 117.574 117.963 -0.389 19806 7607 1 14 . 1 1 37 37 THR HA H 37 4.797 4.797 4.795 0.002 19806 7608 1 14 . 1 1 37 37 THR CA C 37 60.396 60.396 59.673 0.723 19806 7609 1 14 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.797 0.222 19806 7610 1 14 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.640 -0.717 19806 7611 1 14 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.854 -0.223 19806 7612 1 14 . 1 1 39 39 ILE N N 39 119.949 119.949 118.339 1.610 19806 7613 1 14 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.174 0.065 19806 7614 1 14 . 1 1 39 39 ILE CA C 39 62.133 62.133 61.514 0.619 19806 7615 1 14 . 1 1 40 40 THR N N 40 123.962 123.962 121.709 2.253 19806 7616 1 14 . 1 1 40 40 THR HA H 40 5.057 5.057 5.264 -0.207 19806 7617 1 14 . 1 1 40 40 THR CA C 40 62.262 62.262 61.752 0.510 19806 7618 1 14 . 1 1 40 40 THR CB C 40 69.891 69.891 70.900 -1.010 19806 7619 1 14 . 1 1 41 41 LEU N N 41 125.633 125.633 123.329 2.304 19806 7620 1 14 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.875 0.227 19806 7621 1 14 . 1 1 41 41 LEU CA C 41 52.638 52.638 53.278 -0.640 19806 7622 1 14 . 1 1 41 41 LEU CB C 41 45.180 45.180 44.581 0.599 19806 7623 1 14 . 1 1 42 42 LEU N N 42 120.788 120.788 121.988 -1.200 19806 7624 1 14 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.661 0.087 19806 7625 1 14 . 1 1 42 42 LEU CA C 42 53.724 53.724 53.944 -0.220 19806 7626 1 14 . 1 1 42 42 LEU CB C 42 44.384 44.384 41.437 2.947 19806 7627 1 14 . 1 1 43 43 ALA N N 43 123.073 123.073 129.278 -6.205 19806 7628 1 14 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.228 0.202 19806 7629 1 14 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.512 -1.224 19806 7630 1 14 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.473 0.541 19806 7631 1 14 . 1 1 44 44 ASP N N 44 118.196 118.196 118.646 -0.450 19806 7632 1 14 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.382 0.044 19806 7633 1 14 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.765 -0.737 19806 7634 1 14 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.490 -0.280 19806 7635 1 14 . 1 1 45 45 ASP N N 45 115.018 115.018 117.181 -2.163 19806 7636 1 14 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.559 -0.090 19806 7637 1 14 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.270 -0.476 19806 7638 1 14 . 1 1 45 45 ASP CB C 45 39.864 39.864 40.668 -0.804 19806 7639 1 14 . 1 1 46 46 GLY N N 46 107.499 107.499 108.492 -0.993 19806 7640 1 14 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.762 0.152 19806 7641 1 14 . 1 1 47 47 GLU N N 47 117.331 117.331 116.607 0.724 19806 7642 1 14 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.497 0.034 19806 7643 1 14 . 1 1 47 47 GLU CA C 47 56.938 56.938 55.645 1.293 19806 7644 1 14 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.628 2.505 19806 7645 1 14 . 1 1 48 48 THR N N 48 118.462 118.462 118.394 0.068 19806 7646 1 14 . 1 1 48 48 THR HA H 48 4.243 4.243 4.542 -0.299 19806 7647 1 14 . 1 1 48 48 THR CA C 48 62.834 62.834 61.827 1.007 19806 7648 1 14 . 1 1 48 48 THR CB C 48 68.649 68.649 70.239 -1.590 19806 7649 1 14 . 1 1 49 49 GLU N N 49 123.834 123.834 128.433 -4.599 19806 7650 1 14 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.447 0.498 19806 7651 1 14 . 1 1 49 49 GLU CA C 49 55.358 55.358 57.364 -2.006 19806 7652 1 14 . 1 1 49 49 GLU CB C 49 31.395 31.395 29.098 2.297 19806 7653 1 14 . 1 1 50 50 LYS N N 50 122.868 122.868 127.687 -4.819 19806 7654 1 14 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.639 0.002 19806 7655 1 14 . 1 1 50 50 LYS CA C 50 54.111 54.111 55.664 -1.553 19806 7656 1 14 . 1 1 50 50 LYS CB C 50 35.312 35.312 34.419 0.893 19806 7657 1 14 . 1 1 51 51 THR N N 51 111.386 111.386 113.221 -1.835 19806 7658 1 14 . 1 1 51 51 THR HA H 51 5.619 5.619 5.444 0.175 19806 7659 1 14 . 1 1 51 51 THR CA C 51 58.980 58.980 60.625 -1.645 19806 7660 1 14 . 1 1 51 51 THR CB C 51 71.277 71.277 70.316 0.961 19806 7661 1 14 . 1 1 52 52 PHE N N 52 120.631 120.631 118.924 1.707 19806 7662 1 14 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.860 0.103 19806 7663 1 14 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.570 -1.441 19806 7664 1 14 . 1 1 52 52 PHE CB C 52 41.049 41.049 42.248 -1.199 19806 7665 1 14 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.265 0.183 19806 7666 1 14 . 1 1 53 53 PRO CA C 53 62.489 62.489 62.531 -0.042 19806 7667 1 14 . 1 1 53 53 PRO CB C 53 32.240 32.240 31.791 0.449 19806 7668 1 14 . 1 1 54 54 PHE N N 54 128.034 128.034 119.321 8.713 19806 7669 1 14 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.746 0.082 19806 7670 1 14 . 1 1 54 54 PHE CA C 54 55.509 55.509 54.670 0.839 19806 7671 1 14 . 1 1 54 54 PHE CB C 54 37.028 37.028 36.846 0.182 19806 7672 1 14 . 1 1 55 55 THR N N 55 111.757 111.757 114.444 -2.687 19806 7673 1 14 . 1 1 55 55 THR HA H 55 4.413 4.413 4.091 0.322 19806 7674 1 14 . 1 1 55 55 THR CA C 55 60.578 60.578 61.354 -0.776 19806 7675 1 14 . 1 1 55 55 THR CB C 55 69.447 69.447 69.778 -0.331 19806 7676 1 14 . 1 1 56 56 LYS N N 56 118.734 118.734 121.375 -2.641 19806 7677 1 14 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.048 -1.566 19806 7678 1 14 . 1 1 56 56 LYS CA C 56 59.381 59.381 59.318 0.063 19806 7679 1 14 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.800 1.450 19806 7680 1 14 . 1 1 57 57 GLU N N 57 119.675 119.675 117.660 2.015 19806 7681 1 14 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.007 0.262 19806 7682 1 14 . 1 1 57 57 GLU CA C 57 57.152 57.152 59.188 -2.036 19806 7683 1 14 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.321 -2.371 19806 7684 1 14 . 1 1 58 58 LYS N N 58 114.700 114.700 117.827 -3.127 19806 7685 1 14 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.230 0.082 19806 7686 1 14 . 1 1 58 58 LYS CA C 58 55.595 55.595 55.157 0.438 19806 7687 1 14 . 1 1 58 58 LYS CB C 58 32.011 32.011 30.390 1.621 19806 7688 1 14 . 1 1 59 59 TRP N N 59 118.204 118.204 125.003 -6.799 19806 7689 1 14 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.024 0.075 19806 7690 1 14 . 1 1 59 59 TRP CA C 59 55.577 55.577 55.275 0.302 19806 7691 1 14 . 1 1 59 59 TRP CB C 59 32.037 32.037 29.926 2.111 19806 7692 1 14 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.535 -0.272 19806 7693 1 14 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.280 -2.559 19806 7694 1 14 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.779 -2.930 19806 7695 1 14 . 1 1 61 61 LEU N N 61 123.758 123.758 122.333 1.425 19806 7696 1 14 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.322 -0.683 19806 7697 1 14 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.548 0.327 19806 7698 1 14 . 1 1 61 61 LEU CB C 61 40.815 40.815 41.547 -0.732 19806 7699 1 14 . 1 1 62 62 LEU N N 62 124.052 124.052 128.046 -3.994 19806 7700 1 14 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.267 0.088 19806 7701 1 14 . 1 1 62 62 LEU CA C 62 53.992 53.992 55.841 -1.849 19806 7702 1 14 . 1 1 62 62 LEU CB C 62 44.686 44.686 43.205 1.481 19806 7703 1 14 . 1 1 63 63 ASP N N 63 117.271 117.271 117.589 -0.318 19806 7704 1 14 . 1 1 63 63 ASP HA H 63 5.033 5.033 4.833 0.200 19806 7705 1 14 . 1 1 63 63 ASP CA C 63 51.101 51.101 53.245 -2.144 19806 7706 1 14 . 1 1 63 63 ASP CB C 63 43.345 43.345 43.127 0.218 19806 7707 1 14 . 1 1 64 64 SER N N 64 112.856 112.856 115.931 -3.075 19806 7708 1 14 . 1 1 64 64 SER HA H 64 3.865 3.865 4.062 -0.197 19806 7709 1 14 . 1 1 64 64 SER CA C 64 60.910 60.910 61.473 -0.563 19806 7710 1 14 . 1 1 64 64 SER CB C 64 62.378 62.378 63.026 -0.648 19806 7711 1 14 . 1 1 65 65 GLU N N 65 120.070 120.070 118.940 1.130 19806 7712 1 14 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.263 -0.245 19806 7713 1 14 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.559 -0.216 19806 7714 1 14 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.247 -0.360 19806 7715 1 14 . 1 1 66 66 THR N N 66 115.852 115.852 113.224 2.628 19806 7716 1 14 . 1 1 66 66 THR HA H 66 3.991 3.991 4.389 -0.398 19806 7717 1 14 . 1 1 66 66 THR CA C 66 65.804 65.804 62.751 3.053 19806 7718 1 14 . 1 1 66 66 THR CB C 66 68.451 68.451 69.082 -0.631 19806 7719 1 14 . 1 1 67 67 MET N N 67 113.585 113.585 119.287 -5.702 19806 7720 1 14 . 1 1 67 67 MET HA H 67 4.267 4.267 4.108 0.159 19806 7721 1 14 . 1 1 67 67 MET CA C 67 52.135 52.135 54.844 -2.709 19806 7722 1 14 . 1 1 67 67 MET CB C 67 28.963 28.963 32.976 -4.013 19806 7723 1 14 . 1 1 68 68 LYS N N 68 118.462 118.462 119.494 -1.032 19806 7724 1 14 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.537 -0.167 19806 7725 1 14 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.589 -0.107 19806 7726 1 14 . 1 1 68 68 LYS CB C 68 34.179 34.179 32.971 1.208 19806 7727 1 14 . 1 1 69 69 GLU N N 69 121.700 121.700 117.418 4.282 19806 7728 1 14 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.209 0.315 19806 7729 1 14 . 1 1 69 69 GLU CA C 69 55.942 55.942 57.773 -1.831 19806 7730 1 14 . 1 1 69 69 GLU CB C 69 30.424 30.424 29.825 0.599 19806 7731 1 14 . 1 1 70 70 GLU N N 70 123.445 123.445 120.126 3.319 19806 7732 1 14 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.692 0.005 19806 7733 1 14 . 1 1 70 70 GLU CA C 70 55.473 55.473 55.169 0.304 19806 7734 1 14 . 1 1 70 70 GLU CB C 70 33.162 33.162 33.599 -0.437 19806 7735 1 14 . 1 1 71 71 ARG N N 71 122.150 122.150 122.607 -0.457 19806 7736 1 14 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.911 0.240 19806 7737 1 14 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.514 -0.066 19806 7738 1 14 . 1 1 71 71 ARG CB C 71 31.703 31.703 31.530 0.173 19806 7739 1 14 . 1 1 72 72 ILE N N 72 125.686 125.686 127.389 -1.703 19806 7740 1 14 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.214 0.382 19806 7741 1 14 . 1 1 72 72 ILE CA C 72 59.512 59.512 61.403 -1.891 19806 7742 1 14 . 1 1 72 72 ILE CB C 72 41.095 41.095 39.295 1.800 19806 7743 1 14 . 1 1 73 73 THR N N 73 121.600 121.600 122.171 -0.571 19806 7744 1 14 . 1 1 73 73 THR HA H 73 4.603 4.603 4.591 0.012 19806 7745 1 14 . 1 1 73 73 THR CA C 73 61.937 61.937 61.010 0.927 19806 7746 1 14 . 1 1 73 73 THR CB C 73 68.669 68.669 69.061 -0.392 19806 7747 1 14 . 1 1 74 74 GLN N N 74 124.607 124.607 127.392 -2.785 19806 7748 1 14 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.782 -0.201 19806 7749 1 14 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.518 0.171 19806 7750 1 14 . 1 1 74 74 GLN CB C 74 29.490 29.490 32.181 -2.691 19806 7751 1 14 . 1 1 75 75 GLU N N 75 122.962 122.962 119.637 3.325 19806 7752 1 14 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.359 -0.300 19806 7753 1 14 . 1 1 75 75 GLU CA C 75 58.845 58.845 56.957 1.888 19806 7754 1 14 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.291 -0.718 19806 7755 1 14 . 1 1 76 76 GLU N N 76 115.466 115.466 119.017 -3.551 19806 7756 1 14 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.455 -0.147 19806 7757 1 14 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.775 0.002 19806 7758 1 14 . 1 1 76 76 GLU CB C 76 29.072 29.072 29.810 -0.738 19806 7759 1 14 . 1 1 77 77 GLY N N 77 106.771 106.771 107.713 -0.942 19806 7760 1 14 . 1 1 77 77 GLY CA C 77 45.014 45.014 45.551 -0.537 19806 7761 1 14 . 1 1 78 78 GLY N N 78 108.535 108.535 107.720 0.815 19806 7762 1 14 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.821 -0.114 19806 7763 1 14 . 1 1 79 79 ILE N N 79 121.066 121.066 121.150 -0.084 19806 7764 1 14 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.509 0.298 19806 7765 1 14 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.341 -0.998 19806 7766 1 14 . 1 1 79 79 ILE CB C 79 39.220 39.220 38.190 1.030 19806 7767 1 14 . 1 1 80 80 TYR N N 80 130.709 130.709 130.298 0.411 19806 7768 1 14 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.161 0.103 19806 7769 1 14 . 1 1 80 80 TYR CA C 80 58.161 58.161 57.469 0.691 19806 7770 1 14 . 1 1 80 80 TYR CB C 80 40.621 40.621 37.153 3.468 19806 7771 1 14 . 1 1 81 81 VAL N N 81 126.965 126.965 127.741 -0.776 19806 7772 1 14 . 1 1 81 81 VAL HA H 81 4.854 4.854 3.919 0.935 19806 7773 1 14 . 1 1 81 81 VAL CA C 81 60.457 60.457 62.537 -2.080 19806 7774 1 14 . 1 1 81 81 VAL CB C 81 35.004 35.004 33.168 1.836 19806 7775 1 14 . 1 1 82 82 SER N N 82 120.914 120.914 119.932 0.982 19806 7776 1 14 . 1 1 82 82 SER HA H 82 5.185 5.185 4.825 0.360 19806 7777 1 14 . 1 1 82 82 SER CA C 82 55.260 55.260 57.497 -2.237 19806 7778 1 14 . 1 1 82 82 SER CB C 82 64.785 64.785 63.120 1.665 19806 7779 1 14 . 1 1 83 83 LYS N N 83 119.415 119.415 124.753 -5.338 19806 7780 1 14 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.975 -0.197 19806 7781 1 14 . 1 1 83 83 LYS CA C 83 54.759 54.759 53.763 0.996 19806 7782 1 14 . 1 1 83 83 LYS CB C 83 35.514 35.514 34.210 1.304 19806 7783 1 14 . 1 1 84 84 PHE N N 84 119.220 119.220 118.122 1.098 19806 7784 1 14 . 1 1 84 84 PHE HA H 84 5.441 5.441 4.682 0.759 19806 7785 1 14 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.649 0.765 19806 7786 1 14 . 1 1 84 84 PHE CB C 84 37.523 37.523 39.197 -1.673 19806 7787 1 14 . 1 1 85 85 THR N N 85 119.257 119.257 116.243 3.014 19806 7788 1 14 . 1 1 85 85 THR HA H 85 4.057 4.057 4.298 -0.241 19806 7789 1 14 . 1 1 85 85 THR CA C 85 62.660 62.660 61.875 0.785 19806 7790 1 14 . 1 1 85 85 THR CB C 85 67.698 67.698 68.938 -1.240 19806 7791 1 14 . 1 1 86 86 LEU N N 86 121.612 121.612 121.786 -0.174 19806 7792 1 14 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.850 -0.252 19806 7793 1 14 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.868 0.377 19806 7794 1 14 . 1 1 86 86 LEU CB C 86 44.657 44.657 45.738 -1.081 19806 7795 1 14 . 1 1 87 87 ASN N N 87 127.684 127.684 121.528 6.156 19806 7796 1 14 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.792 0.219 19806 7797 1 14 . 1 1 87 87 ASN CA C 87 51.299 51.299 53.180 -1.881 19806 7798 1 14 . 1 1 87 87 ASN CB C 87 38.595 38.595 39.581 -0.986 19806 7799 1 14 . 1 1 88 88 GLU N N 88 120.509 120.509 124.643 -4.134 19806 7800 1 14 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.906 -0.049 19806 7801 1 14 . 1 1 88 88 GLU CA C 88 54.382 54.382 53.125 1.257 19806 7802 1 14 . 1 1 88 88 GLU CB C 88 29.808 29.808 31.588 -1.780 19806 7803 1 14 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.472 -0.091 19806 7804 1 14 . 1 1 89 89 PRO CA C 89 65.898 65.898 65.026 0.872 19806 7805 1 14 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.143 0.208 19806 7806 1 14 . 1 1 90 90 LYS N N 90 107.288 107.288 114.087 -6.799 19806 7807 1 14 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.608 0.076 19806 7808 1 14 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.602 -0.623 19806 7809 1 14 . 1 1 90 90 LYS CB C 90 32.994 32.994 33.695 -0.701 19806 7810 1 14 . 1 1 91 91 HIS N N 91 119.523 119.523 118.807 0.716 19806 7811 1 14 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.343 0.434 19806 7812 1 14 . 1 1 91 91 HIS CA C 91 53.705 53.705 55.322 -1.617 19806 7813 1 14 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.648 -0.454 19806 7814 1 14 . 1 1 92 92 LYS N N 92 122.527 122.527 128.459 -5.932 19806 7815 1 14 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.587 0.542 19806 7816 1 14 . 1 1 92 92 LYS CA C 92 54.291 54.291 55.408 -1.117 19806 7817 1 14 . 1 1 92 92 LYS CB C 92 37.479 37.479 35.757 1.722 19806 7818 1 14 . 1 1 93 93 ILE N N 93 121.564 121.564 124.541 -2.977 19806 7819 1 14 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.200 1.110 19806 7820 1 14 . 1 1 93 93 ILE CA C 93 61.137 61.137 58.886 2.251 19806 7821 1 14 . 1 1 93 93 ILE CB C 93 41.088 41.088 39.238 1.850 19806 7822 1 14 . 1 1 94 94 PHE N N 94 128.955 128.955 123.812 5.143 19806 7823 1 14 . 1 1 94 94 PHE HA H 94 4.900 4.900 4.887 0.013 19806 7824 1 14 . 1 1 94 94 PHE CA C 94 55.843 55.843 57.295 -1.452 19806 7825 1 14 . 1 1 95 95 GLU N N 95 124.809 124.809 126.288 -1.479 19806 7826 1 14 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.365 0.053 19806 7827 1 14 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.553 0.928 19806 7828 1 14 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.492 1.667 19806 7829 1 14 . 1 1 96 96 ALA N N 96 123.759 123.759 123.859 -0.100 19806 7830 1 14 . 1 1 96 96 ALA HA H 96 5.379 5.379 4.990 0.389 19806 7831 1 14 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.567 -1.026 19806 7832 1 14 . 1 1 96 96 ALA CB C 96 23.830 23.830 22.349 1.481 19806 7833 1 14 . 1 1 97 97 GLY N N 97 106.592 106.592 107.768 -1.176 19806 7834 1 14 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.211 0.224 19806 7835 1 14 . 1 1 98 98 TYR N N 98 119.250 119.250 119.269 -0.019 19806 7836 1 14 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.649 0.169 19806 7837 1 14 . 1 1 98 98 TYR CA C 98 59.387 59.387 58.861 0.526 19806 7838 1 14 . 1 1 98 98 TYR CB C 98 38.122 38.122 38.747 -0.625 19806 7839 1 14 . 1 1 99 99 GLU N N 99 123.080 123.080 124.550 -1.470 19806 7840 1 14 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.059 -0.050 19806 7841 1 14 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.730 -0.321 19806 7842 1 14 . 1 1 99 99 GLU CB C 99 30.254 30.254 29.867 0.387 19806 7843 1 14 . 1 1 100 100 GLU N N 100 116.459 116.459 116.732 -0.273 19806 7844 1 14 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.549 -0.513 19806 7845 1 14 . 1 1 100 100 GLU CA C 100 57.404 57.404 55.981 1.423 19806 7846 1 14 . 1 1 100 100 GLU CB C 100 27.576 27.576 30.052 -2.476 19806 7847 1 14 . 1 1 101 101 SER N N 101 113.069 113.069 115.217 -2.148 19806 7848 1 14 . 1 1 101 101 SER HA H 101 4.839 4.839 4.649 0.190 19806 7849 1 14 . 1 1 101 101 SER CA C 101 56.024 56.024 57.359 -1.335 19806 7850 1 14 . 1 1 101 101 SER CB C 101 64.806 64.806 64.845 -0.039 19806 7851 1 14 . 1 1 102 102 GLU N N 102 120.439 120.439 120.834 -0.395 19806 7852 1 14 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.521 -0.132 19806 7853 1 14 . 1 1 102 102 GLU CA C 102 55.804 55.804 56.038 -0.233 19806 7854 1 14 . 1 1 102 102 GLU CB C 102 29.985 29.985 29.893 0.092 19806 7855 1 14 . 1 1 103 103 VAL N N 103 118.899 118.899 114.643 4.256 19806 7856 1 14 . 1 1 103 103 VAL HA H 103 4.086 4.086 3.817 0.269 19806 7857 1 14 . 1 1 103 103 VAL CA C 103 62.699 62.699 63.285 -0.586 19806 7858 1 14 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.134 0.127 19806 7859 1 14 . 1 1 104 104 ASP N N 104 120.965 120.965 119.387 1.578 19806 7860 1 14 . 1 1 104 104 ASP HA H 104 5.003 5.003 5.017 -0.014 19806 7861 1 14 . 1 1 104 104 ASP CA C 104 54.914 54.914 54.168 0.746 19806 7862 1 14 . 1 1 104 104 ASP CB C 104 42.791 42.791 44.299 -1.508 19806 7863 1 14 . 1 1 105 105 LEU N N 105 120.365 120.365 119.536 0.829 19806 7864 1 14 . 1 1 105 105 LEU HA H 105 5.295 5.295 4.990 0.305 19806 7865 1 14 . 1 1 105 105 LEU CA C 105 54.431 54.431 55.441 -1.010 19806 7866 1 14 . 1 1 105 105 LEU CB C 105 46.001 46.001 44.682 1.319 19806 7867 1 14 . 1 1 106 106 ARG N N 106 126.289 126.289 125.890 0.399 19806 7868 1 14 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.381 0.444 19806 7869 1 14 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.917 -0.245 19806 7870 1 14 . 1 1 106 106 ARG CB C 106 33.920 33.920 34.343 -0.423 19806 7871 1 14 . 1 1 107 107 VAL N N 107 126.145 126.145 122.085 4.060 19806 7872 1 14 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.673 0.006 19806 7873 1 14 . 1 1 107 107 VAL CA C 107 61.671 61.671 59.838 1.833 19806 7874 1 14 . 1 1 107 107 VAL CB C 107 35.350 35.350 36.214 -0.864 19806 7875 1 14 . 1 1 108 108 GLU N N 108 127.093 127.093 117.029 10.064 19806 7876 1 14 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.335 0.932 19806 7877 1 14 . 1 1 108 108 GLU CA C 108 54.761 54.761 54.886 -0.125 19806 7878 1 14 . 1 1 108 108 GLU CB C 108 32.567 32.567 33.344 -0.777 19806 7879 1 14 . 1 1 109 109 PHE N N 109 124.592 124.592 117.109 7.483 19806 7880 1 14 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.694 0.334 19806 7881 1 14 . 1 1 109 109 PHE CA C 109 55.945 55.945 56.328 -0.383 19806 7882 1 14 . 1 1 109 109 PHE CB C 109 43.099 43.099 43.028 0.071 19806 7883 1 14 . 1 1 110 110 GLU N N 110 122.143 122.143 120.237 1.906 19806 7884 1 14 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.628 -0.435 19806 7885 1 14 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.599 0.844 19806 7886 1 14 . 1 1 110 110 GLU CB C 110 35.816 35.816 35.327 0.489 19806 7887 1 14 . 1 1 111 111 LEU N N 111 129.616 129.616 122.860 6.756 19806 7888 1 14 . 1 1 111 111 LEU HA H 111 3.808 3.808 4.256 -0.448 19806 7889 1 14 . 1 1 111 111 LEU CA C 111 53.470 53.470 53.743 -0.273 19806 7890 1 14 . 1 1 111 111 LEU CB C 111 40.400 40.400 43.195 -2.795 19806 7891 1 14 . 1 1 112 112 GLN N N 112 124.742 124.742 126.959 -2.217 19806 7892 1 14 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.208 0.231 19806 7893 1 14 . 1 1 112 112 GLN CA C 112 55.802 55.802 54.670 1.132 19806 7894 1 14 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.507 -0.754 19806 7895 1 14 . 1 1 113 113 ALA N N 113 121.195 121.195 121.655 -0.460 19806 7896 1 14 . 1 1 113 113 ALA HA H 113 4.048 4.048 4.292 -0.244 19806 7897 1 14 . 1 1 113 113 ALA CA C 113 54.518 54.518 52.978 1.540 19806 7898 1 14 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.798 -0.599 19806 7899 1 14 . 1 1 114 114 ASP N N 114 114.525 114.525 119.436 -4.911 19806 7900 1 14 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.460 -0.061 19806 7901 1 14 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.373 -1.465 19806 7902 1 14 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.776 -1.718 19806 7903 1 14 . 1 1 115 115 GLY N N 115 107.526 107.526 108.042 -0.516 19806 7904 1 14 . 1 1 115 115 GLY CA C 115 45.784 45.784 44.765 1.019 19806 7905 1 14 . 1 1 116 116 LYS N N 116 118.818 118.818 118.331 0.487 19806 7906 1 14 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.782 -0.332 19806 7907 1 14 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.039 0.132 19806 7908 1 14 . 1 1 116 116 LYS CB C 116 35.039 35.039 35.544 -0.505 19806 7909 1 14 . 1 1 117 117 TRP N N 117 118.939 118.939 119.079 -0.140 19806 7910 1 14 . 1 1 117 117 TRP CA C 117 56.956 56.956 56.939 0.017 19806 7911 1 14 . 1 1 118 118 TYR N N 118 112.644 112.644 120.557 -7.913 19806 7912 1 14 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.911 0.366 19806 7913 1 14 . 1 1 118 118 TYR CA C 118 56.219 56.219 57.098 -0.879 19806 7914 1 14 . 1 1 118 118 TYR CB C 118 43.282 43.282 42.755 0.527 19806 7915 1 14 . 1 1 119 119 VAL N N 119 119.842 119.842 120.887 -1.045 19806 7916 1 14 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.695 -0.180 19806 7917 1 14 . 1 1 119 119 VAL CA C 119 62.442 62.442 63.319 -0.877 19806 7918 1 14 . 1 1 120 120 VAL N N 120 114.552 114.552 114.176 0.376 19806 7919 1 14 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.427 0.311 19806 7920 1 14 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.544 -0.949 19806 7921 1 14 . 1 1 120 120 VAL CB C 120 32.852 32.852 32.973 -0.121 19806 7922 1 14 . 1 1 121 121 ASP N N 121 118.234 118.234 119.809 -1.575 19806 7923 1 14 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.837 0.426 19806 7924 1 14 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.958 -0.295 19806 7925 1 14 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.677 -0.790 19806 7926 1 14 . 1 1 122 122 CYS N N 122 121.036 121.036 125.508 -4.472 19806 7927 1 14 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.746 0.825 19806 7928 1 14 . 1 1 122 122 CYS CA C 122 57.052 57.052 58.409 -1.357 19806 7929 1 14 . 1 1 122 122 CYS CB C 122 30.834 30.834 28.809 2.025 19806 7930 1 14 . 1 1 123 123 TYR N N 123 127.672 127.672 126.974 0.698 19806 7931 1 14 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.915 0.095 19806 7932 1 14 . 1 1 123 123 TYR CA C 123 57.169 57.169 57.740 -0.571 19806 7933 1 14 . 1 1 123 123 TYR CB C 123 41.408 41.408 42.967 -1.559 19806 7934 1 14 . 1 1 124 124 THR N N 124 120.833 120.833 117.961 2.872 19806 7935 1 14 . 1 1 124 124 THR HA H 124 4.987 4.987 4.772 0.215 19806 7936 1 14 . 1 1 124 124 THR CA C 124 57.153 57.153 60.826 -3.673 19806 7937 1 14 . 1 1 124 124 THR CB C 124 68.607 68.607 71.010 -2.403 19806 7938 1 14 . 1 1 125 125 GLY N N 125 114.347 114.347 112.348 1.999 19806 7939 1 14 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.649 -0.321 19806 7940 1 14 . 1 1 126 126 TRP N N 126 119.918 119.918 121.015 -1.097 19806 7941 1 14 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.016 0.054 19806 7942 1 14 . 1 1 126 126 TRP CA C 126 60.564 60.564 58.481 2.083 19806 7943 1 14 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.215 0.424 19806 7944 1 14 . 1 1 127 127 TYR N N 127 113.911 113.911 111.172 2.739 19806 7945 1 14 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.739 0.255 19806 7946 1 14 . 1 1 127 127 TYR CA C 127 53.384 53.384 56.908 -3.524 19806 7947 1 14 . 1 1 127 127 TYR CB C 127 38.584 38.584 38.434 0.150 19806 7948 1 14 . 1 1 128 128 GLY N N 128 105.181 105.181 106.158 -0.977 19806 7949 1 14 . 1 1 128 128 GLY CA C 128 45.189 45.189 44.383 0.806 19806 7950 1 14 . 1 1 129 129 TYR N N 129 116.588 116.588 119.909 -3.321 19806 7951 1 14 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.229 0.435 19806 7952 1 14 . 1 1 129 129 TYR CA C 129 59.565 59.565 59.594 -0.029 19806 7953 1 14 . 1 1 129 129 TYR CB C 129 38.853 38.853 36.195 2.658 19806 7954 1 14 . 1 1 130 130 ASP N N 130 115.195 115.195 117.122 -1.927 19806 7955 1 14 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.658 -0.273 19806 7956 1 14 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.827 -1.697 19806 7957 1 14 . 1 1 130 130 ASP CB C 130 38.685 38.685 42.267 -3.582 19806 7958 1 14 . 1 1 131 131 LEU N N 131 124.887 124.887 122.657 2.230 19806 7959 1 14 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.928 -0.447 19806 7960 1 14 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.278 1.327 19806 7961 1 14 . 1 1 131 131 LEU CB C 131 42.441 42.441 43.038 -0.597 19806 7962 1 14 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.868 -0.185 19806 7963 1 14 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.468 65.597 19806 7964 1 14 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.219 -0.893 19806 7965 1 14 . 1 1 133 133 ILE N N 133 123.765 123.765 120.342 3.423 19806 7966 1 14 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.703 0.026 19806 7967 1 14 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.228 1.631 19806 7968 1 14 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.149 -0.086 19806 7969 1 14 . 1 1 134 134 GLY N N 134 107.030 107.030 105.825 1.205 19806 7970 1 14 . 1 1 134 134 GLY CA C 134 45.976 45.976 45.466 0.510 19806 7971 1 14 . 1 1 135 135 GLU N N 135 116.566 116.566 120.241 -3.675 19806 7972 1 14 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.561 0.103 19806 7973 1 14 . 1 1 135 135 GLU CA C 135 55.414 55.414 56.182 -0.768 19806 7974 1 14 . 1 1 135 135 GLU CB C 135 30.195 30.195 30.296 -0.101 19806 7975 1 14 . 1 1 136 136 LEU N N 136 124.239 124.239 122.990 1.249 19806 7976 1 14 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.860 0.184 19806 7977 1 14 . 1 1 136 136 LEU CA C 136 59.116 59.116 59.224 -0.108 19806 7978 1 14 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.431 -0.424 19806 7979 1 14 . 1 1 137 137 LYS N N 137 117.225 117.225 116.318 0.907 19806 7980 1 14 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.835 0.028 19806 7981 1 14 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.675 0.780 19806 7982 1 14 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.516 -0.313 19806 7983 1 14 . 1 1 138 138 GLN N N 138 118.718 118.718 118.601 0.117 19806 7984 1 14 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.193 -0.141 19806 7985 1 14 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.487 -0.612 19806 7986 1 14 . 1 1 138 138 GLN CB C 138 28.235 28.235 28.163 0.072 19806 7987 1 14 . 1 1 139 139 THR N N 139 117.970 117.970 117.309 0.661 19806 7988 1 14 . 1 1 139 139 THR HA H 139 4.532 4.532 3.994 0.538 19806 7989 1 14 . 1 1 139 139 THR CA C 139 68.145 68.145 66.703 1.442 19806 7990 1 14 . 1 1 139 139 THR CB C 139 68.103 68.103 68.522 -0.419 19806 7991 1 14 . 1 1 140 140 ILE N N 140 120.391 120.391 122.133 -1.742 19806 7992 1 14 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.613 0.114 19806 7993 1 14 . 1 1 140 140 ILE CA C 140 65.256 65.256 65.435 -0.179 19806 7994 1 14 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.416 0.697 19806 7995 1 14 . 1 1 141 141 GLN N N 141 118.917 118.917 118.282 0.635 19806 7996 1 14 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.935 0.080 19806 7997 1 14 . 1 1 141 141 GLN CA C 141 58.371 58.371 59.058 -0.687 19806 7998 1 14 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.212 -0.865 19806 7999 1 14 . 1 1 142 142 ASN N N 142 119.936 119.936 118.566 1.370 19806 8000 1 14 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.632 -0.117 19806 8001 1 14 . 1 1 142 142 ASN CA C 142 55.799 55.799 56.153 -0.354 19806 8002 1 14 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.712 -1.082 19806 8003 1 14 . 1 1 143 143 VAL N N 143 123.195 123.195 119.211 3.984 19806 8004 1 14 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.478 -0.762 19806 8005 1 14 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.260 0.237 19806 8006 1 14 . 1 1 143 143 VAL CB C 143 30.989 30.989 31.105 -0.116 19806 8007 1 14 . 1 1 144 144 LYS N N 144 120.348 120.348 118.777 1.571 19806 8008 1 14 . 1 1 144 144 LYS HA H 144 3.881 3.881 3.960 -0.079 19806 8009 1 14 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.764 0.360 19806 8010 1 14 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.188 -0.306 19806 8011 1 14 . 1 1 145 145 GLU N N 145 119.220 119.220 119.364 -0.144 19806 8012 1 14 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.091 0.092 19806 8013 1 14 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.135 0.043 19806 8014 1 14 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.571 -0.500 19806 8015 1 14 . 1 1 146 146 GLU N N 146 121.420 121.420 119.510 1.910 19806 8016 1 14 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.097 0.180 19806 8017 1 14 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.207 -0.089 19806 8018 1 14 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.349 -1.006 19806 8019 1 14 . 1 1 147 147 ASN N N 147 119.197 119.197 117.156 2.041 19806 8020 1 14 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.639 -0.072 19806 8021 1 14 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.861 -1.710 19806 8022 1 14 . 1 1 147 147 ASN CB C 147 37.373 37.373 38.068 -0.695 19806 8023 1 14 . 1 1 148 148 ALA N N 148 123.672 123.672 120.823 2.849 19806 8024 1 14 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.510 -0.387 19806 8025 1 14 . 1 1 148 148 ALA CA C 148 55.133 55.133 53.660 1.473 19806 8026 1 14 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.343 -0.736 19806 8027 1 14 . 1 1 149 149 ALA N N 149 119.979 119.979 121.699 -1.720 19806 8028 1 14 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.212 0.049 19806 8029 1 14 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.254 0.391 19806 8030 1 14 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.975 -1.237 19806 8031 1 14 . 1 1 150 150 PHE N N 150 119.592 119.592 120.588 -0.996 19806 8032 1 14 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.140 0.084 19806 8033 1 14 . 1 1 150 150 PHE CA C 150 61.008 61.008 62.027 -1.019 19806 8034 1 14 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.348 -0.286 19806 8035 1 14 . 1 1 151 151 LYS N N 151 116.869 116.869 117.295 -0.426 19806 8036 1 14 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.259 -0.353 19806 8037 1 14 . 1 1 151 151 LYS CA C 151 58.770 58.770 59.038 -0.268 19806 8038 1 14 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.012 0.729 19806 8039 1 14 . 1 1 152 152 GLU N N 152 115.868 115.868 119.223 -3.355 19806 8040 1 14 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.173 -0.120 19806 8041 1 14 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.345 0.311 19806 8042 1 14 . 1 1 152 152 GLU CB C 152 29.753 29.753 30.246 -0.493 19806 8043 1 14 . 1 1 153 153 ILE N N 153 110.437 110.437 118.370 -7.933 19806 8044 1 14 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.705 0.471 19806 8045 1 14 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.321 -1.287 19806 8046 1 14 . 1 1 153 153 ILE CB C 153 39.272 39.272 38.495 0.777 19806 8047 1 14 . 1 1 154 154 HIS N N 154 117.779 117.779 112.771 5.008 19806 8048 1 14 . 1 1 154 154 HIS HA H 154 5.174 5.174 4.989 0.185 19806 8049 1 14 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.087 -0.471 19806 8050 1 14 . 1 1 154 154 HIS CB C 154 28.547 28.547 28.540 0.007 19806 8051 1 15 . 1 1 3 3 SER N N 3 114.847 114.847 117.633 -2.786 19806 8052 1 15 . 1 1 3 3 SER HA H 3 4.463 4.463 4.453 0.010 19806 8053 1 15 . 1 1 3 3 SER CA C 3 58.340 58.340 58.444 -0.104 19806 8054 1 15 . 1 1 3 3 SER CB C 3 63.457 63.457 64.218 -0.761 19806 8055 1 15 . 1 1 4 4 GLU N N 4 121.498 121.498 121.005 0.493 19806 8056 1 15 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.433 -0.101 19806 8057 1 15 . 1 1 4 4 GLU CA C 4 56.443 56.443 55.747 0.696 19806 8058 1 15 . 1 1 4 4 GLU CB C 4 29.966 29.966 30.261 -0.295 19806 8059 1 15 . 1 1 5 5 LEU N N 5 121.589 121.589 122.471 -0.882 19806 8060 1 15 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.562 -0.125 19806 8061 1 15 . 1 1 5 5 LEU CA C 5 55.019 55.019 54.796 0.223 19806 8062 1 15 . 1 1 5 5 LEU CB C 5 42.243 42.243 42.739 -0.496 19806 8063 1 15 . 1 1 6 6 THR N N 6 113.708 113.708 114.315 -0.607 19806 8064 1 15 . 1 1 6 6 THR HA H 6 4.470 4.470 4.545 -0.075 19806 8065 1 15 . 1 1 6 6 THR CA C 6 61.409 61.409 61.597 -0.188 19806 8066 1 15 . 1 1 6 6 THR CB C 6 69.544 69.544 68.707 0.837 19806 8067 1 15 . 1 1 7 7 THR N N 7 114.945 114.945 116.684 -1.739 19806 8068 1 15 . 1 1 7 7 THR HA H 7 4.415 4.415 3.805 0.610 19806 8069 1 15 . 1 1 7 7 THR CA C 7 61.435 61.435 63.022 -1.587 19806 8070 1 15 . 1 1 7 7 THR CB C 7 69.506 69.506 68.778 0.728 19806 8071 1 15 . 1 1 8 8 GLN N N 8 121.368 121.368 119.008 2.360 19806 8072 1 15 . 1 1 8 8 GLN CA C 8 55.684 55.684 56.258 -0.574 19806 8073 1 15 . 1 1 9 9 ASP N N 9 120.595 120.595 120.175 0.420 19806 8074 1 15 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.600 0.047 19806 8075 1 15 . 1 1 9 9 ASP CA C 9 54.115 54.115 54.276 -0.161 19806 8076 1 15 . 1 1 9 9 ASP CB C 9 41.328 41.328 40.883 0.445 19806 8077 1 15 . 1 1 10 10 GLY N N 10 106.984 106.984 105.742 1.242 19806 8078 1 15 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.422 0.073 19806 8079 1 15 . 1 1 11 11 GLU N N 11 120.879 120.879 121.033 -0.154 19806 8080 1 15 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.292 -0.103 19806 8081 1 15 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.772 -0.262 19806 8082 1 15 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.422 1.647 19806 8083 1 15 . 1 1 12 12 ASP N N 12 126.686 126.686 125.338 1.348 19806 8084 1 15 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.545 0.205 19806 8085 1 15 . 1 1 12 12 ASP CA C 12 54.347 54.347 54.138 0.209 19806 8086 1 15 . 1 1 12 12 ASP CB C 12 42.771 42.771 41.959 0.812 19806 8087 1 15 . 1 1 13 13 PHE N N 13 128.055 128.055 122.780 5.275 19806 8088 1 15 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.346 0.066 19806 8089 1 15 . 1 1 13 13 PHE CA C 13 62.551 62.551 59.723 2.828 19806 8090 1 15 . 1 1 13 13 PHE CB C 13 38.833 38.833 37.837 0.996 19806 8091 1 15 . 1 1 14 14 LYS N N 14 117.498 117.498 119.824 -2.326 19806 8092 1 15 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.937 -0.356 19806 8093 1 15 . 1 1 14 14 LYS CA C 14 59.461 59.461 58.561 0.900 19806 8094 1 15 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.365 -0.021 19806 8095 1 15 . 1 1 15 15 SER N N 15 113.775 113.775 114.117 -0.342 19806 8096 1 15 . 1 1 15 15 SER HA H 15 4.167 4.167 4.162 0.005 19806 8097 1 15 . 1 1 15 15 SER CA C 15 61.099 61.099 62.040 -0.941 19806 8098 1 15 . 1 1 15 15 SER CB C 15 62.428 62.428 62.697 -0.269 19806 8099 1 15 . 1 1 16 16 PHE N N 16 122.292 122.292 120.478 1.814 19806 8100 1 15 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.483 -0.193 19806 8101 1 15 . 1 1 16 16 PHE CA C 16 59.773 59.773 59.372 0.401 19806 8102 1 15 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.590 -1.415 19806 8103 1 15 . 1 1 17 17 LEU N N 17 122.472 122.472 122.573 -0.101 19806 8104 1 15 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.284 -0.434 19806 8105 1 15 . 1 1 17 17 LEU CA C 17 56.619 56.619 57.611 -0.992 19806 8106 1 15 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.456 0.006 19806 8107 1 15 . 1 1 18 18 ASP N N 18 117.331 117.331 118.777 -1.446 19806 8108 1 15 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.149 -0.034 19806 8109 1 15 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.413 -1.018 19806 8110 1 15 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.489 -0.136 19806 8111 1 15 . 1 1 19 19 LYS N N 19 120.032 120.032 119.692 0.340 19806 8112 1 15 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.916 -0.239 19806 8113 1 15 . 1 1 19 19 LYS CA C 19 59.067 59.067 59.391 -0.324 19806 8114 1 15 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.434 -0.498 19806 8115 1 15 . 1 1 20 20 PHE N N 20 119.607 119.607 119.587 0.020 19806 8116 1 15 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.344 -0.235 19806 8117 1 15 . 1 1 20 20 PHE CA C 20 62.090 62.090 60.226 1.864 19806 8118 1 15 . 1 1 20 20 PHE CB C 20 40.469 40.469 38.507 1.962 19806 8119 1 15 . 1 1 21 21 THR N N 21 101.473 101.473 110.666 -9.193 19806 8120 1 15 . 1 1 21 21 THR HA H 21 4.259 4.259 3.712 0.547 19806 8121 1 15 . 1 1 21 21 THR CA C 21 61.774 61.774 63.644 -1.870 19806 8122 1 15 . 1 1 22 22 SER N N 22 111.453 111.453 116.746 -5.293 19806 8123 1 15 . 1 1 22 22 SER HA H 22 4.165 4.165 4.332 -0.167 19806 8124 1 15 . 1 1 22 22 SER CA C 22 58.215 58.215 57.623 0.592 19806 8125 1 15 . 1 1 22 22 SER CB C 22 64.570 64.570 63.169 1.401 19806 8126 1 15 . 1 1 23 23 SER N N 23 114.184 114.184 117.108 -2.924 19806 8127 1 15 . 1 1 23 23 SER HA H 23 4.764 4.764 4.792 -0.028 19806 8128 1 15 . 1 1 23 23 SER CA C 23 55.669 55.669 58.618 -2.949 19806 8129 1 15 . 1 1 23 23 SER CB C 23 64.011 64.011 65.591 -1.580 19806 8130 1 15 . 1 1 24 24 ALA N N 24 133.370 133.370 128.850 4.520 19806 8131 1 15 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.442 -0.486 19806 8132 1 15 . 1 1 24 24 ALA CA C 24 55.106 55.106 54.404 0.702 19806 8133 1 15 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.662 0.173 19806 8134 1 15 . 1 1 25 25 ALA N N 25 117.430 117.430 121.400 -3.970 19806 8135 1 15 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.390 -0.073 19806 8136 1 15 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.782 0.419 19806 8137 1 15 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.268 0.081 19806 8138 1 15 . 1 1 26 26 PHE N N 26 116.042 116.042 115.440 0.602 19806 8139 1 15 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.678 -0.368 19806 8140 1 15 . 1 1 26 26 PHE CA C 26 60.759 60.759 59.377 1.382 19806 8141 1 15 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.459 -0.149 19806 8142 1 15 . 1 1 27 27 GLN N N 27 121.820 121.820 121.643 0.177 19806 8143 1 15 . 1 1 27 27 GLN HA H 27 3.391 3.391 4.006 -0.615 19806 8144 1 15 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.757 0.337 19806 8145 1 15 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.918 -1.460 19806 8146 1 15 . 1 1 28 28 TYR N N 28 111.517 111.517 115.084 -3.567 19806 8147 1 15 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.822 0.308 19806 8148 1 15 . 1 1 28 28 TYR CA C 28 62.357 62.357 59.923 2.434 19806 8149 1 15 . 1 1 28 28 TYR CB C 28 38.568 38.568 38.244 0.324 19806 8150 1 15 . 1 1 29 29 THR N N 29 106.324 106.324 111.039 -4.715 19806 8151 1 15 . 1 1 29 29 THR HA H 29 4.489 4.489 4.348 0.141 19806 8152 1 15 . 1 1 29 29 THR CA C 29 63.765 63.765 61.099 2.666 19806 8153 1 15 . 1 1 29 29 THR CB C 29 69.568 69.568 67.867 1.701 19806 8154 1 15 . 1 1 30 30 ARG N N 30 117.696 117.696 119.650 -1.954 19806 8155 1 15 . 1 1 30 30 ARG HA H 30 4.701 4.701 4.124 0.577 19806 8156 1 15 . 1 1 30 30 ARG CA C 30 52.760 52.760 54.665 -1.905 19806 8157 1 15 . 1 1 30 30 ARG CB C 30 35.047 35.047 30.253 4.793 19806 8158 1 15 . 1 1 31 31 VAL N N 31 119.395 119.395 119.944 -0.549 19806 8159 1 15 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.811 -0.581 19806 8160 1 15 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.735 0.456 19806 8161 1 15 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.727 -2.554 19806 8162 1 15 . 1 1 32 32 LYS N N 32 126.124 126.124 125.805 0.319 19806 8163 1 15 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.681 -0.497 19806 8164 1 15 . 1 1 32 32 LYS CA C 32 53.958 53.958 55.940 -1.982 19806 8165 1 15 . 1 1 32 32 LYS CB C 32 31.112 31.112 34.047 -2.934 19806 8166 1 15 . 1 1 33 33 PHE N N 33 119.303 119.303 118.770 0.533 19806 8167 1 15 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.862 -0.348 19806 8168 1 15 . 1 1 33 33 PHE CA C 33 56.272 56.272 54.999 1.273 19806 8169 1 15 . 1 1 33 33 PHE CB C 33 40.378 40.378 40.768 -0.390 19806 8170 1 15 . 1 1 34 34 PRO HA H 34 4.968 4.968 3.941 1.027 19806 8171 1 15 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.263 -0.630 19806 8172 1 15 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.834 0.898 19806 8173 1 15 . 1 1 35 35 LEU N N 35 120.016 120.016 118.316 1.700 19806 8174 1 15 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.511 -0.289 19806 8175 1 15 . 1 1 35 35 LEU CA C 35 54.840 54.840 54.141 0.699 19806 8176 1 15 . 1 1 35 35 LEU CB C 35 41.244 41.244 42.813 -1.569 19806 8177 1 15 . 1 1 36 36 LYS N N 36 117.066 117.066 119.411 -2.345 19806 8178 1 15 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.326 -0.351 19806 8179 1 15 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.345 2.902 19806 8180 1 15 . 1 1 36 36 LYS CB C 36 32.832 32.832 33.076 -0.244 19806 8181 1 15 . 1 1 37 37 THR N N 37 117.574 117.574 118.289 -0.715 19806 8182 1 15 . 1 1 37 37 THR HA H 37 4.797 4.797 4.789 0.008 19806 8183 1 15 . 1 1 37 37 THR CA C 37 60.396 60.396 59.815 0.581 19806 8184 1 15 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.636 0.383 19806 8185 1 15 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.676 -0.753 19806 8186 1 15 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.734 -0.103 19806 8187 1 15 . 1 1 39 39 ILE N N 39 119.949 119.949 120.317 -0.368 19806 8188 1 15 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.277 -0.038 19806 8189 1 15 . 1 1 39 39 ILE CA C 39 62.133 62.133 62.986 -0.853 19806 8190 1 15 . 1 1 40 40 THR N N 40 123.962 123.962 123.665 0.297 19806 8191 1 15 . 1 1 40 40 THR HA H 40 5.057 5.057 5.278 -0.221 19806 8192 1 15 . 1 1 40 40 THR CA C 40 62.262 62.262 61.617 0.645 19806 8193 1 15 . 1 1 40 40 THR CB C 40 69.891 69.891 70.691 -0.800 19806 8194 1 15 . 1 1 41 41 LEU N N 41 125.633 125.633 120.260 5.373 19806 8195 1 15 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.648 0.454 19806 8196 1 15 . 1 1 41 41 LEU CA C 41 52.638 52.638 52.450 0.188 19806 8197 1 15 . 1 1 41 41 LEU CB C 41 45.180 45.180 44.025 1.155 19806 8198 1 15 . 1 1 42 42 LEU N N 42 120.788 120.788 120.984 -0.196 19806 8199 1 15 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.679 0.069 19806 8200 1 15 . 1 1 42 42 LEU CA C 42 53.724 53.724 53.495 0.229 19806 8201 1 15 . 1 1 42 42 LEU CB C 42 44.384 44.384 42.334 2.050 19806 8202 1 15 . 1 1 43 43 ALA N N 43 123.073 123.073 128.032 -4.959 19806 8203 1 15 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.168 0.262 19806 8204 1 15 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.659 -1.371 19806 8205 1 15 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.367 0.647 19806 8206 1 15 . 1 1 44 44 ASP N N 44 118.196 118.196 117.713 0.483 19806 8207 1 15 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.388 0.038 19806 8208 1 15 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.568 -0.540 19806 8209 1 15 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.909 -0.699 19806 8210 1 15 . 1 1 45 45 ASP N N 45 115.018 115.018 118.112 -3.094 19806 8211 1 15 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.493 -0.024 19806 8212 1 15 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.434 -0.641 19806 8213 1 15 . 1 1 45 45 ASP CB C 45 39.864 39.864 40.725 -0.861 19806 8214 1 15 . 1 1 46 46 GLY N N 46 107.499 107.499 108.051 -0.552 19806 8215 1 15 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.496 0.418 19806 8216 1 15 . 1 1 47 47 GLU N N 47 117.331 117.331 117.853 -0.522 19806 8217 1 15 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.609 -0.078 19806 8218 1 15 . 1 1 47 47 GLU CA C 47 56.938 56.938 55.436 1.502 19806 8219 1 15 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.132 3.001 19806 8220 1 15 . 1 1 48 48 THR N N 48 118.462 118.462 116.818 1.644 19806 8221 1 15 . 1 1 48 48 THR HA H 48 4.243 4.243 4.463 -0.220 19806 8222 1 15 . 1 1 48 48 THR CA C 48 62.834 62.834 62.250 0.584 19806 8223 1 15 . 1 1 48 48 THR CB C 48 68.649 68.649 70.555 -1.906 19806 8224 1 15 . 1 1 49 49 GLU N N 49 123.834 123.834 127.247 -3.413 19806 8225 1 15 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.498 0.447 19806 8226 1 15 . 1 1 49 49 GLU CA C 49 55.358 55.358 56.915 -1.557 19806 8227 1 15 . 1 1 49 49 GLU CB C 49 31.395 31.395 30.586 0.809 19806 8228 1 15 . 1 1 50 50 LYS N N 50 122.868 122.868 126.514 -3.646 19806 8229 1 15 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.819 -0.178 19806 8230 1 15 . 1 1 50 50 LYS CA C 50 54.111 54.111 54.608 -0.497 19806 8231 1 15 . 1 1 50 50 LYS CB C 50 35.312 35.312 35.488 -0.176 19806 8232 1 15 . 1 1 51 51 THR N N 51 111.386 111.386 116.066 -4.680 19806 8233 1 15 . 1 1 51 51 THR HA H 51 5.619 5.619 5.265 0.354 19806 8234 1 15 . 1 1 51 51 THR CA C 51 58.980 58.980 62.150 -3.170 19806 8235 1 15 . 1 1 51 51 THR CB C 51 71.277 71.277 69.644 1.633 19806 8236 1 15 . 1 1 52 52 PHE N N 52 120.631 120.631 121.750 -1.119 19806 8237 1 15 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.816 0.147 19806 8238 1 15 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.401 -1.272 19806 8239 1 15 . 1 1 52 52 PHE CB C 52 41.049 41.049 42.760 -1.711 19806 8240 1 15 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.233 0.215 19806 8241 1 15 . 1 1 53 53 PRO CA C 53 62.489 62.489 62.316 0.173 19806 8242 1 15 . 1 1 53 53 PRO CB C 53 32.240 32.240 31.195 1.044 19806 8243 1 15 . 1 1 54 54 PHE N N 54 128.034 128.034 121.457 6.577 19806 8244 1 15 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.748 0.080 19806 8245 1 15 . 1 1 54 54 PHE CA C 54 55.509 55.509 55.398 0.111 19806 8246 1 15 . 1 1 54 54 PHE CB C 54 37.028 37.028 36.596 0.432 19806 8247 1 15 . 1 1 55 55 THR N N 55 111.757 111.757 113.218 -1.461 19806 8248 1 15 . 1 1 55 55 THR HA H 55 4.413 4.413 4.693 -0.280 19806 8249 1 15 . 1 1 55 55 THR CA C 55 60.578 60.578 61.036 -0.458 19806 8250 1 15 . 1 1 55 55 THR CB C 55 69.447 69.447 70.598 -1.151 19806 8251 1 15 . 1 1 56 56 LYS N N 56 118.734 118.734 120.537 -1.803 19806 8252 1 15 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.086 -1.604 19806 8253 1 15 . 1 1 56 56 LYS CA C 56 59.381 59.381 59.360 0.021 19806 8254 1 15 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.001 1.249 19806 8255 1 15 . 1 1 57 57 GLU N N 57 119.675 119.675 118.469 1.206 19806 8256 1 15 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.172 0.097 19806 8257 1 15 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.501 -1.349 19806 8258 1 15 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.962 -3.012 19806 8259 1 15 . 1 1 58 58 LYS N N 58 114.700 114.700 116.887 -2.187 19806 8260 1 15 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.652 -0.340 19806 8261 1 15 . 1 1 58 58 LYS CA C 58 55.595 55.595 55.191 0.405 19806 8262 1 15 . 1 1 58 58 LYS CB C 58 32.011 32.011 31.803 0.208 19806 8263 1 15 . 1 1 59 59 TRP N N 59 118.204 118.204 125.100 -6.896 19806 8264 1 15 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.166 -0.067 19806 8265 1 15 . 1 1 59 59 TRP CA C 59 55.577 55.577 54.947 0.631 19806 8266 1 15 . 1 1 59 59 TRP CB C 59 32.037 32.037 30.252 1.785 19806 8267 1 15 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.455 -0.192 19806 8268 1 15 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.304 -2.583 19806 8269 1 15 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.410 -2.561 19806 8270 1 15 . 1 1 61 61 LEU N N 61 123.758 123.758 124.208 -0.450 19806 8271 1 15 . 1 1 61 61 LEU HA H 61 3.639 3.639 3.873 -0.234 19806 8272 1 15 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.725 0.150 19806 8273 1 15 . 1 1 61 61 LEU CB C 61 40.815 40.815 40.959 -0.144 19806 8274 1 15 . 1 1 62 62 LEU N N 62 124.052 124.052 126.081 -2.029 19806 8275 1 15 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.372 -0.017 19806 8276 1 15 . 1 1 62 62 LEU CA C 62 53.992 53.992 54.462 -0.470 19806 8277 1 15 . 1 1 62 62 LEU CB C 62 44.686 44.686 42.807 1.879 19806 8278 1 15 . 1 1 63 63 ASP N N 63 117.271 117.271 120.986 -3.715 19806 8279 1 15 . 1 1 63 63 ASP HA H 63 5.033 5.033 5.229 -0.196 19806 8280 1 15 . 1 1 63 63 ASP CA C 63 51.101 51.101 53.433 -2.332 19806 8281 1 15 . 1 1 63 63 ASP CB C 63 43.345 43.345 44.048 -0.703 19806 8282 1 15 . 1 1 64 64 SER N N 64 112.856 112.856 115.397 -2.541 19806 8283 1 15 . 1 1 64 64 SER HA H 64 3.865 3.865 4.283 -0.418 19806 8284 1 15 . 1 1 64 64 SER CA C 64 60.910 60.910 61.339 -0.429 19806 8285 1 15 . 1 1 64 64 SER CB C 64 62.378 62.378 63.511 -1.133 19806 8286 1 15 . 1 1 65 65 GLU N N 65 120.070 120.070 120.115 -0.045 19806 8287 1 15 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.237 -0.219 19806 8288 1 15 . 1 1 65 65 GLU CA C 65 58.343 58.343 59.206 -0.863 19806 8289 1 15 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.428 -0.541 19806 8290 1 15 . 1 1 66 66 THR N N 66 115.852 115.852 112.531 3.321 19806 8291 1 15 . 1 1 66 66 THR HA H 66 3.991 3.991 4.362 -0.371 19806 8292 1 15 . 1 1 66 66 THR CA C 66 65.804 65.804 63.986 1.818 19806 8293 1 15 . 1 1 66 66 THR CB C 66 68.451 68.451 68.879 -0.428 19806 8294 1 15 . 1 1 67 67 MET N N 67 113.585 113.585 122.639 -9.054 19806 8295 1 15 . 1 1 67 67 MET HA H 67 4.267 4.267 4.307 -0.040 19806 8296 1 15 . 1 1 67 67 MET CA C 67 52.135 52.135 55.302 -3.167 19806 8297 1 15 . 1 1 67 67 MET CB C 67 28.963 28.963 31.127 -2.164 19806 8298 1 15 . 1 1 68 68 LYS N N 68 118.462 118.462 121.429 -2.967 19806 8299 1 15 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.590 -0.220 19806 8300 1 15 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.348 0.134 19806 8301 1 15 . 1 1 68 68 LYS CB C 68 34.179 34.179 34.518 -0.339 19806 8302 1 15 . 1 1 69 69 GLU N N 69 121.700 121.700 125.283 -3.583 19806 8303 1 15 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.557 -0.033 19806 8304 1 15 . 1 1 69 69 GLU CA C 69 55.942 55.942 57.047 -1.105 19806 8305 1 15 . 1 1 69 69 GLU CB C 69 30.424 30.424 30.105 0.319 19806 8306 1 15 . 1 1 70 70 GLU N N 70 123.445 123.445 125.396 -1.951 19806 8307 1 15 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.651 0.046 19806 8308 1 15 . 1 1 70 70 GLU CA C 70 55.473 55.473 54.988 0.485 19806 8309 1 15 . 1 1 70 70 GLU CB C 70 33.162 33.162 32.509 0.653 19806 8310 1 15 . 1 1 71 71 ARG N N 71 122.150 122.150 120.114 2.036 19806 8311 1 15 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.896 0.255 19806 8312 1 15 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.216 0.232 19806 8313 1 15 . 1 1 71 71 ARG CB C 71 31.703 31.703 33.131 -1.428 19806 8314 1 15 . 1 1 72 72 ILE N N 72 125.686 125.686 126.343 -0.657 19806 8315 1 15 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.483 0.113 19806 8316 1 15 . 1 1 72 72 ILE CA C 72 59.512 59.512 60.269 -0.756 19806 8317 1 15 . 1 1 72 72 ILE CB C 72 41.095 41.095 39.906 1.189 19806 8318 1 15 . 1 1 73 73 THR N N 73 121.600 121.600 122.161 -0.561 19806 8319 1 15 . 1 1 73 73 THR HA H 73 4.603 4.603 4.332 0.271 19806 8320 1 15 . 1 1 73 73 THR CA C 73 61.937 61.937 62.796 -0.859 19806 8321 1 15 . 1 1 73 73 THR CB C 73 68.669 68.669 69.345 -0.676 19806 8322 1 15 . 1 1 74 74 GLN N N 74 124.607 124.607 126.064 -1.457 19806 8323 1 15 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.659 -0.078 19806 8324 1 15 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.462 0.227 19806 8325 1 15 . 1 1 74 74 GLN CB C 74 29.490 29.490 31.503 -2.014 19806 8326 1 15 . 1 1 75 75 GLU N N 75 122.962 122.962 119.039 3.923 19806 8327 1 15 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.456 -0.397 19806 8328 1 15 . 1 1 75 75 GLU CA C 75 58.845 58.845 57.003 1.842 19806 8329 1 15 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.504 -0.931 19806 8330 1 15 . 1 1 76 76 GLU N N 76 115.466 115.466 118.321 -2.855 19806 8331 1 15 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.622 -0.314 19806 8332 1 15 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.333 0.444 19806 8333 1 15 . 1 1 76 76 GLU CB C 76 29.072 29.072 30.678 -1.606 19806 8334 1 15 . 1 1 77 77 GLY N N 77 106.771 106.771 108.377 -1.606 19806 8335 1 15 . 1 1 77 77 GLY CA C 77 45.014 45.014 44.891 0.123 19806 8336 1 15 . 1 1 78 78 GLY N N 78 108.535 108.535 107.590 0.945 19806 8337 1 15 . 1 1 78 78 GLY CA C 78 44.707 44.707 45.555 -0.848 19806 8338 1 15 . 1 1 79 79 ILE N N 79 121.066 121.066 121.582 -0.516 19806 8339 1 15 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.956 -0.149 19806 8340 1 15 . 1 1 79 79 ILE CA C 79 60.343 60.343 60.684 -0.341 19806 8341 1 15 . 1 1 79 79 ILE CB C 79 39.220 39.220 38.666 0.554 19806 8342 1 15 . 1 1 80 80 TYR N N 80 130.709 130.709 130.019 0.690 19806 8343 1 15 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.395 -0.131 19806 8344 1 15 . 1 1 80 80 TYR CA C 80 58.161 58.161 58.758 -0.597 19806 8345 1 15 . 1 1 80 80 TYR CB C 80 40.621 40.621 39.361 1.260 19806 8346 1 15 . 1 1 81 81 VAL N N 81 126.965 126.965 126.207 0.758 19806 8347 1 15 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.580 0.274 19806 8348 1 15 . 1 1 81 81 VAL CA C 81 60.457 60.457 60.800 -0.343 19806 8349 1 15 . 1 1 81 81 VAL CB C 81 35.004 35.004 35.681 -0.677 19806 8350 1 15 . 1 1 82 82 SER N N 82 120.914 120.914 124.139 -3.225 19806 8351 1 15 . 1 1 82 82 SER HA H 82 5.185 5.185 4.533 0.652 19806 8352 1 15 . 1 1 82 82 SER CA C 82 55.260 55.260 57.966 -2.706 19806 8353 1 15 . 1 1 82 82 SER CB C 82 64.785 64.785 63.218 1.567 19806 8354 1 15 . 1 1 83 83 LYS N N 83 119.415 119.415 123.741 -4.326 19806 8355 1 15 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.305 0.473 19806 8356 1 15 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.168 0.591 19806 8357 1 15 . 1 1 83 83 LYS CB C 83 35.514 35.514 36.869 -1.355 19806 8358 1 15 . 1 1 84 84 PHE N N 84 119.220 119.220 118.839 0.381 19806 8359 1 15 . 1 1 84 84 PHE HA H 84 5.441 5.441 4.981 0.460 19806 8360 1 15 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.743 0.671 19806 8361 1 15 . 1 1 84 84 PHE CB C 84 37.523 37.523 39.080 -1.557 19806 8362 1 15 . 1 1 85 85 THR N N 85 119.257 119.257 112.173 7.084 19806 8363 1 15 . 1 1 85 85 THR HA H 85 4.057 4.057 4.337 -0.280 19806 8364 1 15 . 1 1 85 85 THR CA C 85 62.660 62.660 62.378 0.282 19806 8365 1 15 . 1 1 85 85 THR CB C 85 67.698 67.698 69.683 -1.985 19806 8366 1 15 . 1 1 86 86 LEU N N 86 121.612 121.612 122.402 -0.790 19806 8367 1 15 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.769 -0.171 19806 8368 1 15 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.620 0.625 19806 8369 1 15 . 1 1 86 86 LEU CB C 86 44.657 44.657 44.883 -0.226 19806 8370 1 15 . 1 1 87 87 ASN N N 87 127.684 127.684 120.372 7.312 19806 8371 1 15 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.549 0.462 19806 8372 1 15 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.178 -0.879 19806 8373 1 15 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.679 -0.084 19806 8374 1 15 . 1 1 88 88 GLU N N 88 120.509 120.509 121.159 -0.650 19806 8375 1 15 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.394 0.463 19806 8376 1 15 . 1 1 88 88 GLU CA C 88 54.382 54.382 55.560 -1.178 19806 8377 1 15 . 1 1 88 88 GLU CB C 88 29.808 29.808 29.529 0.279 19806 8378 1 15 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.443 -0.062 19806 8379 1 15 . 1 1 89 89 PRO CA C 89 65.898 65.898 65.055 0.843 19806 8380 1 15 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.066 0.285 19806 8381 1 15 . 1 1 90 90 LYS N N 90 107.288 107.288 115.271 -7.983 19806 8382 1 15 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.770 -0.086 19806 8383 1 15 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.896 -0.917 19806 8384 1 15 . 1 1 90 90 LYS CB C 90 32.994 32.994 33.437 -0.443 19806 8385 1 15 . 1 1 91 91 HIS N N 91 119.523 119.523 117.427 2.096 19806 8386 1 15 . 1 1 91 91 HIS HA H 91 5.777 5.777 4.838 0.939 19806 8387 1 15 . 1 1 91 91 HIS CA C 91 53.705 53.705 55.024 -1.319 19806 8388 1 15 . 1 1 91 91 HIS CB C 91 32.194 32.194 31.730 0.464 19806 8389 1 15 . 1 1 92 92 LYS N N 92 122.527 122.527 128.079 -5.552 19806 8390 1 15 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.599 0.530 19806 8391 1 15 . 1 1 92 92 LYS CA C 92 54.291 54.291 55.328 -1.037 19806 8392 1 15 . 1 1 92 92 LYS CB C 92 37.479 37.479 35.048 2.431 19806 8393 1 15 . 1 1 93 93 ILE N N 93 121.564 121.564 125.971 -4.407 19806 8394 1 15 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.441 0.869 19806 8395 1 15 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.838 0.299 19806 8396 1 15 . 1 1 93 93 ILE CB C 93 41.088 41.088 37.798 3.290 19806 8397 1 15 . 1 1 94 94 PHE N N 94 128.955 128.955 129.509 -0.554 19806 8398 1 15 . 1 1 94 94 PHE HA H 94 4.900 4.900 4.765 0.135 19806 8399 1 15 . 1 1 94 94 PHE CA C 94 55.843 55.843 56.680 -0.837 19806 8400 1 15 . 1 1 95 95 GLU N N 95 124.809 124.809 127.277 -2.468 19806 8401 1 15 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.280 0.138 19806 8402 1 15 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.997 0.484 19806 8403 1 15 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.864 1.296 19806 8404 1 15 . 1 1 96 96 ALA N N 96 123.759 123.759 121.886 1.873 19806 8405 1 15 . 1 1 96 96 ALA HA H 96 5.379 5.379 4.576 0.803 19806 8406 1 15 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.637 -1.096 19806 8407 1 15 . 1 1 96 96 ALA CB C 96 23.830 23.830 21.971 1.859 19806 8408 1 15 . 1 1 97 97 GLY N N 97 106.592 106.592 107.441 -0.849 19806 8409 1 15 . 1 1 97 97 GLY CA C 97 45.435 45.435 44.461 0.974 19806 8410 1 15 . 1 1 98 98 TYR N N 98 119.250 119.250 120.061 -0.811 19806 8411 1 15 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.697 0.121 19806 8412 1 15 . 1 1 98 98 TYR CA C 98 59.387 59.387 58.784 0.603 19806 8413 1 15 . 1 1 98 98 TYR CB C 98 38.122 38.122 39.045 -0.923 19806 8414 1 15 . 1 1 99 99 GLU N N 99 123.080 123.080 120.823 2.257 19806 8415 1 15 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.165 -0.156 19806 8416 1 15 . 1 1 99 99 GLU CA C 99 58.409 58.409 57.985 0.424 19806 8417 1 15 . 1 1 99 99 GLU CB C 99 30.254 30.254 30.340 -0.086 19806 8418 1 15 . 1 1 100 100 GLU N N 100 116.459 116.459 115.777 0.682 19806 8419 1 15 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.396 -0.360 19806 8420 1 15 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.421 0.983 19806 8421 1 15 . 1 1 100 100 GLU CB C 100 27.576 27.576 31.047 -3.471 19806 8422 1 15 . 1 1 101 101 SER N N 101 113.069 113.069 114.910 -1.841 19806 8423 1 15 . 1 1 101 101 SER HA H 101 4.839 4.839 4.619 0.220 19806 8424 1 15 . 1 1 101 101 SER CA C 101 56.024 56.024 57.402 -1.378 19806 8425 1 15 . 1 1 101 101 SER CB C 101 64.806 64.806 64.634 0.172 19806 8426 1 15 . 1 1 102 102 GLU N N 102 120.439 120.439 122.145 -1.706 19806 8427 1 15 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.420 -0.031 19806 8428 1 15 . 1 1 102 102 GLU CA C 102 55.804 55.804 55.966 -0.162 19806 8429 1 15 . 1 1 102 102 GLU CB C 102 29.985 29.985 29.855 0.130 19806 8430 1 15 . 1 1 103 103 VAL N N 103 118.899 118.899 117.663 1.236 19806 8431 1 15 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.021 0.065 19806 8432 1 15 . 1 1 103 103 VAL CA C 103 62.699 62.699 62.438 0.261 19806 8433 1 15 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.183 0.078 19806 8434 1 15 . 1 1 104 104 ASP N N 104 120.965 120.965 119.324 1.641 19806 8435 1 15 . 1 1 104 104 ASP HA H 104 5.003 5.003 5.071 -0.068 19806 8436 1 15 . 1 1 104 104 ASP CA C 104 54.914 54.914 54.642 0.272 19806 8437 1 15 . 1 1 104 104 ASP CB C 104 42.791 42.791 43.983 -1.192 19806 8438 1 15 . 1 1 105 105 LEU N N 105 120.365 120.365 119.947 0.418 19806 8439 1 15 . 1 1 105 105 LEU HA H 105 5.295 5.295 4.981 0.314 19806 8440 1 15 . 1 1 105 105 LEU CA C 105 54.431 54.431 55.129 -0.698 19806 8441 1 15 . 1 1 105 105 LEU CB C 105 46.001 46.001 45.437 0.564 19806 8442 1 15 . 1 1 106 106 ARG N N 106 126.289 126.289 126.146 0.143 19806 8443 1 15 . 1 1 106 106 ARG HA H 106 5.825 5.825 4.970 0.855 19806 8444 1 15 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.569 0.103 19806 8445 1 15 . 1 1 106 106 ARG CB C 106 33.920 33.920 33.250 0.670 19806 8446 1 15 . 1 1 107 107 VAL N N 107 126.145 126.145 119.076 7.069 19806 8447 1 15 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.726 -0.047 19806 8448 1 15 . 1 1 107 107 VAL CA C 107 61.671 61.671 59.245 2.426 19806 8449 1 15 . 1 1 107 107 VAL CB C 107 35.350 35.350 35.349 0.001 19806 8450 1 15 . 1 1 108 108 GLU N N 108 127.093 127.093 120.024 7.069 19806 8451 1 15 . 1 1 108 108 GLU HA H 108 5.267 5.267 5.056 0.211 19806 8452 1 15 . 1 1 108 108 GLU CA C 108 54.761 54.761 55.245 -0.484 19806 8453 1 15 . 1 1 108 108 GLU CB C 108 32.567 32.567 34.521 -1.954 19806 8454 1 15 . 1 1 109 109 PHE N N 109 124.592 124.592 122.364 2.228 19806 8455 1 15 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.375 0.653 19806 8456 1 15 . 1 1 109 109 PHE CA C 109 55.945 55.945 55.773 0.172 19806 8457 1 15 . 1 1 109 109 PHE CB C 109 43.099 43.099 40.800 2.299 19806 8458 1 15 . 1 1 110 110 GLU N N 110 122.143 122.143 122.736 -0.593 19806 8459 1 15 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.482 -0.289 19806 8460 1 15 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.310 1.133 19806 8461 1 15 . 1 1 110 110 GLU CB C 110 35.816 35.816 33.283 2.533 19806 8462 1 15 . 1 1 111 111 LEU N N 111 129.616 129.616 125.817 3.799 19806 8463 1 15 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.486 0.322 19806 8464 1 15 . 1 1 111 111 LEU CA C 111 53.470 53.470 54.829 -1.359 19806 8465 1 15 . 1 1 111 111 LEU CB C 111 40.400 40.400 41.249 -0.849 19806 8466 1 15 . 1 1 112 112 GLN N N 112 124.742 124.742 123.573 1.169 19806 8467 1 15 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.364 0.075 19806 8468 1 15 . 1 1 112 112 GLN CA C 112 55.802 55.802 54.151 1.651 19806 8469 1 15 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.841 -1.088 19806 8470 1 15 . 1 1 113 113 ALA N N 113 121.195 121.195 124.430 -3.235 19806 8471 1 15 . 1 1 113 113 ALA HA H 113 4.048 4.048 3.910 0.138 19806 8472 1 15 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.295 0.223 19806 8473 1 15 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.354 -0.155 19806 8474 1 15 . 1 1 114 114 ASP N N 114 114.525 114.525 117.962 -3.437 19806 8475 1 15 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.396 0.003 19806 8476 1 15 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.500 -1.592 19806 8477 1 15 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.911 -1.853 19806 8478 1 15 . 1 1 115 115 GLY N N 115 107.526 107.526 106.842 0.684 19806 8479 1 15 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.032 0.752 19806 8480 1 15 . 1 1 116 116 LYS N N 116 118.818 118.818 120.756 -1.938 19806 8481 1 15 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.650 -0.200 19806 8482 1 15 . 1 1 116 116 LYS CA C 116 54.171 54.171 55.432 -1.261 19806 8483 1 15 . 1 1 116 116 LYS CB C 116 35.039 35.039 33.581 1.458 19806 8484 1 15 . 1 1 117 117 TRP N N 117 118.939 118.939 123.246 -4.307 19806 8485 1 15 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.669 -0.713 19806 8486 1 15 . 1 1 118 118 TYR N N 118 112.644 112.644 120.749 -8.105 19806 8487 1 15 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.650 0.627 19806 8488 1 15 . 1 1 118 118 TYR CA C 118 56.219 56.219 57.309 -1.091 19806 8489 1 15 . 1 1 118 118 TYR CB C 118 43.282 43.282 41.423 1.859 19806 8490 1 15 . 1 1 119 119 VAL N N 119 119.842 119.842 123.819 -3.977 19806 8491 1 15 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.460 0.055 19806 8492 1 15 . 1 1 119 119 VAL CA C 119 62.442 62.442 64.507 -2.066 19806 8493 1 15 . 1 1 120 120 VAL N N 120 114.552 114.552 117.195 -2.643 19806 8494 1 15 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.638 0.100 19806 8495 1 15 . 1 1 120 120 VAL CA C 120 59.595 59.595 61.085 -1.490 19806 8496 1 15 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.061 -0.209 19806 8497 1 15 . 1 1 121 121 ASP N N 121 118.234 118.234 120.022 -1.788 19806 8498 1 15 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.949 0.314 19806 8499 1 15 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.761 -0.098 19806 8500 1 15 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.582 -0.695 19806 8501 1 15 . 1 1 122 122 CYS N N 122 121.036 121.036 123.996 -2.960 19806 8502 1 15 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.726 0.845 19806 8503 1 15 . 1 1 122 122 CYS CA C 122 57.052 57.052 58.532 -1.480 19806 8504 1 15 . 1 1 122 122 CYS CB C 122 30.834 30.834 27.843 2.991 19806 8505 1 15 . 1 1 123 123 TYR N N 123 127.672 127.672 128.176 -0.504 19806 8506 1 15 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.918 0.092 19806 8507 1 15 . 1 1 123 123 TYR CA C 123 57.169 57.169 57.471 -0.302 19806 8508 1 15 . 1 1 123 123 TYR CB C 123 41.408 41.408 42.593 -1.185 19806 8509 1 15 . 1 1 124 124 THR N N 124 120.833 120.833 117.454 3.379 19806 8510 1 15 . 1 1 124 124 THR HA H 124 4.987 4.987 4.667 0.321 19806 8511 1 15 . 1 1 124 124 THR CA C 124 57.153 57.153 60.196 -3.043 19806 8512 1 15 . 1 1 124 124 THR CB C 124 68.607 68.607 71.137 -2.530 19806 8513 1 15 . 1 1 125 125 GLY N N 125 114.347 114.347 112.406 1.941 19806 8514 1 15 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.424 -0.096 19806 8515 1 15 . 1 1 126 126 TRP N N 126 119.918 119.918 120.923 -1.005 19806 8516 1 15 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.029 0.041 19806 8517 1 15 . 1 1 126 126 TRP CA C 126 60.564 60.564 59.252 1.312 19806 8518 1 15 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.099 0.540 19806 8519 1 15 . 1 1 127 127 TYR N N 127 113.911 113.911 113.097 0.814 19806 8520 1 15 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.717 0.277 19806 8521 1 15 . 1 1 127 127 TYR CA C 127 53.384 53.384 56.482 -3.098 19806 8522 1 15 . 1 1 127 127 TYR CB C 127 38.584 38.584 37.258 1.325 19806 8523 1 15 . 1 1 128 128 GLY N N 128 105.181 105.181 108.050 -2.869 19806 8524 1 15 . 1 1 128 128 GLY CA C 128 45.189 45.189 43.671 1.518 19806 8525 1 15 . 1 1 129 129 TYR N N 129 116.588 116.588 119.420 -2.832 19806 8526 1 15 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.584 0.080 19806 8527 1 15 . 1 1 129 129 TYR CA C 129 59.565 59.565 58.446 1.119 19806 8528 1 15 . 1 1 129 129 TYR CB C 129 38.853 38.853 36.886 1.967 19806 8529 1 15 . 1 1 130 130 ASP N N 130 115.195 115.195 119.436 -4.241 19806 8530 1 15 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.722 -0.337 19806 8531 1 15 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.997 -1.867 19806 8532 1 15 . 1 1 130 130 ASP CB C 130 38.685 38.685 42.337 -3.652 19806 8533 1 15 . 1 1 131 131 LEU N N 131 124.887 124.887 121.499 3.388 19806 8534 1 15 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.918 -0.437 19806 8535 1 15 . 1 1 131 131 LEU CA C 131 53.605 53.605 51.736 1.869 19806 8536 1 15 . 1 1 131 131 LEU CB C 131 42.441 42.441 43.708 -1.267 19806 8537 1 15 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.765 -0.082 19806 8538 1 15 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.771 65.294 19806 8539 1 15 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.194 -0.867 19806 8540 1 15 . 1 1 133 133 ILE N N 133 123.765 123.765 119.744 4.021 19806 8541 1 15 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.551 0.178 19806 8542 1 15 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.677 1.183 19806 8543 1 15 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.114 -0.051 19806 8544 1 15 . 1 1 134 134 GLY N N 134 107.030 107.030 107.325 -0.295 19806 8545 1 15 . 1 1 134 134 GLY CA C 134 45.976 45.976 46.102 -0.126 19806 8546 1 15 . 1 1 135 135 GLU N N 135 116.566 116.566 120.724 -4.158 19806 8547 1 15 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.198 0.466 19806 8548 1 15 . 1 1 135 135 GLU CA C 135 55.414 55.414 57.697 -2.283 19806 8549 1 15 . 1 1 135 135 GLU CB C 135 30.195 30.195 28.838 1.357 19806 8550 1 15 . 1 1 136 136 LEU N N 136 124.239 124.239 121.583 2.656 19806 8551 1 15 . 1 1 136 136 LEU HA H 136 4.044 4.044 4.015 0.029 19806 8552 1 15 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.541 0.575 19806 8553 1 15 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.490 -0.483 19806 8554 1 15 . 1 1 137 137 LYS N N 137 117.225 117.225 117.316 -0.091 19806 8555 1 15 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.805 0.058 19806 8556 1 15 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.338 1.117 19806 8557 1 15 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.223 -0.020 19806 8558 1 15 . 1 1 138 138 GLN N N 138 118.718 118.718 119.142 -0.424 19806 8559 1 15 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.145 -0.093 19806 8560 1 15 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.561 -0.686 19806 8561 1 15 . 1 1 138 138 GLN CB C 138 28.235 28.235 28.145 0.090 19806 8562 1 15 . 1 1 139 139 THR N N 139 117.970 117.970 116.975 0.995 19806 8563 1 15 . 1 1 139 139 THR HA H 139 4.532 4.532 4.066 0.466 19806 8564 1 15 . 1 1 139 139 THR CA C 139 68.145 68.145 66.967 1.178 19806 8565 1 15 . 1 1 139 139 THR CB C 139 68.103 68.103 68.326 -0.223 19806 8566 1 15 . 1 1 140 140 ILE N N 140 120.391 120.391 122.529 -2.138 19806 8567 1 15 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.940 -0.213 19806 8568 1 15 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.849 0.407 19806 8569 1 15 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.513 0.600 19806 8570 1 15 . 1 1 141 141 GLN N N 141 118.917 118.917 118.561 0.356 19806 8571 1 15 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.897 0.118 19806 8572 1 15 . 1 1 141 141 GLN CA C 141 58.371 58.371 59.018 -0.647 19806 8573 1 15 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.135 -0.788 19806 8574 1 15 . 1 1 142 142 ASN N N 142 119.936 119.936 118.309 1.627 19806 8575 1 15 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.555 -0.040 19806 8576 1 15 . 1 1 142 142 ASN CA C 142 55.799 55.799 56.090 -0.291 19806 8577 1 15 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.424 -0.794 19806 8578 1 15 . 1 1 143 143 VAL N N 143 123.195 123.195 118.755 4.440 19806 8579 1 15 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.106 -0.390 19806 8580 1 15 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.088 0.409 19806 8581 1 15 . 1 1 143 143 VAL CB C 143 30.989 30.989 30.623 0.366 19806 8582 1 15 . 1 1 144 144 LYS N N 144 120.348 120.348 118.038 2.310 19806 8583 1 15 . 1 1 144 144 LYS HA H 144 3.881 3.881 4.010 -0.129 19806 8584 1 15 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.261 0.862 19806 8585 1 15 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.204 -0.322 19806 8586 1 15 . 1 1 145 145 GLU N N 145 119.220 119.220 118.768 0.452 19806 8587 1 15 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.099 0.084 19806 8588 1 15 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.138 0.040 19806 8589 1 15 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.733 -0.662 19806 8590 1 15 . 1 1 146 146 GLU N N 146 121.420 121.420 119.443 1.977 19806 8591 1 15 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.122 0.155 19806 8592 1 15 . 1 1 146 146 GLU CA C 146 59.118 59.118 58.849 0.269 19806 8593 1 15 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.236 -0.894 19806 8594 1 15 . 1 1 147 147 ASN N N 147 119.197 119.197 117.321 1.876 19806 8595 1 15 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.651 -0.083 19806 8596 1 15 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.158 -1.007 19806 8597 1 15 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.966 -0.593 19806 8598 1 15 . 1 1 148 148 ALA N N 148 123.672 123.672 122.973 0.699 19806 8599 1 15 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.353 -0.230 19806 8600 1 15 . 1 1 148 148 ALA CA C 148 55.133 55.133 54.934 0.198 19806 8601 1 15 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.525 -0.918 19806 8602 1 15 . 1 1 149 149 ALA N N 149 119.979 119.979 121.937 -1.958 19806 8603 1 15 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.053 0.208 19806 8604 1 15 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.834 -0.189 19806 8605 1 15 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.289 -0.551 19806 8606 1 15 . 1 1 150 150 PHE N N 150 119.592 119.592 119.051 0.541 19806 8607 1 15 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.092 0.132 19806 8608 1 15 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.984 -0.976 19806 8609 1 15 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.486 -0.424 19806 8610 1 15 . 1 1 151 151 LYS N N 151 116.869 116.869 118.832 -1.963 19806 8611 1 15 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.207 -0.301 19806 8612 1 15 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.862 -0.092 19806 8613 1 15 . 1 1 151 151 LYS CB C 151 32.741 32.741 31.864 0.877 19806 8614 1 15 . 1 1 152 152 GLU N N 152 115.868 115.868 119.304 -3.436 19806 8615 1 15 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.130 -0.077 19806 8616 1 15 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.877 -0.221 19806 8617 1 15 . 1 1 152 152 GLU CB C 152 29.753 29.753 29.454 0.299 19806 8618 1 15 . 1 1 153 153 ILE N N 153 110.437 110.437 116.988 -6.551 19806 8619 1 15 . 1 1 153 153 ILE HA H 153 4.176 4.176 4.035 0.141 19806 8620 1 15 . 1 1 153 153 ILE CA C 153 61.034 61.034 61.930 -0.896 19806 8621 1 15 . 1 1 153 153 ILE CB C 153 39.272 39.272 39.321 -0.049 19806 8622 1 15 . 1 1 154 154 HIS N N 154 117.779 117.779 117.308 0.471 19806 8623 1 15 . 1 1 154 154 HIS HA H 154 5.174 5.174 4.886 0.288 19806 8624 1 15 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.394 -0.778 19806 8625 1 15 . 1 1 154 154 HIS CB C 154 28.547 28.547 29.501 -0.954 19806 8626 1 16 . 1 1 3 3 SER N N 3 114.847 114.847 115.662 -0.815 19806 8627 1 16 . 1 1 3 3 SER HA H 3 4.463 4.463 4.359 0.103 19806 8628 1 16 . 1 1 3 3 SER CA C 3 58.340 58.340 59.118 -0.778 19806 8629 1 16 . 1 1 3 3 SER CB C 3 63.457 63.457 63.833 -0.376 19806 8630 1 16 . 1 1 4 4 GLU N N 4 121.498 121.498 122.871 -1.373 19806 8631 1 16 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.548 -0.216 19806 8632 1 16 . 1 1 4 4 GLU CA C 4 56.443 56.443 55.748 0.695 19806 8633 1 16 . 1 1 4 4 GLU CB C 4 29.966 29.966 30.992 -1.026 19806 8634 1 16 . 1 1 5 5 LEU N N 5 121.589 121.589 123.518 -1.929 19806 8635 1 16 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.418 0.019 19806 8636 1 16 . 1 1 5 5 LEU CA C 5 55.019 55.019 55.052 -0.033 19806 8637 1 16 . 1 1 5 5 LEU CB C 5 42.243 42.243 42.783 -0.540 19806 8638 1 16 . 1 1 6 6 THR N N 6 113.708 113.708 115.775 -2.067 19806 8639 1 16 . 1 1 6 6 THR HA H 6 4.470 4.470 4.602 -0.132 19806 8640 1 16 . 1 1 6 6 THR CA C 6 61.409 61.409 61.852 -0.443 19806 8641 1 16 . 1 1 6 6 THR CB C 6 69.544 69.544 70.609 -1.065 19806 8642 1 16 . 1 1 7 7 THR N N 7 114.945 114.945 115.857 -0.912 19806 8643 1 16 . 1 1 7 7 THR HA H 7 4.415 4.415 4.423 -0.008 19806 8644 1 16 . 1 1 7 7 THR CA C 7 61.435 61.435 62.981 -1.546 19806 8645 1 16 . 1 1 7 7 THR CB C 7 69.506 69.506 69.167 0.339 19806 8646 1 16 . 1 1 8 8 GLN N N 8 121.368 121.368 123.875 -2.507 19806 8647 1 16 . 1 1 8 8 GLN CA C 8 55.684 55.684 55.649 0.035 19806 8648 1 16 . 1 1 9 9 ASP N N 9 120.595 120.595 120.554 0.041 19806 8649 1 16 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.813 -0.166 19806 8650 1 16 . 1 1 9 9 ASP CA C 9 54.115 54.115 53.888 0.227 19806 8651 1 16 . 1 1 9 9 ASP CB C 9 41.328 41.328 41.471 -0.143 19806 8652 1 16 . 1 1 10 10 GLY N N 10 106.984 106.984 106.248 0.736 19806 8653 1 16 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.527 -0.032 19806 8654 1 16 . 1 1 11 11 GLU N N 11 120.879 120.879 120.078 0.801 19806 8655 1 16 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.313 -0.124 19806 8656 1 16 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.609 -0.099 19806 8657 1 16 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.243 1.826 19806 8658 1 16 . 1 1 12 12 ASP N N 12 126.686 126.686 123.017 3.669 19806 8659 1 16 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.515 0.235 19806 8660 1 16 . 1 1 12 12 ASP CA C 12 54.347 54.347 53.720 0.627 19806 8661 1 16 . 1 1 12 12 ASP CB C 12 42.771 42.771 41.326 1.445 19806 8662 1 16 . 1 1 13 13 PHE N N 13 128.055 128.055 123.288 4.767 19806 8663 1 16 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.558 -0.146 19806 8664 1 16 . 1 1 13 13 PHE CA C 13 62.551 62.551 59.985 2.566 19806 8665 1 16 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.355 0.478 19806 8666 1 16 . 1 1 14 14 LYS N N 14 117.498 117.498 119.151 -1.653 19806 8667 1 16 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.664 -0.083 19806 8668 1 16 . 1 1 14 14 LYS CA C 14 59.461 59.461 57.958 1.503 19806 8669 1 16 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.094 0.250 19806 8670 1 16 . 1 1 15 15 SER N N 15 113.775 113.775 114.919 -1.144 19806 8671 1 16 . 1 1 15 15 SER HA H 15 4.167 4.167 4.077 0.090 19806 8672 1 16 . 1 1 15 15 SER CA C 15 61.099 61.099 61.737 -0.638 19806 8673 1 16 . 1 1 15 15 SER CB C 15 62.428 62.428 62.608 -0.180 19806 8674 1 16 . 1 1 16 16 PHE N N 16 122.292 122.292 119.764 2.528 19806 8675 1 16 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.159 0.131 19806 8676 1 16 . 1 1 16 16 PHE CA C 16 59.773 59.773 59.828 -0.055 19806 8677 1 16 . 1 1 16 16 PHE CB C 16 37.175 37.175 37.831 -0.656 19806 8678 1 16 . 1 1 17 17 LEU N N 17 122.472 122.472 121.049 1.423 19806 8679 1 16 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.752 -0.902 19806 8680 1 16 . 1 1 17 17 LEU CA C 17 56.619 56.619 57.258 -0.639 19806 8681 1 16 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.253 0.209 19806 8682 1 16 . 1 1 18 18 ASP N N 18 117.331 117.331 119.735 -2.404 19806 8683 1 16 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.203 -0.088 19806 8684 1 16 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.894 -1.499 19806 8685 1 16 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.825 -0.472 19806 8686 1 16 . 1 1 19 19 LYS N N 19 120.032 120.032 118.426 1.606 19806 8687 1 16 . 1 1 19 19 LYS HA H 19 3.677 3.677 4.101 -0.424 19806 8688 1 16 . 1 1 19 19 LYS CA C 19 59.067 59.067 58.285 0.782 19806 8689 1 16 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.169 -0.233 19806 8690 1 16 . 1 1 20 20 PHE N N 20 119.607 119.607 119.630 -0.023 19806 8691 1 16 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.347 -0.238 19806 8692 1 16 . 1 1 20 20 PHE CA C 20 62.090 62.090 60.719 1.371 19806 8693 1 16 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.374 1.095 19806 8694 1 16 . 1 1 21 21 THR N N 21 101.473 101.473 109.764 -8.291 19806 8695 1 16 . 1 1 21 21 THR HA H 21 4.259 4.259 3.948 0.311 19806 8696 1 16 . 1 1 21 21 THR CA C 21 61.774 61.774 64.094 -2.320 19806 8697 1 16 . 1 1 22 22 SER N N 22 111.453 111.453 115.002 -3.549 19806 8698 1 16 . 1 1 22 22 SER HA H 22 4.165 4.165 4.757 -0.592 19806 8699 1 16 . 1 1 22 22 SER CA C 22 58.215 58.215 58.146 0.069 19806 8700 1 16 . 1 1 22 22 SER CB C 22 64.570 64.570 64.002 0.568 19806 8701 1 16 . 1 1 23 23 SER N N 23 114.184 114.184 116.311 -2.127 19806 8702 1 16 . 1 1 23 23 SER HA H 23 4.764 4.764 4.750 0.014 19806 8703 1 16 . 1 1 23 23 SER CA C 23 55.669 55.669 58.199 -2.530 19806 8704 1 16 . 1 1 23 23 SER CB C 23 64.011 64.011 63.754 0.257 19806 8705 1 16 . 1 1 24 24 ALA N N 24 133.370 133.370 129.079 4.291 19806 8706 1 16 . 1 1 24 24 ALA HA H 24 3.956 3.956 3.966 -0.010 19806 8707 1 16 . 1 1 24 24 ALA CA C 24 55.106 55.106 55.477 -0.371 19806 8708 1 16 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.085 0.750 19806 8709 1 16 . 1 1 25 25 ALA N N 25 117.430 117.430 119.929 -2.499 19806 8710 1 16 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.438 -0.121 19806 8711 1 16 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.295 0.906 19806 8712 1 16 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.477 -0.128 19806 8713 1 16 . 1 1 26 26 PHE N N 26 116.042 116.042 115.933 0.109 19806 8714 1 16 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.746 -0.436 19806 8715 1 16 . 1 1 26 26 PHE CA C 26 60.759 60.759 59.123 1.636 19806 8716 1 16 . 1 1 26 26 PHE CB C 26 39.310 39.310 40.259 -0.949 19806 8717 1 16 . 1 1 27 27 GLN N N 27 121.820 121.820 122.045 -0.225 19806 8718 1 16 . 1 1 27 27 GLN HA H 27 3.391 3.391 4.107 -0.716 19806 8719 1 16 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.331 0.763 19806 8720 1 16 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.615 -1.158 19806 8721 1 16 . 1 1 28 28 TYR N N 28 111.517 111.517 116.948 -5.431 19806 8722 1 16 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.935 0.195 19806 8723 1 16 . 1 1 28 28 TYR CA C 28 62.357 62.357 60.381 1.976 19806 8724 1 16 . 1 1 28 28 TYR CB C 28 38.568 38.568 38.212 0.356 19806 8725 1 16 . 1 1 29 29 THR N N 29 106.324 106.324 109.497 -3.173 19806 8726 1 16 . 1 1 29 29 THR HA H 29 4.489 4.489 4.516 -0.027 19806 8727 1 16 . 1 1 29 29 THR CA C 29 63.765 63.765 62.850 0.915 19806 8728 1 16 . 1 1 29 29 THR CB C 29 69.568 69.568 68.553 1.015 19806 8729 1 16 . 1 1 30 30 ARG N N 30 117.696 117.696 122.616 -4.920 19806 8730 1 16 . 1 1 30 30 ARG HA H 30 4.701 4.701 4.405 0.296 19806 8731 1 16 . 1 1 30 30 ARG CA C 30 52.760 52.760 54.597 -1.837 19806 8732 1 16 . 1 1 30 30 ARG CB C 30 35.047 35.047 31.494 3.553 19806 8733 1 16 . 1 1 31 31 VAL N N 31 119.395 119.395 118.867 0.528 19806 8734 1 16 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.835 -0.605 19806 8735 1 16 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.574 0.617 19806 8736 1 16 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.320 -2.147 19806 8737 1 16 . 1 1 32 32 LYS N N 32 126.124 126.124 127.436 -1.312 19806 8738 1 16 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.360 -0.176 19806 8739 1 16 . 1 1 32 32 LYS CA C 32 53.958 53.958 55.921 -1.963 19806 8740 1 16 . 1 1 32 32 LYS CB C 32 31.112 31.112 33.555 -2.443 19806 8741 1 16 . 1 1 33 33 PHE N N 33 119.303 119.303 118.487 0.816 19806 8742 1 16 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.885 -0.371 19806 8743 1 16 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.443 0.829 19806 8744 1 16 . 1 1 33 33 PHE CB C 33 40.378 40.378 40.529 -0.151 19806 8745 1 16 . 1 1 34 34 PRO HA H 34 4.968 4.968 2.334 2.634 19806 8746 1 16 . 1 1 34 34 PRO CA C 34 61.633 61.633 61.916 -0.283 19806 8747 1 16 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.055 1.677 19806 8748 1 16 . 1 1 35 35 LEU N N 35 120.016 120.016 117.425 2.591 19806 8749 1 16 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.593 -0.371 19806 8750 1 16 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.432 1.408 19806 8751 1 16 . 1 1 35 35 LEU CB C 35 41.244 41.244 44.277 -3.033 19806 8752 1 16 . 1 1 36 36 LYS N N 36 117.066 117.066 119.914 -2.848 19806 8753 1 16 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.251 -0.276 19806 8754 1 16 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.806 2.441 19806 8755 1 16 . 1 1 36 36 LYS CB C 36 32.832 32.832 32.953 -0.120 19806 8756 1 16 . 1 1 37 37 THR N N 37 117.574 117.574 117.929 -0.355 19806 8757 1 16 . 1 1 37 37 THR HA H 37 4.797 4.797 4.840 -0.043 19806 8758 1 16 . 1 1 37 37 THR CA C 37 60.396 60.396 58.581 1.815 19806 8759 1 16 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.470 0.549 19806 8760 1 16 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.309 -0.386 19806 8761 1 16 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.803 -0.172 19806 8762 1 16 . 1 1 39 39 ILE N N 39 119.949 119.949 119.528 0.421 19806 8763 1 16 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.145 0.094 19806 8764 1 16 . 1 1 39 39 ILE CA C 39 62.133 62.133 62.818 -0.685 19806 8765 1 16 . 1 1 40 40 THR N N 40 123.962 123.962 124.402 -0.440 19806 8766 1 16 . 1 1 40 40 THR HA H 40 5.057 5.057 5.073 -0.016 19806 8767 1 16 . 1 1 40 40 THR CA C 40 62.262 62.262 61.739 0.523 19806 8768 1 16 . 1 1 40 40 THR CB C 40 69.891 69.891 70.016 -0.125 19806 8769 1 16 . 1 1 41 41 LEU N N 41 125.633 125.633 124.604 1.029 19806 8770 1 16 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.865 0.237 19806 8771 1 16 . 1 1 41 41 LEU CA C 41 52.638 52.638 53.143 -0.505 19806 8772 1 16 . 1 1 41 41 LEU CB C 41 45.180 45.180 44.227 0.953 19806 8773 1 16 . 1 1 42 42 LEU N N 42 120.788 120.788 122.847 -2.059 19806 8774 1 16 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.469 0.279 19806 8775 1 16 . 1 1 42 42 LEU CA C 42 53.724 53.724 54.740 -1.016 19806 8776 1 16 . 1 1 42 42 LEU CB C 42 44.384 44.384 42.093 2.291 19806 8777 1 16 . 1 1 43 43 ALA N N 43 123.073 123.073 129.549 -6.476 19806 8778 1 16 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.238 0.192 19806 8779 1 16 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.318 -1.030 19806 8780 1 16 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.483 0.531 19806 8781 1 16 . 1 1 44 44 ASP N N 44 118.196 118.196 118.558 -0.362 19806 8782 1 16 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.387 0.039 19806 8783 1 16 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.797 -0.769 19806 8784 1 16 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.517 -0.307 19806 8785 1 16 . 1 1 45 45 ASP N N 45 115.018 115.018 117.720 -2.702 19806 8786 1 16 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.584 -0.115 19806 8787 1 16 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.967 -1.173 19806 8788 1 16 . 1 1 45 45 ASP CB C 45 39.864 39.864 41.299 -1.435 19806 8789 1 16 . 1 1 46 46 GLY N N 46 107.499 107.499 105.753 1.746 19806 8790 1 16 . 1 1 46 46 GLY CA C 46 45.914 45.914 44.992 0.922 19806 8791 1 16 . 1 1 47 47 GLU N N 47 117.331 117.331 118.966 -1.635 19806 8792 1 16 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.458 0.073 19806 8793 1 16 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.404 0.534 19806 8794 1 16 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.638 2.495 19806 8795 1 16 . 1 1 48 48 THR N N 48 118.462 118.462 119.953 -1.491 19806 8796 1 16 . 1 1 48 48 THR HA H 48 4.243 4.243 4.217 0.026 19806 8797 1 16 . 1 1 48 48 THR CA C 48 62.834 62.834 63.072 -0.238 19806 8798 1 16 . 1 1 48 48 THR CB C 48 68.649 68.649 68.792 -0.143 19806 8799 1 16 . 1 1 49 49 GLU N N 49 123.834 123.834 128.489 -4.655 19806 8800 1 16 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.711 0.234 19806 8801 1 16 . 1 1 49 49 GLU CA C 49 55.358 55.358 57.157 -1.799 19806 8802 1 16 . 1 1 49 49 GLU CB C 49 31.395 31.395 30.695 0.700 19806 8803 1 16 . 1 1 50 50 LYS N N 50 122.868 122.868 124.402 -1.534 19806 8804 1 16 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.693 -0.052 19806 8805 1 16 . 1 1 50 50 LYS CA C 50 54.111 54.111 54.893 -0.782 19806 8806 1 16 . 1 1 50 50 LYS CB C 50 35.312 35.312 35.613 -0.301 19806 8807 1 16 . 1 1 51 51 THR N N 51 111.386 111.386 114.773 -3.387 19806 8808 1 16 . 1 1 51 51 THR HA H 51 5.619 5.619 5.508 0.111 19806 8809 1 16 . 1 1 51 51 THR CA C 51 58.980 58.980 61.249 -2.269 19806 8810 1 16 . 1 1 51 51 THR CB C 51 71.277 71.277 69.885 1.392 19806 8811 1 16 . 1 1 52 52 PHE N N 52 120.631 120.631 120.253 0.378 19806 8812 1 16 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.937 0.026 19806 8813 1 16 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.428 -1.299 19806 8814 1 16 . 1 1 52 52 PHE CB C 52 41.049 41.049 42.237 -1.188 19806 8815 1 16 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.681 -0.233 19806 8816 1 16 . 1 1 53 53 PRO CA C 53 62.489 62.489 63.090 -0.601 19806 8817 1 16 . 1 1 53 53 PRO CB C 53 32.240 32.240 32.332 -0.092 19806 8818 1 16 . 1 1 54 54 PHE N N 54 128.034 128.034 124.841 3.193 19806 8819 1 16 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.580 0.248 19806 8820 1 16 . 1 1 54 54 PHE CA C 54 55.509 55.509 56.522 -1.013 19806 8821 1 16 . 1 1 54 54 PHE CB C 54 37.028 37.028 38.526 -1.498 19806 8822 1 16 . 1 1 55 55 THR N N 55 111.757 111.757 116.701 -4.944 19806 8823 1 16 . 1 1 55 55 THR HA H 55 4.413 4.413 4.338 0.075 19806 8824 1 16 . 1 1 55 55 THR CA C 55 60.578 60.578 60.062 0.516 19806 8825 1 16 . 1 1 55 55 THR CB C 55 69.447 69.447 70.781 -1.334 19806 8826 1 16 . 1 1 56 56 LYS N N 56 118.734 118.734 120.401 -1.667 19806 8827 1 16 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.025 -1.543 19806 8828 1 16 . 1 1 56 56 LYS CA C 56 59.381 59.381 60.097 -0.716 19806 8829 1 16 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.983 1.267 19806 8830 1 16 . 1 1 57 57 GLU N N 57 119.675 119.675 117.199 2.476 19806 8831 1 16 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.068 0.201 19806 8832 1 16 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.798 -1.646 19806 8833 1 16 . 1 1 57 57 GLU CB C 57 26.950 26.950 28.849 -1.899 19806 8834 1 16 . 1 1 58 58 LYS N N 58 114.700 114.700 115.745 -1.045 19806 8835 1 16 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.473 -0.161 19806 8836 1 16 . 1 1 58 58 LYS CA C 58 55.595 55.595 55.031 0.564 19806 8837 1 16 . 1 1 58 58 LYS CB C 58 32.011 32.011 33.297 -1.286 19806 8838 1 16 . 1 1 59 59 TRP N N 59 118.204 118.204 124.859 -6.655 19806 8839 1 16 . 1 1 59 59 TRP HA H 59 5.099 5.099 4.429 0.670 19806 8840 1 16 . 1 1 59 59 TRP CA C 59 55.577 55.577 55.211 0.366 19806 8841 1 16 . 1 1 59 59 TRP CB C 59 32.037 32.037 28.919 3.118 19806 8842 1 16 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.394 -0.131 19806 8843 1 16 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.535 -2.814 19806 8844 1 16 . 1 1 60 60 PRO CB C 60 29.849 29.849 31.955 -2.106 19806 8845 1 16 . 1 1 61 61 LEU N N 61 123.758 123.758 122.670 1.088 19806 8846 1 16 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.202 -0.563 19806 8847 1 16 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.083 0.792 19806 8848 1 16 . 1 1 61 61 LEU CB C 61 40.815 40.815 42.536 -1.721 19806 8849 1 16 . 1 1 62 62 LEU N N 62 124.052 124.052 120.775 3.277 19806 8850 1 16 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.473 -0.118 19806 8851 1 16 . 1 1 62 62 LEU CA C 62 53.992 53.992 53.252 0.741 19806 8852 1 16 . 1 1 62 62 LEU CB C 62 44.686 44.686 43.929 0.757 19806 8853 1 16 . 1 1 63 63 ASP N N 63 117.271 117.271 120.914 -3.643 19806 8854 1 16 . 1 1 63 63 ASP HA H 63 5.033 5.033 4.805 0.228 19806 8855 1 16 . 1 1 63 63 ASP CA C 63 51.101 51.101 53.157 -2.056 19806 8856 1 16 . 1 1 63 63 ASP CB C 63 43.345 43.345 42.772 0.573 19806 8857 1 16 . 1 1 64 64 SER N N 64 112.856 112.856 114.164 -1.308 19806 8858 1 16 . 1 1 64 64 SER HA H 64 3.865 3.865 4.202 -0.337 19806 8859 1 16 . 1 1 64 64 SER CA C 64 60.910 60.910 60.599 0.311 19806 8860 1 16 . 1 1 64 64 SER CB C 64 62.378 62.378 62.900 -0.522 19806 8861 1 16 . 1 1 65 65 GLU N N 65 120.070 120.070 119.701 0.369 19806 8862 1 16 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.086 -0.068 19806 8863 1 16 . 1 1 65 65 GLU CA C 65 58.343 58.343 59.038 -0.695 19806 8864 1 16 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.193 -0.306 19806 8865 1 16 . 1 1 66 66 THR N N 66 115.852 115.852 113.895 1.957 19806 8866 1 16 . 1 1 66 66 THR HA H 66 3.991 3.991 3.918 0.073 19806 8867 1 16 . 1 1 66 66 THR CA C 66 65.804 65.804 64.262 1.542 19806 8868 1 16 . 1 1 66 66 THR CB C 66 68.451 68.451 68.784 -0.333 19806 8869 1 16 . 1 1 67 67 MET N N 67 113.585 113.585 118.683 -5.098 19806 8870 1 16 . 1 1 67 67 MET HA H 67 4.267 4.267 4.642 -0.375 19806 8871 1 16 . 1 1 67 67 MET CA C 67 52.135 52.135 54.155 -2.020 19806 8872 1 16 . 1 1 67 67 MET CB C 67 28.963 28.963 33.580 -4.617 19806 8873 1 16 . 1 1 68 68 LYS N N 68 118.462 118.462 121.019 -2.557 19806 8874 1 16 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.610 -0.240 19806 8875 1 16 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.237 0.245 19806 8876 1 16 . 1 1 68 68 LYS CB C 68 34.179 34.179 34.201 -0.022 19806 8877 1 16 . 1 1 69 69 GLU N N 69 121.700 121.700 123.442 -1.742 19806 8878 1 16 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.974 -0.450 19806 8879 1 16 . 1 1 69 69 GLU CA C 69 55.942 55.942 55.684 0.258 19806 8880 1 16 . 1 1 69 69 GLU CB C 69 30.424 30.424 30.524 -0.100 19806 8881 1 16 . 1 1 70 70 GLU N N 70 123.445 123.445 125.099 -1.654 19806 8882 1 16 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.618 0.079 19806 8883 1 16 . 1 1 70 70 GLU CA C 70 55.473 55.473 55.005 0.468 19806 8884 1 16 . 1 1 70 70 GLU CB C 70 33.162 33.162 33.209 -0.047 19806 8885 1 16 . 1 1 71 71 ARG N N 71 122.150 122.150 124.478 -2.328 19806 8886 1 16 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.626 0.525 19806 8887 1 16 . 1 1 71 71 ARG CA C 71 55.448 55.448 54.949 0.499 19806 8888 1 16 . 1 1 71 71 ARG CB C 71 31.703 31.703 30.535 1.168 19806 8889 1 16 . 1 1 72 72 ILE N N 72 125.686 125.686 126.169 -0.483 19806 8890 1 16 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.243 0.353 19806 8891 1 16 . 1 1 72 72 ILE CA C 72 59.512 59.512 61.067 -1.555 19806 8892 1 16 . 1 1 72 72 ILE CB C 72 41.095 41.095 39.302 1.793 19806 8893 1 16 . 1 1 73 73 THR N N 73 121.600 121.600 119.873 1.727 19806 8894 1 16 . 1 1 73 73 THR HA H 73 4.603 4.603 4.559 0.044 19806 8895 1 16 . 1 1 73 73 THR CA C 73 61.937 61.937 61.181 0.756 19806 8896 1 16 . 1 1 73 73 THR CB C 73 68.669 68.669 68.876 -0.207 19806 8897 1 16 . 1 1 74 74 GLN N N 74 124.607 124.607 127.950 -3.343 19806 8898 1 16 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.688 -0.107 19806 8899 1 16 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.417 0.272 19806 8900 1 16 . 1 1 74 74 GLN CB C 74 29.490 29.490 31.706 -2.216 19806 8901 1 16 . 1 1 75 75 GLU N N 75 122.962 122.962 122.715 0.247 19806 8902 1 16 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.248 -0.189 19806 8903 1 16 . 1 1 75 75 GLU CA C 75 58.845 58.845 57.958 0.887 19806 8904 1 16 . 1 1 75 75 GLU CB C 75 29.573 29.573 29.700 -0.127 19806 8905 1 16 . 1 1 76 76 GLU N N 76 115.466 115.466 118.070 -2.604 19806 8906 1 16 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.456 -0.148 19806 8907 1 16 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.347 0.430 19806 8908 1 16 . 1 1 76 76 GLU CB C 76 29.072 29.072 29.738 -0.666 19806 8909 1 16 . 1 1 77 77 GLY N N 77 106.771 106.771 106.632 0.139 19806 8910 1 16 . 1 1 77 77 GLY CA C 77 45.014 45.014 44.825 0.189 19806 8911 1 16 . 1 1 78 78 GLY N N 78 108.535 108.535 108.270 0.265 19806 8912 1 16 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.507 0.200 19806 8913 1 16 . 1 1 79 79 ILE N N 79 121.066 121.066 122.174 -1.108 19806 8914 1 16 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.396 0.411 19806 8915 1 16 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.819 -1.476 19806 8916 1 16 . 1 1 79 79 ILE CB C 79 39.220 39.220 37.567 1.653 19806 8917 1 16 . 1 1 80 80 TYR N N 80 130.709 130.709 130.314 0.395 19806 8918 1 16 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.578 -0.314 19806 8919 1 16 . 1 1 80 80 TYR CA C 80 58.161 58.161 58.146 0.015 19806 8920 1 16 . 1 1 80 80 TYR CB C 80 40.621 40.621 38.626 1.996 19806 8921 1 16 . 1 1 81 81 VAL N N 81 126.965 126.965 126.499 0.466 19806 8922 1 16 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.938 -0.084 19806 8923 1 16 . 1 1 81 81 VAL CA C 81 60.457 60.457 59.904 0.553 19806 8924 1 16 . 1 1 81 81 VAL CB C 81 35.004 35.004 35.590 -0.585 19806 8925 1 16 . 1 1 82 82 SER N N 82 120.914 120.914 123.260 -2.346 19806 8926 1 16 . 1 1 82 82 SER HA H 82 5.185 5.185 4.949 0.236 19806 8927 1 16 . 1 1 82 82 SER CA C 82 55.260 55.260 57.484 -2.224 19806 8928 1 16 . 1 1 82 82 SER CB C 82 64.785 64.785 63.948 0.837 19806 8929 1 16 . 1 1 83 83 LYS N N 83 119.415 119.415 124.325 -4.910 19806 8930 1 16 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.126 0.652 19806 8931 1 16 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.150 0.609 19806 8932 1 16 . 1 1 83 83 LYS CB C 83 35.514 35.514 36.808 -1.294 19806 8933 1 16 . 1 1 84 84 PHE N N 84 119.220 119.220 118.536 0.684 19806 8934 1 16 . 1 1 84 84 PHE HA H 84 5.441 5.441 4.634 0.807 19806 8935 1 16 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.682 0.732 19806 8936 1 16 . 1 1 84 84 PHE CB C 84 37.523 37.523 38.583 -1.060 19806 8937 1 16 . 1 1 85 85 THR N N 85 119.257 119.257 116.065 3.192 19806 8938 1 16 . 1 1 85 85 THR HA H 85 4.057 4.057 4.544 -0.487 19806 8939 1 16 . 1 1 85 85 THR CA C 85 62.660 62.660 62.026 0.634 19806 8940 1 16 . 1 1 85 85 THR CB C 85 67.698 67.698 69.360 -1.662 19806 8941 1 16 . 1 1 86 86 LEU N N 86 121.612 121.612 121.398 0.214 19806 8942 1 16 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.770 -0.172 19806 8943 1 16 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.745 0.500 19806 8944 1 16 . 1 1 86 86 LEU CB C 86 44.657 44.657 45.130 -0.473 19806 8945 1 16 . 1 1 87 87 ASN N N 87 127.684 127.684 122.086 5.598 19806 8946 1 16 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.829 0.182 19806 8947 1 16 . 1 1 87 87 ASN CA C 87 51.299 51.299 53.102 -1.804 19806 8948 1 16 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.980 -0.385 19806 8949 1 16 . 1 1 88 88 GLU N N 88 120.509 120.509 122.067 -1.558 19806 8950 1 16 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.833 0.024 19806 8951 1 16 . 1 1 88 88 GLU CA C 88 54.382 54.382 53.617 0.765 19806 8952 1 16 . 1 1 88 88 GLU CB C 88 29.808 29.808 30.782 -0.974 19806 8953 1 16 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.314 0.067 19806 8954 1 16 . 1 1 89 89 PRO CA C 89 65.898 65.898 64.871 1.027 19806 8955 1 16 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.450 -0.099 19806 8956 1 16 . 1 1 90 90 LYS N N 90 107.288 107.288 115.680 -8.392 19806 8957 1 16 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.557 0.127 19806 8958 1 16 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.365 -0.386 19806 8959 1 16 . 1 1 90 90 LYS CB C 90 32.994 32.994 33.178 -0.184 19806 8960 1 16 . 1 1 91 91 HIS N N 91 119.523 119.523 116.769 2.754 19806 8961 1 16 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.630 0.147 19806 8962 1 16 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.217 -0.512 19806 8963 1 16 . 1 1 91 91 HIS CB C 91 32.194 32.194 33.187 -0.993 19806 8964 1 16 . 1 1 92 92 LYS N N 92 122.527 122.527 121.830 0.697 19806 8965 1 16 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.709 0.420 19806 8966 1 16 . 1 1 92 92 LYS CA C 92 54.291 54.291 55.426 -1.135 19806 8967 1 16 . 1 1 92 92 LYS CB C 92 37.479 37.479 36.162 1.317 19806 8968 1 16 . 1 1 93 93 ILE N N 93 121.564 121.564 121.627 -0.063 19806 8969 1 16 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.976 0.334 19806 8970 1 16 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.081 1.056 19806 8971 1 16 . 1 1 93 93 ILE CB C 93 41.088 41.088 42.180 -1.092 19806 8972 1 16 . 1 1 94 94 PHE N N 94 128.955 128.955 128.136 0.819 19806 8973 1 16 . 1 1 94 94 PHE HA H 94 4.900 4.900 4.997 -0.097 19806 8974 1 16 . 1 1 94 94 PHE CA C 94 55.843 55.843 55.981 -0.138 19806 8975 1 16 . 1 1 95 95 GLU N N 95 124.809 124.809 127.720 -2.911 19806 8976 1 16 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.365 0.053 19806 8977 1 16 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.882 0.599 19806 8978 1 16 . 1 1 95 95 GLU CB C 95 35.160 35.160 32.566 2.594 19806 8979 1 16 . 1 1 96 96 ALA N N 96 123.759 123.759 125.969 -2.210 19806 8980 1 16 . 1 1 96 96 ALA HA H 96 5.379 5.379 5.347 0.032 19806 8981 1 16 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.004 -0.463 19806 8982 1 16 . 1 1 96 96 ALA CB C 96 23.830 23.830 22.692 1.138 19806 8983 1 16 . 1 1 97 97 GLY N N 97 106.592 106.592 107.556 -0.964 19806 8984 1 16 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.430 0.005 19806 8985 1 16 . 1 1 98 98 TYR N N 98 119.250 119.250 119.829 -0.579 19806 8986 1 16 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.768 0.050 19806 8987 1 16 . 1 1 98 98 TYR CA C 98 59.387 59.387 57.663 1.724 19806 8988 1 16 . 1 1 98 98 TYR CB C 98 38.122 38.122 38.487 -0.365 19806 8989 1 16 . 1 1 99 99 GLU N N 99 123.080 123.080 125.826 -2.746 19806 8990 1 16 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.082 -0.074 19806 8991 1 16 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.614 -0.205 19806 8992 1 16 . 1 1 99 99 GLU CB C 99 30.254 30.254 29.889 0.365 19806 8993 1 16 . 1 1 100 100 GLU N N 100 116.459 116.459 115.487 0.972 19806 8994 1 16 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.517 -0.481 19806 8995 1 16 . 1 1 100 100 GLU CA C 100 57.404 57.404 55.842 1.562 19806 8996 1 16 . 1 1 100 100 GLU CB C 100 27.576 27.576 29.372 -1.796 19806 8997 1 16 . 1 1 101 101 SER N N 101 113.069 113.069 115.933 -2.864 19806 8998 1 16 . 1 1 101 101 SER HA H 101 4.839 4.839 4.600 0.239 19806 8999 1 16 . 1 1 101 101 SER CA C 101 56.024 56.024 57.451 -1.427 19806 9000 1 16 . 1 1 101 101 SER CB C 101 64.806 64.806 65.043 -0.237 19806 9001 1 16 . 1 1 102 102 GLU N N 102 120.439 120.439 121.756 -1.317 19806 9002 1 16 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.397 -0.008 19806 9003 1 16 . 1 1 102 102 GLU CA C 102 55.804 55.804 56.431 -0.627 19806 9004 1 16 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.238 -0.254 19806 9005 1 16 . 1 1 103 103 VAL N N 103 118.899 118.899 116.960 1.939 19806 9006 1 16 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.068 0.018 19806 9007 1 16 . 1 1 103 103 VAL CA C 103 62.699 62.699 61.303 1.396 19806 9008 1 16 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.755 -0.494 19806 9009 1 16 . 1 1 104 104 ASP N N 104 120.965 120.965 119.171 1.794 19806 9010 1 16 . 1 1 104 104 ASP HA H 104 5.003 5.003 5.011 -0.008 19806 9011 1 16 . 1 1 104 104 ASP CA C 104 54.914 54.914 54.661 0.253 19806 9012 1 16 . 1 1 104 104 ASP CB C 104 42.791 42.791 44.440 -1.649 19806 9013 1 16 . 1 1 105 105 LEU N N 105 120.365 120.365 119.791 0.574 19806 9014 1 16 . 1 1 105 105 LEU HA H 105 5.295 5.295 5.375 -0.081 19806 9015 1 16 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.685 -0.254 19806 9016 1 16 . 1 1 105 105 LEU CB C 105 46.001 46.001 44.895 1.106 19806 9017 1 16 . 1 1 106 106 ARG N N 106 126.289 126.289 125.823 0.466 19806 9018 1 16 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.375 0.450 19806 9019 1 16 . 1 1 106 106 ARG CA C 106 54.672 54.672 53.904 0.768 19806 9020 1 16 . 1 1 106 106 ARG CB C 106 33.920 33.920 33.702 0.218 19806 9021 1 16 . 1 1 107 107 VAL N N 107 126.145 126.145 121.535 4.610 19806 9022 1 16 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.738 -0.059 19806 9023 1 16 . 1 1 107 107 VAL CA C 107 61.671 61.671 60.672 0.999 19806 9024 1 16 . 1 1 107 107 VAL CB C 107 35.350 35.350 36.161 -0.811 19806 9025 1 16 . 1 1 108 108 GLU N N 108 127.093 127.093 124.648 2.445 19806 9026 1 16 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.974 0.293 19806 9027 1 16 . 1 1 108 108 GLU CA C 108 54.761 54.761 54.525 0.236 19806 9028 1 16 . 1 1 108 108 GLU CB C 108 32.567 32.567 33.473 -0.906 19806 9029 1 16 . 1 1 109 109 PHE N N 109 124.592 124.592 125.845 -1.253 19806 9030 1 16 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.372 0.656 19806 9031 1 16 . 1 1 109 109 PHE CA C 109 55.945 55.945 55.950 -0.005 19806 9032 1 16 . 1 1 109 109 PHE CB C 109 43.099 43.099 40.814 2.285 19806 9033 1 16 . 1 1 110 110 GLU N N 110 122.143 122.143 122.479 -0.336 19806 9034 1 16 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.166 0.027 19806 9035 1 16 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.355 1.087 19806 9036 1 16 . 1 1 110 110 GLU CB C 110 35.816 35.816 34.428 1.388 19806 9037 1 16 . 1 1 111 111 LEU N N 111 129.616 129.616 123.376 6.240 19806 9038 1 16 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.388 0.420 19806 9039 1 16 . 1 1 111 111 LEU CA C 111 53.470 53.470 54.709 -1.239 19806 9040 1 16 . 1 1 111 111 LEU CB C 111 40.400 40.400 41.548 -1.148 19806 9041 1 16 . 1 1 112 112 GLN N N 112 124.742 124.742 122.288 2.454 19806 9042 1 16 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.472 -0.033 19806 9043 1 16 . 1 1 112 112 GLN CA C 112 55.802 55.802 53.739 2.063 19806 9044 1 16 . 1 1 112 112 GLN CB C 112 28.753 28.753 30.814 -2.061 19806 9045 1 16 . 1 1 113 113 ALA N N 113 121.195 121.195 126.155 -4.960 19806 9046 1 16 . 1 1 113 113 ALA HA H 113 4.048 4.048 3.928 0.120 19806 9047 1 16 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.581 -0.063 19806 9048 1 16 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.234 -0.035 19806 9049 1 16 . 1 1 114 114 ASP N N 114 114.525 114.525 116.946 -2.421 19806 9050 1 16 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.449 -0.050 19806 9051 1 16 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.674 -1.766 19806 9052 1 16 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.739 -1.681 19806 9053 1 16 . 1 1 115 115 GLY N N 115 107.526 107.526 106.599 0.927 19806 9054 1 16 . 1 1 115 115 GLY CA C 115 45.784 45.784 44.947 0.838 19806 9055 1 16 . 1 1 116 116 LYS N N 116 118.818 118.818 119.811 -0.993 19806 9056 1 16 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.763 -0.313 19806 9057 1 16 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.229 -0.058 19806 9058 1 16 . 1 1 116 116 LYS CB C 116 35.039 35.039 35.448 -0.409 19806 9059 1 16 . 1 1 117 117 TRP N N 117 118.939 118.939 121.219 -2.280 19806 9060 1 16 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.255 -0.299 19806 9061 1 16 . 1 1 118 118 TYR N N 118 112.644 112.644 117.256 -4.612 19806 9062 1 16 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.921 0.356 19806 9063 1 16 . 1 1 118 118 TYR CA C 118 56.219 56.219 57.110 -0.891 19806 9064 1 16 . 1 1 118 118 TYR CB C 118 43.282 43.282 43.180 0.102 19806 9065 1 16 . 1 1 119 119 VAL N N 119 119.842 119.842 122.314 -2.472 19806 9066 1 16 . 1 1 119 119 VAL HA H 119 4.515 4.515 5.060 -0.545 19806 9067 1 16 . 1 1 119 119 VAL CA C 119 62.442 62.442 61.415 1.027 19806 9068 1 16 . 1 1 120 120 VAL N N 120 114.552 114.552 121.300 -6.748 19806 9069 1 16 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.666 0.072 19806 9070 1 16 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.549 -0.954 19806 9071 1 16 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.300 -0.448 19806 9072 1 16 . 1 1 121 121 ASP N N 121 118.234 118.234 119.518 -1.284 19806 9073 1 16 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.924 0.339 19806 9074 1 16 . 1 1 121 121 ASP CA C 121 53.663 53.663 54.411 -0.748 19806 9075 1 16 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.228 -0.341 19806 9076 1 16 . 1 1 122 122 CYS N N 122 121.036 121.036 125.028 -3.992 19806 9077 1 16 . 1 1 122 122 CYS HA H 122 5.571 5.571 5.050 0.521 19806 9078 1 16 . 1 1 122 122 CYS CA C 122 57.052 57.052 58.232 -1.180 19806 9079 1 16 . 1 1 122 122 CYS CB C 122 30.834 30.834 28.582 2.252 19806 9080 1 16 . 1 1 123 123 TYR N N 123 127.672 127.672 127.899 -0.227 19806 9081 1 16 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.628 0.382 19806 9082 1 16 . 1 1 123 123 TYR CA C 123 57.169 57.169 57.596 -0.427 19806 9083 1 16 . 1 1 123 123 TYR CB C 123 41.408 41.408 41.376 0.032 19806 9084 1 16 . 1 1 124 124 THR N N 124 120.833 120.833 121.431 -0.598 19806 9085 1 16 . 1 1 124 124 THR HA H 124 4.987 4.987 5.003 -0.016 19806 9086 1 16 . 1 1 124 124 THR CA C 124 57.153 57.153 59.692 -2.539 19806 9087 1 16 . 1 1 124 124 THR CB C 124 68.607 68.607 71.302 -2.695 19806 9088 1 16 . 1 1 125 125 GLY N N 125 114.347 114.347 112.982 1.365 19806 9089 1 16 . 1 1 125 125 GLY CA C 125 46.328 46.328 47.064 -0.736 19806 9090 1 16 . 1 1 126 126 TRP N N 126 119.918 119.918 122.049 -2.131 19806 9091 1 16 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.122 -0.052 19806 9092 1 16 . 1 1 126 126 TRP CA C 126 60.564 60.564 59.119 1.445 19806 9093 1 16 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.597 0.042 19806 9094 1 16 . 1 1 127 127 TYR N N 127 113.911 113.911 112.345 1.566 19806 9095 1 16 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.738 0.256 19806 9096 1 16 . 1 1 127 127 TYR CA C 127 53.384 53.384 57.635 -4.251 19806 9097 1 16 . 1 1 127 127 TYR CB C 127 38.584 38.584 39.121 -0.537 19806 9098 1 16 . 1 1 128 128 GLY N N 128 105.181 105.181 107.350 -2.169 19806 9099 1 16 . 1 1 128 128 GLY CA C 128 45.189 45.189 44.659 0.530 19806 9100 1 16 . 1 1 129 129 TYR N N 129 116.588 116.588 121.501 -4.913 19806 9101 1 16 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.214 0.450 19806 9102 1 16 . 1 1 129 129 TYR CA C 129 59.565 59.565 58.606 0.959 19806 9103 1 16 . 1 1 129 129 TYR CB C 129 38.853 38.853 36.056 2.797 19806 9104 1 16 . 1 1 130 130 ASP N N 130 115.195 115.195 120.432 -5.237 19806 9105 1 16 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.652 -0.267 19806 9106 1 16 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.594 -1.464 19806 9107 1 16 . 1 1 130 130 ASP CB C 130 38.685 38.685 42.362 -3.677 19806 9108 1 16 . 1 1 131 131 LEU N N 131 124.887 124.887 121.639 3.248 19806 9109 1 16 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.806 -0.325 19806 9110 1 16 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.043 1.562 19806 9111 1 16 . 1 1 131 131 LEU CB C 131 42.441 42.441 45.010 -2.569 19806 9112 1 16 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.739 -0.056 19806 9113 1 16 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.773 65.292 19806 9114 1 16 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.116 -0.789 19806 9115 1 16 . 1 1 133 133 ILE N N 133 123.765 123.765 119.708 4.057 19806 9116 1 16 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.588 0.141 19806 9117 1 16 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.615 1.245 19806 9118 1 16 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.077 -0.014 19806 9119 1 16 . 1 1 134 134 GLY N N 134 107.030 107.030 105.745 1.285 19806 9120 1 16 . 1 1 134 134 GLY CA C 134 45.976 45.976 46.044 -0.067 19806 9121 1 16 . 1 1 135 135 GLU N N 135 116.566 116.566 122.497 -5.931 19806 9122 1 16 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.362 0.302 19806 9123 1 16 . 1 1 135 135 GLU CA C 135 55.414 55.414 56.582 -1.168 19806 9124 1 16 . 1 1 135 135 GLU CB C 135 30.195 30.195 29.196 0.999 19806 9125 1 16 . 1 1 136 136 LEU N N 136 124.239 124.239 121.843 2.396 19806 9126 1 16 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.963 0.081 19806 9127 1 16 . 1 1 136 136 LEU CA C 136 59.116 59.116 57.783 1.333 19806 9128 1 16 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.640 -0.633 19806 9129 1 16 . 1 1 137 137 LYS N N 137 117.225 117.225 117.813 -0.588 19806 9130 1 16 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.808 0.055 19806 9131 1 16 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.784 0.671 19806 9132 1 16 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.937 -0.734 19806 9133 1 16 . 1 1 138 138 GLN N N 138 118.718 118.718 118.015 0.703 19806 9134 1 16 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.034 0.018 19806 9135 1 16 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.787 -0.912 19806 9136 1 16 . 1 1 138 138 GLN CB C 138 28.235 28.235 28.001 0.234 19806 9137 1 16 . 1 1 139 139 THR N N 139 117.970 117.970 116.845 1.125 19806 9138 1 16 . 1 1 139 139 THR HA H 139 4.532 4.532 3.906 0.626 19806 9139 1 16 . 1 1 139 139 THR CA C 139 68.145 68.145 66.890 1.255 19806 9140 1 16 . 1 1 139 139 THR CB C 139 68.103 68.103 68.101 0.002 19806 9141 1 16 . 1 1 140 140 ILE N N 140 120.391 120.391 120.735 -0.344 19806 9142 1 16 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.942 -0.215 19806 9143 1 16 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.259 0.997 19806 9144 1 16 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.662 0.451 19806 9145 1 16 . 1 1 141 141 GLN N N 141 118.917 118.917 119.293 -0.376 19806 9146 1 16 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.974 0.041 19806 9147 1 16 . 1 1 141 141 GLN CA C 141 58.371 58.371 58.837 -0.466 19806 9148 1 16 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.149 -0.802 19806 9149 1 16 . 1 1 142 142 ASN N N 142 119.936 119.936 118.692 1.244 19806 9150 1 16 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.511 0.004 19806 9151 1 16 . 1 1 142 142 ASN CA C 142 55.799 55.799 55.751 0.048 19806 9152 1 16 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.238 -0.608 19806 9153 1 16 . 1 1 143 143 VAL N N 143 123.195 123.195 119.458 3.737 19806 9154 1 16 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.393 -0.677 19806 9155 1 16 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.709 -0.212 19806 9156 1 16 . 1 1 143 143 VAL CB C 143 30.989 30.989 31.198 -0.209 19806 9157 1 16 . 1 1 144 144 LYS N N 144 120.348 120.348 118.543 1.805 19806 9158 1 16 . 1 1 144 144 LYS HA H 144 3.881 3.881 3.964 -0.083 19806 9159 1 16 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.616 0.507 19806 9160 1 16 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.103 -0.221 19806 9161 1 16 . 1 1 145 145 GLU N N 145 119.220 119.220 118.969 0.251 19806 9162 1 16 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.116 0.067 19806 9163 1 16 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.256 -0.078 19806 9164 1 16 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.686 -0.616 19806 9165 1 16 . 1 1 146 146 GLU N N 146 121.420 121.420 120.352 1.068 19806 9166 1 16 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.068 0.209 19806 9167 1 16 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.689 -0.571 19806 9168 1 16 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.563 -1.221 19806 9169 1 16 . 1 1 147 147 ASN N N 147 119.197 119.197 116.842 2.355 19806 9170 1 16 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.664 -0.096 19806 9171 1 16 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.502 -1.351 19806 9172 1 16 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.958 -0.585 19806 9173 1 16 . 1 1 148 148 ALA N N 148 123.672 123.672 123.385 0.287 19806 9174 1 16 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.315 -0.192 19806 9175 1 16 . 1 1 148 148 ALA CA C 148 55.133 55.133 54.532 0.601 19806 9176 1 16 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.847 -1.240 19806 9177 1 16 . 1 1 149 149 ALA N N 149 119.979 119.979 122.415 -2.436 19806 9178 1 16 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.036 0.225 19806 9179 1 16 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.948 -0.303 19806 9180 1 16 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.257 -0.519 19806 9181 1 16 . 1 1 150 150 PHE N N 150 119.592 119.592 119.025 0.567 19806 9182 1 16 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.161 0.063 19806 9183 1 16 . 1 1 150 150 PHE CA C 150 61.008 61.008 62.038 -1.030 19806 9184 1 16 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.393 -0.331 19806 9185 1 16 . 1 1 151 151 LYS N N 151 116.869 116.869 118.272 -1.403 19806 9186 1 16 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.217 -0.311 19806 9187 1 16 . 1 1 151 151 LYS CA C 151 58.770 58.770 59.065 -0.295 19806 9188 1 16 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.032 0.709 19806 9189 1 16 . 1 1 152 152 GLU N N 152 115.868 115.868 119.001 -3.133 19806 9190 1 16 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.178 -0.125 19806 9191 1 16 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.427 0.229 19806 9192 1 16 . 1 1 152 152 GLU CB C 152 29.753 29.753 30.203 -0.450 19806 9193 1 16 . 1 1 153 153 ILE N N 153 110.437 110.437 118.476 -8.039 19806 9194 1 16 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.698 0.478 19806 9195 1 16 . 1 1 153 153 ILE CA C 153 61.034 61.034 63.122 -2.088 19806 9196 1 16 . 1 1 153 153 ILE CB C 153 39.272 39.272 38.583 0.689 19806 9197 1 16 . 1 1 154 154 HIS N N 154 117.779 117.779 112.002 5.777 19806 9198 1 16 . 1 1 154 154 HIS HA H 154 5.174 5.174 4.865 0.309 19806 9199 1 16 . 1 1 154 154 HIS CA C 154 51.616 51.616 51.917 -0.301 19806 9200 1 16 . 1 1 154 154 HIS CB C 154 28.547 28.547 27.890 0.657 19806 9201 1 17 . 1 1 3 3 SER N N 3 114.847 114.847 115.601 -0.754 19806 9202 1 17 . 1 1 3 3 SER HA H 3 4.463 4.463 4.552 -0.089 19806 9203 1 17 . 1 1 3 3 SER CA C 3 58.340 58.340 58.206 0.133 19806 9204 1 17 . 1 1 3 3 SER CB C 3 63.457 63.457 63.531 -0.074 19806 9205 1 17 . 1 1 4 4 GLU N N 4 121.498 121.498 120.167 1.331 19806 9206 1 17 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.503 -0.171 19806 9207 1 17 . 1 1 4 4 GLU CA C 4 56.443 56.443 55.373 1.070 19806 9208 1 17 . 1 1 4 4 GLU CB C 4 29.966 29.966 30.816 -0.850 19806 9209 1 17 . 1 1 5 5 LEU N N 5 121.589 121.589 122.832 -1.243 19806 9210 1 17 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.361 0.076 19806 9211 1 17 . 1 1 5 5 LEU CA C 5 55.019 55.019 55.732 -0.713 19806 9212 1 17 . 1 1 5 5 LEU CB C 5 42.243 42.243 42.803 -0.560 19806 9213 1 17 . 1 1 6 6 THR N N 6 113.708 113.708 110.268 3.440 19806 9214 1 17 . 1 1 6 6 THR HA H 6 4.470 4.470 4.556 -0.086 19806 9215 1 17 . 1 1 6 6 THR CA C 6 61.409 61.409 61.263 0.146 19806 9216 1 17 . 1 1 6 6 THR CB C 6 69.544 69.544 69.411 0.133 19806 9217 1 17 . 1 1 7 7 THR N N 7 114.945 114.945 115.430 -0.485 19806 9218 1 17 . 1 1 7 7 THR HA H 7 4.415 4.415 3.994 0.421 19806 9219 1 17 . 1 1 7 7 THR CA C 7 61.435 61.435 64.004 -2.569 19806 9220 1 17 . 1 1 7 7 THR CB C 7 69.506 69.506 68.981 0.525 19806 9221 1 17 . 1 1 8 8 GLN N N 8 121.368 121.368 119.539 1.829 19806 9222 1 17 . 1 1 8 8 GLN CA C 8 55.684 55.684 55.797 -0.113 19806 9223 1 17 . 1 1 9 9 ASP N N 9 120.595 120.595 121.724 -1.129 19806 9224 1 17 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.783 -0.136 19806 9225 1 17 . 1 1 9 9 ASP CA C 9 54.115 54.115 54.082 0.033 19806 9226 1 17 . 1 1 9 9 ASP CB C 9 41.328 41.328 42.081 -0.753 19806 9227 1 17 . 1 1 10 10 GLY N N 10 106.984 106.984 106.957 0.027 19806 9228 1 17 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.662 -0.167 19806 9229 1 17 . 1 1 11 11 GLU N N 11 120.879 120.879 122.144 -1.265 19806 9230 1 17 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.439 -0.250 19806 9231 1 17 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.266 0.244 19806 9232 1 17 . 1 1 11 11 GLU CB C 11 33.069 33.069 32.045 1.024 19806 9233 1 17 . 1 1 12 12 ASP N N 12 126.686 126.686 120.083 6.603 19806 9234 1 17 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.826 -0.076 19806 9235 1 17 . 1 1 12 12 ASP CA C 12 54.347 54.347 52.839 1.508 19806 9236 1 17 . 1 1 12 12 ASP CB C 12 42.771 42.771 43.040 -0.269 19806 9237 1 17 . 1 1 13 13 PHE N N 13 128.055 128.055 120.820 7.235 19806 9238 1 17 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.408 0.004 19806 9239 1 17 . 1 1 13 13 PHE CA C 13 62.551 62.551 58.959 3.592 19806 9240 1 17 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.044 0.789 19806 9241 1 17 . 1 1 14 14 LYS N N 14 117.498 117.498 119.553 -2.055 19806 9242 1 17 . 1 1 14 14 LYS HA H 14 3.581 3.581 4.029 -0.448 19806 9243 1 17 . 1 1 14 14 LYS CA C 14 59.461 59.461 58.059 1.402 19806 9244 1 17 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.773 -0.429 19806 9245 1 17 . 1 1 15 15 SER N N 15 113.775 113.775 115.723 -1.948 19806 9246 1 17 . 1 1 15 15 SER HA H 15 4.167 4.167 4.117 0.050 19806 9247 1 17 . 1 1 15 15 SER CA C 15 61.099 61.099 61.923 -0.824 19806 9248 1 17 . 1 1 15 15 SER CB C 15 62.428 62.428 63.062 -0.634 19806 9249 1 17 . 1 1 16 16 PHE N N 16 122.292 122.292 118.410 3.882 19806 9250 1 17 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.490 -0.200 19806 9251 1 17 . 1 1 16 16 PHE CA C 16 59.773 59.773 59.047 0.726 19806 9252 1 17 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.397 -1.222 19806 9253 1 17 . 1 1 17 17 LEU N N 17 122.472 122.472 121.856 0.616 19806 9254 1 17 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.367 -0.517 19806 9255 1 17 . 1 1 17 17 LEU CA C 17 56.619 56.619 56.988 -0.369 19806 9256 1 17 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.385 0.077 19806 9257 1 17 . 1 1 18 18 ASP N N 18 117.331 117.331 120.396 -3.065 19806 9258 1 17 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.243 -0.128 19806 9259 1 17 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.357 -0.962 19806 9260 1 17 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.736 -0.383 19806 9261 1 17 . 1 1 19 19 LYS N N 19 120.032 120.032 119.277 0.755 19806 9262 1 17 . 1 1 19 19 LYS HA H 19 3.677 3.677 4.033 -0.356 19806 9263 1 17 . 1 1 19 19 LYS CA C 19 59.067 59.067 59.007 0.060 19806 9264 1 17 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.293 -0.357 19806 9265 1 17 . 1 1 20 20 PHE N N 20 119.607 119.607 119.714 -0.107 19806 9266 1 17 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.355 -0.246 19806 9267 1 17 . 1 1 20 20 PHE CA C 20 62.090 62.090 60.570 1.520 19806 9268 1 17 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.127 1.342 19806 9269 1 17 . 1 1 21 21 THR N N 21 101.473 101.473 110.218 -8.745 19806 9270 1 17 . 1 1 21 21 THR HA H 21 4.259 4.259 3.978 0.281 19806 9271 1 17 . 1 1 21 21 THR CA C 21 61.774 61.774 64.444 -2.670 19806 9272 1 17 . 1 1 22 22 SER N N 22 111.453 111.453 115.204 -3.751 19806 9273 1 17 . 1 1 22 22 SER HA H 22 4.165 4.165 4.405 -0.240 19806 9274 1 17 . 1 1 22 22 SER CA C 22 58.215 58.215 58.657 -0.442 19806 9275 1 17 . 1 1 22 22 SER CB C 22 64.570 64.570 64.132 0.438 19806 9276 1 17 . 1 1 23 23 SER N N 23 114.184 114.184 115.686 -1.502 19806 9277 1 17 . 1 1 23 23 SER HA H 23 4.764 4.764 4.812 -0.048 19806 9278 1 17 . 1 1 23 23 SER CA C 23 55.669 55.669 57.778 -2.109 19806 9279 1 17 . 1 1 23 23 SER CB C 23 64.011 64.011 66.334 -2.322 19806 9280 1 17 . 1 1 24 24 ALA N N 24 133.370 133.370 127.025 6.345 19806 9281 1 17 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.088 -0.132 19806 9282 1 17 . 1 1 24 24 ALA CA C 24 55.106 55.106 55.013 0.093 19806 9283 1 17 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.213 0.622 19806 9284 1 17 . 1 1 25 25 ALA N N 25 117.430 117.430 120.752 -3.322 19806 9285 1 17 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.542 -0.225 19806 9286 1 17 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.714 0.487 19806 9287 1 17 . 1 1 25 25 ALA CB C 25 18.349 18.349 17.955 0.394 19806 9288 1 17 . 1 1 26 26 PHE N N 26 116.042 116.042 116.325 -0.283 19806 9289 1 17 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.492 -0.182 19806 9290 1 17 . 1 1 26 26 PHE CA C 26 60.759 60.759 58.771 1.988 19806 9291 1 17 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.210 0.100 19806 9292 1 17 . 1 1 27 27 GLN N N 27 121.820 121.820 119.201 2.619 19806 9293 1 17 . 1 1 27 27 GLN HA H 27 3.391 3.391 3.938 -0.547 19806 9294 1 17 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.176 0.918 19806 9295 1 17 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.749 -1.292 19806 9296 1 17 . 1 1 28 28 TYR N N 28 111.517 111.517 117.644 -6.127 19806 9297 1 17 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.904 0.226 19806 9298 1 17 . 1 1 28 28 TYR CA C 28 62.357 62.357 60.635 1.722 19806 9299 1 17 . 1 1 28 28 TYR CB C 28 38.568 38.568 37.759 0.809 19806 9300 1 17 . 1 1 29 29 THR N N 29 106.324 106.324 112.534 -6.210 19806 9301 1 17 . 1 1 29 29 THR HA H 29 4.489 4.489 4.180 0.309 19806 9302 1 17 . 1 1 29 29 THR CA C 29 63.765 63.765 63.161 0.604 19806 9303 1 17 . 1 1 29 29 THR CB C 29 69.568 69.568 67.305 2.263 19806 9304 1 17 . 1 1 30 30 ARG N N 30 117.696 117.696 119.646 -1.950 19806 9305 1 17 . 1 1 30 30 ARG HA H 30 4.701 4.701 3.370 1.331 19806 9306 1 17 . 1 1 30 30 ARG CA C 30 52.760 52.760 54.769 -2.009 19806 9307 1 17 . 1 1 30 30 ARG CB C 30 35.047 35.047 31.723 3.324 19806 9308 1 17 . 1 1 31 31 VAL N N 31 119.395 119.395 119.245 0.150 19806 9309 1 17 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.716 -0.486 19806 9310 1 17 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.531 0.660 19806 9311 1 17 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.369 -2.196 19806 9312 1 17 . 1 1 32 32 LYS N N 32 126.124 126.124 123.374 2.750 19806 9313 1 17 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.538 -0.354 19806 9314 1 17 . 1 1 32 32 LYS CA C 32 53.958 53.958 54.244 -0.286 19806 9315 1 17 . 1 1 32 32 LYS CB C 32 31.112 31.112 34.300 -3.188 19806 9316 1 17 . 1 1 33 33 PHE N N 33 119.303 119.303 118.828 0.475 19806 9317 1 17 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.907 -0.393 19806 9318 1 17 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.477 0.795 19806 9319 1 17 . 1 1 33 33 PHE CB C 33 40.378 40.378 39.537 0.841 19806 9320 1 17 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.634 0.334 19806 9321 1 17 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.782 -1.149 19806 9322 1 17 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.653 1.079 19806 9323 1 17 . 1 1 35 35 LEU N N 35 120.016 120.016 118.221 1.795 19806 9324 1 17 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.470 -0.248 19806 9325 1 17 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.479 1.361 19806 9326 1 17 . 1 1 35 35 LEU CB C 35 41.244 41.244 44.554 -3.310 19806 9327 1 17 . 1 1 36 36 LYS N N 36 117.066 117.066 120.227 -3.161 19806 9328 1 17 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.276 -0.301 19806 9329 1 17 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.874 2.373 19806 9330 1 17 . 1 1 36 36 LYS CB C 36 32.832 32.832 32.688 0.144 19806 9331 1 17 . 1 1 37 37 THR N N 37 117.574 117.574 114.072 3.502 19806 9332 1 17 . 1 1 37 37 THR HA H 37 4.797 4.797 4.814 -0.017 19806 9333 1 17 . 1 1 37 37 THR CA C 37 60.396 60.396 59.084 1.312 19806 9334 1 17 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.702 0.317 19806 9335 1 17 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.578 -0.655 19806 9336 1 17 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.757 -0.126 19806 9337 1 17 . 1 1 39 39 ILE N N 39 119.949 119.949 120.043 -0.094 19806 9338 1 17 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.180 0.059 19806 9339 1 17 . 1 1 39 39 ILE CA C 39 62.133 62.133 62.816 -0.683 19806 9340 1 17 . 1 1 40 40 THR N N 40 123.962 123.962 122.632 1.330 19806 9341 1 17 . 1 1 40 40 THR HA H 40 5.057 5.057 5.128 -0.071 19806 9342 1 17 . 1 1 40 40 THR CA C 40 62.262 62.262 61.267 0.995 19806 9343 1 17 . 1 1 40 40 THR CB C 40 69.891 69.891 71.142 -1.251 19806 9344 1 17 . 1 1 41 41 LEU N N 41 125.633 125.633 123.103 2.530 19806 9345 1 17 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.762 0.340 19806 9346 1 17 . 1 1 41 41 LEU CA C 41 52.638 52.638 53.568 -0.930 19806 9347 1 17 . 1 1 41 41 LEU CB C 41 45.180 45.180 46.916 -1.736 19806 9348 1 17 . 1 1 42 42 LEU N N 42 120.788 120.788 122.951 -2.163 19806 9349 1 17 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.617 0.131 19806 9350 1 17 . 1 1 42 42 LEU CA C 42 53.724 53.724 54.782 -1.058 19806 9351 1 17 . 1 1 42 42 LEU CB C 42 44.384 44.384 43.099 1.286 19806 9352 1 17 . 1 1 43 43 ALA N N 43 123.073 123.073 129.244 -6.171 19806 9353 1 17 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.429 0.001 19806 9354 1 17 . 1 1 43 43 ALA CA C 43 51.288 51.288 51.968 -0.680 19806 9355 1 17 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.592 0.422 19806 9356 1 17 . 1 1 44 44 ASP N N 44 118.196 118.196 119.278 -1.082 19806 9357 1 17 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.464 -0.038 19806 9358 1 17 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.643 -0.615 19806 9359 1 17 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.710 -0.500 19806 9360 1 17 . 1 1 45 45 ASP N N 45 115.018 115.018 118.505 -3.487 19806 9361 1 17 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.628 -0.159 19806 9362 1 17 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.461 -0.667 19806 9363 1 17 . 1 1 45 45 ASP CB C 45 39.864 39.864 40.657 -0.793 19806 9364 1 17 . 1 1 46 46 GLY N N 46 107.499 107.499 108.868 -1.369 19806 9365 1 17 . 1 1 46 46 GLY CA C 46 45.914 45.914 46.151 -0.237 19806 9366 1 17 . 1 1 47 47 GLU N N 47 117.331 117.331 117.111 0.220 19806 9367 1 17 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.413 0.118 19806 9368 1 17 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.278 0.660 19806 9369 1 17 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.570 2.563 19806 9370 1 17 . 1 1 48 48 THR N N 48 118.462 118.462 119.134 -0.672 19806 9371 1 17 . 1 1 48 48 THR HA H 48 4.243 4.243 4.399 -0.156 19806 9372 1 17 . 1 1 48 48 THR CA C 48 62.834 62.834 62.019 0.815 19806 9373 1 17 . 1 1 48 48 THR CB C 48 68.649 68.649 69.364 -0.715 19806 9374 1 17 . 1 1 49 49 GLU N N 49 123.834 123.834 128.264 -4.430 19806 9375 1 17 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.703 0.242 19806 9376 1 17 . 1 1 49 49 GLU CA C 49 55.358 55.358 56.978 -1.620 19806 9377 1 17 . 1 1 49 49 GLU CB C 49 31.395 31.395 30.420 0.975 19806 9378 1 17 . 1 1 50 50 LYS N N 50 122.868 122.868 127.466 -4.598 19806 9379 1 17 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.757 -0.116 19806 9380 1 17 . 1 1 50 50 LYS CA C 50 54.111 54.111 54.956 -0.845 19806 9381 1 17 . 1 1 50 50 LYS CB C 50 35.312 35.312 35.235 0.077 19806 9382 1 17 . 1 1 51 51 THR N N 51 111.386 111.386 113.397 -2.011 19806 9383 1 17 . 1 1 51 51 THR HA H 51 5.619 5.619 5.240 0.379 19806 9384 1 17 . 1 1 51 51 THR CA C 51 58.980 58.980 60.658 -1.678 19806 9385 1 17 . 1 1 51 51 THR CB C 51 71.277 71.277 70.061 1.216 19806 9386 1 17 . 1 1 52 52 PHE N N 52 120.631 120.631 118.170 2.461 19806 9387 1 17 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.884 0.079 19806 9388 1 17 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.661 -1.532 19806 9389 1 17 . 1 1 52 52 PHE CB C 52 41.049 41.049 42.217 -1.168 19806 9390 1 17 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.483 -0.035 19806 9391 1 17 . 1 1 53 53 PRO CA C 53 62.489 62.489 63.091 -0.602 19806 9392 1 17 . 1 1 53 53 PRO CB C 53 32.240 32.240 31.821 0.419 19806 9393 1 17 . 1 1 54 54 PHE N N 54 128.034 128.034 126.322 1.712 19806 9394 1 17 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.365 0.463 19806 9395 1 17 . 1 1 54 54 PHE CA C 54 55.509 55.509 58.608 -3.099 19806 9396 1 17 . 1 1 54 54 PHE CB C 54 37.028 37.028 39.886 -2.858 19806 9397 1 17 . 1 1 55 55 THR N N 55 111.757 111.757 117.838 -6.081 19806 9398 1 17 . 1 1 55 55 THR HA H 55 4.413 4.413 4.383 0.030 19806 9399 1 17 . 1 1 55 55 THR CA C 55 60.578 60.578 59.682 0.896 19806 9400 1 17 . 1 1 55 55 THR CB C 55 69.447 69.447 71.495 -2.048 19806 9401 1 17 . 1 1 56 56 LYS N N 56 118.734 118.734 119.238 -0.504 19806 9402 1 17 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.199 -1.717 19806 9403 1 17 . 1 1 56 56 LYS CA C 56 59.381 59.381 59.675 -0.294 19806 9404 1 17 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.016 1.234 19806 9405 1 17 . 1 1 57 57 GLU N N 57 119.675 119.675 119.780 -0.105 19806 9406 1 17 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.110 0.159 19806 9407 1 17 . 1 1 57 57 GLU CA C 57 57.152 57.152 59.140 -1.988 19806 9408 1 17 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.478 -2.528 19806 9409 1 17 . 1 1 58 58 LYS N N 58 114.700 114.700 116.160 -1.460 19806 9410 1 17 . 1 1 58 58 LYS HA H 58 4.312 4.312 3.692 0.620 19806 9411 1 17 . 1 1 58 58 LYS CA C 58 55.595 55.595 55.384 0.211 19806 9412 1 17 . 1 1 58 58 LYS CB C 58 32.011 32.011 31.096 0.915 19806 9413 1 17 . 1 1 59 59 TRP N N 59 118.204 118.204 123.560 -5.356 19806 9414 1 17 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.273 -0.174 19806 9415 1 17 . 1 1 59 59 TRP CA C 59 55.577 55.577 55.085 0.492 19806 9416 1 17 . 1 1 59 59 TRP CB C 59 32.037 32.037 30.159 1.878 19806 9417 1 17 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.577 -0.314 19806 9418 1 17 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.456 -2.735 19806 9419 1 17 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.232 -2.383 19806 9420 1 17 . 1 1 61 61 LEU N N 61 123.758 123.758 124.677 -0.919 19806 9421 1 17 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.335 -0.696 19806 9422 1 17 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.797 0.078 19806 9423 1 17 . 1 1 61 61 LEU CB C 61 40.815 40.815 41.336 -0.521 19806 9424 1 17 . 1 1 62 62 LEU N N 62 124.052 124.052 123.352 0.700 19806 9425 1 17 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.561 -0.206 19806 9426 1 17 . 1 1 62 62 LEU CA C 62 53.992 53.992 53.877 0.116 19806 9427 1 17 . 1 1 62 62 LEU CB C 62 44.686 44.686 43.941 0.745 19806 9428 1 17 . 1 1 63 63 ASP N N 63 117.271 117.271 118.723 -1.452 19806 9429 1 17 . 1 1 63 63 ASP HA H 63 5.033 5.033 4.918 0.115 19806 9430 1 17 . 1 1 63 63 ASP CA C 63 51.101 51.101 52.584 -1.483 19806 9431 1 17 . 1 1 63 63 ASP CB C 63 43.345 43.345 44.317 -0.972 19806 9432 1 17 . 1 1 64 64 SER N N 64 112.856 112.856 115.732 -2.876 19806 9433 1 17 . 1 1 64 64 SER HA H 64 3.865 3.865 4.228 -0.363 19806 9434 1 17 . 1 1 64 64 SER CA C 64 60.910 60.910 61.142 -0.232 19806 9435 1 17 . 1 1 64 64 SER CB C 64 62.378 62.378 63.154 -0.776 19806 9436 1 17 . 1 1 65 65 GLU N N 65 120.070 120.070 119.147 0.923 19806 9437 1 17 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.232 -0.214 19806 9438 1 17 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.735 -0.392 19806 9439 1 17 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.496 -0.609 19806 9440 1 17 . 1 1 66 66 THR N N 66 115.852 115.852 111.732 4.120 19806 9441 1 17 . 1 1 66 66 THR HA H 66 3.991 3.991 4.631 -0.640 19806 9442 1 17 . 1 1 66 66 THR CA C 66 65.804 65.804 63.148 2.656 19806 9443 1 17 . 1 1 66 66 THR CB C 66 68.451 68.451 69.790 -1.339 19806 9444 1 17 . 1 1 67 67 MET N N 67 113.585 113.585 120.216 -6.631 19806 9445 1 17 . 1 1 67 67 MET HA H 67 4.267 4.267 4.784 -0.517 19806 9446 1 17 . 1 1 67 67 MET CA C 67 52.135 52.135 54.322 -2.187 19806 9447 1 17 . 1 1 67 67 MET CB C 67 28.963 28.963 34.073 -5.110 19806 9448 1 17 . 1 1 68 68 LYS N N 68 118.462 118.462 121.067 -2.605 19806 9449 1 17 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.382 -0.012 19806 9450 1 17 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.827 -0.345 19806 9451 1 17 . 1 1 68 68 LYS CB C 68 34.179 34.179 33.111 1.067 19806 9452 1 17 . 1 1 69 69 GLU N N 69 121.700 121.700 120.445 1.255 19806 9453 1 17 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.846 -0.322 19806 9454 1 17 . 1 1 69 69 GLU CA C 69 55.942 55.942 56.024 -0.082 19806 9455 1 17 . 1 1 69 69 GLU CB C 69 30.424 30.424 30.907 -0.483 19806 9456 1 17 . 1 1 70 70 GLU N N 70 123.445 123.445 126.123 -2.678 19806 9457 1 17 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.701 -0.004 19806 9458 1 17 . 1 1 70 70 GLU CA C 70 55.473 55.473 54.727 0.746 19806 9459 1 17 . 1 1 70 70 GLU CB C 70 33.162 33.162 32.871 0.291 19806 9460 1 17 . 1 1 71 71 ARG N N 71 122.150 122.150 122.155 -0.005 19806 9461 1 17 . 1 1 71 71 ARG HA H 71 5.151 5.151 5.054 0.097 19806 9462 1 17 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.035 0.414 19806 9463 1 17 . 1 1 71 71 ARG CB C 71 31.703 31.703 31.176 0.527 19806 9464 1 17 . 1 1 72 72 ILE N N 72 125.686 125.686 126.840 -1.154 19806 9465 1 17 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.318 0.278 19806 9466 1 17 . 1 1 72 72 ILE CA C 72 59.512 59.512 60.982 -1.470 19806 9467 1 17 . 1 1 72 72 ILE CB C 72 41.095 41.095 39.733 1.362 19806 9468 1 17 . 1 1 73 73 THR N N 73 121.600 121.600 119.080 2.520 19806 9469 1 17 . 1 1 73 73 THR HA H 73 4.603 4.603 4.707 -0.104 19806 9470 1 17 . 1 1 73 73 THR CA C 73 61.937 61.937 60.957 0.980 19806 9471 1 17 . 1 1 73 73 THR CB C 73 68.669 68.669 69.213 -0.544 19806 9472 1 17 . 1 1 74 74 GLN N N 74 124.607 124.607 126.951 -2.344 19806 9473 1 17 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.804 -0.223 19806 9474 1 17 . 1 1 74 74 GLN CA C 74 54.689 54.689 55.097 -0.409 19806 9475 1 17 . 1 1 74 74 GLN CB C 74 29.490 29.490 31.046 -1.556 19806 9476 1 17 . 1 1 75 75 GLU N N 75 122.962 122.962 118.953 4.009 19806 9477 1 17 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.354 -0.295 19806 9478 1 17 . 1 1 75 75 GLU CA C 75 58.845 58.845 56.823 2.022 19806 9479 1 17 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.197 -0.624 19806 9480 1 17 . 1 1 76 76 GLU N N 76 115.466 115.466 123.097 -7.631 19806 9481 1 17 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.471 -0.163 19806 9482 1 17 . 1 1 76 76 GLU CA C 76 56.777 56.777 55.791 0.986 19806 9483 1 17 . 1 1 76 76 GLU CB C 76 29.072 29.072 29.168 -0.095 19806 9484 1 17 . 1 1 77 77 GLY N N 77 106.771 106.771 108.679 -1.908 19806 9485 1 17 . 1 1 77 77 GLY CA C 77 45.014 45.014 45.153 -0.139 19806 9486 1 17 . 1 1 78 78 GLY N N 78 108.535 108.535 107.146 1.389 19806 9487 1 17 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.884 -0.177 19806 9488 1 17 . 1 1 79 79 ILE N N 79 121.066 121.066 121.543 -0.477 19806 9489 1 17 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.409 0.398 19806 9490 1 17 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.304 -0.961 19806 9491 1 17 . 1 1 79 79 ILE CB C 79 39.220 39.220 37.758 1.462 19806 9492 1 17 . 1 1 80 80 TYR N N 80 130.709 130.709 129.472 1.237 19806 9493 1 17 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.046 0.218 19806 9494 1 17 . 1 1 80 80 TYR CA C 80 58.161 58.161 59.137 -0.976 19806 9495 1 17 . 1 1 80 80 TYR CB C 80 40.621 40.621 38.639 1.982 19806 9496 1 17 . 1 1 81 81 VAL N N 81 126.965 126.965 126.858 0.107 19806 9497 1 17 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.662 0.192 19806 9498 1 17 . 1 1 81 81 VAL CA C 81 60.457 60.457 60.204 0.253 19806 9499 1 17 . 1 1 81 81 VAL CB C 81 35.004 35.004 35.720 -0.716 19806 9500 1 17 . 1 1 82 82 SER N N 82 120.914 120.914 118.789 2.125 19806 9501 1 17 . 1 1 82 82 SER HA H 82 5.185 5.185 5.055 0.130 19806 9502 1 17 . 1 1 82 82 SER CA C 82 55.260 55.260 57.366 -2.106 19806 9503 1 17 . 1 1 82 82 SER CB C 82 64.785 64.785 64.357 0.428 19806 9504 1 17 . 1 1 83 83 LYS N N 83 119.415 119.415 122.462 -3.047 19806 9505 1 17 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.865 -0.087 19806 9506 1 17 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.614 0.145 19806 9507 1 17 . 1 1 83 83 LYS CB C 83 35.514 35.514 37.488 -1.974 19806 9508 1 17 . 1 1 84 84 PHE N N 84 119.220 119.220 117.300 1.920 19806 9509 1 17 . 1 1 84 84 PHE HA H 84 5.441 5.441 5.257 0.184 19806 9510 1 17 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.450 0.964 19806 9511 1 17 . 1 1 84 84 PHE CB C 84 37.523 37.523 39.081 -1.558 19806 9512 1 17 . 1 1 85 85 THR N N 85 119.257 119.257 114.350 4.907 19806 9513 1 17 . 1 1 85 85 THR HA H 85 4.057 4.057 4.203 -0.146 19806 9514 1 17 . 1 1 85 85 THR CA C 85 62.660 62.660 63.241 -0.581 19806 9515 1 17 . 1 1 85 85 THR CB C 85 67.698 67.698 69.262 -1.564 19806 9516 1 17 . 1 1 86 86 LEU N N 86 121.612 121.612 122.979 -1.367 19806 9517 1 17 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.630 -0.032 19806 9518 1 17 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.432 0.813 19806 9519 1 17 . 1 1 86 86 LEU CB C 86 44.657 44.657 44.179 0.478 19806 9520 1 17 . 1 1 87 87 ASN N N 87 127.684 127.684 119.144 8.540 19806 9521 1 17 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.572 0.439 19806 9522 1 17 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.421 -1.122 19806 9523 1 17 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.754 -0.159 19806 9524 1 17 . 1 1 88 88 GLU N N 88 120.509 120.509 121.701 -1.192 19806 9525 1 17 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.773 0.084 19806 9526 1 17 . 1 1 88 88 GLU CA C 88 54.382 54.382 53.867 0.515 19806 9527 1 17 . 1 1 88 88 GLU CB C 88 29.808 29.808 30.390 -0.582 19806 9528 1 17 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.650 -0.269 19806 9529 1 17 . 1 1 89 89 PRO CA C 89 65.898 65.898 64.848 1.050 19806 9530 1 17 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.341 0.010 19806 9531 1 17 . 1 1 90 90 LYS N N 90 107.288 107.288 115.214 -7.926 19806 9532 1 17 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.476 0.208 19806 9533 1 17 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.705 -0.725 19806 9534 1 17 . 1 1 90 90 LYS CB C 90 32.994 32.994 33.677 -0.683 19806 9535 1 17 . 1 1 91 91 HIS N N 91 119.523 119.523 116.719 2.804 19806 9536 1 17 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.769 0.008 19806 9537 1 17 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.396 -0.691 19806 9538 1 17 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.865 -0.671 19806 9539 1 17 . 1 1 92 92 LYS N N 92 122.527 122.527 122.274 0.253 19806 9540 1 17 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.668 0.461 19806 9541 1 17 . 1 1 92 92 LYS CA C 92 54.291 54.291 55.332 -1.041 19806 9542 1 17 . 1 1 92 92 LYS CB C 92 37.479 37.479 37.260 0.219 19806 9543 1 17 . 1 1 93 93 ILE N N 93 121.564 121.564 119.756 1.808 19806 9544 1 17 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.648 0.662 19806 9545 1 17 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.375 0.762 19806 9546 1 17 . 1 1 93 93 ILE CB C 93 41.088 41.088 42.206 -1.118 19806 9547 1 17 . 1 1 94 94 PHE N N 94 128.955 128.955 127.966 0.989 19806 9548 1 17 . 1 1 94 94 PHE HA H 94 4.900 4.900 5.170 -0.270 19806 9549 1 17 . 1 1 94 94 PHE CA C 94 55.843 55.843 55.659 0.184 19806 9550 1 17 . 1 1 95 95 GLU N N 95 124.809 124.809 124.893 -0.084 19806 9551 1 17 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.104 0.314 19806 9552 1 17 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.412 1.069 19806 9553 1 17 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.433 1.727 19806 9554 1 17 . 1 1 96 96 ALA N N 96 123.759 123.759 121.588 2.171 19806 9555 1 17 . 1 1 96 96 ALA HA H 96 5.379 5.379 4.887 0.492 19806 9556 1 17 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.583 -1.042 19806 9557 1 17 . 1 1 96 96 ALA CB C 96 23.830 23.830 21.889 1.941 19806 9558 1 17 . 1 1 97 97 GLY N N 97 106.592 106.592 107.971 -1.379 19806 9559 1 17 . 1 1 97 97 GLY CA C 97 45.435 45.435 44.684 0.751 19806 9560 1 17 . 1 1 98 98 TYR N N 98 119.250 119.250 120.360 -1.110 19806 9561 1 17 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.547 0.271 19806 9562 1 17 . 1 1 98 98 TYR CA C 98 59.387 59.387 59.580 -0.192 19806 9563 1 17 . 1 1 98 98 TYR CB C 98 38.122 38.122 38.640 -0.518 19806 9564 1 17 . 1 1 99 99 GLU N N 99 123.080 123.080 122.595 0.485 19806 9565 1 17 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.037 -0.028 19806 9566 1 17 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.991 -0.582 19806 9567 1 17 . 1 1 99 99 GLU CB C 99 30.254 30.254 30.175 0.079 19806 9568 1 17 . 1 1 100 100 GLU N N 100 116.459 116.459 118.796 -2.337 19806 9569 1 17 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.351 -0.315 19806 9570 1 17 . 1 1 100 100 GLU CA C 100 57.404 57.404 57.000 0.404 19806 9571 1 17 . 1 1 100 100 GLU CB C 100 27.576 27.576 30.288 -2.712 19806 9572 1 17 . 1 1 101 101 SER N N 101 113.069 113.069 115.355 -2.286 19806 9573 1 17 . 1 1 101 101 SER HA H 101 4.839 4.839 4.529 0.310 19806 9574 1 17 . 1 1 101 101 SER CA C 101 56.024 56.024 57.858 -1.834 19806 9575 1 17 . 1 1 101 101 SER CB C 101 64.806 64.806 63.950 0.856 19806 9576 1 17 . 1 1 102 102 GLU N N 102 120.439 120.439 120.778 -0.339 19806 9577 1 17 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.383 0.006 19806 9578 1 17 . 1 1 102 102 GLU CA C 102 55.804 55.804 55.801 0.003 19806 9579 1 17 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.326 -0.341 19806 9580 1 17 . 1 1 103 103 VAL N N 103 118.899 118.899 114.987 3.912 19806 9581 1 17 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.030 0.056 19806 9582 1 17 . 1 1 103 103 VAL CA C 103 62.699 62.699 62.666 0.033 19806 9583 1 17 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.675 -0.414 19806 9584 1 17 . 1 1 104 104 ASP N N 104 120.965 120.965 120.085 0.880 19806 9585 1 17 . 1 1 104 104 ASP HA H 104 5.003 5.003 5.153 -0.150 19806 9586 1 17 . 1 1 104 104 ASP CA C 104 54.914 54.914 54.583 0.331 19806 9587 1 17 . 1 1 104 104 ASP CB C 104 42.791 42.791 44.196 -1.405 19806 9588 1 17 . 1 1 105 105 LEU N N 105 120.365 120.365 120.652 -0.287 19806 9589 1 17 . 1 1 105 105 LEU HA H 105 5.295 5.295 5.421 -0.126 19806 9590 1 17 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.185 0.246 19806 9591 1 17 . 1 1 105 105 LEU CB C 105 46.001 46.001 45.580 0.421 19806 9592 1 17 . 1 1 106 106 ARG N N 106 126.289 126.289 124.148 2.141 19806 9593 1 17 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.394 0.431 19806 9594 1 17 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.779 -0.107 19806 9595 1 17 . 1 1 106 106 ARG CB C 106 33.920 33.920 34.872 -0.952 19806 9596 1 17 . 1 1 107 107 VAL N N 107 126.145 126.145 119.907 6.238 19806 9597 1 17 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.475 0.204 19806 9598 1 17 . 1 1 107 107 VAL CA C 107 61.671 61.671 60.665 1.006 19806 9599 1 17 . 1 1 107 107 VAL CB C 107 35.350 35.350 36.688 -1.338 19806 9600 1 17 . 1 1 108 108 GLU N N 108 127.093 127.093 123.211 3.882 19806 9601 1 17 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.882 0.385 19806 9602 1 17 . 1 1 108 108 GLU CA C 108 54.761 54.761 54.816 -0.055 19806 9603 1 17 . 1 1 108 108 GLU CB C 108 32.567 32.567 33.733 -1.166 19806 9604 1 17 . 1 1 109 109 PHE N N 109 124.592 124.592 121.036 3.556 19806 9605 1 17 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.536 0.492 19806 9606 1 17 . 1 1 109 109 PHE CA C 109 55.945 55.945 55.603 0.342 19806 9607 1 17 . 1 1 109 109 PHE CB C 109 43.099 43.099 42.056 1.042 19806 9608 1 17 . 1 1 110 110 GLU N N 110 122.143 122.143 120.819 1.324 19806 9609 1 17 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.125 0.068 19806 9610 1 17 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.473 0.970 19806 9611 1 17 . 1 1 110 110 GLU CB C 110 35.816 35.816 34.624 1.192 19806 9612 1 17 . 1 1 111 111 LEU N N 111 129.616 129.616 124.365 5.251 19806 9613 1 17 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.900 -0.092 19806 9614 1 17 . 1 1 111 111 LEU CA C 111 53.470 53.470 54.584 -1.114 19806 9615 1 17 . 1 1 111 111 LEU CB C 111 40.400 40.400 42.097 -1.697 19806 9616 1 17 . 1 1 112 112 GLN N N 112 124.742 124.742 124.839 -0.097 19806 9617 1 17 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.103 0.336 19806 9618 1 17 . 1 1 112 112 GLN CA C 112 55.802 55.802 55.241 0.561 19806 9619 1 17 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.500 -0.747 19806 9620 1 17 . 1 1 113 113 ALA N N 113 121.195 121.195 123.453 -2.258 19806 9621 1 17 . 1 1 113 113 ALA HA H 113 4.048 4.048 4.028 0.020 19806 9622 1 17 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.408 0.110 19806 9623 1 17 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.718 -0.519 19806 9624 1 17 . 1 1 114 114 ASP N N 114 114.525 114.525 116.584 -2.059 19806 9625 1 17 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.446 -0.047 19806 9626 1 17 . 1 1 114 114 ASP CA C 114 52.908 52.908 55.004 -2.095 19806 9627 1 17 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.427 -1.369 19806 9628 1 17 . 1 1 115 115 GLY N N 115 107.526 107.526 106.312 1.214 19806 9629 1 17 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.413 0.372 19806 9630 1 17 . 1 1 116 116 LYS N N 116 118.818 118.818 119.572 -0.754 19806 9631 1 17 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.467 -0.017 19806 9632 1 17 . 1 1 116 116 LYS CA C 116 54.171 54.171 55.464 -1.293 19806 9633 1 17 . 1 1 116 116 LYS CB C 116 35.039 35.039 33.507 1.532 19806 9634 1 17 . 1 1 117 117 TRP N N 117 118.939 118.939 123.326 -4.387 19806 9635 1 17 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.960 -1.004 19806 9636 1 17 . 1 1 118 118 TYR N N 118 112.644 112.644 119.908 -7.264 19806 9637 1 17 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.806 0.471 19806 9638 1 17 . 1 1 118 118 TYR CA C 118 56.219 56.219 57.838 -1.619 19806 9639 1 17 . 1 1 118 118 TYR CB C 118 43.282 43.282 42.940 0.342 19806 9640 1 17 . 1 1 119 119 VAL N N 119 119.842 119.842 124.413 -4.571 19806 9641 1 17 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.653 -0.138 19806 9642 1 17 . 1 1 119 119 VAL CA C 119 62.442 62.442 62.549 -0.107 19806 9643 1 17 . 1 1 120 120 VAL N N 120 114.552 114.552 119.186 -4.634 19806 9644 1 17 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.513 0.225 19806 9645 1 17 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.256 -0.661 19806 9646 1 17 . 1 1 120 120 VAL CB C 120 32.852 32.852 32.290 0.562 19806 9647 1 17 . 1 1 121 121 ASP N N 121 118.234 118.234 119.863 -1.629 19806 9648 1 17 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.990 0.273 19806 9649 1 17 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.852 -0.189 19806 9650 1 17 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.489 -0.602 19806 9651 1 17 . 1 1 122 122 CYS N N 122 121.036 121.036 121.519 -0.483 19806 9652 1 17 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.853 0.718 19806 9653 1 17 . 1 1 122 122 CYS CA C 122 57.052 57.052 58.709 -1.657 19806 9654 1 17 . 1 1 122 122 CYS CB C 122 30.834 30.834 29.397 1.437 19806 9655 1 17 . 1 1 123 123 TYR N N 123 127.672 127.672 129.086 -1.414 19806 9656 1 17 . 1 1 123 123 TYR HA H 123 5.010 5.010 5.072 -0.062 19806 9657 1 17 . 1 1 123 123 TYR CA C 123 57.169 57.169 57.363 -0.194 19806 9658 1 17 . 1 1 123 123 TYR CB C 123 41.408 41.408 42.054 -0.646 19806 9659 1 17 . 1 1 124 124 THR N N 124 120.833 120.833 120.448 0.385 19806 9660 1 17 . 1 1 124 124 THR HA H 124 4.987 4.987 4.983 0.004 19806 9661 1 17 . 1 1 124 124 THR CA C 124 57.153 57.153 58.501 -1.348 19806 9662 1 17 . 1 1 124 124 THR CB C 124 68.607 68.607 71.161 -2.554 19806 9663 1 17 . 1 1 125 125 GLY N N 125 114.347 114.347 112.273 2.074 19806 9664 1 17 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.628 -0.300 19806 9665 1 17 . 1 1 126 126 TRP N N 126 119.918 119.918 121.445 -1.527 19806 9666 1 17 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.077 -0.006 19806 9667 1 17 . 1 1 126 126 TRP CA C 126 60.564 60.564 58.561 2.003 19806 9668 1 17 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.661 -0.022 19806 9669 1 17 . 1 1 127 127 TYR N N 127 113.911 113.911 114.443 -0.532 19806 9670 1 17 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.653 0.341 19806 9671 1 17 . 1 1 127 127 TYR CA C 127 53.384 53.384 57.087 -3.703 19806 9672 1 17 . 1 1 127 127 TYR CB C 127 38.584 38.584 38.144 0.440 19806 9673 1 17 . 1 1 128 128 GLY N N 128 105.181 105.181 107.650 -2.469 19806 9674 1 17 . 1 1 128 128 GLY CA C 128 45.189 45.189 43.572 1.617 19806 9675 1 17 . 1 1 129 129 TYR N N 129 116.588 116.588 120.360 -3.772 19806 9676 1 17 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.645 0.019 19806 9677 1 17 . 1 1 129 129 TYR CA C 129 59.565 59.565 58.346 1.219 19806 9678 1 17 . 1 1 129 129 TYR CB C 129 38.853 38.853 36.723 2.130 19806 9679 1 17 . 1 1 130 130 ASP N N 130 115.195 115.195 120.380 -5.185 19806 9680 1 17 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.731 -0.346 19806 9681 1 17 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.836 -1.706 19806 9682 1 17 . 1 1 130 130 ASP CB C 130 38.685 38.685 42.935 -4.250 19806 9683 1 17 . 1 1 131 131 LEU N N 131 124.887 124.887 123.298 1.589 19806 9684 1 17 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.894 -0.413 19806 9685 1 17 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.059 1.546 19806 9686 1 17 . 1 1 131 131 LEU CB C 131 42.441 42.441 41.838 0.603 19806 9687 1 17 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.616 0.067 19806 9688 1 17 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.892 65.173 19806 9689 1 17 . 1 1 132 132 PRO CB C 132 32.327 32.327 32.943 -0.616 19806 9690 1 17 . 1 1 133 133 ILE N N 133 123.765 123.765 120.395 3.370 19806 9691 1 17 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.698 0.031 19806 9692 1 17 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.435 1.425 19806 9693 1 17 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.205 -0.142 19806 9694 1 17 . 1 1 134 134 GLY N N 134 107.030 107.030 106.504 0.526 19806 9695 1 17 . 1 1 134 134 GLY CA C 134 45.976 45.976 46.018 -0.042 19806 9696 1 17 . 1 1 135 135 GLU N N 135 116.566 116.566 122.337 -5.771 19806 9697 1 17 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.100 0.564 19806 9698 1 17 . 1 1 135 135 GLU CA C 135 55.414 55.414 57.772 -2.358 19806 9699 1 17 . 1 1 135 135 GLU CB C 135 30.195 30.195 28.876 1.319 19806 9700 1 17 . 1 1 136 136 LEU N N 136 124.239 124.239 121.826 2.413 19806 9701 1 17 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.827 0.217 19806 9702 1 17 . 1 1 136 136 LEU CA C 136 59.116 59.116 57.839 1.277 19806 9703 1 17 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.578 -0.571 19806 9704 1 17 . 1 1 137 137 LYS N N 137 117.225 117.225 117.584 -0.359 19806 9705 1 17 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.769 0.094 19806 9706 1 17 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.684 0.771 19806 9707 1 17 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.773 -0.570 19806 9708 1 17 . 1 1 138 138 GLN N N 138 118.718 118.718 118.024 0.694 19806 9709 1 17 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.082 -0.030 19806 9710 1 17 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.495 -0.620 19806 9711 1 17 . 1 1 138 138 GLN CB C 138 28.235 28.235 27.996 0.239 19806 9712 1 17 . 1 1 139 139 THR N N 139 117.970 117.970 117.770 0.200 19806 9713 1 17 . 1 1 139 139 THR HA H 139 4.532 4.532 3.883 0.649 19806 9714 1 17 . 1 1 139 139 THR CA C 139 68.145 68.145 67.319 0.827 19806 9715 1 17 . 1 1 139 139 THR CB C 139 68.103 68.103 68.130 -0.027 19806 9716 1 17 . 1 1 140 140 ILE N N 140 120.391 120.391 121.615 -1.224 19806 9717 1 17 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.770 -0.043 19806 9718 1 17 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.717 0.539 19806 9719 1 17 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.242 0.870 19806 9720 1 17 . 1 1 141 141 GLN N N 141 118.917 118.917 118.826 0.091 19806 9721 1 17 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.889 0.126 19806 9722 1 17 . 1 1 141 141 GLN CA C 141 58.371 58.371 58.929 -0.558 19806 9723 1 17 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.424 -1.077 19806 9724 1 17 . 1 1 142 142 ASN N N 142 119.936 119.936 118.091 1.845 19806 9725 1 17 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.465 0.050 19806 9726 1 17 . 1 1 142 142 ASN CA C 142 55.799 55.799 55.647 0.152 19806 9727 1 17 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.194 -0.564 19806 9728 1 17 . 1 1 143 143 VAL N N 143 123.195 123.195 119.865 3.330 19806 9729 1 17 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.314 -0.598 19806 9730 1 17 . 1 1 143 143 VAL CA C 143 66.497 66.497 65.772 0.725 19806 9731 1 17 . 1 1 143 143 VAL CB C 143 30.989 30.989 31.051 -0.062 19806 9732 1 17 . 1 1 144 144 LYS N N 144 120.348 120.348 118.659 1.689 19806 9733 1 17 . 1 1 144 144 LYS HA H 144 3.881 3.881 4.008 -0.127 19806 9734 1 17 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.475 0.648 19806 9735 1 17 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.079 -0.197 19806 9736 1 17 . 1 1 145 145 GLU N N 145 119.220 119.220 119.462 -0.242 19806 9737 1 17 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.243 -0.060 19806 9738 1 17 . 1 1 145 145 GLU CA C 145 59.178 59.178 58.816 0.362 19806 9739 1 17 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.840 -0.769 19806 9740 1 17 . 1 1 146 146 GLU N N 146 121.420 121.420 121.032 0.388 19806 9741 1 17 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.029 0.248 19806 9742 1 17 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.747 -0.629 19806 9743 1 17 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.702 -1.360 19806 9744 1 17 . 1 1 147 147 ASN N N 147 119.197 119.197 117.189 2.008 19806 9745 1 17 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.616 -0.048 19806 9746 1 17 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.725 -1.574 19806 9747 1 17 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.822 -0.449 19806 9748 1 17 . 1 1 148 148 ALA N N 148 123.672 123.672 124.063 -0.391 19806 9749 1 17 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.072 0.051 19806 9750 1 17 . 1 1 148 148 ALA CA C 148 55.133 55.133 55.349 -0.216 19806 9751 1 17 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.342 -0.735 19806 9752 1 17 . 1 1 149 149 ALA N N 149 119.979 119.979 120.114 -0.135 19806 9753 1 17 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.152 0.109 19806 9754 1 17 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.362 0.283 19806 9755 1 17 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.408 -0.670 19806 9756 1 17 . 1 1 150 150 PHE N N 150 119.592 119.592 120.233 -0.641 19806 9757 1 17 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.290 -0.066 19806 9758 1 17 . 1 1 150 150 PHE CA C 150 61.008 61.008 60.729 0.279 19806 9759 1 17 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.815 -0.753 19806 9760 1 17 . 1 1 151 151 LYS N N 151 116.869 116.869 119.697 -2.828 19806 9761 1 17 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.479 -0.573 19806 9762 1 17 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.821 -0.050 19806 9763 1 17 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.104 0.637 19806 9764 1 17 . 1 1 152 152 GLU N N 152 115.868 115.868 119.273 -3.405 19806 9765 1 17 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.191 -0.138 19806 9766 1 17 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.347 0.309 19806 9767 1 17 . 1 1 152 152 GLU CB C 152 29.753 29.753 29.908 -0.155 19806 9768 1 17 . 1 1 153 153 ILE N N 153 110.437 110.437 116.545 -6.108 19806 9769 1 17 . 1 1 153 153 ILE HA H 153 4.176 4.176 4.096 0.080 19806 9770 1 17 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.348 -1.314 19806 9771 1 17 . 1 1 153 153 ILE CB C 153 39.272 39.272 40.178 -0.906 19806 9772 1 17 . 1 1 154 154 HIS N N 154 117.779 117.779 118.133 -0.354 19806 9773 1 17 . 1 1 154 154 HIS HA H 154 5.174 5.174 5.020 0.154 19806 9774 1 17 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.798 -1.182 19806 9775 1 17 . 1 1 154 154 HIS CB C 154 28.547 28.547 31.179 -2.632 19806 9776 1 18 . 1 1 3 3 SER N N 3 114.847 114.847 116.535 -1.688 19806 9777 1 18 . 1 1 3 3 SER HA H 3 4.463 4.463 4.452 0.011 19806 9778 1 18 . 1 1 3 3 SER CA C 3 58.340 58.340 59.213 -0.873 19806 9779 1 18 . 1 1 3 3 SER CB C 3 63.457 63.457 63.782 -0.326 19806 9780 1 18 . 1 1 4 4 GLU N N 4 121.498 121.498 122.413 -0.915 19806 9781 1 18 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.516 -0.184 19806 9782 1 18 . 1 1 4 4 GLU CA C 4 56.443 56.443 55.884 0.559 19806 9783 1 18 . 1 1 4 4 GLU CB C 4 29.966 29.966 31.201 -1.235 19806 9784 1 18 . 1 1 5 5 LEU N N 5 121.589 121.589 120.073 1.516 19806 9785 1 18 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.693 -0.256 19806 9786 1 18 . 1 1 5 5 LEU CA C 5 55.019 55.019 55.106 -0.087 19806 9787 1 18 . 1 1 5 5 LEU CB C 5 42.243 42.243 42.950 -0.707 19806 9788 1 18 . 1 1 6 6 THR N N 6 113.708 113.708 113.510 0.198 19806 9789 1 18 . 1 1 6 6 THR HA H 6 4.470 4.470 4.446 0.024 19806 9790 1 18 . 1 1 6 6 THR CA C 6 61.409 61.409 62.100 -0.691 19806 9791 1 18 . 1 1 6 6 THR CB C 6 69.544 69.544 68.755 0.789 19806 9792 1 18 . 1 1 7 7 THR N N 7 114.945 114.945 117.851 -2.906 19806 9793 1 18 . 1 1 7 7 THR HA H 7 4.415 4.415 4.054 0.361 19806 9794 1 18 . 1 1 7 7 THR CA C 7 61.435 61.435 63.039 -1.604 19806 9795 1 18 . 1 1 7 7 THR CB C 7 69.506 69.506 68.577 0.929 19806 9796 1 18 . 1 1 8 8 GLN N N 8 121.368 121.368 119.725 1.643 19806 9797 1 18 . 1 1 8 8 GLN CA C 8 55.684 55.684 57.441 -1.757 19806 9798 1 18 . 1 1 9 9 ASP N N 9 120.595 120.595 121.811 -1.216 19806 9799 1 18 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.722 -0.075 19806 9800 1 18 . 1 1 9 9 ASP CA C 9 54.115 54.115 53.848 0.267 19806 9801 1 18 . 1 1 9 9 ASP CB C 9 41.328 41.328 41.112 0.216 19806 9802 1 18 . 1 1 10 10 GLY N N 10 106.984 106.984 113.326 -6.342 19806 9803 1 18 . 1 1 10 10 GLY CA C 10 44.495 44.495 45.099 -0.604 19806 9804 1 18 . 1 1 11 11 GLU N N 11 120.879 120.879 121.139 -0.260 19806 9805 1 18 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.528 -0.339 19806 9806 1 18 . 1 1 11 11 GLU CA C 11 56.510 56.510 55.157 1.353 19806 9807 1 18 . 1 1 11 11 GLU CB C 11 33.069 33.069 32.040 1.029 19806 9808 1 18 . 1 1 12 12 ASP N N 12 126.686 126.686 122.726 3.960 19806 9809 1 18 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.574 0.176 19806 9810 1 18 . 1 1 12 12 ASP CA C 12 54.347 54.347 54.812 -0.465 19806 9811 1 18 . 1 1 12 12 ASP CB C 12 42.771 42.771 41.646 1.125 19806 9812 1 18 . 1 1 13 13 PHE N N 13 128.055 128.055 124.085 3.970 19806 9813 1 18 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.542 -0.130 19806 9814 1 18 . 1 1 13 13 PHE CA C 13 62.551 62.551 61.169 1.381 19806 9815 1 18 . 1 1 13 13 PHE CB C 13 38.833 38.833 39.237 -0.404 19806 9816 1 18 . 1 1 14 14 LYS N N 14 117.498 117.498 118.353 -0.855 19806 9817 1 18 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.663 -0.082 19806 9818 1 18 . 1 1 14 14 LYS CA C 14 59.461 59.461 58.837 0.624 19806 9819 1 18 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.133 0.211 19806 9820 1 18 . 1 1 15 15 SER N N 15 113.775 113.775 113.160 0.615 19806 9821 1 18 . 1 1 15 15 SER HA H 15 4.167 4.167 4.233 -0.066 19806 9822 1 18 . 1 1 15 15 SER CA C 15 61.099 61.099 60.950 0.149 19806 9823 1 18 . 1 1 15 15 SER CB C 15 62.428 62.428 62.499 -0.071 19806 9824 1 18 . 1 1 16 16 PHE N N 16 122.292 122.292 119.269 3.023 19806 9825 1 18 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.443 -0.153 19806 9826 1 18 . 1 1 16 16 PHE CA C 16 59.773 59.773 59.227 0.546 19806 9827 1 18 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.208 -1.033 19806 9828 1 18 . 1 1 17 17 LEU N N 17 122.472 122.472 121.652 0.820 19806 9829 1 18 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.373 -0.523 19806 9830 1 18 . 1 1 17 17 LEU CA C 17 56.619 56.619 57.577 -0.958 19806 9831 1 18 . 1 1 17 17 LEU CB C 17 40.462 40.462 39.892 0.570 19806 9832 1 18 . 1 1 18 18 ASP N N 18 117.331 117.331 119.362 -2.031 19806 9833 1 18 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.359 -0.244 19806 9834 1 18 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.607 -1.212 19806 9835 1 18 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.359 -0.006 19806 9836 1 18 . 1 1 19 19 LYS N N 19 120.032 120.032 119.367 0.665 19806 9837 1 18 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.948 -0.271 19806 9838 1 18 . 1 1 19 19 LYS CA C 19 59.067 59.067 59.310 -0.243 19806 9839 1 18 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.086 -0.150 19806 9840 1 18 . 1 1 20 20 PHE N N 20 119.607 119.607 119.749 -0.142 19806 9841 1 18 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.311 -0.202 19806 9842 1 18 . 1 1 20 20 PHE CA C 20 62.090 62.090 61.342 0.748 19806 9843 1 18 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.253 1.216 19806 9844 1 18 . 1 1 21 21 THR N N 21 101.473 101.473 109.464 -7.991 19806 9845 1 18 . 1 1 21 21 THR HA H 21 4.259 4.259 4.340 -0.081 19806 9846 1 18 . 1 1 21 21 THR CA C 21 61.774 61.774 63.698 -1.924 19806 9847 1 18 . 1 1 22 22 SER N N 22 111.453 111.453 115.299 -3.846 19806 9848 1 18 . 1 1 22 22 SER HA H 22 4.165 4.165 3.698 0.467 19806 9849 1 18 . 1 1 22 22 SER CA C 22 58.215 58.215 57.225 0.990 19806 9850 1 18 . 1 1 22 22 SER CB C 22 64.570 64.570 64.439 0.132 19806 9851 1 18 . 1 1 23 23 SER N N 23 114.184 114.184 115.070 -0.886 19806 9852 1 18 . 1 1 23 23 SER HA H 23 4.764 4.764 4.907 -0.143 19806 9853 1 18 . 1 1 23 23 SER CA C 23 55.669 55.669 56.447 -0.778 19806 9854 1 18 . 1 1 23 23 SER CB C 23 64.011 64.011 64.338 -0.327 19806 9855 1 18 . 1 1 24 24 ALA N N 24 133.370 133.370 130.995 2.375 19806 9856 1 18 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.157 -0.201 19806 9857 1 18 . 1 1 24 24 ALA CA C 24 55.106 55.106 56.082 -0.976 19806 9858 1 18 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.255 0.580 19806 9859 1 18 . 1 1 25 25 ALA N N 25 117.430 117.430 120.279 -2.849 19806 9860 1 18 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.393 -0.076 19806 9861 1 18 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.372 0.829 19806 9862 1 18 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.331 0.018 19806 9863 1 18 . 1 1 26 26 PHE N N 26 116.042 116.042 117.919 -1.877 19806 9864 1 18 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.339 -0.029 19806 9865 1 18 . 1 1 26 26 PHE CA C 26 60.759 60.759 61.392 -0.633 19806 9866 1 18 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.372 -0.062 19806 9867 1 18 . 1 1 27 27 GLN N N 27 121.820 121.820 120.125 1.695 19806 9868 1 18 . 1 1 27 27 GLN HA H 27 3.391 3.391 3.929 -0.538 19806 9869 1 18 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.769 0.325 19806 9870 1 18 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.379 -0.922 19806 9871 1 18 . 1 1 28 28 TYR N N 28 111.517 111.517 116.107 -4.590 19806 9872 1 18 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.959 0.171 19806 9873 1 18 . 1 1 28 28 TYR CA C 28 62.357 62.357 59.691 2.666 19806 9874 1 18 . 1 1 28 28 TYR CB C 28 38.568 38.568 37.831 0.737 19806 9875 1 18 . 1 1 29 29 THR N N 29 106.324 106.324 111.143 -4.819 19806 9876 1 18 . 1 1 29 29 THR HA H 29 4.489 4.489 4.269 0.220 19806 9877 1 18 . 1 1 29 29 THR CA C 29 63.765 63.765 63.525 0.240 19806 9878 1 18 . 1 1 29 29 THR CB C 29 69.568 69.568 69.216 0.352 19806 9879 1 18 . 1 1 30 30 ARG N N 30 117.696 117.696 120.196 -2.500 19806 9880 1 18 . 1 1 30 30 ARG HA H 30 4.701 4.701 3.138 1.563 19806 9881 1 18 . 1 1 30 30 ARG CA C 30 52.760 52.760 54.294 -1.534 19806 9882 1 18 . 1 1 30 30 ARG CB C 30 35.047 35.047 30.218 4.829 19806 9883 1 18 . 1 1 31 31 VAL N N 31 119.395 119.395 119.230 0.165 19806 9884 1 18 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.368 -0.138 19806 9885 1 18 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.168 1.023 19806 9886 1 18 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.528 -2.355 19806 9887 1 18 . 1 1 32 32 LYS N N 32 126.124 126.124 125.423 0.701 19806 9888 1 18 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.522 -0.338 19806 9889 1 18 . 1 1 32 32 LYS CA C 32 53.958 53.958 54.656 -0.698 19806 9890 1 18 . 1 1 32 32 LYS CB C 32 31.112 31.112 34.091 -2.979 19806 9891 1 18 . 1 1 33 33 PHE N N 33 119.303 119.303 118.389 0.914 19806 9892 1 18 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.873 -0.359 19806 9893 1 18 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.404 0.868 19806 9894 1 18 . 1 1 33 33 PHE CB C 33 40.378 40.378 40.029 0.349 19806 9895 1 18 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.827 0.141 19806 9896 1 18 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.974 -1.341 19806 9897 1 18 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.714 1.018 19806 9898 1 18 . 1 1 35 35 LEU N N 35 120.016 120.016 119.393 0.623 19806 9899 1 18 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.491 -0.269 19806 9900 1 18 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.778 1.062 19806 9901 1 18 . 1 1 35 35 LEU CB C 35 41.244 41.244 42.057 -0.813 19806 9902 1 18 . 1 1 36 36 LYS N N 36 117.066 117.066 117.494 -0.428 19806 9903 1 18 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.477 -0.502 19806 9904 1 18 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.131 3.116 19806 9905 1 18 . 1 1 36 36 LYS CB C 36 32.832 32.832 33.937 -1.105 19806 9906 1 18 . 1 1 37 37 THR N N 37 117.574 117.574 118.904 -1.330 19806 9907 1 18 . 1 1 37 37 THR HA H 37 4.797 4.797 4.858 -0.061 19806 9908 1 18 . 1 1 37 37 THR CA C 37 60.396 60.396 60.230 0.166 19806 9909 1 18 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.693 0.326 19806 9910 1 18 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.380 -0.458 19806 9911 1 18 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.883 -0.252 19806 9912 1 18 . 1 1 39 39 ILE N N 39 119.949 119.949 119.124 0.825 19806 9913 1 18 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.401 -0.162 19806 9914 1 18 . 1 1 39 39 ILE CA C 39 62.133 62.133 63.284 -1.151 19806 9915 1 18 . 1 1 40 40 THR N N 40 123.962 123.962 124.373 -0.411 19806 9916 1 18 . 1 1 40 40 THR HA H 40 5.057 5.057 5.362 -0.305 19806 9917 1 18 . 1 1 40 40 THR CA C 40 62.262 62.262 61.687 0.575 19806 9918 1 18 . 1 1 40 40 THR CB C 40 69.891 69.891 70.313 -0.422 19806 9919 1 18 . 1 1 41 41 LEU N N 41 125.633 125.633 123.498 2.135 19806 9920 1 18 . 1 1 41 41 LEU HA H 41 5.102 5.102 5.094 0.008 19806 9921 1 18 . 1 1 41 41 LEU CA C 41 52.638 52.638 52.859 -0.221 19806 9922 1 18 . 1 1 41 41 LEU CB C 41 45.180 45.180 44.544 0.636 19806 9923 1 18 . 1 1 42 42 LEU N N 42 120.788 120.788 124.033 -3.245 19806 9924 1 18 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.637 0.111 19806 9925 1 18 . 1 1 42 42 LEU CA C 42 53.724 53.724 52.335 1.389 19806 9926 1 18 . 1 1 42 42 LEU CB C 42 44.384 44.384 39.532 4.852 19806 9927 1 18 . 1 1 43 43 ALA N N 43 123.073 123.073 123.786 -0.713 19806 9928 1 18 . 1 1 43 43 ALA HA H 43 4.430 4.430 3.955 0.475 19806 9929 1 18 . 1 1 43 43 ALA CA C 43 51.288 51.288 53.716 -2.428 19806 9930 1 18 . 1 1 43 43 ALA CB C 43 20.014 20.014 18.399 1.615 19806 9931 1 18 . 1 1 44 44 ASP N N 44 118.196 118.196 120.627 -2.431 19806 9932 1 18 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.743 -0.317 19806 9933 1 18 . 1 1 44 44 ASP CA C 44 56.028 56.028 55.047 0.981 19806 9934 1 18 . 1 1 44 44 ASP CB C 44 40.210 40.210 39.157 1.053 19806 9935 1 18 . 1 1 45 45 ASP N N 45 115.018 115.018 117.965 -2.947 19806 9936 1 18 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.719 -0.250 19806 9937 1 18 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.746 -0.952 19806 9938 1 18 . 1 1 45 45 ASP CB C 45 39.864 39.864 43.703 -3.839 19806 9939 1 18 . 1 1 46 46 GLY N N 46 107.499 107.499 108.664 -1.165 19806 9940 1 18 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.449 0.465 19806 9941 1 18 . 1 1 47 47 GLU N N 47 117.331 117.331 119.045 -1.714 19806 9942 1 18 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.495 0.036 19806 9943 1 18 . 1 1 47 47 GLU CA C 47 56.938 56.938 55.694 1.244 19806 9944 1 18 . 1 1 47 47 GLU CB C 47 33.133 33.133 31.797 1.336 19806 9945 1 18 . 1 1 48 48 THR N N 48 118.462 118.462 116.559 1.903 19806 9946 1 18 . 1 1 48 48 THR HA H 48 4.243 4.243 4.501 -0.258 19806 9947 1 18 . 1 1 48 48 THR CA C 48 62.834 62.834 61.591 1.243 19806 9948 1 18 . 1 1 48 48 THR CB C 48 68.649 68.649 70.437 -1.788 19806 9949 1 18 . 1 1 49 49 GLU N N 49 123.834 123.834 127.536 -3.702 19806 9950 1 18 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.415 0.530 19806 9951 1 18 . 1 1 49 49 GLU CA C 49 55.358 55.358 56.901 -1.543 19806 9952 1 18 . 1 1 49 49 GLU CB C 49 31.395 31.395 28.502 2.893 19806 9953 1 18 . 1 1 50 50 LYS N N 50 122.868 122.868 125.238 -2.370 19806 9954 1 18 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.586 0.055 19806 9955 1 18 . 1 1 50 50 LYS CA C 50 54.111 54.111 55.991 -1.880 19806 9956 1 18 . 1 1 50 50 LYS CB C 50 35.312 35.312 33.980 1.332 19806 9957 1 18 . 1 1 51 51 THR N N 51 111.386 111.386 113.649 -2.263 19806 9958 1 18 . 1 1 51 51 THR HA H 51 5.619 5.619 5.620 -0.001 19806 9959 1 18 . 1 1 51 51 THR CA C 51 58.980 58.980 60.188 -1.208 19806 9960 1 18 . 1 1 51 51 THR CB C 51 71.277 71.277 70.525 0.752 19806 9961 1 18 . 1 1 52 52 PHE N N 52 120.631 120.631 119.835 0.796 19806 9962 1 18 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.857 0.106 19806 9963 1 18 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.462 -1.333 19806 9964 1 18 . 1 1 52 52 PHE CB C 52 41.049 41.049 42.090 -1.041 19806 9965 1 18 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.505 -0.057 19806 9966 1 18 . 1 1 53 53 PRO CA C 53 62.489 62.489 62.918 -0.429 19806 9967 1 18 . 1 1 53 53 PRO CB C 53 32.240 32.240 31.373 0.867 19806 9968 1 18 . 1 1 54 54 PHE N N 54 128.034 128.034 126.135 1.899 19806 9969 1 18 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.397 0.431 19806 9970 1 18 . 1 1 54 54 PHE CA C 54 55.509 55.509 59.628 -4.119 19806 9971 1 18 . 1 1 54 54 PHE CB C 54 37.028 37.028 40.036 -3.008 19806 9972 1 18 . 1 1 55 55 THR N N 55 111.757 111.757 119.053 -7.296 19806 9973 1 18 . 1 1 55 55 THR HA H 55 4.413 4.413 3.519 0.894 19806 9974 1 18 . 1 1 55 55 THR CA C 55 60.578 60.578 60.086 0.492 19806 9975 1 18 . 1 1 55 55 THR CB C 55 69.447 69.447 70.328 -0.881 19806 9976 1 18 . 1 1 56 56 LYS N N 56 118.734 118.734 120.576 -1.842 19806 9977 1 18 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.094 -1.612 19806 9978 1 18 . 1 1 56 56 LYS CA C 56 59.381 59.381 60.133 -0.752 19806 9979 1 18 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.224 1.026 19806 9980 1 18 . 1 1 57 57 GLU N N 57 119.675 119.675 118.748 0.927 19806 9981 1 18 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.030 0.239 19806 9982 1 18 . 1 1 57 57 GLU CA C 57 57.152 57.152 59.014 -1.862 19806 9983 1 18 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.666 -2.716 19806 9984 1 18 . 1 1 58 58 LYS N N 58 114.700 114.700 114.267 0.433 19806 9985 1 18 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.548 -0.236 19806 9986 1 18 . 1 1 58 58 LYS CA C 58 55.595 55.595 54.573 1.022 19806 9987 1 18 . 1 1 58 58 LYS CB C 58 32.011 32.011 31.634 0.377 19806 9988 1 18 . 1 1 59 59 TRP N N 59 118.204 118.204 124.726 -6.522 19806 9989 1 18 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.235 -0.136 19806 9990 1 18 . 1 1 59 59 TRP CA C 59 55.577 55.577 55.218 0.359 19806 9991 1 18 . 1 1 59 59 TRP CB C 59 32.037 32.037 30.388 1.649 19806 9992 1 18 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.304 -0.041 19806 9993 1 18 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.610 -2.889 19806 9994 1 18 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.161 -2.312 19806 9995 1 18 . 1 1 61 61 LEU N N 61 123.758 123.758 122.308 1.450 19806 9996 1 18 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.207 -0.568 19806 9997 1 18 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.065 0.810 19806 9998 1 18 . 1 1 61 61 LEU CB C 61 40.815 40.815 41.274 -0.459 19806 9999 1 18 . 1 1 62 62 LEU N N 62 124.052 124.052 124.184 -0.132 19806 10000 1 18 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.438 -0.083 19806 10001 1 18 . 1 1 62 62 LEU CA C 62 53.992 53.992 54.083 -0.091 19806 10002 1 18 . 1 1 62 62 LEU CB C 62 44.686 44.686 43.602 1.084 19806 10003 1 18 . 1 1 63 63 ASP N N 63 117.271 117.271 119.892 -2.621 19806 10004 1 18 . 1 1 63 63 ASP HA H 63 5.033 5.033 5.185 -0.152 19806 10005 1 18 . 1 1 63 63 ASP CA C 63 51.101 51.101 52.982 -1.881 19806 10006 1 18 . 1 1 63 63 ASP CB C 63 43.345 43.345 44.239 -0.894 19806 10007 1 18 . 1 1 64 64 SER N N 64 112.856 112.856 116.119 -3.263 19806 10008 1 18 . 1 1 64 64 SER HA H 64 3.865 3.865 4.175 -0.310 19806 10009 1 18 . 1 1 64 64 SER CA C 64 60.910 60.910 62.233 -1.323 19806 10010 1 18 . 1 1 64 64 SER CB C 64 62.378 62.378 63.323 -0.945 19806 10011 1 18 . 1 1 65 65 GLU N N 65 120.070 120.070 119.855 0.215 19806 10012 1 18 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.241 -0.223 19806 10013 1 18 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.699 -0.356 19806 10014 1 18 . 1 1 65 65 GLU CB C 65 28.887 28.887 28.972 -0.085 19806 10015 1 18 . 1 1 66 66 THR N N 66 115.852 115.852 113.789 2.063 19806 10016 1 18 . 1 1 66 66 THR HA H 66 3.991 3.991 4.475 -0.484 19806 10017 1 18 . 1 1 66 66 THR CA C 66 65.804 65.804 63.436 2.368 19806 10018 1 18 . 1 1 66 66 THR CB C 66 68.451 68.451 69.312 -0.861 19806 10019 1 18 . 1 1 67 67 MET N N 67 113.585 113.585 119.862 -6.277 19806 10020 1 18 . 1 1 67 67 MET HA H 67 4.267 4.267 4.291 -0.024 19806 10021 1 18 . 1 1 67 67 MET CA C 67 52.135 52.135 53.314 -1.179 19806 10022 1 18 . 1 1 67 67 MET CB C 67 28.963 28.963 33.462 -4.499 19806 10023 1 18 . 1 1 68 68 LYS N N 68 118.462 118.462 120.628 -2.166 19806 10024 1 18 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.409 -0.039 19806 10025 1 18 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.795 -0.314 19806 10026 1 18 . 1 1 68 68 LYS CB C 68 34.179 34.179 33.079 1.100 19806 10027 1 18 . 1 1 69 69 GLU N N 69 121.700 121.700 123.122 -1.422 19806 10028 1 18 . 1 1 69 69 GLU HA H 69 4.524 4.524 5.049 -0.525 19806 10029 1 18 . 1 1 69 69 GLU CA C 69 55.942 55.942 55.990 -0.048 19806 10030 1 18 . 1 1 69 69 GLU CB C 69 30.424 30.424 31.440 -1.016 19806 10031 1 18 . 1 1 70 70 GLU N N 70 123.445 123.445 123.042 0.403 19806 10032 1 18 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.603 0.094 19806 10033 1 18 . 1 1 70 70 GLU CA C 70 55.473 55.473 55.341 0.132 19806 10034 1 18 . 1 1 70 70 GLU CB C 70 33.162 33.162 32.442 0.720 19806 10035 1 18 . 1 1 71 71 ARG N N 71 122.150 122.150 121.940 0.210 19806 10036 1 18 . 1 1 71 71 ARG HA H 71 5.151 5.151 5.015 0.136 19806 10037 1 18 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.166 0.282 19806 10038 1 18 . 1 1 71 71 ARG CB C 71 31.703 31.703 31.167 0.536 19806 10039 1 18 . 1 1 72 72 ILE N N 72 125.686 125.686 127.579 -1.893 19806 10040 1 18 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.269 0.327 19806 10041 1 18 . 1 1 72 72 ILE CA C 72 59.512 59.512 60.753 -1.241 19806 10042 1 18 . 1 1 72 72 ILE CB C 72 41.095 41.095 37.690 3.405 19806 10043 1 18 . 1 1 73 73 THR N N 73 121.600 121.600 122.861 -1.261 19806 10044 1 18 . 1 1 73 73 THR HA H 73 4.603 4.603 4.314 0.289 19806 10045 1 18 . 1 1 73 73 THR CA C 73 61.937 61.937 62.437 -0.500 19806 10046 1 18 . 1 1 73 73 THR CB C 73 68.669 68.669 69.042 -0.373 19806 10047 1 18 . 1 1 74 74 GLN N N 74 124.607 124.607 126.770 -2.163 19806 10048 1 18 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.597 -0.016 19806 10049 1 18 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.157 0.532 19806 10050 1 18 . 1 1 74 74 GLN CB C 74 29.490 29.490 31.160 -1.670 19806 10051 1 18 . 1 1 75 75 GLU N N 75 122.962 122.962 119.933 3.029 19806 10052 1 18 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.358 -0.299 19806 10053 1 18 . 1 1 75 75 GLU CA C 75 58.845 58.845 57.482 1.363 19806 10054 1 18 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.109 -0.536 19806 10055 1 18 . 1 1 76 76 GLU N N 76 115.466 115.466 119.744 -4.278 19806 10056 1 18 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.278 0.030 19806 10057 1 18 . 1 1 76 76 GLU CA C 76 56.777 56.777 57.239 -0.462 19806 10058 1 18 . 1 1 76 76 GLU CB C 76 29.072 29.072 29.649 -0.577 19806 10059 1 18 . 1 1 77 77 GLY N N 77 106.771 106.771 109.049 -2.278 19806 10060 1 18 . 1 1 77 77 GLY CA C 77 45.014 45.014 44.705 0.310 19806 10061 1 18 . 1 1 78 78 GLY N N 78 108.535 108.535 106.221 2.314 19806 10062 1 18 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.157 0.550 19806 10063 1 18 . 1 1 79 79 ILE N N 79 121.066 121.066 121.568 -0.502 19806 10064 1 18 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.454 0.353 19806 10065 1 18 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.802 -1.459 19806 10066 1 18 . 1 1 79 79 ILE CB C 79 39.220 39.220 37.665 1.555 19806 10067 1 18 . 1 1 80 80 TYR N N 80 130.709 130.709 129.982 0.727 19806 10068 1 18 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.429 -0.165 19806 10069 1 18 . 1 1 80 80 TYR CA C 80 58.161 58.161 58.872 -0.711 19806 10070 1 18 . 1 1 80 80 TYR CB C 80 40.621 40.621 39.482 1.139 19806 10071 1 18 . 1 1 81 81 VAL N N 81 126.965 126.965 126.071 0.894 19806 10072 1 18 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.680 0.174 19806 10073 1 18 . 1 1 81 81 VAL CA C 81 60.457 60.457 60.703 -0.246 19806 10074 1 18 . 1 1 81 81 VAL CB C 81 35.004 35.004 35.821 -0.817 19806 10075 1 18 . 1 1 82 82 SER N N 82 120.914 120.914 119.145 1.769 19806 10076 1 18 . 1 1 82 82 SER HA H 82 5.185 5.185 5.070 0.115 19806 10077 1 18 . 1 1 82 82 SER CA C 82 55.260 55.260 57.593 -2.333 19806 10078 1 18 . 1 1 82 82 SER CB C 82 64.785 64.785 63.852 0.933 19806 10079 1 18 . 1 1 83 83 LYS N N 83 119.415 119.415 122.603 -3.188 19806 10080 1 18 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.977 -0.199 19806 10081 1 18 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.867 -0.108 19806 10082 1 18 . 1 1 83 83 LYS CB C 83 35.514 35.514 37.788 -2.274 19806 10083 1 18 . 1 1 84 84 PHE N N 84 119.220 119.220 118.146 1.074 19806 10084 1 18 . 1 1 84 84 PHE HA H 84 5.441 5.441 5.307 0.134 19806 10085 1 18 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.112 1.302 19806 10086 1 18 . 1 1 84 84 PHE CB C 84 37.523 37.523 39.675 -2.152 19806 10087 1 18 . 1 1 85 85 THR N N 85 119.257 119.257 117.108 2.149 19806 10088 1 18 . 1 1 85 85 THR HA H 85 4.057 4.057 4.393 -0.336 19806 10089 1 18 . 1 1 85 85 THR CA C 85 62.660 62.660 61.815 0.845 19806 10090 1 18 . 1 1 85 85 THR CB C 85 67.698 67.698 69.722 -2.024 19806 10091 1 18 . 1 1 86 86 LEU N N 86 121.612 121.612 122.287 -0.675 19806 10092 1 18 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.769 -0.171 19806 10093 1 18 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.795 0.449 19806 10094 1 18 . 1 1 86 86 LEU CB C 86 44.657 44.657 45.294 -0.637 19806 10095 1 18 . 1 1 87 87 ASN N N 87 127.684 127.684 119.614 8.070 19806 10096 1 18 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.649 0.362 19806 10097 1 18 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.458 -1.159 19806 10098 1 18 . 1 1 87 87 ASN CB C 87 38.595 38.595 39.043 -0.448 19806 10099 1 18 . 1 1 88 88 GLU N N 88 120.509 120.509 121.243 -0.734 19806 10100 1 18 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.312 0.545 19806 10101 1 18 . 1 1 88 88 GLU CA C 88 54.382 54.382 56.233 -1.851 19806 10102 1 18 . 1 1 88 88 GLU CB C 88 29.808 29.808 30.126 -0.318 19806 10103 1 18 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.359 0.022 19806 10104 1 18 . 1 1 89 89 PRO CA C 89 65.898 65.898 65.039 0.859 19806 10105 1 18 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.124 0.227 19806 10106 1 18 . 1 1 90 90 LYS N N 90 107.288 107.288 113.743 -6.455 19806 10107 1 18 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.795 -0.111 19806 10108 1 18 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.551 -0.572 19806 10109 1 18 . 1 1 90 90 LYS CB C 90 32.994 32.994 33.953 -0.959 19806 10110 1 18 . 1 1 91 91 HIS N N 91 119.523 119.523 118.355 1.168 19806 10111 1 18 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.398 0.379 19806 10112 1 18 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.370 -0.665 19806 10113 1 18 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.332 -0.138 19806 10114 1 18 . 1 1 92 92 LYS N N 92 122.527 122.527 125.877 -3.350 19806 10115 1 18 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.830 0.299 19806 10116 1 18 . 1 1 92 92 LYS CA C 92 54.291 54.291 55.528 -1.237 19806 10117 1 18 . 1 1 92 92 LYS CB C 92 37.479 37.479 36.748 0.731 19806 10118 1 18 . 1 1 93 93 ILE N N 93 121.564 121.564 125.561 -3.997 19806 10119 1 18 . 1 1 93 93 ILE HA H 93 5.310 5.310 5.005 0.305 19806 10120 1 18 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.783 0.354 19806 10121 1 18 . 1 1 93 93 ILE CB C 93 41.088 41.088 41.531 -0.443 19806 10122 1 18 . 1 1 94 94 PHE N N 94 128.955 128.955 129.415 -0.460 19806 10123 1 18 . 1 1 94 94 PHE HA H 94 4.900 4.900 5.280 -0.380 19806 10124 1 18 . 1 1 94 94 PHE CA C 94 55.843 55.843 55.661 0.182 19806 10125 1 18 . 1 1 95 95 GLU N N 95 124.809 124.809 124.424 0.385 19806 10126 1 18 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.185 0.233 19806 10127 1 18 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.500 0.981 19806 10128 1 18 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.287 1.873 19806 10129 1 18 . 1 1 96 96 ALA N N 96 123.759 123.759 122.049 1.710 19806 10130 1 18 . 1 1 96 96 ALA HA H 96 5.379 5.379 4.800 0.579 19806 10131 1 18 . 1 1 96 96 ALA CA C 96 49.541 49.541 51.113 -1.572 19806 10132 1 18 . 1 1 96 96 ALA CB C 96 23.830 23.830 21.869 1.961 19806 10133 1 18 . 1 1 97 97 GLY N N 97 106.592 106.592 107.292 -0.700 19806 10134 1 18 . 1 1 97 97 GLY CA C 97 45.435 45.435 44.682 0.753 19806 10135 1 18 . 1 1 98 98 TYR N N 98 119.250 119.250 120.198 -0.948 19806 10136 1 18 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.774 0.044 19806 10137 1 18 . 1 1 98 98 TYR CA C 98 59.387 59.387 58.162 1.225 19806 10138 1 18 . 1 1 98 98 TYR CB C 98 38.122 38.122 39.001 -0.879 19806 10139 1 18 . 1 1 99 99 GLU N N 99 123.080 123.080 124.290 -1.210 19806 10140 1 18 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.078 -0.069 19806 10141 1 18 . 1 1 99 99 GLU CA C 99 58.409 58.409 59.076 -0.667 19806 10142 1 18 . 1 1 99 99 GLU CB C 99 30.254 30.254 29.965 0.289 19806 10143 1 18 . 1 1 100 100 GLU N N 100 116.459 116.459 116.371 0.088 19806 10144 1 18 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.544 -0.508 19806 10145 1 18 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.021 1.383 19806 10146 1 18 . 1 1 100 100 GLU CB C 100 27.576 27.576 30.367 -2.792 19806 10147 1 18 . 1 1 101 101 SER N N 101 113.069 113.069 115.076 -2.007 19806 10148 1 18 . 1 1 101 101 SER HA H 101 4.839 4.839 4.665 0.174 19806 10149 1 18 . 1 1 101 101 SER CA C 101 56.024 56.024 57.460 -1.436 19806 10150 1 18 . 1 1 101 101 SER CB C 101 64.806 64.806 65.115 -0.309 19806 10151 1 18 . 1 1 102 102 GLU N N 102 120.439 120.439 121.478 -1.039 19806 10152 1 18 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.449 -0.060 19806 10153 1 18 . 1 1 102 102 GLU CA C 102 55.804 55.804 56.197 -0.393 19806 10154 1 18 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.533 -0.548 19806 10155 1 18 . 1 1 103 103 VAL N N 103 118.899 118.899 116.458 2.441 19806 10156 1 18 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.161 -0.075 19806 10157 1 18 . 1 1 103 103 VAL CA C 103 62.699 62.699 60.964 1.735 19806 10158 1 18 . 1 1 103 103 VAL CB C 103 32.261 32.261 33.117 -0.856 19806 10159 1 18 . 1 1 104 104 ASP N N 104 120.965 120.965 119.317 1.648 19806 10160 1 18 . 1 1 104 104 ASP HA H 104 5.003 5.003 4.850 0.153 19806 10161 1 18 . 1 1 104 104 ASP CA C 104 54.914 54.914 55.206 -0.292 19806 10162 1 18 . 1 1 104 104 ASP CB C 104 42.791 42.791 44.145 -1.353 19806 10163 1 18 . 1 1 105 105 LEU N N 105 120.365 120.365 118.084 2.281 19806 10164 1 18 . 1 1 105 105 LEU HA H 105 5.295 5.295 5.122 0.173 19806 10165 1 18 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.602 -0.171 19806 10166 1 18 . 1 1 105 105 LEU CB C 105 46.001 46.001 45.061 0.940 19806 10167 1 18 . 1 1 106 106 ARG N N 106 126.289 126.289 125.846 0.443 19806 10168 1 18 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.186 0.639 19806 10169 1 18 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.589 0.083 19806 10170 1 18 . 1 1 106 106 ARG CB C 106 33.920 33.920 33.312 0.608 19806 10171 1 18 . 1 1 107 107 VAL N N 107 126.145 126.145 122.540 3.605 19806 10172 1 18 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.907 -0.228 19806 10173 1 18 . 1 1 107 107 VAL CA C 107 61.671 61.671 59.753 1.918 19806 10174 1 18 . 1 1 107 107 VAL CB C 107 35.350 35.350 35.516 -0.166 19806 10175 1 18 . 1 1 108 108 GLU N N 108 127.093 127.093 126.982 0.111 19806 10176 1 18 . 1 1 108 108 GLU HA H 108 5.267 5.267 5.670 -0.403 19806 10177 1 18 . 1 1 108 108 GLU CA C 108 54.761 54.761 54.731 0.030 19806 10178 1 18 . 1 1 108 108 GLU CB C 108 32.567 32.567 34.682 -2.115 19806 10179 1 18 . 1 1 109 109 PHE N N 109 124.592 124.592 120.576 4.016 19806 10180 1 18 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.365 0.663 19806 10181 1 18 . 1 1 109 109 PHE CA C 109 55.945 55.945 57.097 -1.152 19806 10182 1 18 . 1 1 109 109 PHE CB C 109 43.099 43.099 43.889 -0.790 19806 10183 1 18 . 1 1 110 110 GLU N N 110 122.143 122.143 121.911 0.232 19806 10184 1 18 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.039 0.154 19806 10185 1 18 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.454 0.989 19806 10186 1 18 . 1 1 110 110 GLU CB C 110 35.816 35.816 33.895 1.921 19806 10187 1 18 . 1 1 111 111 LEU N N 111 129.616 129.616 125.803 3.813 19806 10188 1 18 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.458 0.350 19806 10189 1 18 . 1 1 111 111 LEU CA C 111 53.470 53.470 54.683 -1.213 19806 10190 1 18 . 1 1 111 111 LEU CB C 111 40.400 40.400 41.242 -0.842 19806 10191 1 18 . 1 1 112 112 GLN N N 112 124.742 124.742 124.212 0.530 19806 10192 1 18 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.267 0.172 19806 10193 1 18 . 1 1 112 112 GLN CA C 112 55.802 55.802 54.194 1.608 19806 10194 1 18 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.678 -0.925 19806 10195 1 18 . 1 1 113 113 ALA N N 113 121.195 121.195 125.696 -4.501 19806 10196 1 18 . 1 1 113 113 ALA HA H 113 4.048 4.048 3.870 0.178 19806 10197 1 18 . 1 1 113 113 ALA CA C 113 54.518 54.518 54.571 -0.052 19806 10198 1 18 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.300 -0.101 19806 10199 1 18 . 1 1 114 114 ASP N N 114 114.525 114.525 117.035 -2.510 19806 10200 1 18 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.449 -0.050 19806 10201 1 18 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.071 -1.163 19806 10202 1 18 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.566 -1.508 19806 10203 1 18 . 1 1 115 115 GLY N N 115 107.526 107.526 105.272 2.254 19806 10204 1 18 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.452 0.332 19806 10205 1 18 . 1 1 116 116 LYS N N 116 118.818 118.818 119.453 -0.635 19806 10206 1 18 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.839 -0.389 19806 10207 1 18 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.558 -0.387 19806 10208 1 18 . 1 1 116 116 LYS CB C 116 35.039 35.039 36.099 -1.060 19806 10209 1 18 . 1 1 117 117 TRP N N 117 118.939 118.939 124.217 -5.278 19806 10210 1 18 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.345 -0.389 19806 10211 1 18 . 1 1 118 118 TYR N N 118 112.644 112.644 121.596 -8.952 19806 10212 1 18 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.899 0.378 19806 10213 1 18 . 1 1 118 118 TYR CA C 118 56.219 56.219 56.555 -0.336 19806 10214 1 18 . 1 1 118 118 TYR CB C 118 43.282 43.282 41.797 1.485 19806 10215 1 18 . 1 1 119 119 VAL N N 119 119.842 119.842 120.964 -1.122 19806 10216 1 18 . 1 1 119 119 VAL HA H 119 4.515 4.515 3.217 1.298 19806 10217 1 18 . 1 1 119 119 VAL CA C 119 62.442 62.442 63.089 -0.647 19806 10218 1 18 . 1 1 120 120 VAL N N 120 114.552 114.552 113.884 0.668 19806 10219 1 18 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.488 0.250 19806 10220 1 18 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.550 -0.955 19806 10221 1 18 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.431 -0.579 19806 10222 1 18 . 1 1 121 121 ASP N N 121 118.234 118.234 119.519 -1.285 19806 10223 1 18 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.866 0.397 19806 10224 1 18 . 1 1 121 121 ASP CA C 121 53.663 53.663 54.230 -0.567 19806 10225 1 18 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.247 -0.360 19806 10226 1 18 . 1 1 122 122 CYS N N 122 121.036 121.036 125.057 -4.021 19806 10227 1 18 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.608 0.963 19806 10228 1 18 . 1 1 122 122 CYS CA C 122 57.052 57.052 56.938 0.114 19806 10229 1 18 . 1 1 122 122 CYS CB C 122 30.834 30.834 28.100 2.734 19806 10230 1 18 . 1 1 123 123 TYR N N 123 127.672 127.672 121.830 5.842 19806 10231 1 18 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.531 0.479 19806 10232 1 18 . 1 1 123 123 TYR CA C 123 57.169 57.169 59.845 -2.676 19806 10233 1 18 . 1 1 123 123 TYR CB C 123 41.408 41.408 39.847 1.561 19806 10234 1 18 . 1 1 124 124 THR N N 124 120.833 120.833 119.362 1.471 19806 10235 1 18 . 1 1 124 124 THR HA H 124 4.987 4.987 4.909 0.078 19806 10236 1 18 . 1 1 124 124 THR CA C 124 57.153 57.153 58.878 -1.725 19806 10237 1 18 . 1 1 124 124 THR CB C 124 68.607 68.607 71.563 -2.956 19806 10238 1 18 . 1 1 125 125 GLY N N 125 114.347 114.347 112.247 2.100 19806 10239 1 18 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.806 -0.478 19806 10240 1 18 . 1 1 126 126 TRP N N 126 119.918 119.918 121.737 -1.819 19806 10241 1 18 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.002 0.068 19806 10242 1 18 . 1 1 126 126 TRP CA C 126 60.564 60.564 59.413 1.151 19806 10243 1 18 . 1 1 126 126 TRP CB C 126 29.639 29.639 28.956 0.683 19806 10244 1 18 . 1 1 127 127 TYR N N 127 113.911 113.911 113.411 0.500 19806 10245 1 18 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.750 0.244 19806 10246 1 18 . 1 1 127 127 TYR CA C 127 53.384 53.384 56.695 -3.311 19806 10247 1 18 . 1 1 127 127 TYR CB C 127 38.584 38.584 37.642 0.943 19806 10248 1 18 . 1 1 128 128 GLY N N 128 105.181 105.181 108.375 -3.194 19806 10249 1 18 . 1 1 128 128 GLY CA C 128 45.189 45.189 44.010 1.179 19806 10250 1 18 . 1 1 129 129 TYR N N 129 116.588 116.588 118.442 -1.854 19806 10251 1 18 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.622 0.042 19806 10252 1 18 . 1 1 129 129 TYR CA C 129 59.565 59.565 56.231 3.334 19806 10253 1 18 . 1 1 129 129 TYR CB C 129 38.853 38.853 35.715 3.138 19806 10254 1 18 . 1 1 130 130 ASP N N 130 115.195 115.195 121.330 -6.135 19806 10255 1 18 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.753 -0.368 19806 10256 1 18 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.685 -1.555 19806 10257 1 18 . 1 1 130 130 ASP CB C 130 38.685 38.685 43.024 -4.339 19806 10258 1 18 . 1 1 131 131 LEU N N 131 124.887 124.887 122.186 2.701 19806 10259 1 18 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.926 -0.445 19806 10260 1 18 . 1 1 131 131 LEU CA C 131 53.605 53.605 51.174 2.431 19806 10261 1 18 . 1 1 131 131 LEU CB C 131 42.441 42.441 42.586 -0.145 19806 10262 1 18 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.758 -0.075 19806 10263 1 18 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.626 65.439 19806 10264 1 18 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.233 -0.906 19806 10265 1 18 . 1 1 133 133 ILE N N 133 123.765 123.765 118.773 4.992 19806 10266 1 18 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.653 0.076 19806 10267 1 18 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.169 1.691 19806 10268 1 18 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.128 -0.065 19806 10269 1 18 . 1 1 134 134 GLY N N 134 107.030 107.030 105.849 1.181 19806 10270 1 18 . 1 1 134 134 GLY CA C 134 45.976 45.976 46.239 -0.263 19806 10271 1 18 . 1 1 135 135 GLU N N 135 116.566 116.566 121.875 -5.309 19806 10272 1 18 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.296 0.368 19806 10273 1 18 . 1 1 135 135 GLU CA C 135 55.414 55.414 56.976 -1.562 19806 10274 1 18 . 1 1 135 135 GLU CB C 135 30.195 30.195 29.451 0.744 19806 10275 1 18 . 1 1 136 136 LEU N N 136 124.239 124.239 121.705 2.534 19806 10276 1 18 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.951 0.093 19806 10277 1 18 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.054 1.062 19806 10278 1 18 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.709 -0.702 19806 10279 1 18 . 1 1 137 137 LYS N N 137 117.225 117.225 117.313 -0.088 19806 10280 1 18 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.808 0.055 19806 10281 1 18 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.777 0.678 19806 10282 1 18 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.940 -0.737 19806 10283 1 18 . 1 1 138 138 GLN N N 138 118.718 118.718 118.192 0.526 19806 10284 1 18 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.123 -0.071 19806 10285 1 18 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.567 -0.692 19806 10286 1 18 . 1 1 138 138 GLN CB C 138 28.235 28.235 28.002 0.233 19806 10287 1 18 . 1 1 139 139 THR N N 139 117.970 117.970 117.041 0.929 19806 10288 1 18 . 1 1 139 139 THR HA H 139 4.532 4.532 4.012 0.520 19806 10289 1 18 . 1 1 139 139 THR CA C 139 68.145 68.145 66.876 1.269 19806 10290 1 18 . 1 1 139 139 THR CB C 139 68.103 68.103 68.392 -0.289 19806 10291 1 18 . 1 1 140 140 ILE N N 140 120.391 120.391 121.893 -1.502 19806 10292 1 18 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.915 -0.188 19806 10293 1 18 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.319 0.937 19806 10294 1 18 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.587 0.526 19806 10295 1 18 . 1 1 141 141 GLN N N 141 118.917 118.917 119.006 -0.089 19806 10296 1 18 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.852 0.163 19806 10297 1 18 . 1 1 141 141 GLN CA C 141 58.371 58.371 59.156 -0.785 19806 10298 1 18 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.557 -1.210 19806 10299 1 18 . 1 1 142 142 ASN N N 142 119.936 119.936 118.661 1.275 19806 10300 1 18 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.577 -0.062 19806 10301 1 18 . 1 1 142 142 ASN CA C 142 55.799 55.799 55.812 -0.013 19806 10302 1 18 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.100 -0.470 19806 10303 1 18 . 1 1 143 143 VAL N N 143 123.195 123.195 119.010 4.185 19806 10304 1 18 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.286 -0.570 19806 10305 1 18 . 1 1 143 143 VAL CA C 143 66.497 66.497 65.771 0.726 19806 10306 1 18 . 1 1 143 143 VAL CB C 143 30.989 30.989 30.691 0.298 19806 10307 1 18 . 1 1 144 144 LYS N N 144 120.348 120.348 119.360 0.988 19806 10308 1 18 . 1 1 144 144 LYS HA H 144 3.881 3.881 3.975 -0.094 19806 10309 1 18 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.950 0.173 19806 10310 1 18 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.207 -0.325 19806 10311 1 18 . 1 1 145 145 GLU N N 145 119.220 119.220 119.075 0.145 19806 10312 1 18 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.067 0.116 19806 10313 1 18 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.140 0.038 19806 10314 1 18 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.492 -0.421 19806 10315 1 18 . 1 1 146 146 GLU N N 146 121.420 121.420 119.495 1.925 19806 10316 1 18 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.131 0.146 19806 10317 1 18 . 1 1 146 146 GLU CA C 146 59.118 59.118 58.725 0.393 19806 10318 1 18 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.253 -0.912 19806 10319 1 18 . 1 1 147 147 ASN N N 147 119.197 119.197 118.260 0.937 19806 10320 1 18 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.487 0.081 19806 10321 1 18 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.926 -1.775 19806 10322 1 18 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.760 -0.387 19806 10323 1 18 . 1 1 148 148 ALA N N 148 123.672 123.672 122.675 0.997 19806 10324 1 18 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.172 -0.049 19806 10325 1 18 . 1 1 148 148 ALA CA C 148 55.133 55.133 55.069 0.064 19806 10326 1 18 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.095 -0.488 19806 10327 1 18 . 1 1 149 149 ALA N N 149 119.979 119.979 121.973 -1.994 19806 10328 1 18 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.047 0.214 19806 10329 1 18 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.695 -0.050 19806 10330 1 18 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.357 -0.619 19806 10331 1 18 . 1 1 150 150 PHE N N 150 119.592 119.592 119.136 0.456 19806 10332 1 18 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.082 0.142 19806 10333 1 18 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.421 -0.413 19806 10334 1 18 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.272 -0.210 19806 10335 1 18 . 1 1 151 151 LYS N N 151 116.869 116.869 118.286 -1.417 19806 10336 1 18 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.341 -0.435 19806 10337 1 18 . 1 1 151 151 LYS CA C 151 58.770 58.770 59.070 -0.300 19806 10338 1 18 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.233 0.508 19806 10339 1 18 . 1 1 152 152 GLU N N 152 115.868 115.868 118.363 -2.495 19806 10340 1 18 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.116 -0.063 19806 10341 1 18 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.614 0.042 19806 10342 1 18 . 1 1 152 152 GLU CB C 152 29.753 29.753 29.777 -0.024 19806 10343 1 18 . 1 1 153 153 ILE N N 153 110.437 110.437 118.194 -7.757 19806 10344 1 18 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.805 0.371 19806 10345 1 18 . 1 1 153 153 ILE CA C 153 61.034 61.034 63.553 -2.519 19806 10346 1 18 . 1 1 153 153 ILE CB C 153 39.272 39.272 38.606 0.666 19806 10347 1 18 . 1 1 154 154 HIS N N 154 117.779 117.779 115.960 1.819 19806 10348 1 18 . 1 1 154 154 HIS HA H 154 5.174 5.174 5.096 0.078 19806 10349 1 18 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.103 -0.487 19806 10350 1 18 . 1 1 154 154 HIS CB C 154 28.547 28.547 29.102 -0.555 19806 10351 1 19 . 1 1 3 3 SER N N 3 114.847 114.847 112.697 2.150 19806 10352 1 19 . 1 1 3 3 SER HA H 3 4.463 4.463 4.449 0.014 19806 10353 1 19 . 1 1 3 3 SER CA C 3 58.340 58.340 58.020 0.320 19806 10354 1 19 . 1 1 3 3 SER CB C 3 63.457 63.457 64.204 -0.747 19806 10355 1 19 . 1 1 4 4 GLU N N 4 121.498 121.498 118.314 3.184 19806 10356 1 19 . 1 1 4 4 GLU HA H 4 4.332 4.332 3.957 0.375 19806 10357 1 19 . 1 1 4 4 GLU CA C 4 56.443 56.443 57.113 -0.670 19806 10358 1 19 . 1 1 4 4 GLU CB C 4 29.966 29.966 28.347 1.619 19806 10359 1 19 . 1 1 5 5 LEU N N 5 121.589 121.589 119.729 1.860 19806 10360 1 19 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.293 0.144 19806 10361 1 19 . 1 1 5 5 LEU CA C 5 55.019 55.019 56.596 -1.577 19806 10362 1 19 . 1 1 5 5 LEU CB C 5 42.243 42.243 42.011 0.232 19806 10363 1 19 . 1 1 6 6 THR N N 6 113.708 113.708 113.861 -0.153 19806 10364 1 19 . 1 1 6 6 THR HA H 6 4.470 4.470 4.774 -0.304 19806 10365 1 19 . 1 1 6 6 THR CA C 6 61.409 61.409 61.351 0.058 19806 10366 1 19 . 1 1 6 6 THR CB C 6 69.544 69.544 70.245 -0.701 19806 10367 1 19 . 1 1 7 7 THR N N 7 114.945 114.945 109.998 4.947 19806 10368 1 19 . 1 1 7 7 THR HA H 7 4.415 4.415 4.494 -0.079 19806 10369 1 19 . 1 1 7 7 THR CA C 7 61.435 61.435 61.951 -0.516 19806 10370 1 19 . 1 1 7 7 THR CB C 7 69.506 69.506 69.570 -0.065 19806 10371 1 19 . 1 1 8 8 GLN N N 8 121.368 121.368 121.998 -0.630 19806 10372 1 19 . 1 1 8 8 GLN CA C 8 55.684 55.684 55.614 0.070 19806 10373 1 19 . 1 1 9 9 ASP N N 9 120.595 120.595 117.778 2.817 19806 10374 1 19 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.578 0.069 19806 10375 1 19 . 1 1 9 9 ASP CA C 9 54.115 54.115 53.970 0.145 19806 10376 1 19 . 1 1 9 9 ASP CB C 9 41.328 41.328 41.615 -0.287 19806 10377 1 19 . 1 1 10 10 GLY N N 10 106.984 106.984 106.277 0.707 19806 10378 1 19 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.625 -0.130 19806 10379 1 19 . 1 1 11 11 GLU N N 11 120.879 120.879 121.756 -0.877 19806 10380 1 19 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.284 -0.095 19806 10381 1 19 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.451 0.059 19806 10382 1 19 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.115 1.954 19806 10383 1 19 . 1 1 12 12 ASP N N 12 126.686 126.686 123.566 3.120 19806 10384 1 19 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.542 0.208 19806 10385 1 19 . 1 1 12 12 ASP CA C 12 54.347 54.347 55.168 -0.821 19806 10386 1 19 . 1 1 12 12 ASP CB C 12 42.771 42.771 41.984 0.787 19806 10387 1 19 . 1 1 13 13 PHE N N 13 128.055 128.055 123.383 4.672 19806 10388 1 19 . 1 1 13 13 PHE HA H 13 3.412 3.412 4.146 -0.734 19806 10389 1 19 . 1 1 13 13 PHE CA C 13 62.551 62.551 60.035 2.515 19806 10390 1 19 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.643 0.190 19806 10391 1 19 . 1 1 14 14 LYS N N 14 117.498 117.498 119.554 -2.056 19806 10392 1 19 . 1 1 14 14 LYS HA H 14 3.581 3.581 4.018 -0.437 19806 10393 1 19 . 1 1 14 14 LYS CA C 14 59.461 59.461 57.778 1.683 19806 10394 1 19 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.462 -0.117 19806 10395 1 19 . 1 1 15 15 SER N N 15 113.775 113.775 114.355 -0.580 19806 10396 1 19 . 1 1 15 15 SER HA H 15 4.167 4.167 4.053 0.114 19806 10397 1 19 . 1 1 15 15 SER CA C 15 61.099 61.099 61.888 -0.789 19806 10398 1 19 . 1 1 15 15 SER CB C 15 62.428 62.428 62.563 -0.135 19806 10399 1 19 . 1 1 16 16 PHE N N 16 122.292 122.292 120.278 2.014 19806 10400 1 19 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.606 -0.316 19806 10401 1 19 . 1 1 16 16 PHE CA C 16 59.773 59.773 60.058 -0.285 19806 10402 1 19 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.687 -1.512 19806 10403 1 19 . 1 1 17 17 LEU N N 17 122.472 122.472 121.004 1.468 19806 10404 1 19 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.362 -0.512 19806 10405 1 19 . 1 1 17 17 LEU CA C 17 56.619 56.619 56.174 0.445 19806 10406 1 19 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.181 0.281 19806 10407 1 19 . 1 1 18 18 ASP N N 18 117.331 117.331 119.696 -2.365 19806 10408 1 19 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.230 -0.115 19806 10409 1 19 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.619 -1.224 19806 10410 1 19 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.854 -0.501 19806 10411 1 19 . 1 1 19 19 LYS N N 19 120.032 120.032 119.377 0.655 19806 10412 1 19 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.883 -0.206 19806 10413 1 19 . 1 1 19 19 LYS CA C 19 59.067 59.067 59.191 -0.124 19806 10414 1 19 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.028 -0.092 19806 10415 1 19 . 1 1 20 20 PHE N N 20 119.607 119.607 119.418 0.189 19806 10416 1 19 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.321 -0.212 19806 10417 1 19 . 1 1 20 20 PHE CA C 20 62.090 62.090 61.041 1.049 19806 10418 1 19 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.199 1.270 19806 10419 1 19 . 1 1 21 21 THR N N 21 101.473 101.473 110.571 -9.098 19806 10420 1 19 . 1 1 21 21 THR HA H 21 4.259 4.259 4.303 -0.044 19806 10421 1 19 . 1 1 21 21 THR CA C 21 61.774 61.774 64.645 -2.871 19806 10422 1 19 . 1 1 22 22 SER N N 22 111.453 111.453 116.830 -5.377 19806 10423 1 19 . 1 1 22 22 SER HA H 22 4.165 4.165 4.637 -0.472 19806 10424 1 19 . 1 1 22 22 SER CA C 22 58.215 58.215 58.450 -0.235 19806 10425 1 19 . 1 1 22 22 SER CB C 22 64.570 64.570 63.882 0.688 19806 10426 1 19 . 1 1 23 23 SER N N 23 114.184 114.184 117.301 -3.117 19806 10427 1 19 . 1 1 23 23 SER HA H 23 4.764 4.764 5.023 -0.259 19806 10428 1 19 . 1 1 23 23 SER CA C 23 55.669 55.669 57.591 -1.922 19806 10429 1 19 . 1 1 23 23 SER CB C 23 64.011 64.011 64.961 -0.950 19806 10430 1 19 . 1 1 24 24 ALA N N 24 133.370 133.370 128.657 4.713 19806 10431 1 19 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.238 -0.282 19806 10432 1 19 . 1 1 24 24 ALA CA C 24 55.106 55.106 54.174 0.932 19806 10433 1 19 . 1 1 24 24 ALA CB C 24 19.835 19.835 18.929 0.906 19806 10434 1 19 . 1 1 25 25 ALA N N 25 117.430 117.430 118.702 -1.272 19806 10435 1 19 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.692 -0.375 19806 10436 1 19 . 1 1 25 25 ALA CA C 25 55.201 55.201 52.081 3.120 19806 10437 1 19 . 1 1 25 25 ALA CB C 25 18.349 18.349 19.485 -1.136 19806 10438 1 19 . 1 1 26 26 PHE N N 26 116.042 116.042 118.343 -2.301 19806 10439 1 19 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.581 -0.271 19806 10440 1 19 . 1 1 26 26 PHE CA C 26 60.759 60.759 60.092 0.667 19806 10441 1 19 . 1 1 26 26 PHE CB C 26 39.310 39.310 40.932 -1.623 19806 10442 1 19 . 1 1 27 27 GLN N N 27 121.820 121.820 120.596 1.224 19806 10443 1 19 . 1 1 27 27 GLN HA H 27 3.391 3.391 4.108 -0.717 19806 10444 1 19 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.377 0.717 19806 10445 1 19 . 1 1 27 27 GLN CB C 27 27.457 27.457 27.591 -0.134 19806 10446 1 19 . 1 1 28 28 TYR N N 28 111.517 111.517 115.730 -4.213 19806 10447 1 19 . 1 1 28 28 TYR HA H 28 4.130 4.130 4.200 -0.070 19806 10448 1 19 . 1 1 28 28 TYR CA C 28 62.357 62.357 58.852 3.505 19806 10449 1 19 . 1 1 28 28 TYR CB C 28 38.568 38.568 37.456 1.112 19806 10450 1 19 . 1 1 29 29 THR N N 29 106.324 106.324 112.440 -6.116 19806 10451 1 19 . 1 1 29 29 THR HA H 29 4.489 4.489 4.576 -0.087 19806 10452 1 19 . 1 1 29 29 THR CA C 29 63.765 63.765 61.746 2.019 19806 10453 1 19 . 1 1 29 29 THR CB C 29 69.568 69.568 69.313 0.255 19806 10454 1 19 . 1 1 30 30 ARG N N 30 117.696 117.696 120.680 -2.984 19806 10455 1 19 . 1 1 30 30 ARG HA H 30 4.701 4.701 3.831 0.870 19806 10456 1 19 . 1 1 30 30 ARG CA C 30 52.760 52.760 55.308 -2.548 19806 10457 1 19 . 1 1 30 30 ARG CB C 30 35.047 35.047 31.611 3.436 19806 10458 1 19 . 1 1 31 31 VAL N N 31 119.395 119.395 118.847 0.548 19806 10459 1 19 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.165 0.065 19806 10460 1 19 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.784 0.407 19806 10461 1 19 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.155 -1.982 19806 10462 1 19 . 1 1 32 32 LYS N N 32 126.124 126.124 124.516 1.608 19806 10463 1 19 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.511 -0.327 19806 10464 1 19 . 1 1 32 32 LYS CA C 32 53.958 53.958 54.211 -0.253 19806 10465 1 19 . 1 1 32 32 LYS CB C 32 31.112 31.112 34.070 -2.958 19806 10466 1 19 . 1 1 33 33 PHE N N 33 119.303 119.303 118.561 0.742 19806 10467 1 19 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.931 -0.417 19806 10468 1 19 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.715 0.557 19806 10469 1 19 . 1 1 33 33 PHE CB C 33 40.378 40.378 39.758 0.620 19806 10470 1 19 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.822 0.146 19806 10471 1 19 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.944 -1.311 19806 10472 1 19 . 1 1 34 34 PRO CB C 34 33.732 33.732 33.032 0.700 19806 10473 1 19 . 1 1 35 35 LEU N N 35 120.016 120.016 120.563 -0.547 19806 10474 1 19 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.668 -0.446 19806 10475 1 19 . 1 1 35 35 LEU CA C 35 54.840 54.840 54.263 0.577 19806 10476 1 19 . 1 1 35 35 LEU CB C 35 41.244 41.244 43.072 -1.828 19806 10477 1 19 . 1 1 36 36 LYS N N 36 117.066 117.066 119.221 -2.155 19806 10478 1 19 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.341 -0.366 19806 10479 1 19 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.919 2.328 19806 10480 1 19 . 1 1 36 36 LYS CB C 36 32.832 32.832 33.258 -0.426 19806 10481 1 19 . 1 1 37 37 THR N N 37 117.574 117.574 117.843 -0.269 19806 10482 1 19 . 1 1 37 37 THR HA H 37 4.797 4.797 4.783 0.014 19806 10483 1 19 . 1 1 37 37 THR CA C 37 60.396 60.396 60.114 0.282 19806 10484 1 19 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.705 0.314 19806 10485 1 19 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.661 -0.738 19806 10486 1 19 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.538 0.094 19806 10487 1 19 . 1 1 39 39 ILE N N 39 119.949 119.949 119.609 0.340 19806 10488 1 19 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.037 0.202 19806 10489 1 19 . 1 1 39 39 ILE CA C 39 62.133 62.133 62.926 -0.793 19806 10490 1 19 . 1 1 40 40 THR N N 40 123.962 123.962 122.939 1.023 19806 10491 1 19 . 1 1 40 40 THR HA H 40 5.057 5.057 4.926 0.131 19806 10492 1 19 . 1 1 40 40 THR CA C 40 62.262 62.262 61.034 1.228 19806 10493 1 19 . 1 1 40 40 THR CB C 40 69.891 69.891 70.093 -0.202 19806 10494 1 19 . 1 1 41 41 LEU N N 41 125.633 125.633 117.097 8.536 19806 10495 1 19 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.611 0.491 19806 10496 1 19 . 1 1 41 41 LEU CA C 41 52.638 52.638 53.153 -0.515 19806 10497 1 19 . 1 1 41 41 LEU CB C 41 45.180 45.180 43.654 1.526 19806 10498 1 19 . 1 1 42 42 LEU N N 42 120.788 120.788 121.381 -0.593 19806 10499 1 19 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.714 0.034 19806 10500 1 19 . 1 1 42 42 LEU CA C 42 53.724 53.724 54.091 -0.367 19806 10501 1 19 . 1 1 42 42 LEU CB C 42 44.384 44.384 41.775 2.609 19806 10502 1 19 . 1 1 43 43 ALA N N 43 123.073 123.073 127.891 -4.818 19806 10503 1 19 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.203 0.227 19806 10504 1 19 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.658 -1.371 19806 10505 1 19 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.399 0.615 19806 10506 1 19 . 1 1 44 44 ASP N N 44 118.196 118.196 119.105 -0.909 19806 10507 1 19 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.396 0.030 19806 10508 1 19 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.961 -0.933 19806 10509 1 19 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.851 -0.641 19806 10510 1 19 . 1 1 45 45 ASP N N 45 115.018 115.018 118.351 -3.333 19806 10511 1 19 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.580 -0.111 19806 10512 1 19 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.254 -0.460 19806 10513 1 19 . 1 1 45 45 ASP CB C 45 39.864 39.864 40.971 -1.107 19806 10514 1 19 . 1 1 46 46 GLY N N 46 107.499 107.499 107.145 0.354 19806 10515 1 19 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.516 0.398 19806 10516 1 19 . 1 1 47 47 GLU N N 47 117.331 117.331 117.672 -0.341 19806 10517 1 19 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.611 -0.080 19806 10518 1 19 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.475 0.463 19806 10519 1 19 . 1 1 47 47 GLU CB C 47 33.133 33.133 31.150 1.983 19806 10520 1 19 . 1 1 48 48 THR N N 48 118.462 118.462 116.945 1.517 19806 10521 1 19 . 1 1 48 48 THR HA H 48 4.243 4.243 4.628 -0.385 19806 10522 1 19 . 1 1 48 48 THR CA C 48 62.834 62.834 61.523 1.310 19806 10523 1 19 . 1 1 48 48 THR CB C 48 68.649 68.649 69.575 -0.926 19806 10524 1 19 . 1 1 49 49 GLU N N 49 123.834 123.834 127.615 -3.781 19806 10525 1 19 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.427 0.518 19806 10526 1 19 . 1 1 49 49 GLU CA C 49 55.358 55.358 57.852 -2.494 19806 10527 1 19 . 1 1 49 49 GLU CB C 49 31.395 31.395 29.696 1.699 19806 10528 1 19 . 1 1 50 50 LYS N N 50 122.868 122.868 127.589 -4.721 19806 10529 1 19 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.738 -0.097 19806 10530 1 19 . 1 1 50 50 LYS CA C 50 54.111 54.111 54.979 -0.868 19806 10531 1 19 . 1 1 50 50 LYS CB C 50 35.312 35.312 35.136 0.176 19806 10532 1 19 . 1 1 51 51 THR N N 51 111.386 111.386 114.375 -2.989 19806 10533 1 19 . 1 1 51 51 THR HA H 51 5.619 5.619 5.350 0.269 19806 10534 1 19 . 1 1 51 51 THR CA C 51 58.980 58.980 60.864 -1.884 19806 10535 1 19 . 1 1 51 51 THR CB C 51 71.277 71.277 70.129 1.148 19806 10536 1 19 . 1 1 52 52 PHE N N 52 120.631 120.631 119.916 0.715 19806 10537 1 19 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.888 0.075 19806 10538 1 19 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.476 -1.347 19806 10539 1 19 . 1 1 52 52 PHE CB C 52 41.049 41.049 41.425 -0.376 19806 10540 1 19 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.476 -0.028 19806 10541 1 19 . 1 1 53 53 PRO CA C 53 62.489 62.489 63.059 -0.570 19806 10542 1 19 . 1 1 53 53 PRO CB C 53 32.240 32.240 31.965 0.275 19806 10543 1 19 . 1 1 54 54 PHE N N 54 128.034 128.034 126.237 1.797 19806 10544 1 19 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.562 0.266 19806 10545 1 19 . 1 1 54 54 PHE CA C 54 55.509 55.509 57.832 -2.323 19806 10546 1 19 . 1 1 54 54 PHE CB C 54 37.028 37.028 40.093 -3.066 19806 10547 1 19 . 1 1 55 55 THR N N 55 111.757 111.757 117.986 -6.229 19806 10548 1 19 . 1 1 55 55 THR HA H 55 4.413 4.413 4.334 0.079 19806 10549 1 19 . 1 1 55 55 THR CA C 55 60.578 60.578 59.859 0.718 19806 10550 1 19 . 1 1 55 55 THR CB C 55 69.447 69.447 71.421 -1.974 19806 10551 1 19 . 1 1 56 56 LYS N N 56 118.734 118.734 120.761 -2.027 19806 10552 1 19 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.241 -1.759 19806 10553 1 19 . 1 1 56 56 LYS CA C 56 59.381 59.381 59.288 0.093 19806 10554 1 19 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.926 1.324 19806 10555 1 19 . 1 1 57 57 GLU N N 57 119.675 119.675 117.176 2.499 19806 10556 1 19 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.112 0.157 19806 10557 1 19 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.768 -1.616 19806 10558 1 19 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.220 -2.270 19806 10559 1 19 . 1 1 58 58 LYS N N 58 114.700 114.700 115.737 -1.037 19806 10560 1 19 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.330 -0.018 19806 10561 1 19 . 1 1 58 58 LYS CA C 58 55.595 55.595 54.810 0.785 19806 10562 1 19 . 1 1 58 58 LYS CB C 58 32.011 32.011 32.293 -0.282 19806 10563 1 19 . 1 1 59 59 TRP N N 59 118.204 118.204 124.677 -6.473 19806 10564 1 19 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.312 -0.213 19806 10565 1 19 . 1 1 59 59 TRP CA C 59 55.577 55.577 55.315 0.262 19806 10566 1 19 . 1 1 59 59 TRP CB C 59 32.037 32.037 29.731 2.306 19806 10567 1 19 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.518 -0.255 19806 10568 1 19 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.740 -3.019 19806 10569 1 19 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.368 -2.519 19806 10570 1 19 . 1 1 61 61 LEU N N 61 123.758 123.758 123.835 -0.077 19806 10571 1 19 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.361 -0.722 19806 10572 1 19 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.250 0.625 19806 10573 1 19 . 1 1 61 61 LEU CB C 61 40.815 40.815 41.898 -1.083 19806 10574 1 19 . 1 1 62 62 LEU N N 62 124.052 124.052 126.516 -2.464 19806 10575 1 19 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.694 -0.339 19806 10576 1 19 . 1 1 62 62 LEU CA C 62 53.992 53.992 53.690 0.302 19806 10577 1 19 . 1 1 62 62 LEU CB C 62 44.686 44.686 43.248 1.438 19806 10578 1 19 . 1 1 63 63 ASP N N 63 117.271 117.271 123.392 -6.121 19806 10579 1 19 . 1 1 63 63 ASP HA H 63 5.033 5.033 5.299 -0.266 19806 10580 1 19 . 1 1 63 63 ASP CA C 63 51.101 51.101 53.162 -2.061 19806 10581 1 19 . 1 1 63 63 ASP CB C 63 43.345 43.345 43.000 0.345 19806 10582 1 19 . 1 1 64 64 SER N N 64 112.856 112.856 115.014 -2.158 19806 10583 1 19 . 1 1 64 64 SER HA H 64 3.865 3.865 4.427 -0.562 19806 10584 1 19 . 1 1 64 64 SER CA C 64 60.910 60.910 61.283 -0.373 19806 10585 1 19 . 1 1 64 64 SER CB C 64 62.378 62.378 63.403 -1.025 19806 10586 1 19 . 1 1 65 65 GLU N N 65 120.070 120.070 120.568 -0.498 19806 10587 1 19 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.097 -0.079 19806 10588 1 19 . 1 1 65 65 GLU CA C 65 58.343 58.343 59.071 -0.728 19806 10589 1 19 . 1 1 65 65 GLU CB C 65 28.887 28.887 28.542 0.345 19806 10590 1 19 . 1 1 66 66 THR N N 66 115.852 115.852 113.182 2.670 19806 10591 1 19 . 1 1 66 66 THR HA H 66 3.991 3.991 4.483 -0.492 19806 10592 1 19 . 1 1 66 66 THR CA C 66 65.804 65.804 62.512 3.292 19806 10593 1 19 . 1 1 66 66 THR CB C 66 68.451 68.451 69.328 -0.877 19806 10594 1 19 . 1 1 67 67 MET N N 67 113.585 113.585 120.908 -7.323 19806 10595 1 19 . 1 1 67 67 MET HA H 67 4.267 4.267 4.834 -0.567 19806 10596 1 19 . 1 1 67 67 MET CA C 67 52.135 52.135 55.409 -3.274 19806 10597 1 19 . 1 1 67 67 MET CB C 67 28.963 28.963 33.524 -4.561 19806 10598 1 19 . 1 1 68 68 LYS N N 68 118.462 118.462 121.086 -2.624 19806 10599 1 19 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.550 -0.180 19806 10600 1 19 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.432 0.050 19806 10601 1 19 . 1 1 68 68 LYS CB C 68 34.179 34.179 34.392 -0.213 19806 10602 1 19 . 1 1 69 69 GLU N N 69 121.700 121.700 124.664 -2.964 19806 10603 1 19 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.634 -0.110 19806 10604 1 19 . 1 1 69 69 GLU CA C 69 55.942 55.942 57.225 -1.283 19806 10605 1 19 . 1 1 69 69 GLU CB C 69 30.424 30.424 29.906 0.518 19806 10606 1 19 . 1 1 70 70 GLU N N 70 123.445 123.445 125.880 -2.435 19806 10607 1 19 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.517 0.180 19806 10608 1 19 . 1 1 70 70 GLU CA C 70 55.473 55.473 55.779 -0.306 19806 10609 1 19 . 1 1 70 70 GLU CB C 70 33.162 33.162 32.874 0.287 19806 10610 1 19 . 1 1 71 71 ARG N N 71 122.150 122.150 124.488 -2.338 19806 10611 1 19 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.767 0.384 19806 10612 1 19 . 1 1 71 71 ARG CA C 71 55.448 55.448 54.897 0.551 19806 10613 1 19 . 1 1 71 71 ARG CB C 71 31.703 31.703 30.141 1.562 19806 10614 1 19 . 1 1 72 72 ILE N N 72 125.686 125.686 127.076 -1.390 19806 10615 1 19 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.039 0.557 19806 10616 1 19 . 1 1 72 72 ILE CA C 72 59.512 59.512 61.437 -1.925 19806 10617 1 19 . 1 1 72 72 ILE CB C 72 41.095 41.095 37.748 3.348 19806 10618 1 19 . 1 1 73 73 THR N N 73 121.600 121.600 124.170 -2.570 19806 10619 1 19 . 1 1 73 73 THR HA H 73 4.603 4.603 4.338 0.265 19806 10620 1 19 . 1 1 73 73 THR CA C 73 61.937 61.937 62.806 -0.869 19806 10621 1 19 . 1 1 73 73 THR CB C 73 68.669 68.669 68.809 -0.140 19806 10622 1 19 . 1 1 74 74 GLN N N 74 124.607 124.607 128.162 -3.555 19806 10623 1 19 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.702 -0.121 19806 10624 1 19 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.258 0.431 19806 10625 1 19 . 1 1 74 74 GLN CB C 74 29.490 29.490 30.679 -1.189 19806 10626 1 19 . 1 1 75 75 GLU N N 75 122.962 122.962 118.736 4.226 19806 10627 1 19 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.358 -0.299 19806 10628 1 19 . 1 1 75 75 GLU CA C 75 58.845 58.845 56.832 2.013 19806 10629 1 19 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.195 -0.622 19806 10630 1 19 . 1 1 76 76 GLU N N 76 115.466 115.466 120.305 -4.839 19806 10631 1 19 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.326 -0.018 19806 10632 1 19 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.557 0.220 19806 10633 1 19 . 1 1 76 76 GLU CB C 76 29.072 29.072 30.039 -0.967 19806 10634 1 19 . 1 1 77 77 GLY N N 77 106.771 106.771 106.443 0.328 19806 10635 1 19 . 1 1 77 77 GLY CA C 77 45.014 45.014 44.693 0.321 19806 10636 1 19 . 1 1 78 78 GLY N N 78 108.535 108.535 106.872 1.663 19806 10637 1 19 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.432 0.275 19806 10638 1 19 . 1 1 79 79 ILE N N 79 121.066 121.066 121.756 -0.690 19806 10639 1 19 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.555 0.252 19806 10640 1 19 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.558 -1.215 19806 10641 1 19 . 1 1 79 79 ILE CB C 79 39.220 39.220 37.906 1.314 19806 10642 1 19 . 1 1 80 80 TYR N N 80 130.709 130.709 130.373 0.336 19806 10643 1 19 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.582 -0.318 19806 10644 1 19 . 1 1 80 80 TYR CA C 80 58.161 58.161 58.584 -0.423 19806 10645 1 19 . 1 1 80 80 TYR CB C 80 40.621 40.621 39.440 1.181 19806 10646 1 19 . 1 1 81 81 VAL N N 81 126.965 126.965 126.281 0.684 19806 10647 1 19 . 1 1 81 81 VAL HA H 81 4.854 4.854 5.037 -0.183 19806 10648 1 19 . 1 1 81 81 VAL CA C 81 60.457 60.457 59.518 0.939 19806 10649 1 19 . 1 1 81 81 VAL CB C 81 35.004 35.004 36.362 -1.358 19806 10650 1 19 . 1 1 82 82 SER N N 82 120.914 120.914 123.032 -2.118 19806 10651 1 19 . 1 1 82 82 SER HA H 82 5.185 5.185 4.832 0.353 19806 10652 1 19 . 1 1 82 82 SER CA C 82 55.260 55.260 57.545 -2.285 19806 10653 1 19 . 1 1 82 82 SER CB C 82 64.785 64.785 64.447 0.339 19806 10654 1 19 . 1 1 83 83 LYS N N 83 119.415 119.415 123.223 -3.808 19806 10655 1 19 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.829 -0.051 19806 10656 1 19 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.764 -0.005 19806 10657 1 19 . 1 1 83 83 LYS CB C 83 35.514 35.514 37.303 -1.789 19806 10658 1 19 . 1 1 84 84 PHE N N 84 119.220 119.220 118.562 0.658 19806 10659 1 19 . 1 1 84 84 PHE HA H 84 5.441 5.441 5.264 0.177 19806 10660 1 19 . 1 1 84 84 PHE CA C 84 58.414 58.414 58.088 0.326 19806 10661 1 19 . 1 1 84 84 PHE CB C 84 37.523 37.523 39.106 -1.583 19806 10662 1 19 . 1 1 85 85 THR N N 85 119.257 119.257 113.192 6.065 19806 10663 1 19 . 1 1 85 85 THR HA H 85 4.057 4.057 4.338 -0.281 19806 10664 1 19 . 1 1 85 85 THR CA C 85 62.660 62.660 62.696 -0.036 19806 10665 1 19 . 1 1 85 85 THR CB C 85 67.698 67.698 69.600 -1.902 19806 10666 1 19 . 1 1 86 86 LEU N N 86 121.612 121.612 123.309 -1.697 19806 10667 1 19 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.501 0.097 19806 10668 1 19 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.889 0.356 19806 10669 1 19 . 1 1 86 86 LEU CB C 86 44.657 44.657 43.749 0.908 19806 10670 1 19 . 1 1 87 87 ASN N N 87 127.684 127.684 123.345 4.339 19806 10671 1 19 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.613 0.398 19806 10672 1 19 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.730 -1.431 19806 10673 1 19 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.770 -0.174 19806 10674 1 19 . 1 1 88 88 GLU N N 88 120.509 120.509 121.587 -1.078 19806 10675 1 19 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.830 0.027 19806 10676 1 19 . 1 1 88 88 GLU CA C 88 54.382 54.382 53.231 1.151 19806 10677 1 19 . 1 1 88 88 GLU CB C 88 29.808 29.808 31.497 -1.689 19806 10678 1 19 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.453 -0.072 19806 10679 1 19 . 1 1 89 89 PRO CA C 89 65.898 65.898 65.047 0.851 19806 10680 1 19 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.211 0.141 19806 10681 1 19 . 1 1 90 90 LYS N N 90 107.288 107.288 114.219 -6.931 19806 10682 1 19 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.608 0.076 19806 10683 1 19 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.503 -0.524 19806 10684 1 19 . 1 1 90 90 LYS CB C 90 32.994 32.994 33.187 -0.193 19806 10685 1 19 . 1 1 91 91 HIS N N 91 119.523 119.523 118.666 0.857 19806 10686 1 19 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.537 0.240 19806 10687 1 19 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.759 -1.054 19806 10688 1 19 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.769 -0.575 19806 10689 1 19 . 1 1 92 92 LYS N N 92 122.527 122.527 125.272 -2.745 19806 10690 1 19 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.657 0.472 19806 10691 1 19 . 1 1 92 92 LYS CA C 92 54.291 54.291 55.114 -0.823 19806 10692 1 19 . 1 1 92 92 LYS CB C 92 37.479 37.479 36.849 0.630 19806 10693 1 19 . 1 1 93 93 ILE N N 93 121.564 121.564 122.908 -1.344 19806 10694 1 19 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.495 0.815 19806 10695 1 19 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.702 0.435 19806 10696 1 19 . 1 1 93 93 ILE CB C 93 41.088 41.088 42.044 -0.956 19806 10697 1 19 . 1 1 94 94 PHE N N 94 128.955 128.955 128.511 0.444 19806 10698 1 19 . 1 1 94 94 PHE HA H 94 4.900 4.900 5.256 -0.356 19806 10699 1 19 . 1 1 94 94 PHE CA C 94 55.843 55.843 57.012 -1.169 19806 10700 1 19 . 1 1 95 95 GLU N N 95 124.809 124.809 126.193 -1.384 19806 10701 1 19 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.028 0.390 19806 10702 1 19 . 1 1 95 95 GLU CA C 95 54.481 54.481 54.418 0.063 19806 10703 1 19 . 1 1 95 95 GLU CB C 95 35.160 35.160 34.679 0.481 19806 10704 1 19 . 1 1 96 96 ALA N N 96 123.759 123.759 124.410 -0.651 19806 10705 1 19 . 1 1 96 96 ALA HA H 96 5.379 5.379 5.253 0.126 19806 10706 1 19 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.224 -0.683 19806 10707 1 19 . 1 1 96 96 ALA CB C 96 23.830 23.830 22.412 1.418 19806 10708 1 19 . 1 1 97 97 GLY N N 97 106.592 106.592 108.585 -1.993 19806 10709 1 19 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.537 -0.102 19806 10710 1 19 . 1 1 98 98 TYR N N 98 119.250 119.250 119.715 -0.465 19806 10711 1 19 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.819 -0.001 19806 10712 1 19 . 1 1 98 98 TYR CA C 98 59.387 59.387 58.273 1.114 19806 10713 1 19 . 1 1 98 98 TYR CB C 98 38.122 38.122 38.480 -0.358 19806 10714 1 19 . 1 1 99 99 GLU N N 99 123.080 123.080 126.172 -3.092 19806 10715 1 19 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.007 0.002 19806 10716 1 19 . 1 1 99 99 GLU CA C 99 58.409 58.409 59.449 -1.040 19806 10717 1 19 . 1 1 99 99 GLU CB C 99 30.254 30.254 29.878 0.376 19806 10718 1 19 . 1 1 100 100 GLU N N 100 116.459 116.459 116.398 0.061 19806 10719 1 19 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.581 -0.545 19806 10720 1 19 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.238 1.166 19806 10721 1 19 . 1 1 100 100 GLU CB C 100 27.576 27.576 29.721 -2.145 19806 10722 1 19 . 1 1 101 101 SER N N 101 113.069 113.069 115.047 -1.978 19806 10723 1 19 . 1 1 101 101 SER HA H 101 4.839 4.839 4.668 0.171 19806 10724 1 19 . 1 1 101 101 SER CA C 101 56.024 56.024 56.994 -0.970 19806 10725 1 19 . 1 1 101 101 SER CB C 101 64.806 64.806 64.438 0.368 19806 10726 1 19 . 1 1 102 102 GLU N N 102 120.439 120.439 121.685 -1.246 19806 10727 1 19 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.458 -0.069 19806 10728 1 19 . 1 1 102 102 GLU CA C 102 55.804 55.804 56.202 -0.398 19806 10729 1 19 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.009 -0.024 19806 10730 1 19 . 1 1 103 103 VAL N N 103 118.899 118.899 115.689 3.210 19806 10731 1 19 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.049 0.037 19806 10732 1 19 . 1 1 103 103 VAL CA C 103 62.699 62.699 62.526 0.173 19806 10733 1 19 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.730 -0.469 19806 10734 1 19 . 1 1 104 104 ASP N N 104 120.965 120.965 118.865 2.100 19806 10735 1 19 . 1 1 104 104 ASP HA H 104 5.003 5.003 5.063 -0.060 19806 10736 1 19 . 1 1 104 104 ASP CA C 104 54.914 54.914 54.877 0.037 19806 10737 1 19 . 1 1 104 104 ASP CB C 104 42.791 42.791 44.535 -1.744 19806 10738 1 19 . 1 1 105 105 LEU N N 105 120.365 120.365 119.529 0.836 19806 10739 1 19 . 1 1 105 105 LEU HA H 105 5.295 5.295 5.070 0.225 19806 10740 1 19 . 1 1 105 105 LEU CA C 105 54.431 54.431 55.008 -0.577 19806 10741 1 19 . 1 1 105 105 LEU CB C 105 46.001 46.001 44.976 1.025 19806 10742 1 19 . 1 1 106 106 ARG N N 106 126.289 126.289 124.478 1.811 19806 10743 1 19 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.237 0.588 19806 10744 1 19 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.430 0.242 19806 10745 1 19 . 1 1 106 106 ARG CB C 106 33.920 33.920 34.731 -0.811 19806 10746 1 19 . 1 1 107 107 VAL N N 107 126.145 126.145 119.816 6.329 19806 10747 1 19 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.350 0.329 19806 10748 1 19 . 1 1 107 107 VAL CA C 107 61.671 61.671 61.416 0.255 19806 10749 1 19 . 1 1 107 107 VAL CB C 107 35.350 35.350 36.632 -1.282 19806 10750 1 19 . 1 1 108 108 GLU N N 108 127.093 127.093 120.994 6.099 19806 10751 1 19 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.782 0.485 19806 10752 1 19 . 1 1 108 108 GLU CA C 108 54.761 54.761 55.121 -0.360 19806 10753 1 19 . 1 1 108 108 GLU CB C 108 32.567 32.567 33.732 -1.165 19806 10754 1 19 . 1 1 109 109 PHE N N 109 124.592 124.592 121.856 2.736 19806 10755 1 19 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.418 0.610 19806 10756 1 19 . 1 1 109 109 PHE CA C 109 55.945 55.945 56.778 -0.833 19806 10757 1 19 . 1 1 109 109 PHE CB C 109 43.099 43.099 42.724 0.375 19806 10758 1 19 . 1 1 110 110 GLU N N 110 122.143 122.143 121.036 1.107 19806 10759 1 19 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.580 -0.387 19806 10760 1 19 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.572 0.871 19806 10761 1 19 . 1 1 110 110 GLU CB C 110 35.816 35.816 35.082 0.734 19806 10762 1 19 . 1 1 111 111 LEU N N 111 129.616 129.616 121.124 8.492 19806 10763 1 19 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.786 0.022 19806 10764 1 19 . 1 1 111 111 LEU CA C 111 53.470 53.470 55.297 -1.827 19806 10765 1 19 . 1 1 111 111 LEU CB C 111 40.400 40.400 42.606 -2.206 19806 10766 1 19 . 1 1 112 112 GLN N N 112 124.742 124.742 119.842 4.900 19806 10767 1 19 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.340 0.099 19806 10768 1 19 . 1 1 112 112 GLN CA C 112 55.802 55.802 55.988 -0.186 19806 10769 1 19 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.846 -1.093 19806 10770 1 19 . 1 1 113 113 ALA N N 113 121.195 121.195 121.551 -0.356 19806 10771 1 19 . 1 1 113 113 ALA HA H 113 4.048 4.048 4.375 -0.327 19806 10772 1 19 . 1 1 113 113 ALA CA C 113 54.518 54.518 51.389 3.129 19806 10773 1 19 . 1 1 113 113 ALA CB C 113 18.199 18.199 19.477 -1.278 19806 10774 1 19 . 1 1 114 114 ASP N N 114 114.525 114.525 115.462 -0.937 19806 10775 1 19 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.216 0.182 19806 10776 1 19 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.767 -1.859 19806 10777 1 19 . 1 1 114 114 ASP CB C 114 39.058 39.058 39.472 -0.415 19806 10778 1 19 . 1 1 115 115 GLY N N 115 107.526 107.526 102.254 5.272 19806 10779 1 19 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.539 0.245 19806 10780 1 19 . 1 1 116 116 LYS N N 116 118.818 118.818 118.934 -0.116 19806 10781 1 19 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.648 -0.198 19806 10782 1 19 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.608 -0.437 19806 10783 1 19 . 1 1 116 116 LYS CB C 116 35.039 35.039 35.006 0.033 19806 10784 1 19 . 1 1 117 117 TRP N N 117 118.939 118.939 122.770 -3.831 19806 10785 1 19 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.312 -0.356 19806 10786 1 19 . 1 1 118 118 TYR N N 118 112.644 112.644 118.374 -5.730 19806 10787 1 19 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.979 0.298 19806 10788 1 19 . 1 1 118 118 TYR CA C 118 56.219 56.219 57.032 -0.813 19806 10789 1 19 . 1 1 118 118 TYR CB C 118 43.282 43.282 42.477 0.805 19806 10790 1 19 . 1 1 119 119 VAL N N 119 119.842 119.842 119.646 0.196 19806 10791 1 19 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.926 -0.411 19806 10792 1 19 . 1 1 119 119 VAL CA C 119 62.442 62.442 60.083 2.359 19806 10793 1 19 . 1 1 120 120 VAL N N 120 114.552 114.552 111.251 3.301 19806 10794 1 19 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.477 0.261 19806 10795 1 19 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.757 -1.161 19806 10796 1 19 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.543 -0.691 19806 10797 1 19 . 1 1 121 121 ASP N N 121 118.234 118.234 118.839 -0.605 19806 10798 1 19 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.881 0.382 19806 10799 1 19 . 1 1 121 121 ASP CA C 121 53.663 53.663 54.202 -0.539 19806 10800 1 19 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.631 -0.744 19806 10801 1 19 . 1 1 122 122 CYS N N 122 121.036 121.036 123.694 -2.658 19806 10802 1 19 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.855 0.716 19806 10803 1 19 . 1 1 122 122 CYS CA C 122 57.052 57.052 58.467 -1.415 19806 10804 1 19 . 1 1 122 122 CYS CB C 122 30.834 30.834 27.695 3.139 19806 10805 1 19 . 1 1 123 123 TYR N N 123 127.672 127.672 126.647 1.025 19806 10806 1 19 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.748 0.262 19806 10807 1 19 . 1 1 123 123 TYR CA C 123 57.169 57.169 58.507 -1.337 19806 10808 1 19 . 1 1 123 123 TYR CB C 123 41.408 41.408 41.116 0.292 19806 10809 1 19 . 1 1 124 124 THR N N 124 120.833 120.833 117.684 3.149 19806 10810 1 19 . 1 1 124 124 THR HA H 124 4.987 4.987 4.691 0.296 19806 10811 1 19 . 1 1 124 124 THR CA C 124 57.153 57.153 59.739 -2.586 19806 10812 1 19 . 1 1 124 124 THR CB C 124 68.607 68.607 71.612 -3.005 19806 10813 1 19 . 1 1 125 125 GLY N N 125 114.347 114.347 110.414 3.933 19806 10814 1 19 . 1 1 125 125 GLY CA C 125 46.328 46.328 45.476 0.852 19806 10815 1 19 . 1 1 126 126 TRP N N 126 119.918 119.918 121.839 -1.921 19806 10816 1 19 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.134 -0.064 19806 10817 1 19 . 1 1 126 126 TRP CA C 126 60.564 60.564 58.974 1.591 19806 10818 1 19 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.620 0.019 19806 10819 1 19 . 1 1 127 127 TYR N N 127 113.911 113.911 117.740 -3.829 19806 10820 1 19 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.584 0.410 19806 10821 1 19 . 1 1 127 127 TYR CA C 127 53.384 53.384 57.248 -3.865 19806 10822 1 19 . 1 1 127 127 TYR CB C 127 38.584 38.584 36.411 2.173 19806 10823 1 19 . 1 1 128 128 GLY N N 128 105.181 105.181 108.729 -3.548 19806 10824 1 19 . 1 1 128 128 GLY CA C 128 45.189 45.189 43.997 1.192 19806 10825 1 19 . 1 1 129 129 TYR N N 129 116.588 116.588 117.795 -1.207 19806 10826 1 19 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.696 -0.032 19806 10827 1 19 . 1 1 129 129 TYR CA C 129 59.565 59.565 58.690 0.875 19806 10828 1 19 . 1 1 129 129 TYR CB C 129 38.853 38.853 37.991 0.862 19806 10829 1 19 . 1 1 130 130 ASP N N 130 115.195 115.195 119.133 -3.938 19806 10830 1 19 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.753 -0.368 19806 10831 1 19 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.795 -1.665 19806 10832 1 19 . 1 1 130 130 ASP CB C 130 38.685 38.685 41.824 -3.139 19806 10833 1 19 . 1 1 131 131 LEU N N 131 124.887 124.887 121.822 3.065 19806 10834 1 19 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.923 -0.442 19806 10835 1 19 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.031 1.574 19806 10836 1 19 . 1 1 131 131 LEU CB C 131 42.441 42.441 44.034 -1.593 19806 10837 1 19 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.980 -0.297 19806 10838 1 19 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.426 65.639 19806 10839 1 19 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.145 -0.818 19806 10840 1 19 . 1 1 133 133 ILE N N 133 123.765 123.765 120.227 3.538 19806 10841 1 19 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.659 0.070 19806 10842 1 19 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.553 1.308 19806 10843 1 19 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.215 -0.152 19806 10844 1 19 . 1 1 134 134 GLY N N 134 107.030 107.030 105.901 1.129 19806 10845 1 19 . 1 1 134 134 GLY CA C 134 45.976 45.976 46.108 -0.133 19806 10846 1 19 . 1 1 135 135 GLU N N 135 116.566 116.566 121.018 -4.452 19806 10847 1 19 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.275 0.389 19806 10848 1 19 . 1 1 135 135 GLU CA C 135 55.414 55.414 56.641 -1.227 19806 10849 1 19 . 1 1 135 135 GLU CB C 135 30.195 30.195 28.984 1.211 19806 10850 1 19 . 1 1 136 136 LEU N N 136 124.239 124.239 122.438 1.801 19806 10851 1 19 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.866 0.178 19806 10852 1 19 . 1 1 136 136 LEU CA C 136 59.116 59.116 57.926 1.190 19806 10853 1 19 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.407 -0.400 19806 10854 1 19 . 1 1 137 137 LYS N N 137 117.225 117.225 117.100 0.125 19806 10855 1 19 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.792 0.071 19806 10856 1 19 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.428 1.027 19806 10857 1 19 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.590 -0.387 19806 10858 1 19 . 1 1 138 138 GLN N N 138 118.718 118.718 118.548 0.170 19806 10859 1 19 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.055 -0.003 19806 10860 1 19 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.719 -0.844 19806 10861 1 19 . 1 1 138 138 GLN CB C 138 28.235 28.235 27.847 0.388 19806 10862 1 19 . 1 1 139 139 THR N N 139 117.970 117.970 114.971 2.999 19806 10863 1 19 . 1 1 139 139 THR HA H 139 4.532 4.532 4.173 0.358 19806 10864 1 19 . 1 1 139 139 THR CA C 139 68.145 68.145 65.702 2.443 19806 10865 1 19 . 1 1 139 139 THR CB C 139 68.103 68.103 68.113 -0.010 19806 10866 1 19 . 1 1 140 140 ILE N N 140 120.391 120.391 123.395 -3.004 19806 10867 1 19 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.950 -0.223 19806 10868 1 19 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.877 0.379 19806 10869 1 19 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.779 0.334 19806 10870 1 19 . 1 1 141 141 GLN N N 141 118.917 118.917 119.258 -0.341 19806 10871 1 19 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.788 0.227 19806 10872 1 19 . 1 1 141 141 GLN CA C 141 58.371 58.371 59.476 -1.105 19806 10873 1 19 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.340 -0.993 19806 10874 1 19 . 1 1 142 142 ASN N N 142 119.936 119.936 116.362 3.574 19806 10875 1 19 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.437 0.078 19806 10876 1 19 . 1 1 142 142 ASN CA C 142 55.799 55.799 55.666 0.133 19806 10877 1 19 . 1 1 142 142 ASN CB C 142 37.630 37.630 37.497 0.133 19806 10878 1 19 . 1 1 143 143 VAL N N 143 123.195 123.195 121.165 2.030 19806 10879 1 19 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.264 -0.548 19806 10880 1 19 . 1 1 143 143 VAL CA C 143 66.497 66.497 65.931 0.566 19806 10881 1 19 . 1 1 143 143 VAL CB C 143 30.989 30.989 31.277 -0.288 19806 10882 1 19 . 1 1 144 144 LYS N N 144 120.348 120.348 120.947 -0.599 19806 10883 1 19 . 1 1 144 144 LYS HA H 144 3.881 3.881 3.904 -0.023 19806 10884 1 19 . 1 1 144 144 LYS CA C 144 60.123 60.123 60.061 0.062 19806 10885 1 19 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.144 -0.262 19806 10886 1 19 . 1 1 145 145 GLU N N 145 119.220 119.220 118.845 0.375 19806 10887 1 19 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.038 0.145 19806 10888 1 19 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.700 -0.522 19806 10889 1 19 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.395 -0.324 19806 10890 1 19 . 1 1 146 146 GLU N N 146 121.420 121.420 120.142 1.278 19806 10891 1 19 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.054 0.223 19806 10892 1 19 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.627 -0.509 19806 10893 1 19 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.604 -1.262 19806 10894 1 19 . 1 1 147 147 ASN N N 147 119.197 119.197 118.153 1.044 19806 10895 1 19 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.517 0.051 19806 10896 1 19 . 1 1 147 147 ASN CA C 147 54.151 54.151 56.002 -1.851 19806 10897 1 19 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.821 -0.448 19806 10898 1 19 . 1 1 148 148 ALA N N 148 123.672 123.672 122.807 0.865 19806 10899 1 19 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.117 0.006 19806 10900 1 19 . 1 1 148 148 ALA CA C 148 55.133 55.133 55.075 0.058 19806 10901 1 19 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.249 -0.642 19806 10902 1 19 . 1 1 149 149 ALA N N 149 119.979 119.979 121.715 -1.736 19806 10903 1 19 . 1 1 149 149 ALA HA H 149 4.261 4.261 3.965 0.296 19806 10904 1 19 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.860 -0.215 19806 10905 1 19 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.420 -0.682 19806 10906 1 19 . 1 1 150 150 PHE N N 150 119.592 119.592 119.182 0.410 19806 10907 1 19 . 1 1 150 150 PHE HA H 150 4.224 4.224 3.789 0.435 19806 10908 1 19 . 1 1 150 150 PHE CA C 150 61.008 61.008 60.583 0.425 19806 10909 1 19 . 1 1 150 150 PHE CB C 150 39.062 39.062 38.974 0.088 19806 10910 1 19 . 1 1 151 151 LYS N N 151 116.869 116.869 117.186 -0.317 19806 10911 1 19 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.253 -0.347 19806 10912 1 19 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.587 0.183 19806 10913 1 19 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.259 0.482 19806 10914 1 19 . 1 1 152 152 GLU N N 152 115.868 115.868 119.269 -3.401 19806 10915 1 19 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.155 -0.102 19806 10916 1 19 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.633 0.023 19806 10917 1 19 . 1 1 152 152 GLU CB C 152 29.753 29.753 30.193 -0.440 19806 10918 1 19 . 1 1 153 153 ILE N N 153 110.437 110.437 118.864 -8.427 19806 10919 1 19 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.997 0.179 19806 10920 1 19 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.894 -1.859 19806 10921 1 19 . 1 1 153 153 ILE CB C 153 39.272 39.272 39.816 -0.544 19806 10922 1 19 . 1 1 154 154 HIS N N 154 117.779 117.779 114.375 3.404 19806 10923 1 19 . 1 1 154 154 HIS HA H 154 5.174 5.174 5.049 0.125 19806 10924 1 19 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.346 -0.730 19806 10925 1 19 . 1 1 154 154 HIS CB C 154 28.547 28.547 28.528 0.019 19806 10926 1 20 . 1 1 3 3 SER N N 3 114.847 114.847 118.089 -3.242 19806 10927 1 20 . 1 1 3 3 SER HA H 3 4.463 4.463 4.107 0.355 19806 10928 1 20 . 1 1 3 3 SER CA C 3 58.340 58.340 59.716 -1.376 19806 10929 1 20 . 1 1 3 3 SER CB C 3 63.457 63.457 63.518 -0.061 19806 10930 1 20 . 1 1 4 4 GLU N N 4 121.498 121.498 118.963 2.535 19806 10931 1 20 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.433 -0.101 19806 10932 1 20 . 1 1 4 4 GLU CA C 4 56.443 56.443 55.872 0.571 19806 10933 1 20 . 1 1 4 4 GLU CB C 4 29.966 29.966 31.560 -1.594 19806 10934 1 20 . 1 1 5 5 LEU N N 5 121.589 121.589 123.819 -2.230 19806 10935 1 20 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.706 -0.269 19806 10936 1 20 . 1 1 5 5 LEU CA C 5 55.019 55.019 55.089 -0.070 19806 10937 1 20 . 1 1 5 5 LEU CB C 5 42.243 42.243 41.749 0.494 19806 10938 1 20 . 1 1 6 6 THR N N 6 113.708 113.708 115.565 -1.857 19806 10939 1 20 . 1 1 6 6 THR HA H 6 4.470 4.470 4.747 -0.277 19806 10940 1 20 . 1 1 6 6 THR CA C 6 61.409 61.409 60.663 0.745 19806 10941 1 20 . 1 1 6 6 THR CB C 6 69.544 69.544 70.279 -0.735 19806 10942 1 20 . 1 1 7 7 THR N N 7 114.945 114.945 113.525 1.420 19806 10943 1 20 . 1 1 7 7 THR HA H 7 4.415 4.415 4.717 -0.302 19806 10944 1 20 . 1 1 7 7 THR CA C 7 61.435 61.435 61.668 -0.233 19806 10945 1 20 . 1 1 7 7 THR CB C 7 69.506 69.506 70.197 -0.691 19806 10946 1 20 . 1 1 8 8 GLN N N 8 121.368 121.368 124.390 -3.022 19806 10947 1 20 . 1 1 8 8 GLN CA C 8 55.684 55.684 55.349 0.335 19806 10948 1 20 . 1 1 9 9 ASP N N 9 120.595 120.595 119.793 0.802 19806 10949 1 20 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.314 0.333 19806 10950 1 20 . 1 1 9 9 ASP CA C 9 54.115 54.115 54.842 -0.727 19806 10951 1 20 . 1 1 9 9 ASP CB C 9 41.328 41.328 40.207 1.121 19806 10952 1 20 . 1 1 10 10 GLY N N 10 106.984 106.984 101.439 5.545 19806 10953 1 20 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.371 0.124 19806 10954 1 20 . 1 1 11 11 GLU N N 11 120.879 120.879 120.636 0.243 19806 10955 1 20 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.459 -0.270 19806 10956 1 20 . 1 1 11 11 GLU CA C 11 56.510 56.510 55.022 1.488 19806 10957 1 20 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.726 1.343 19806 10958 1 20 . 1 1 12 12 ASP N N 12 126.686 126.686 123.133 3.553 19806 10959 1 20 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.338 0.412 19806 10960 1 20 . 1 1 12 12 ASP CA C 12 54.347 54.347 54.363 -0.016 19806 10961 1 20 . 1 1 12 12 ASP CB C 12 42.771 42.771 42.050 0.721 19806 10962 1 20 . 1 1 13 13 PHE N N 13 128.055 128.055 120.387 7.668 19806 10963 1 20 . 1 1 13 13 PHE HA H 13 3.412 3.412 4.073 -0.661 19806 10964 1 20 . 1 1 13 13 PHE CA C 13 62.551 62.551 59.443 3.108 19806 10965 1 20 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.479 0.354 19806 10966 1 20 . 1 1 14 14 LYS N N 14 117.498 117.498 119.153 -1.655 19806 10967 1 20 . 1 1 14 14 LYS HA H 14 3.581 3.581 4.327 -0.746 19806 10968 1 20 . 1 1 14 14 LYS CA C 14 59.461 59.461 57.985 1.476 19806 10969 1 20 . 1 1 14 14 LYS CB C 14 31.344 31.344 32.279 -0.935 19806 10970 1 20 . 1 1 15 15 SER N N 15 113.775 113.775 115.063 -1.288 19806 10971 1 20 . 1 1 15 15 SER HA H 15 4.167 4.167 4.168 -0.001 19806 10972 1 20 . 1 1 15 15 SER CA C 15 61.099 61.099 61.731 -0.632 19806 10973 1 20 . 1 1 15 15 SER CB C 15 62.428 62.428 62.492 -0.064 19806 10974 1 20 . 1 1 16 16 PHE N N 16 122.292 122.292 120.022 2.270 19806 10975 1 20 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.562 -0.272 19806 10976 1 20 . 1 1 16 16 PHE CA C 16 59.773 59.773 60.257 -0.484 19806 10977 1 20 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.498 -1.323 19806 10978 1 20 . 1 1 17 17 LEU N N 17 122.472 122.472 120.971 1.501 19806 10979 1 20 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.330 -0.480 19806 10980 1 20 . 1 1 17 17 LEU CA C 17 56.619 56.619 56.080 0.539 19806 10981 1 20 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.155 0.307 19806 10982 1 20 . 1 1 18 18 ASP N N 18 117.331 117.331 120.311 -2.980 19806 10983 1 20 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.217 -0.102 19806 10984 1 20 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.336 -0.941 19806 10985 1 20 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.912 -0.559 19806 10986 1 20 . 1 1 19 19 LYS N N 19 120.032 120.032 118.393 1.639 19806 10987 1 20 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.926 -0.249 19806 10988 1 20 . 1 1 19 19 LYS CA C 19 59.067 59.067 59.265 -0.198 19806 10989 1 20 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.502 -0.566 19806 10990 1 20 . 1 1 20 20 PHE N N 20 119.607 119.607 120.248 -0.641 19806 10991 1 20 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.316 -0.207 19806 10992 1 20 . 1 1 20 20 PHE CA C 20 62.090 62.090 60.864 1.226 19806 10993 1 20 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.116 1.353 19806 10994 1 20 . 1 1 21 21 THR N N 21 101.473 101.473 110.796 -9.323 19806 10995 1 20 . 1 1 21 21 THR HA H 21 4.259 4.259 4.029 0.230 19806 10996 1 20 . 1 1 21 21 THR CA C 21 61.774 61.774 63.642 -1.868 19806 10997 1 20 . 1 1 22 22 SER N N 22 111.453 111.453 116.117 -4.664 19806 10998 1 20 . 1 1 22 22 SER HA H 22 4.165 4.165 4.144 0.021 19806 10999 1 20 . 1 1 22 22 SER CA C 22 58.215 58.215 56.683 1.532 19806 11000 1 20 . 1 1 22 22 SER CB C 22 64.570 64.570 63.395 1.175 19806 11001 1 20 . 1 1 23 23 SER N N 23 114.184 114.184 114.169 0.015 19806 11002 1 20 . 1 1 23 23 SER HA H 23 4.764 4.764 4.945 -0.181 19806 11003 1 20 . 1 1 23 23 SER CA C 23 55.669 55.669 57.298 -1.629 19806 11004 1 20 . 1 1 23 23 SER CB C 23 64.011 64.011 66.075 -2.064 19806 11005 1 20 . 1 1 24 24 ALA N N 24 133.370 133.370 124.799 8.571 19806 11006 1 20 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.421 -0.465 19806 11007 1 20 . 1 1 24 24 ALA CA C 24 55.106 55.106 53.278 1.829 19806 11008 1 20 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.355 0.480 19806 11009 1 20 . 1 1 25 25 ALA N N 25 117.430 117.430 121.579 -4.149 19806 11010 1 20 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.496 -0.179 19806 11011 1 20 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.514 0.687 19806 11012 1 20 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.445 -0.096 19806 11013 1 20 . 1 1 26 26 PHE N N 26 116.042 116.042 114.960 1.082 19806 11014 1 20 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.676 -0.366 19806 11015 1 20 . 1 1 26 26 PHE CA C 26 60.759 60.759 57.941 2.818 19806 11016 1 20 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.531 -0.221 19806 11017 1 20 . 1 1 27 27 GLN N N 27 121.820 121.820 119.200 2.620 19806 11018 1 20 . 1 1 27 27 GLN HA H 27 3.391 3.391 4.158 -0.767 19806 11019 1 20 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.214 0.880 19806 11020 1 20 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.660 -1.202 19806 11021 1 20 . 1 1 28 28 TYR N N 28 111.517 111.517 117.688 -6.171 19806 11022 1 20 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.995 0.135 19806 11023 1 20 . 1 1 28 28 TYR CA C 28 62.357 62.357 60.609 1.748 19806 11024 1 20 . 1 1 28 28 TYR CB C 28 38.568 38.568 37.831 0.737 19806 11025 1 20 . 1 1 29 29 THR N N 29 106.324 106.324 112.156 -5.832 19806 11026 1 20 . 1 1 29 29 THR HA H 29 4.489 4.489 3.926 0.563 19806 11027 1 20 . 1 1 29 29 THR CA C 29 63.765 63.765 63.953 -0.188 19806 11028 1 20 . 1 1 29 29 THR CB C 29 69.568 69.568 68.295 1.273 19806 11029 1 20 . 1 1 30 30 ARG N N 30 117.696 117.696 120.684 -2.988 19806 11030 1 20 . 1 1 30 30 ARG HA H 30 4.701 4.701 4.168 0.533 19806 11031 1 20 . 1 1 30 30 ARG CA C 30 52.760 52.760 54.809 -2.049 19806 11032 1 20 . 1 1 30 30 ARG CB C 30 35.047 35.047 30.790 4.257 19806 11033 1 20 . 1 1 31 31 VAL N N 31 119.395 119.395 118.937 0.458 19806 11034 1 20 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.447 -0.217 19806 11035 1 20 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.940 0.252 19806 11036 1 20 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.790 -2.617 19806 11037 1 20 . 1 1 32 32 LYS N N 32 126.124 126.124 124.737 1.387 19806 11038 1 20 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.445 -0.261 19806 11039 1 20 . 1 1 32 32 LYS CA C 32 53.958 53.958 55.551 -1.593 19806 11040 1 20 . 1 1 32 32 LYS CB C 32 31.112 31.112 33.815 -2.703 19806 11041 1 20 . 1 1 33 33 PHE N N 33 119.303 119.303 118.242 1.061 19806 11042 1 20 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.963 -0.449 19806 11043 1 20 . 1 1 33 33 PHE CA C 33 56.272 56.272 56.012 0.260 19806 11044 1 20 . 1 1 33 33 PHE CB C 33 40.378 40.378 39.924 0.454 19806 11045 1 20 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.737 0.231 19806 11046 1 20 . 1 1 34 34 PRO CA C 34 61.633 61.633 63.043 -1.410 19806 11047 1 20 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.950 0.782 19806 11048 1 20 . 1 1 35 35 LEU N N 35 120.016 120.016 119.666 0.350 19806 11049 1 20 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.768 -0.546 19806 11050 1 20 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.456 1.384 19806 11051 1 20 . 1 1 35 35 LEU CB C 35 41.244 41.244 44.049 -2.805 19806 11052 1 20 . 1 1 36 36 LYS N N 36 117.066 117.066 119.264 -2.198 19806 11053 1 20 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.298 -0.323 19806 11054 1 20 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.898 2.349 19806 11055 1 20 . 1 1 36 36 LYS CB C 36 32.832 32.832 32.977 -0.145 19806 11056 1 20 . 1 1 37 37 THR N N 37 117.574 117.574 117.888 -0.314 19806 11057 1 20 . 1 1 37 37 THR HA H 37 4.797 4.797 4.873 -0.076 19806 11058 1 20 . 1 1 37 37 THR CA C 37 60.396 60.396 58.742 1.654 19806 11059 1 20 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.677 0.342 19806 11060 1 20 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.546 -0.623 19806 11061 1 20 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.868 -0.237 19806 11062 1 20 . 1 1 39 39 ILE N N 39 119.949 119.949 118.263 1.686 19806 11063 1 20 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.013 0.226 19806 11064 1 20 . 1 1 39 39 ILE CA C 39 62.133 62.133 63.576 -1.443 19806 11065 1 20 . 1 1 40 40 THR N N 40 123.962 123.962 111.248 12.714 19806 11066 1 20 . 1 1 40 40 THR HA H 40 5.057 5.057 4.197 0.860 19806 11067 1 20 . 1 1 40 40 THR CA C 40 62.262 62.262 63.405 -1.143 19806 11068 1 20 . 1 1 40 40 THR CB C 40 69.891 69.891 67.295 2.596 19806 11069 1 20 . 1 1 41 41 LEU N N 41 125.633 125.633 117.763 7.870 19806 11070 1 20 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.736 0.366 19806 11071 1 20 . 1 1 41 41 LEU CA C 41 52.638 52.638 52.431 0.207 19806 11072 1 20 . 1 1 41 41 LEU CB C 41 45.180 45.180 43.597 1.583 19806 11073 1 20 . 1 1 42 42 LEU N N 42 120.788 120.788 120.189 0.599 19806 11074 1 20 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.732 0.016 19806 11075 1 20 . 1 1 42 42 LEU CA C 42 53.724 53.724 53.182 0.542 19806 11076 1 20 . 1 1 42 42 LEU CB C 42 44.384 44.384 42.569 1.815 19806 11077 1 20 . 1 1 43 43 ALA N N 43 123.073 123.073 127.398 -4.325 19806 11078 1 20 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.171 0.259 19806 11079 1 20 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.691 -1.403 19806 11080 1 20 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.241 0.772 19806 11081 1 20 . 1 1 44 44 ASP N N 44 118.196 118.196 118.504 -0.308 19806 11082 1 20 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.338 0.088 19806 11083 1 20 . 1 1 44 44 ASP CA C 44 56.028 56.028 57.432 -1.404 19806 11084 1 20 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.685 -0.475 19806 11085 1 20 . 1 1 45 45 ASP N N 45 115.018 115.018 117.569 -2.551 19806 11086 1 20 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.475 -0.006 19806 11087 1 20 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.661 -0.867 19806 11088 1 20 . 1 1 45 45 ASP CB C 45 39.864 39.864 40.829 -0.965 19806 11089 1 20 . 1 1 46 46 GLY N N 46 107.499 107.499 108.853 -1.354 19806 11090 1 20 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.676 0.238 19806 11091 1 20 . 1 1 47 47 GLU N N 47 117.331 117.331 117.132 0.199 19806 11092 1 20 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.530 0.001 19806 11093 1 20 . 1 1 47 47 GLU CA C 47 56.938 56.938 55.617 1.321 19806 11094 1 20 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.373 2.760 19806 11095 1 20 . 1 1 48 48 THR N N 48 118.462 118.462 116.334 2.128 19806 11096 1 20 . 1 1 48 48 THR HA H 48 4.243 4.243 4.522 -0.279 19806 11097 1 20 . 1 1 48 48 THR CA C 48 62.834 62.834 61.771 1.063 19806 11098 1 20 . 1 1 48 48 THR CB C 48 68.649 68.649 70.634 -1.985 19806 11099 1 20 . 1 1 49 49 GLU N N 49 123.834 123.834 128.003 -4.169 19806 11100 1 20 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.476 0.469 19806 11101 1 20 . 1 1 49 49 GLU CA C 49 55.358 55.358 56.892 -1.534 19806 11102 1 20 . 1 1 49 49 GLU CB C 49 31.395 31.395 29.019 2.376 19806 11103 1 20 . 1 1 50 50 LYS N N 50 122.868 122.868 126.850 -3.982 19806 11104 1 20 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.474 0.167 19806 11105 1 20 . 1 1 50 50 LYS CA C 50 54.111 54.111 55.825 -1.714 19806 11106 1 20 . 1 1 50 50 LYS CB C 50 35.312 35.312 33.145 2.167 19806 11107 1 20 . 1 1 51 51 THR N N 51 111.386 111.386 115.276 -3.890 19806 11108 1 20 . 1 1 51 51 THR HA H 51 5.619 5.619 4.455 1.164 19806 11109 1 20 . 1 1 51 51 THR CA C 51 58.980 58.980 61.992 -3.011 19806 11110 1 20 . 1 1 51 51 THR CB C 51 71.277 71.277 69.669 1.608 19806 11111 1 20 . 1 1 52 52 PHE N N 52 120.631 120.631 118.051 2.580 19806 11112 1 20 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.883 0.080 19806 11113 1 20 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.281 -1.152 19806 11114 1 20 . 1 1 52 52 PHE CB C 52 41.049 41.049 41.653 -0.604 19806 11115 1 20 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.559 -0.111 19806 11116 1 20 . 1 1 53 53 PRO CA C 53 62.489 62.489 62.836 -0.347 19806 11117 1 20 . 1 1 53 53 PRO CB C 53 32.240 32.240 32.582 -0.342 19806 11118 1 20 . 1 1 54 54 PHE N N 54 128.034 128.034 122.526 5.508 19806 11119 1 20 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.699 0.129 19806 11120 1 20 . 1 1 54 54 PHE CA C 54 55.509 55.509 57.305 -1.796 19806 11121 1 20 . 1 1 54 54 PHE CB C 54 37.028 37.028 41.230 -4.202 19806 11122 1 20 . 1 1 55 55 THR N N 55 111.757 111.757 116.883 -5.126 19806 11123 1 20 . 1 1 55 55 THR HA H 55 4.413 4.413 4.419 -0.006 19806 11124 1 20 . 1 1 55 55 THR CA C 55 60.578 60.578 59.816 0.762 19806 11125 1 20 . 1 1 55 55 THR CB C 55 69.447 69.447 71.798 -2.351 19806 11126 1 20 . 1 1 56 56 LYS N N 56 118.734 118.734 120.716 -1.982 19806 11127 1 20 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.390 -1.908 19806 11128 1 20 . 1 1 56 56 LYS CA C 56 59.381 59.381 58.869 0.512 19806 11129 1 20 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.764 1.486 19806 11130 1 20 . 1 1 57 57 GLU N N 57 119.675 119.675 119.564 0.111 19806 11131 1 20 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.011 0.258 19806 11132 1 20 . 1 1 57 57 GLU CA C 57 57.152 57.152 59.110 -1.958 19806 11133 1 20 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.593 -2.643 19806 11134 1 20 . 1 1 58 58 LYS N N 58 114.700 114.700 113.403 1.297 19806 11135 1 20 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.482 -0.170 19806 11136 1 20 . 1 1 58 58 LYS CA C 58 55.595 55.595 54.330 1.265 19806 11137 1 20 . 1 1 58 58 LYS CB C 58 32.011 32.011 31.294 0.717 19806 11138 1 20 . 1 1 59 59 TRP N N 59 118.204 118.204 126.269 -8.065 19806 11139 1 20 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.309 -0.210 19806 11140 1 20 . 1 1 59 59 TRP CA C 59 55.577 55.577 56.385 -0.808 19806 11141 1 20 . 1 1 59 59 TRP CB C 59 32.037 32.037 30.386 1.651 19806 11142 1 20 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.392 -0.129 19806 11143 1 20 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.730 -3.009 19806 11144 1 20 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.028 -2.179 19806 11145 1 20 . 1 1 61 61 LEU N N 61 123.758 123.758 123.984 -0.226 19806 11146 1 20 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.367 -0.728 19806 11147 1 20 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.967 -0.092 19806 11148 1 20 . 1 1 61 61 LEU CB C 61 40.815 40.815 42.437 -1.622 19806 11149 1 20 . 1 1 62 62 LEU N N 62 124.052 124.052 121.786 2.266 19806 11150 1 20 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.454 -0.098 19806 11151 1 20 . 1 1 62 62 LEU CA C 62 53.992 53.992 53.704 0.288 19806 11152 1 20 . 1 1 62 62 LEU CB C 62 44.686 44.686 43.982 0.704 19806 11153 1 20 . 1 1 63 63 ASP N N 63 117.271 117.271 116.469 0.802 19806 11154 1 20 . 1 1 63 63 ASP HA H 63 5.033 5.033 4.841 0.192 19806 11155 1 20 . 1 1 63 63 ASP CA C 63 51.101 51.101 52.369 -1.268 19806 11156 1 20 . 1 1 63 63 ASP CB C 63 43.345 43.345 42.728 0.617 19806 11157 1 20 . 1 1 64 64 SER N N 64 112.856 112.856 114.337 -1.481 19806 11158 1 20 . 1 1 64 64 SER HA H 64 3.865 3.865 4.351 -0.486 19806 11159 1 20 . 1 1 64 64 SER CA C 64 60.910 60.910 60.664 0.245 19806 11160 1 20 . 1 1 64 64 SER CB C 64 62.378 62.378 63.180 -0.802 19806 11161 1 20 . 1 1 65 65 GLU N N 65 120.070 120.070 120.264 -0.194 19806 11162 1 20 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.432 -0.414 19806 11163 1 20 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.185 0.158 19806 11164 1 20 . 1 1 65 65 GLU CB C 65 28.887 28.887 30.162 -1.275 19806 11165 1 20 . 1 1 66 66 THR N N 66 115.852 115.852 115.175 0.677 19806 11166 1 20 . 1 1 66 66 THR HA H 66 3.991 3.991 4.489 -0.498 19806 11167 1 20 . 1 1 66 66 THR CA C 66 65.804 65.804 64.127 1.677 19806 11168 1 20 . 1 1 66 66 THR CB C 66 68.451 68.451 69.629 -1.178 19806 11169 1 20 . 1 1 67 67 MET N N 67 113.585 113.585 120.785 -7.200 19806 11170 1 20 . 1 1 67 67 MET HA H 67 4.267 4.267 4.576 -0.309 19806 11171 1 20 . 1 1 67 67 MET CA C 67 52.135 52.135 54.319 -2.184 19806 11172 1 20 . 1 1 67 67 MET CB C 67 28.963 28.963 33.001 -4.038 19806 11173 1 20 . 1 1 68 68 LYS N N 68 118.462 118.462 119.599 -1.137 19806 11174 1 20 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.610 -0.240 19806 11175 1 20 . 1 1 68 68 LYS CA C 68 55.482 55.482 54.972 0.510 19806 11176 1 20 . 1 1 68 68 LYS CB C 68 34.179 34.179 33.699 0.480 19806 11177 1 20 . 1 1 69 69 GLU N N 69 121.700 121.700 121.416 0.284 19806 11178 1 20 . 1 1 69 69 GLU HA H 69 4.524 4.524 5.217 -0.693 19806 11179 1 20 . 1 1 69 69 GLU CA C 69 55.942 55.942 55.652 0.290 19806 11180 1 20 . 1 1 69 69 GLU CB C 69 30.424 30.424 30.846 -0.422 19806 11181 1 20 . 1 1 70 70 GLU N N 70 123.445 123.445 125.417 -1.972 19806 11182 1 20 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.582 0.115 19806 11183 1 20 . 1 1 70 70 GLU CA C 70 55.473 55.473 55.582 -0.109 19806 11184 1 20 . 1 1 70 70 GLU CB C 70 33.162 33.162 33.492 -0.330 19806 11185 1 20 . 1 1 71 71 ARG N N 71 122.150 122.150 123.095 -0.945 19806 11186 1 20 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.932 0.219 19806 11187 1 20 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.381 0.067 19806 11188 1 20 . 1 1 71 71 ARG CB C 71 31.703 31.703 30.780 0.923 19806 11189 1 20 . 1 1 72 72 ILE N N 72 125.686 125.686 127.259 -1.573 19806 11190 1 20 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.062 0.534 19806 11191 1 20 . 1 1 72 72 ILE CA C 72 59.512 59.512 61.294 -1.782 19806 11192 1 20 . 1 1 72 72 ILE CB C 72 41.095 41.095 37.594 3.501 19806 11193 1 20 . 1 1 73 73 THR N N 73 121.600 121.600 123.873 -2.273 19806 11194 1 20 . 1 1 73 73 THR HA H 73 4.603 4.603 4.439 0.164 19806 11195 1 20 . 1 1 73 73 THR CA C 73 61.937 61.937 61.706 0.231 19806 11196 1 20 . 1 1 73 73 THR CB C 73 68.669 68.669 68.919 -0.250 19806 11197 1 20 . 1 1 74 74 GLN N N 74 124.607 124.607 127.983 -3.376 19806 11198 1 20 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.631 -0.050 19806 11199 1 20 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.375 0.314 19806 11200 1 20 . 1 1 74 74 GLN CB C 74 29.490 29.490 30.868 -1.378 19806 11201 1 20 . 1 1 75 75 GLU N N 75 122.962 122.962 118.503 4.459 19806 11202 1 20 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.299 -0.240 19806 11203 1 20 . 1 1 75 75 GLU CA C 75 58.845 58.845 57.024 1.821 19806 11204 1 20 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.258 -0.685 19806 11205 1 20 . 1 1 76 76 GLU N N 76 115.466 115.466 122.192 -6.726 19806 11206 1 20 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.454 -0.146 19806 11207 1 20 . 1 1 76 76 GLU CA C 76 56.777 56.777 55.971 0.806 19806 11208 1 20 . 1 1 76 76 GLU CB C 76 29.072 29.072 28.386 0.686 19806 11209 1 20 . 1 1 77 77 GLY N N 77 106.771 106.771 106.883 -0.112 19806 11210 1 20 . 1 1 77 77 GLY CA C 77 45.014 45.014 45.266 -0.251 19806 11211 1 20 . 1 1 78 78 GLY N N 78 108.535 108.535 108.170 0.365 19806 11212 1 20 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.516 0.191 19806 11213 1 20 . 1 1 79 79 ILE N N 79 121.066 121.066 120.715 0.351 19806 11214 1 20 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.938 -0.131 19806 11215 1 20 . 1 1 79 79 ILE CA C 79 60.343 60.343 60.409 -0.066 19806 11216 1 20 . 1 1 79 79 ILE CB C 79 39.220 39.220 39.431 -0.211 19806 11217 1 20 . 1 1 80 80 TYR N N 80 130.709 130.709 129.837 0.872 19806 11218 1 20 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.288 -0.024 19806 11219 1 20 . 1 1 80 80 TYR CA C 80 58.161 58.161 55.577 2.584 19806 11220 1 20 . 1 1 80 80 TYR CB C 80 40.621 40.621 38.642 1.979 19806 11221 1 20 . 1 1 81 81 VAL N N 81 126.965 126.965 127.351 -0.386 19806 11222 1 20 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.571 0.283 19806 11223 1 20 . 1 1 81 81 VAL CA C 81 60.457 60.457 60.853 -0.396 19806 11224 1 20 . 1 1 81 81 VAL CB C 81 35.004 35.004 34.398 0.607 19806 11225 1 20 . 1 1 82 82 SER N N 82 120.914 120.914 122.210 -1.296 19806 11226 1 20 . 1 1 82 82 SER HA H 82 5.185 5.185 5.075 0.110 19806 11227 1 20 . 1 1 82 82 SER CA C 82 55.260 55.260 57.459 -2.199 19806 11228 1 20 . 1 1 82 82 SER CB C 82 64.785 64.785 64.176 0.609 19806 11229 1 20 . 1 1 83 83 LYS N N 83 119.415 119.415 122.320 -2.905 19806 11230 1 20 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.614 0.164 19806 11231 1 20 . 1 1 83 83 LYS CA C 83 54.759 54.759 55.148 -0.389 19806 11232 1 20 . 1 1 83 83 LYS CB C 83 35.514 35.514 37.089 -1.575 19806 11233 1 20 . 1 1 84 84 PHE N N 84 119.220 119.220 120.550 -1.330 19806 11234 1 20 . 1 1 84 84 PHE HA H 84 5.441 5.441 4.902 0.539 19806 11235 1 20 . 1 1 84 84 PHE CA C 84 58.414 58.414 58.737 -0.323 19806 11236 1 20 . 1 1 84 84 PHE CB C 84 37.523 37.523 38.318 -0.795 19806 11237 1 20 . 1 1 85 85 THR N N 85 119.257 119.257 121.255 -1.998 19806 11238 1 20 . 1 1 85 85 THR HA H 85 4.057 4.057 4.052 0.005 19806 11239 1 20 . 1 1 85 85 THR CA C 85 62.660 62.660 64.136 -1.476 19806 11240 1 20 . 1 1 85 85 THR CB C 85 67.698 67.698 69.193 -1.495 19806 11241 1 20 . 1 1 86 86 LEU N N 86 121.612 121.612 121.530 0.082 19806 11242 1 20 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.436 0.162 19806 11243 1 20 . 1 1 86 86 LEU CA C 86 55.245 55.245 55.078 0.167 19806 11244 1 20 . 1 1 86 86 LEU CB C 86 44.657 44.657 43.337 1.320 19806 11245 1 20 . 1 1 87 87 ASN N N 87 127.684 127.684 119.755 7.929 19806 11246 1 20 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.749 0.262 19806 11247 1 20 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.828 -1.529 19806 11248 1 20 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.980 -0.385 19806 11249 1 20 . 1 1 88 88 GLU N N 88 120.509 120.509 121.790 -1.281 19806 11250 1 20 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.710 0.147 19806 11251 1 20 . 1 1 88 88 GLU CA C 88 54.382 54.382 53.816 0.566 19806 11252 1 20 . 1 1 88 88 GLU CB C 88 29.808 29.808 29.546 0.262 19806 11253 1 20 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.359 0.022 19806 11254 1 20 . 1 1 89 89 PRO CA C 89 65.898 65.898 65.309 0.589 19806 11255 1 20 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.050 0.301 19806 11256 1 20 . 1 1 90 90 LYS N N 90 107.288 107.288 116.353 -9.065 19806 11257 1 20 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.838 -0.154 19806 11258 1 20 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.824 -0.845 19806 11259 1 20 . 1 1 90 90 LYS CB C 90 32.994 32.994 32.487 0.507 19806 11260 1 20 . 1 1 91 91 HIS N N 91 119.523 119.523 118.083 1.440 19806 11261 1 20 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.377 0.400 19806 11262 1 20 . 1 1 91 91 HIS CA C 91 53.705 53.705 55.010 -1.305 19806 11263 1 20 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.593 -0.399 19806 11264 1 20 . 1 1 92 92 LYS N N 92 122.527 122.527 127.540 -5.013 19806 11265 1 20 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.855 0.274 19806 11266 1 20 . 1 1 92 92 LYS CA C 92 54.291 54.291 54.581 -0.290 19806 11267 1 20 . 1 1 92 92 LYS CB C 92 37.479 37.479 34.961 2.518 19806 11268 1 20 . 1 1 93 93 ILE N N 93 121.564 121.564 123.077 -1.513 19806 11269 1 20 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.375 0.935 19806 11270 1 20 . 1 1 93 93 ILE CA C 93 61.137 61.137 58.844 2.292 19806 11271 1 20 . 1 1 93 93 ILE CB C 93 41.088 41.088 38.272 2.816 19806 11272 1 20 . 1 1 94 94 PHE N N 94 128.955 128.955 125.627 3.328 19806 11273 1 20 . 1 1 94 94 PHE HA H 94 4.900 4.900 4.503 0.397 19806 11274 1 20 . 1 1 94 94 PHE CA C 94 55.843 55.843 55.964 -0.121 19806 11275 1 20 . 1 1 95 95 GLU N N 95 124.809 124.809 126.884 -2.075 19806 11276 1 20 . 1 1 95 95 GLU HA H 95 5.418 5.418 4.412 1.006 19806 11277 1 20 . 1 1 95 95 GLU CA C 95 54.481 54.481 54.369 0.112 19806 11278 1 20 . 1 1 95 95 GLU CB C 95 35.160 35.160 31.596 3.564 19806 11279 1 20 . 1 1 96 96 ALA N N 96 123.759 123.759 127.714 -3.955 19806 11280 1 20 . 1 1 96 96 ALA HA H 96 5.379 5.379 5.043 0.336 19806 11281 1 20 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.426 -0.885 19806 11282 1 20 . 1 1 96 96 ALA CB C 96 23.830 23.830 21.080 2.750 19806 11283 1 20 . 1 1 97 97 GLY N N 97 106.592 106.592 111.144 -4.552 19806 11284 1 20 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.046 0.389 19806 11285 1 20 . 1 1 98 98 TYR N N 98 119.250 119.250 119.800 -0.550 19806 11286 1 20 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.676 0.142 19806 11287 1 20 . 1 1 98 98 TYR CA C 98 59.387 59.387 58.873 0.514 19806 11288 1 20 . 1 1 98 98 TYR CB C 98 38.122 38.122 39.159 -1.037 19806 11289 1 20 . 1 1 99 99 GLU N N 99 123.080 123.080 124.413 -1.333 19806 11290 1 20 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.159 -0.150 19806 11291 1 20 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.771 -0.362 19806 11292 1 20 . 1 1 99 99 GLU CB C 99 30.254 30.254 30.007 0.247 19806 11293 1 20 . 1 1 100 100 GLU N N 100 116.459 116.459 115.127 1.332 19806 11294 1 20 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.522 -0.486 19806 11295 1 20 . 1 1 100 100 GLU CA C 100 57.404 57.404 55.920 1.484 19806 11296 1 20 . 1 1 100 100 GLU CB C 100 27.576 27.576 29.615 -2.039 19806 11297 1 20 . 1 1 101 101 SER N N 101 113.069 113.069 115.444 -2.375 19806 11298 1 20 . 1 1 101 101 SER HA H 101 4.839 4.839 4.549 0.290 19806 11299 1 20 . 1 1 101 101 SER CA C 101 56.024 56.024 56.778 -0.754 19806 11300 1 20 . 1 1 101 101 SER CB C 101 64.806 64.806 64.217 0.589 19806 11301 1 20 . 1 1 102 102 GLU N N 102 120.439 120.439 121.062 -0.623 19806 11302 1 20 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.359 0.030 19806 11303 1 20 . 1 1 102 102 GLU CA C 102 55.804 55.804 56.043 -0.239 19806 11304 1 20 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.186 -0.200 19806 11305 1 20 . 1 1 103 103 VAL N N 103 118.899 118.899 114.103 4.796 19806 11306 1 20 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.068 0.018 19806 11307 1 20 . 1 1 103 103 VAL CA C 103 62.699 62.699 61.751 0.948 19806 11308 1 20 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.687 -0.426 19806 11309 1 20 . 1 1 104 104 ASP N N 104 120.965 120.965 121.529 -0.564 19806 11310 1 20 . 1 1 104 104 ASP HA H 104 5.003 5.003 4.997 0.006 19806 11311 1 20 . 1 1 104 104 ASP CA C 104 54.914 54.914 55.577 -0.663 19806 11312 1 20 . 1 1 104 104 ASP CB C 104 42.791 42.791 43.630 -0.839 19806 11313 1 20 . 1 1 105 105 LEU N N 105 120.365 120.365 118.202 2.163 19806 11314 1 20 . 1 1 105 105 LEU HA H 105 5.295 5.295 5.117 0.178 19806 11315 1 20 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.584 -0.153 19806 11316 1 20 . 1 1 105 105 LEU CB C 105 46.001 46.001 45.820 0.181 19806 11317 1 20 . 1 1 106 106 ARG N N 106 126.289 126.289 122.496 3.793 19806 11318 1 20 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.288 0.537 19806 11319 1 20 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.112 0.560 19806 11320 1 20 . 1 1 106 106 ARG CB C 106 33.920 33.920 34.587 -0.667 19806 11321 1 20 . 1 1 107 107 VAL N N 107 126.145 126.145 118.076 8.069 19806 11322 1 20 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.146 0.533 19806 11323 1 20 . 1 1 107 107 VAL CA C 107 61.671 61.671 61.265 0.406 19806 11324 1 20 . 1 1 107 107 VAL CB C 107 35.350 35.350 35.803 -0.453 19806 11325 1 20 . 1 1 108 108 GLU N N 108 127.093 127.093 125.189 1.904 19806 11326 1 20 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.523 0.744 19806 11327 1 20 . 1 1 108 108 GLU CA C 108 54.761 54.761 55.019 -0.258 19806 11328 1 20 . 1 1 108 108 GLU CB C 108 32.567 32.567 31.348 1.219 19806 11329 1 20 . 1 1 109 109 PHE N N 109 124.592 124.592 122.401 2.191 19806 11330 1 20 . 1 1 109 109 PHE HA H 109 6.028 6.028 4.848 1.180 19806 11331 1 20 . 1 1 109 109 PHE CA C 109 55.945 55.945 55.870 0.075 19806 11332 1 20 . 1 1 109 109 PHE CB C 109 43.099 43.099 40.501 2.598 19806 11333 1 20 . 1 1 110 110 GLU N N 110 122.143 122.143 121.832 0.311 19806 11334 1 20 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.541 -0.348 19806 11335 1 20 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.639 0.805 19806 11336 1 20 . 1 1 110 110 GLU CB C 110 35.816 35.816 34.755 1.061 19806 11337 1 20 . 1 1 111 111 LEU N N 111 129.616 129.616 121.926 7.690 19806 11338 1 20 . 1 1 111 111 LEU HA H 111 3.808 3.808 4.284 -0.476 19806 11339 1 20 . 1 1 111 111 LEU CA C 111 53.470 53.470 54.150 -0.680 19806 11340 1 20 . 1 1 111 111 LEU CB C 111 40.400 40.400 42.978 -2.578 19806 11341 1 20 . 1 1 112 112 GLN N N 112 124.742 124.742 123.607 1.135 19806 11342 1 20 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.174 0.265 19806 11343 1 20 . 1 1 112 112 GLN CA C 112 55.802 55.802 57.647 -1.845 19806 11344 1 20 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.268 -0.515 19806 11345 1 20 . 1 1 113 113 ALA N N 113 121.195 121.195 120.130 1.065 19806 11346 1 20 . 1 1 113 113 ALA HA H 113 4.048 4.048 4.438 -0.390 19806 11347 1 20 . 1 1 113 113 ALA CA C 113 54.518 54.518 52.145 2.373 19806 11348 1 20 . 1 1 113 113 ALA CB C 113 18.199 18.199 19.262 -1.063 19806 11349 1 20 . 1 1 114 114 ASP N N 114 114.525 114.525 116.901 -2.376 19806 11350 1 20 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.593 -0.194 19806 11351 1 20 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.493 -1.585 19806 11352 1 20 . 1 1 114 114 ASP CB C 114 39.058 39.058 42.119 -3.061 19806 11353 1 20 . 1 1 115 115 GLY N N 115 107.526 107.526 107.267 0.259 19806 11354 1 20 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.057 0.727 19806 11355 1 20 . 1 1 116 116 LYS N N 116 118.818 118.818 120.513 -1.695 19806 11356 1 20 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.547 -0.097 19806 11357 1 20 . 1 1 116 116 LYS CA C 116 54.171 54.171 55.532 -1.361 19806 11358 1 20 . 1 1 116 116 LYS CB C 116 35.039 35.039 33.796 1.243 19806 11359 1 20 . 1 1 117 117 TRP N N 117 118.939 118.939 123.373 -4.434 19806 11360 1 20 . 1 1 117 117 TRP CA C 117 56.956 56.956 56.744 0.212 19806 11361 1 20 . 1 1 118 118 TYR N N 118 112.644 112.644 118.931 -6.287 19806 11362 1 20 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.636 0.641 19806 11363 1 20 . 1 1 118 118 TYR CA C 118 56.219 56.219 57.162 -0.943 19806 11364 1 20 . 1 1 118 118 TYR CB C 118 43.282 43.282 40.099 3.183 19806 11365 1 20 . 1 1 119 119 VAL N N 119 119.842 119.842 124.366 -4.524 19806 11366 1 20 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.039 0.476 19806 11367 1 20 . 1 1 119 119 VAL CA C 119 62.442 62.442 64.384 -1.942 19806 11368 1 20 . 1 1 120 120 VAL N N 120 114.552 114.552 118.136 -3.584 19806 11369 1 20 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.381 0.357 19806 11370 1 20 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.603 -1.008 19806 11371 1 20 . 1 1 120 120 VAL CB C 120 32.852 32.852 32.721 0.131 19806 11372 1 20 . 1 1 121 121 ASP N N 121 118.234 118.234 119.967 -1.733 19806 11373 1 20 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.793 0.470 19806 11374 1 20 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.463 0.200 19806 11375 1 20 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.749 -0.862 19806 11376 1 20 . 1 1 122 122 CYS N N 122 121.036 121.036 121.511 -0.475 19806 11377 1 20 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.597 0.974 19806 11378 1 20 . 1 1 122 122 CYS CA C 122 57.052 57.052 57.828 -0.776 19806 11379 1 20 . 1 1 122 122 CYS CB C 122 30.834 30.834 28.734 2.100 19806 11380 1 20 . 1 1 123 123 TYR N N 123 127.672 127.672 127.740 -0.068 19806 11381 1 20 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.835 0.175 19806 11382 1 20 . 1 1 123 123 TYR CA C 123 57.169 57.169 57.827 -0.658 19806 11383 1 20 . 1 1 123 123 TYR CB C 123 41.408 41.408 42.249 -0.841 19806 11384 1 20 . 1 1 124 124 THR N N 124 120.833 120.833 117.634 3.199 19806 11385 1 20 . 1 1 124 124 THR HA H 124 4.987 4.987 4.955 0.032 19806 11386 1 20 . 1 1 124 124 THR CA C 124 57.153 57.153 60.494 -3.341 19806 11387 1 20 . 1 1 124 124 THR CB C 124 68.607 68.607 71.427 -2.820 19806 11388 1 20 . 1 1 125 125 GLY N N 125 114.347 114.347 111.918 2.429 19806 11389 1 20 . 1 1 125 125 GLY CA C 125 46.328 46.328 45.658 0.670 19806 11390 1 20 . 1 1 126 126 TRP N N 126 119.918 119.918 120.938 -1.020 19806 11391 1 20 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.183 -0.113 19806 11392 1 20 . 1 1 126 126 TRP CA C 126 60.564 60.564 58.870 1.694 19806 11393 1 20 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.772 -0.133 19806 11394 1 20 . 1 1 127 127 TYR N N 127 113.911 113.911 113.180 0.731 19806 11395 1 20 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.810 0.184 19806 11396 1 20 . 1 1 127 127 TYR CA C 127 53.384 53.384 57.365 -3.981 19806 11397 1 20 . 1 1 127 127 TYR CB C 127 38.584 38.584 39.274 -0.690 19806 11398 1 20 . 1 1 128 128 GLY N N 128 105.181 105.181 107.682 -2.501 19806 11399 1 20 . 1 1 128 128 GLY CA C 128 45.189 45.189 44.645 0.544 19806 11400 1 20 . 1 1 129 129 TYR N N 129 116.588 116.588 119.977 -3.389 19806 11401 1 20 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.269 0.395 19806 11402 1 20 . 1 1 129 129 TYR CA C 129 59.565 59.565 58.377 1.188 19806 11403 1 20 . 1 1 129 129 TYR CB C 129 38.853 38.853 35.961 2.892 19806 11404 1 20 . 1 1 130 130 ASP N N 130 115.195 115.195 120.632 -5.437 19806 11405 1 20 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.630 -0.245 19806 11406 1 20 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.593 -1.463 19806 11407 1 20 . 1 1 130 130 ASP CB C 130 38.685 38.685 41.794 -3.109 19806 11408 1 20 . 1 1 131 131 LEU N N 131 124.887 124.887 123.717 1.170 19806 11409 1 20 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.840 -0.359 19806 11410 1 20 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.225 1.380 19806 11411 1 20 . 1 1 131 131 LEU CB C 131 42.441 42.441 41.160 1.282 19806 11412 1 20 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.803 -0.120 19806 11413 1 20 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.557 65.508 19806 11414 1 20 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.264 -0.937 19806 11415 1 20 . 1 1 133 133 ILE N N 133 123.765 123.765 119.735 4.030 19806 11416 1 20 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.672 0.057 19806 11417 1 20 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.765 1.095 19806 11418 1 20 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.160 -0.097 19806 11419 1 20 . 1 1 134 134 GLY N N 134 107.030 107.030 107.509 -0.479 19806 11420 1 20 . 1 1 134 134 GLY CA C 134 45.976 45.976 46.084 -0.108 19806 11421 1 20 . 1 1 135 135 GLU N N 135 116.566 116.566 122.522 -5.956 19806 11422 1 20 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.143 0.521 19806 11423 1 20 . 1 1 135 135 GLU CA C 135 55.414 55.414 57.744 -2.330 19806 11424 1 20 . 1 1 135 135 GLU CB C 135 30.195 30.195 28.887 1.308 19806 11425 1 20 . 1 1 136 136 LEU N N 136 124.239 124.239 120.714 3.525 19806 11426 1 20 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.939 0.105 19806 11427 1 20 . 1 1 136 136 LEU CA C 136 59.116 59.116 57.874 1.242 19806 11428 1 20 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.650 -0.643 19806 11429 1 20 . 1 1 137 137 LYS N N 137 117.225 117.225 117.368 -0.143 19806 11430 1 20 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.759 0.104 19806 11431 1 20 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.200 1.255 19806 11432 1 20 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.164 0.039 19806 11433 1 20 . 1 1 138 138 GLN N N 138 118.718 118.718 119.710 -0.992 19806 11434 1 20 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.239 -0.187 19806 11435 1 20 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.638 -0.763 19806 11436 1 20 . 1 1 138 138 GLN CB C 138 28.235 28.235 28.110 0.125 19806 11437 1 20 . 1 1 139 139 THR N N 139 117.970 117.970 116.407 1.563 19806 11438 1 20 . 1 1 139 139 THR HA H 139 4.532 4.532 4.014 0.518 19806 11439 1 20 . 1 1 139 139 THR CA C 139 68.145 68.145 67.176 0.969 19806 11440 1 20 . 1 1 139 139 THR CB C 139 68.103 68.103 68.437 -0.334 19806 11441 1 20 . 1 1 140 140 ILE N N 140 120.391 120.391 121.966 -1.575 19806 11442 1 20 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.973 -0.246 19806 11443 1 20 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.009 1.247 19806 11444 1 20 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.603 0.510 19806 11445 1 20 . 1 1 141 141 GLN N N 141 118.917 118.917 119.572 -0.655 19806 11446 1 20 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.926 0.089 19806 11447 1 20 . 1 1 141 141 GLN CA C 141 58.371 58.371 59.215 -0.845 19806 11448 1 20 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.587 -1.240 19806 11449 1 20 . 1 1 142 142 ASN N N 142 119.936 119.936 117.641 2.295 19806 11450 1 20 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.666 -0.151 19806 11451 1 20 . 1 1 142 142 ASN CA C 142 55.799 55.799 54.536 1.263 19806 11452 1 20 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.132 -0.502 19806 11453 1 20 . 1 1 143 143 VAL N N 143 123.195 123.195 120.355 2.840 19806 11454 1 20 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.070 -0.354 19806 11455 1 20 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.335 0.162 19806 11456 1 20 . 1 1 143 143 VAL CB C 143 30.989 30.989 31.206 -0.217 19806 11457 1 20 . 1 1 144 144 LYS N N 144 120.348 120.348 117.586 2.762 19806 11458 1 20 . 1 1 144 144 LYS HA H 144 3.881 3.881 3.994 -0.113 19806 11459 1 20 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.177 0.946 19806 11460 1 20 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.228 -0.346 19806 11461 1 20 . 1 1 145 145 GLU N N 145 119.220 119.220 119.492 -0.272 19806 11462 1 20 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.107 0.076 19806 11463 1 20 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.059 0.119 19806 11464 1 20 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.340 -0.270 19806 11465 1 20 . 1 1 146 146 GLU N N 146 121.420 121.420 120.052 1.368 19806 11466 1 20 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.077 0.200 19806 11467 1 20 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.142 -0.024 19806 11468 1 20 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.225 -0.883 19806 11469 1 20 . 1 1 147 147 ASN N N 147 119.197 119.197 117.613 1.584 19806 11470 1 20 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.591 -0.023 19806 11471 1 20 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.830 -1.679 19806 11472 1 20 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.941 -0.568 19806 11473 1 20 . 1 1 148 148 ALA N N 148 123.672 123.672 121.848 1.824 19806 11474 1 20 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.316 -0.193 19806 11475 1 20 . 1 1 148 148 ALA CA C 148 55.133 55.133 54.652 0.481 19806 11476 1 20 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.272 -0.665 19806 11477 1 20 . 1 1 149 149 ALA N N 149 119.979 119.979 121.987 -2.008 19806 11478 1 20 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.148 0.113 19806 11479 1 20 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.562 0.083 19806 11480 1 20 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.387 -0.649 19806 11481 1 20 . 1 1 150 150 PHE N N 150 119.592 119.592 119.973 -0.381 19806 11482 1 20 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.137 0.087 19806 11483 1 20 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.328 -0.320 19806 11484 1 20 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.508 -0.446 19806 11485 1 20 . 1 1 151 151 LYS N N 151 116.869 116.869 118.324 -1.455 19806 11486 1 20 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.340 -0.434 19806 11487 1 20 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.454 0.316 19806 11488 1 20 . 1 1 151 151 LYS CB C 151 32.741 32.741 31.968 0.773 19806 11489 1 20 . 1 1 152 152 GLU N N 152 115.868 115.868 119.618 -3.750 19806 11490 1 20 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.095 -0.042 19806 11491 1 20 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.852 -0.196 19806 11492 1 20 . 1 1 152 152 GLU CB C 152 29.753 29.753 29.890 -0.137 19806 11493 1 20 . 1 1 153 153 ILE N N 153 110.437 110.437 117.216 -6.779 19806 11494 1 20 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.850 0.326 19806 11495 1 20 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.605 -1.571 19806 11496 1 20 . 1 1 153 153 ILE CB C 153 39.272 39.272 38.921 0.351 19806 11497 1 20 . 1 1 154 154 HIS N N 154 117.779 117.779 117.408 0.371 19806 11498 1 20 . 1 1 154 154 HIS HA H 154 5.174 5.174 4.959 0.215 19806 11499 1 20 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.407 -0.791 19806 11500 1 20 . 1 1 154 154 HIS CB C 154 28.547 28.547 29.222 -0.675 19806 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 146 3.037 0.709 2.963 19806 2 1 1 "Average Difference" HA 150 0.362 -0.042 0.361 19806 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19806 4 1 1 "Average Difference" CA 152 5.441 -0.183 5.456 19806 5 1 1 "Average Difference" CB 136 1.262 0.038 1.266 19806 6 1 1 "Average Difference" HN 0 0.000 0.000 0.000 19806 7 1 2 "Average Difference" N 146 3.390 0.537 3.359 19806 8 1 2 "Average Difference" HA 150 0.383 -0.024 0.384 19806 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19806 10 1 2 "Average Difference" CA 152 5.410 -0.388 5.414 19806 11 1 2 "Average Difference" CB 136 1.547 -0.029 1.552 19806 12 1 2 "Average Difference" HN 0 0.000 0.000 0.000 19806 13 1 3 "Average Difference" N 146 3.151 0.549 3.114 19806 14 1 3 "Average Difference" HA 150 0.365 -0.035 0.365 19806 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19806 16 1 3 "Average Difference" CA 152 5.448 -0.236 5.461 19806 17 1 3 "Average Difference" CB 136 1.354 0.125 1.353 19806 18 1 3 "Average Difference" HN 0 0.000 0.000 0.000 19806 19 1 4 "Average Difference" N 146 3.319 0.456 3.299 19806 20 1 4 "Average Difference" HA 150 0.363 -0.023 0.364 19806 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19806 22 1 4 "Average Difference" CA 152 5.430 -0.262 5.442 19806 23 1 4 "Average Difference" CB 136 1.406 0.187 1.399 19806 24 1 4 "Average Difference" HN 0 0.000 0.000 0.000 19806 25 1 5 "Average Difference" N 146 2.944 0.659 2.879 19806 26 1 5 "Average Difference" HA 150 0.349 -0.038 0.348 19806 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19806 28 1 5 "Average Difference" CA 152 5.419 -0.267 5.430 19806 29 1 5 "Average Difference" CB 136 1.356 0.011 1.361 19806 30 1 5 "Average Difference" HN 0 0.000 0.000 0.000 19806 31 1 6 "Average Difference" N 146 2.993 0.659 2.930 19806 32 1 6 "Average Difference" HA 150 0.345 -0.006 0.347 19806 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19806 34 1 6 "Average Difference" CA 152 5.430 -0.337 5.438 19806 35 1 6 "Average Difference" CB 136 1.477 0.232 1.464 19806 36 1 6 "Average Difference" HN 0 0.000 0.000 0.000 19806 37 1 7 "Average Difference" N 146 3.180 0.380 3.168 19806 38 1 7 "Average Difference" HA 150 0.364 -0.043 0.363 19806 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19806 40 1 7 "Average Difference" CA 152 5.475 -0.242 5.488 19806 41 1 7 "Average Difference" CB 136 1.457 0.061 1.461 19806 42 1 7 "Average Difference" HN 0 0.000 0.000 0.000 19806 43 1 8 "Average Difference" N 146 3.444 0.165 3.452 19806 44 1 8 "Average Difference" HA 150 0.353 -0.031 0.353 19806 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19806 46 1 8 "Average Difference" CA 152 5.444 -0.298 5.453 19806 47 1 8 "Average Difference" CB 136 1.356 0.172 1.350 19806 48 1 8 "Average Difference" HN 0 0.000 0.000 0.000 19806 49 1 9 "Average Difference" N 146 3.193 0.864 3.085 19806 50 1 9 "Average Difference" HA 150 0.379 -0.035 0.379 19806 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19806 52 1 9 "Average Difference" CA 152 5.442 -0.301 5.452 19806 53 1 9 "Average Difference" CB 136 1.322 0.130 1.320 19806 54 1 9 "Average Difference" HN 0 0.000 0.000 0.000 19806 55 1 10 "Average Difference" N 146 3.408 0.651 3.356 19806 56 1 10 "Average Difference" HA 150 0.436 -0.061 0.433 19806 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19806 58 1 10 "Average Difference" CA 152 5.440 -0.273 5.451 19806 59 1 10 "Average Difference" CB 136 1.346 0.098 1.348 19806 60 1 10 "Average Difference" HN 0 0.000 0.000 0.000 19806 61 1 11 "Average Difference" N 146 3.117 0.337 3.110 19806 62 1 11 "Average Difference" HA 150 0.404 -0.055 0.402 19806 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19806 64 1 11 "Average Difference" CA 152 5.450 -0.196 5.465 19806 65 1 11 "Average Difference" CB 136 1.565 0.078 1.568 19806 66 1 11 "Average Difference" HN 0 0.000 0.000 0.000 19806 67 1 12 "Average Difference" N 146 3.095 0.602 3.046 19806 68 1 12 "Average Difference" HA 150 0.399 -0.021 0.399 19806 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19806 70 1 12 "Average Difference" CA 152 5.429 -0.324 5.437 19806 71 1 12 "Average Difference" CB 136 1.499 0.132 1.498 19806 72 1 12 "Average Difference" HN 0 0.000 0.000 0.000 19806 73 1 13 "Average Difference" N 146 3.194 0.663 3.136 19806 74 1 13 "Average Difference" HA 150 0.349 -0.026 0.350 19806 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19806 76 1 13 "Average Difference" CA 152 5.473 -0.303 5.483 19806 77 1 13 "Average Difference" CB 136 1.329 0.078 1.332 19806 78 1 13 "Average Difference" HN 0 0.000 0.000 0.000 19806 79 1 14 "Average Difference" N 146 3.276 0.186 3.282 19806 80 1 14 "Average Difference" HA 150 0.367 -0.022 0.367 19806 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19806 82 1 14 "Average Difference" CA 152 5.458 -0.295 5.468 19806 83 1 14 "Average Difference" CB 136 1.372 0.068 1.375 19806 84 1 14 "Average Difference" HN 0 0.000 0.000 0.000 19806 85 1 15 "Average Difference" N 146 3.115 0.600 3.067 19806 86 1 15 "Average Difference" HA 150 0.354 -0.042 0.353 19806 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19806 88 1 15 "Average Difference" CA 152 5.431 -0.263 5.443 19806 89 1 15 "Average Difference" CB 136 1.386 0.056 1.390 19806 90 1 15 "Average Difference" HN 0 0.000 0.000 0.000 19806 91 1 16 "Average Difference" N 146 2.900 0.698 2.824 19806 92 1 16 "Average Difference" HA 150 0.385 -0.031 0.385 19806 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19806 94 1 16 "Average Difference" CA 152 5.419 -0.336 5.427 19806 95 1 16 "Average Difference" CB 136 1.306 0.167 1.300 19806 96 1 16 "Average Difference" HN 0 0.000 0.000 0.000 19806 97 1 17 "Average Difference" N 146 3.136 0.413 3.120 19806 98 1 17 "Average Difference" HA 150 0.334 -0.015 0.335 19806 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19806 100 1 17 "Average Difference" CA 152 5.417 -0.303 5.426 19806 101 1 17 "Average Difference" CB 136 1.348 0.281 1.323 19806 102 1 17 "Average Difference" HN 0 0.000 0.000 0.000 19806 103 1 18 "Average Difference" N 146 2.867 0.562 2.821 19806 104 1 18 "Average Difference" HA 150 0.364 -0.035 0.363 19806 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19806 106 1 18 "Average Difference" CA 152 5.449 -0.273 5.460 19806 107 1 18 "Average Difference" CB 136 1.473 0.124 1.474 19806 108 1 18 "Average Difference" HN 0 0.000 0.000 0.000 19806 109 1 19 "Average Difference" N 146 3.198 0.335 3.191 19806 110 1 19 "Average Difference" HA 150 0.348 0.004 0.349 19806 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19806 112 1 19 "Average Difference" CA 152 5.479 -0.274 5.490 19806 113 1 19 "Average Difference" CB 136 1.311 0.179 1.303 19806 114 1 19 "Average Difference" HN 0 0.000 0.000 0.000 19806 115 1 20 "Average Difference" N 146 3.531 0.367 3.524 19806 116 1 20 "Average Difference" HA 150 0.411 -0.034 0.411 19806 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19806 118 1 20 "Average Difference" CA 152 5.460 -0.335 5.467 19806 119 1 20 "Average Difference" CB 136 1.530 0.021 1.536 19806 120 1 20 "Average Difference" HN 0 0.000 0.000 0.000 19806 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 19806 _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 SER N N 3 114.847 114.847 115.497 -0.650 19806 2 1 . 1 1 3 3 SER HA H 3 4.463 4.463 4.534 -0.071 19806 3 1 . 1 1 3 3 SER CA C 3 58.340 58.340 58.433 -0.094 19806 4 1 . 1 1 3 3 SER CB C 3 63.457 63.457 64.499 -1.042 19806 5 1 . 1 1 4 4 GLU N N 4 121.498 121.498 120.366 1.132 19806 6 1 . 1 1 4 4 GLU HA H 4 4.332 4.332 4.488 -0.156 19806 7 1 . 1 1 4 4 GLU CA C 4 56.443 56.443 56.118 0.325 19806 8 1 . 1 1 4 4 GLU CB C 4 29.966 29.966 30.492 -0.526 19806 9 1 . 1 1 5 5 LEU N N 5 121.589 121.589 121.908 -0.319 19806 10 1 . 1 1 5 5 LEU HA H 5 4.437 4.437 4.537 -0.100 19806 11 1 . 1 1 5 5 LEU CA C 5 55.019 55.019 55.334 -0.315 19806 12 1 . 1 1 5 5 LEU CB C 5 42.243 42.243 42.806 -0.563 19806 13 1 . 1 1 6 6 THR N N 6 113.708 113.708 114.160 -0.452 19806 14 1 . 1 1 6 6 THR HA H 6 4.470 4.470 4.530 -0.060 19806 15 1 . 1 1 6 6 THR CA C 6 61.409 61.409 61.926 -0.517 19806 16 1 . 1 1 6 6 THR CB C 6 69.544 69.544 69.606 -0.062 19806 17 1 . 1 1 7 7 THR N N 7 114.945 114.945 114.805 0.140 19806 18 1 . 1 1 7 7 THR HA H 7 4.415 4.415 4.389 0.026 19806 19 1 . 1 1 7 7 THR CA C 7 61.435 61.435 62.230 -0.795 19806 20 1 . 1 1 7 7 THR CB C 7 69.506 69.506 69.747 -0.241 19806 21 1 . 1 1 8 8 GLN N N 8 121.368 121.368 121.615 -0.247 19806 22 1 . 1 1 8 8 GLN CA C 8 55.684 55.684 56.045 -0.361 19806 23 1 . 1 1 9 9 ASP N N 9 120.595 120.595 120.753 -0.158 19806 24 1 . 1 1 9 9 ASP HA H 9 4.647 4.647 4.609 0.038 19806 25 1 . 1 1 9 9 ASP CA C 9 54.115 54.115 54.078 0.037 19806 26 1 . 1 1 9 9 ASP CB C 9 41.328 41.328 41.240 0.088 19806 27 1 . 1 1 10 10 GLY N N 10 106.984 106.984 106.648 0.336 19806 28 1 . 1 1 10 10 GLY CA C 10 44.495 44.495 44.599 -0.104 19806 29 1 . 1 1 11 11 GLU N N 11 120.879 120.879 120.996 -0.117 19806 30 1 . 1 1 11 11 GLU HA H 11 4.189 4.189 4.332 -0.143 19806 31 1 . 1 1 11 11 GLU CA C 11 56.510 56.510 56.457 0.053 19806 32 1 . 1 1 11 11 GLU CB C 11 33.069 33.069 31.447 1.622 19806 33 1 . 1 1 12 12 ASP N N 12 126.686 126.686 122.571 4.115 19806 34 1 . 1 1 12 12 ASP HA H 12 4.750 4.750 4.631 0.119 19806 35 1 . 1 1 12 12 ASP CA C 12 54.347 54.347 54.098 0.249 19806 36 1 . 1 1 12 12 ASP CB C 12 42.771 42.771 42.014 0.757 19806 37 1 . 1 1 13 13 PHE N N 13 128.055 128.055 121.797 6.258 19806 38 1 . 1 1 13 13 PHE HA H 13 3.412 3.412 3.737 -0.325 19806 39 1 . 1 1 13 13 PHE CA C 13 62.551 62.551 60.205 2.346 19806 40 1 . 1 1 13 13 PHE CB C 13 38.833 38.833 38.573 0.260 19806 41 1 . 1 1 14 14 LYS N N 14 117.498 117.498 118.737 -1.239 19806 42 1 . 1 1 14 14 LYS HA H 14 3.581 3.581 3.881 -0.300 19806 43 1 . 1 1 14 14 LYS CA C 14 59.461 59.461 58.008 1.453 19806 44 1 . 1 1 14 14 LYS CB C 14 31.344 31.344 31.656 -0.312 19806 45 1 . 1 1 15 15 SER N N 15 113.775 113.775 114.848 -1.073 19806 46 1 . 1 1 15 15 SER HA H 15 4.167 4.167 4.136 0.031 19806 47 1 . 1 1 15 15 SER CA C 15 61.099 61.099 61.590 -0.491 19806 48 1 . 1 1 15 15 SER CB C 15 62.428 62.428 62.846 -0.418 19806 49 1 . 1 1 16 16 PHE N N 16 122.292 122.292 119.158 3.134 19806 50 1 . 1 1 16 16 PHE HA H 16 4.290 4.290 4.486 -0.196 19806 51 1 . 1 1 16 16 PHE CA C 16 59.773 59.773 59.394 0.379 19806 52 1 . 1 1 16 16 PHE CB C 16 37.175 37.175 38.465 -1.290 19806 53 1 . 1 1 17 17 LEU N N 17 122.472 122.472 121.498 0.974 19806 54 1 . 1 1 17 17 LEU HA H 17 2.850 2.850 3.408 -0.558 19806 55 1 . 1 1 17 17 LEU CA C 17 56.619 56.619 57.003 -0.384 19806 56 1 . 1 1 17 17 LEU CB C 17 40.462 40.462 40.303 0.159 19806 57 1 . 1 1 18 18 ASP N N 18 117.331 117.331 119.670 -2.339 19806 58 1 . 1 1 18 18 ASP HA H 18 4.115 4.115 4.228 -0.113 19806 59 1 . 1 1 18 18 ASP CA C 18 56.395 56.395 57.441 -1.046 19806 60 1 . 1 1 18 18 ASP CB C 18 40.353 40.353 40.566 -0.213 19806 61 1 . 1 1 19 19 LYS N N 19 120.032 120.032 118.760 1.272 19806 62 1 . 1 1 19 19 LYS HA H 19 3.677 3.677 3.985 -0.308 19806 63 1 . 1 1 19 19 LYS CA C 19 59.067 59.067 58.803 0.264 19806 64 1 . 1 1 19 19 LYS CB C 19 31.936 31.936 32.331 -0.395 19806 65 1 . 1 1 20 20 PHE N N 20 119.607 119.607 119.591 0.016 19806 66 1 . 1 1 20 20 PHE HA H 20 4.109 4.109 4.371 -0.262 19806 67 1 . 1 1 20 20 PHE CA C 20 62.090 62.090 60.755 1.335 19806 68 1 . 1 1 20 20 PHE CB C 20 40.469 40.469 39.199 1.270 19806 69 1 . 1 1 21 21 THR N N 21 101.473 101.473 110.444 -8.972 19806 70 1 . 1 1 21 21 THR HA H 21 4.259 4.259 4.006 0.253 19806 71 1 . 1 1 21 21 THR CA C 21 61.774 61.774 64.030 -2.256 19806 72 1 . 1 1 22 22 SER N N 22 111.453 111.453 115.675 -4.222 19806 73 1 . 1 1 22 22 SER HA H 22 4.165 4.165 4.369 -0.204 19806 74 1 . 1 1 22 22 SER CA C 22 58.215 58.215 57.890 0.325 19806 75 1 . 1 1 22 22 SER CB C 22 64.570 64.570 63.891 0.679 19806 76 1 . 1 1 23 23 SER N N 23 114.184 114.184 116.016 -1.832 19806 77 1 . 1 1 23 23 SER HA H 23 4.764 4.764 4.881 -0.117 19806 78 1 . 1 1 23 23 SER CA C 23 55.669 55.669 57.854 -2.185 19806 79 1 . 1 1 23 23 SER CB C 23 64.011 64.011 64.880 -0.869 19806 80 1 . 1 1 24 24 ALA N N 24 133.370 133.370 128.900 4.470 19806 81 1 . 1 1 24 24 ALA HA H 24 3.956 3.956 4.235 -0.279 19806 82 1 . 1 1 24 24 ALA CA C 24 55.106 55.106 55.021 0.085 19806 83 1 . 1 1 24 24 ALA CB C 24 19.835 19.835 19.289 0.546 19806 84 1 . 1 1 25 25 ALA N N 25 117.430 117.430 120.232 -2.802 19806 85 1 . 1 1 25 25 ALA HA H 25 4.317 4.317 4.492 -0.175 19806 86 1 . 1 1 25 25 ALA CA C 25 55.201 55.201 54.249 0.952 19806 87 1 . 1 1 25 25 ALA CB C 25 18.349 18.349 18.498 -0.149 19806 88 1 . 1 1 26 26 PHE N N 26 116.042 116.042 117.063 -1.021 19806 89 1 . 1 1 26 26 PHE HA H 26 4.310 4.310 4.593 -0.283 19806 90 1 . 1 1 26 26 PHE CA C 26 60.759 60.759 59.621 1.138 19806 91 1 . 1 1 26 26 PHE CB C 26 39.310 39.310 39.855 -0.545 19806 92 1 . 1 1 27 27 GLN N N 27 121.820 121.820 120.028 1.792 19806 93 1 . 1 1 27 27 GLN HA H 27 3.391 3.391 4.028 -0.637 19806 94 1 . 1 1 27 27 GLN CA C 27 60.094 60.094 59.371 0.723 19806 95 1 . 1 1 27 27 GLN CB C 27 27.457 27.457 28.564 -1.107 19806 96 1 . 1 1 28 28 TYR N N 28 111.517 111.517 116.288 -4.771 19806 97 1 . 1 1 28 28 TYR HA H 28 4.130 4.130 3.898 0.232 19806 98 1 . 1 1 28 28 TYR CA C 28 62.357 62.357 59.826 2.531 19806 99 1 . 1 1 28 28 TYR CB C 28 38.568 38.568 37.984 0.584 19806 100 1 . 1 1 29 29 THR N N 29 106.324 106.324 111.356 -5.031 19806 101 1 . 1 1 29 29 THR HA H 29 4.489 4.489 4.322 0.167 19806 102 1 . 1 1 29 29 THR CA C 29 63.765 63.765 62.383 1.382 19806 103 1 . 1 1 29 29 THR CB C 29 69.568 69.568 68.291 1.277 19806 104 1 . 1 1 30 30 ARG N N 30 117.696 117.696 120.299 -2.603 19806 105 1 . 1 1 30 30 ARG HA H 30 4.701 4.701 3.947 0.754 19806 106 1 . 1 1 30 30 ARG CA C 30 52.760 52.760 55.025 -2.265 19806 107 1 . 1 1 30 30 ARG CB C 30 35.047 35.047 31.017 4.030 19806 108 1 . 1 1 31 31 VAL N N 31 119.395 119.395 119.228 0.167 19806 109 1 . 1 1 31 31 VAL HA H 31 4.230 4.230 4.644 -0.414 19806 110 1 . 1 1 31 31 VAL CA C 31 61.191 61.191 60.574 0.617 19806 111 1 . 1 1 31 31 VAL CB C 31 32.173 32.173 34.594 -2.421 19806 112 1 . 1 1 32 32 LYS N N 32 126.124 126.124 125.512 0.612 19806 113 1 . 1 1 32 32 LYS HA H 32 4.184 4.184 4.539 -0.355 19806 114 1 . 1 1 32 32 LYS CA C 32 53.958 53.958 55.092 -1.134 19806 115 1 . 1 1 32 32 LYS CB C 32 31.112 31.112 33.909 -2.797 19806 116 1 . 1 1 33 33 PHE N N 33 119.303 119.303 119.000 0.303 19806 117 1 . 1 1 33 33 PHE HA H 33 4.514 4.514 4.893 -0.379 19806 118 1 . 1 1 33 33 PHE CA C 33 56.272 56.272 55.512 0.760 19806 119 1 . 1 1 33 33 PHE CB C 33 40.378 40.378 40.182 0.196 19806 120 1 . 1 1 34 34 PRO HA H 34 4.968 4.968 4.184 0.784 19806 121 1 . 1 1 34 34 PRO CA C 34 61.633 61.633 62.645 -1.012 19806 122 1 . 1 1 34 34 PRO CB C 34 33.732 33.732 32.737 0.995 19806 123 1 . 1 1 35 35 LEU N N 35 120.016 120.016 118.477 1.539 19806 124 1 . 1 1 35 35 LEU HA H 35 4.222 4.222 4.479 -0.257 19806 125 1 . 1 1 35 35 LEU CA C 35 54.840 54.840 53.821 1.019 19806 126 1 . 1 1 35 35 LEU CB C 35 41.244 41.244 43.510 -2.266 19806 127 1 . 1 1 36 36 LYS N N 36 117.066 117.066 119.219 -2.153 19806 128 1 . 1 1 36 36 LYS HA H 36 3.975 3.975 4.315 -0.340 19806 129 1 . 1 1 36 36 LYS CA C 36 60.247 60.247 57.677 2.570 19806 130 1 . 1 1 36 36 LYS CB C 36 32.832 32.832 33.069 -0.237 19806 131 1 . 1 1 37 37 THR N N 37 117.574 117.574 117.146 0.428 19806 132 1 . 1 1 37 37 THR HA H 37 4.797 4.797 4.821 -0.024 19806 133 1 . 1 1 37 37 THR CA C 37 60.396 60.396 59.261 1.135 19806 134 1 . 1 1 38 38 PRO HA H 38 5.019 5.019 4.706 0.313 19806 135 1 . 1 1 38 38 PRO CA C 38 61.923 61.923 62.460 -0.537 19806 136 1 . 1 1 38 38 PRO CB C 38 32.631 32.631 32.840 -0.209 19806 137 1 . 1 1 39 39 ILE N N 39 119.949 119.949 119.003 0.946 19806 138 1 . 1 1 39 39 ILE HA H 39 4.239 4.239 4.219 0.020 19806 139 1 . 1 1 39 39 ILE CA C 39 62.133 62.133 62.490 -0.357 19806 140 1 . 1 1 40 40 THR N N 40 123.962 123.962 120.621 3.341 19806 141 1 . 1 1 40 40 THR HA H 40 5.057 5.057 4.812 0.245 19806 142 1 . 1 1 40 40 THR CA C 40 62.262 62.262 61.998 0.264 19806 143 1 . 1 1 40 40 THR CB C 40 69.891 69.891 69.457 0.434 19806 144 1 . 1 1 41 41 LEU N N 41 125.633 125.633 123.313 2.320 19806 145 1 . 1 1 41 41 LEU HA H 41 5.102 5.102 4.790 0.312 19806 146 1 . 1 1 41 41 LEU CA C 41 52.638 52.638 53.029 -0.391 19806 147 1 . 1 1 41 41 LEU CB C 41 45.180 45.180 44.309 0.871 19806 148 1 . 1 1 42 42 LEU N N 42 120.788 120.788 123.068 -2.280 19806 149 1 . 1 1 42 42 LEU HA H 42 4.748 4.748 4.543 0.205 19806 150 1 . 1 1 42 42 LEU CA C 42 53.724 53.724 54.153 -0.429 19806 151 1 . 1 1 42 42 LEU CB C 42 44.384 44.384 41.774 2.610 19806 152 1 . 1 1 43 43 ALA N N 43 123.073 123.073 128.478 -5.405 19806 153 1 . 1 1 43 43 ALA HA H 43 4.430 4.430 4.206 0.224 19806 154 1 . 1 1 43 43 ALA CA C 43 51.288 51.288 52.622 -1.334 19806 155 1 . 1 1 43 43 ALA CB C 43 20.014 20.014 19.327 0.687 19806 156 1 . 1 1 44 44 ASP N N 44 118.196 118.196 118.628 -0.432 19806 157 1 . 1 1 44 44 ASP HA H 44 4.426 4.426 4.423 0.003 19806 158 1 . 1 1 44 44 ASP CA C 44 56.028 56.028 56.672 -0.644 19806 159 1 . 1 1 44 44 ASP CB C 44 40.210 40.210 40.552 -0.342 19806 160 1 . 1 1 45 45 ASP N N 45 115.018 115.018 118.011 -2.994 19806 161 1 . 1 1 45 45 ASP HA H 45 4.469 4.469 4.562 -0.093 19806 162 1 . 1 1 45 45 ASP CA C 45 53.794 53.794 54.529 -0.735 19806 163 1 . 1 1 45 45 ASP CB C 45 39.864 39.864 41.147 -1.283 19806 164 1 . 1 1 46 46 GLY N N 46 107.499 107.499 107.638 -0.139 19806 165 1 . 1 1 46 46 GLY CA C 46 45.914 45.914 45.657 0.257 19806 166 1 . 1 1 47 47 GLU N N 47 117.331 117.331 117.872 -0.541 19806 167 1 . 1 1 47 47 GLU HA H 47 4.531 4.531 4.499 0.032 19806 168 1 . 1 1 47 47 GLU CA C 47 56.938 56.938 56.097 0.841 19806 169 1 . 1 1 47 47 GLU CB C 47 33.133 33.133 30.649 2.484 19806 170 1 . 1 1 48 48 THR N N 48 118.462 118.462 118.166 0.296 19806 171 1 . 1 1 48 48 THR HA H 48 4.243 4.243 4.415 -0.172 19806 172 1 . 1 1 48 48 THR CA C 48 62.834 62.834 62.276 0.558 19806 173 1 . 1 1 48 48 THR CB C 48 68.649 68.649 69.650 -1.001 19806 174 1 . 1 1 49 49 GLU N N 49 123.834 123.834 127.942 -4.108 19806 175 1 . 1 1 49 49 GLU HA H 49 4.945 4.945 4.443 0.502 19806 176 1 . 1 1 49 49 GLU CA C 49 55.358 55.358 57.101 -1.743 19806 177 1 . 1 1 49 49 GLU CB C 49 31.395 31.395 29.751 1.644 19806 178 1 . 1 1 50 50 LYS N N 50 122.868 122.868 127.147 -4.279 19806 179 1 . 1 1 50 50 LYS HA H 50 4.641 4.641 4.658 -0.017 19806 180 1 . 1 1 50 50 LYS CA C 50 54.111 54.111 55.116 -1.004 19806 181 1 . 1 1 50 50 LYS CB C 50 35.312 35.312 34.583 0.729 19806 182 1 . 1 1 51 51 THR N N 51 111.386 111.386 115.327 -3.942 19806 183 1 . 1 1 51 51 THR HA H 51 5.619 5.619 5.088 0.531 19806 184 1 . 1 1 51 51 THR CA C 51 58.980 58.980 61.314 -2.334 19806 185 1 . 1 1 51 51 THR CB C 51 71.277 71.277 69.839 1.438 19806 186 1 . 1 1 52 52 PHE N N 52 120.631 120.631 119.738 0.893 19806 187 1 . 1 1 52 52 PHE HA H 52 4.963 4.963 4.869 0.094 19806 188 1 . 1 1 52 52 PHE CA C 52 54.129 54.129 55.445 -1.316 19806 189 1 . 1 1 52 52 PHE CB C 52 41.049 41.049 41.654 -0.605 19806 190 1 . 1 1 53 53 PRO HA H 53 4.448 4.448 4.475 -0.027 19806 191 1 . 1 1 53 53 PRO CA C 53 62.489 62.489 62.869 -0.380 19806 192 1 . 1 1 53 53 PRO CB C 53 32.240 32.240 32.018 0.222 19806 193 1 . 1 1 54 54 PHE N N 54 128.034 128.034 123.259 4.775 19806 194 1 . 1 1 54 54 PHE HA H 54 4.828 4.828 4.642 0.186 19806 195 1 . 1 1 54 54 PHE CA C 54 55.509 55.509 56.914 -1.405 19806 196 1 . 1 1 54 54 PHE CB C 54 37.028 37.028 39.533 -2.505 19806 197 1 . 1 1 55 55 THR N N 55 111.757 111.757 116.324 -4.567 19806 198 1 . 1 1 55 55 THR HA H 55 4.413 4.413 4.246 0.167 19806 199 1 . 1 1 55 55 THR CA C 55 60.578 60.578 60.078 0.499 19806 200 1 . 1 1 55 55 THR CB C 55 69.447 69.447 71.009 -1.562 19806 201 1 . 1 1 56 56 LYS N N 56 118.734 118.734 120.292 -1.558 19806 202 1 . 1 1 56 56 LYS HA H 56 2.482 2.482 4.162 -1.680 19806 203 1 . 1 1 56 56 LYS CA C 56 59.381 59.381 59.160 0.221 19806 204 1 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.014 1.236 19806 205 1 . 1 1 57 57 GLU N N 57 119.675 119.675 118.590 1.085 19806 206 1 . 1 1 57 57 GLU HA H 57 4.269 4.269 4.095 0.174 19806 207 1 . 1 1 57 57 GLU CA C 57 57.152 57.152 58.875 -1.723 19806 208 1 . 1 1 57 57 GLU CB C 57 26.950 26.950 29.411 -2.461 19806 209 1 . 1 1 58 58 LYS N N 58 114.700 114.700 117.015 -2.315 19806 210 1 . 1 1 58 58 LYS HA H 58 4.312 4.312 4.330 -0.018 19806 211 1 . 1 1 58 58 LYS CA C 58 55.595 55.595 55.378 0.217 19806 212 1 . 1 1 58 58 LYS CB C 58 32.011 32.011 31.564 0.447 19806 213 1 . 1 1 59 59 TRP N N 59 118.204 118.204 124.377 -6.173 19806 214 1 . 1 1 59 59 TRP HA H 59 5.099 5.099 5.113 -0.014 19806 215 1 . 1 1 59 59 TRP CA C 59 55.577 55.577 55.120 0.457 19806 216 1 . 1 1 59 59 TRP CB C 59 32.037 32.037 30.215 1.822 19806 217 1 . 1 1 60 60 PRO HA H 60 4.263 4.263 4.437 -0.174 19806 218 1 . 1 1 60 60 PRO CA C 60 59.721 59.721 62.535 -2.814 19806 219 1 . 1 1 60 60 PRO CB C 60 29.849 29.849 32.215 -2.366 19806 220 1 . 1 1 61 61 LEU N N 61 123.758 123.758 124.141 -0.383 19806 221 1 . 1 1 61 61 LEU HA H 61 3.639 3.639 4.237 -0.598 19806 222 1 . 1 1 61 61 LEU CA C 61 54.875 54.875 54.459 0.416 19806 223 1 . 1 1 61 61 LEU CB C 61 40.815 40.815 41.643 -0.828 19806 224 1 . 1 1 62 62 LEU N N 62 124.052 124.052 124.753 -0.701 19806 225 1 . 1 1 62 62 LEU HA H 62 4.355 4.355 4.350 0.005 19806 226 1 . 1 1 62 62 LEU CA C 62 53.992 53.992 54.187 -0.195 19806 227 1 . 1 1 62 62 LEU CB C 62 44.686 44.686 43.237 1.449 19806 228 1 . 1 1 63 63 ASP N N 63 117.271 117.271 119.186 -1.915 19806 229 1 . 1 1 63 63 ASP HA H 63 5.033 5.033 4.944 0.089 19806 230 1 . 1 1 63 63 ASP CA C 63 51.101 51.101 52.855 -1.754 19806 231 1 . 1 1 63 63 ASP CB C 63 43.345 43.345 43.196 0.149 19806 232 1 . 1 1 64 64 SER N N 64 112.856 112.856 114.941 -2.085 19806 233 1 . 1 1 64 64 SER HA H 64 3.865 3.865 4.279 -0.414 19806 234 1 . 1 1 64 64 SER CA C 64 60.910 60.910 61.019 -0.109 19806 235 1 . 1 1 64 64 SER CB C 64 62.378 62.378 63.236 -0.858 19806 236 1 . 1 1 65 65 GLU N N 65 120.070 120.070 119.947 0.123 19806 237 1 . 1 1 65 65 GLU HA H 65 4.018 4.018 4.244 -0.226 19806 238 1 . 1 1 65 65 GLU CA C 65 58.343 58.343 58.717 -0.374 19806 239 1 . 1 1 65 65 GLU CB C 65 28.887 28.887 29.380 -0.493 19806 240 1 . 1 1 66 66 THR N N 66 115.852 115.852 113.577 2.275 19806 241 1 . 1 1 66 66 THR HA H 66 3.991 3.991 4.344 -0.353 19806 242 1 . 1 1 66 66 THR CA C 66 65.804 65.804 64.026 1.778 19806 243 1 . 1 1 66 66 THR CB C 66 68.451 68.451 69.105 -0.654 19806 244 1 . 1 1 67 67 MET N N 67 113.585 113.585 120.833 -7.248 19806 245 1 . 1 1 67 67 MET HA H 67 4.267 4.267 4.437 -0.170 19806 246 1 . 1 1 67 67 MET CA C 67 52.135 52.135 54.318 -2.183 19806 247 1 . 1 1 67 67 MET CB C 67 28.963 28.963 32.062 -3.099 19806 248 1 . 1 1 68 68 LYS N N 68 118.462 118.462 121.015 -2.553 19806 249 1 . 1 1 68 68 LYS HA H 68 4.370 4.370 4.548 -0.178 19806 250 1 . 1 1 68 68 LYS CA C 68 55.482 55.482 55.401 0.081 19806 251 1 . 1 1 68 68 LYS CB C 68 34.179 34.179 34.297 -0.118 19806 252 1 . 1 1 69 69 GLU N N 69 121.700 121.700 122.843 -1.143 19806 253 1 . 1 1 69 69 GLU HA H 69 4.524 4.524 4.744 -0.220 19806 254 1 . 1 1 69 69 GLU CA C 69 55.942 55.942 56.312 -0.369 19806 255 1 . 1 1 69 69 GLU CB C 69 30.424 30.424 30.511 -0.087 19806 256 1 . 1 1 70 70 GLU N N 70 123.445 123.445 124.515 -1.070 19806 257 1 . 1 1 70 70 GLU HA H 70 4.697 4.697 4.612 0.085 19806 258 1 . 1 1 70 70 GLU CA C 70 55.473 55.473 55.148 0.325 19806 259 1 . 1 1 70 70 GLU CB C 70 33.162 33.162 32.811 0.351 19806 260 1 . 1 1 71 71 ARG N N 71 122.150 122.150 122.194 -0.044 19806 261 1 . 1 1 71 71 ARG HA H 71 5.151 5.151 4.858 0.293 19806 262 1 . 1 1 71 71 ARG CA C 71 55.448 55.448 55.280 0.168 19806 263 1 . 1 1 71 71 ARG CB C 71 31.703 31.703 31.351 0.352 19806 264 1 . 1 1 72 72 ILE N N 72 125.686 125.686 127.316 -1.630 19806 265 1 . 1 1 72 72 ILE HA H 72 4.596 4.596 4.269 0.327 19806 266 1 . 1 1 72 72 ILE CA C 72 59.512 59.512 60.824 -1.312 19806 267 1 . 1 1 72 72 ILE CB C 72 41.095 41.095 38.710 2.385 19806 268 1 . 1 1 73 73 THR N N 73 121.600 121.600 122.753 -1.153 19806 269 1 . 1 1 73 73 THR HA H 73 4.603 4.603 4.406 0.197 19806 270 1 . 1 1 73 73 THR CA C 73 61.937 61.937 62.133 -0.197 19806 271 1 . 1 1 73 73 THR CB C 73 68.669 68.669 68.730 -0.061 19806 272 1 . 1 1 74 74 GLN N N 74 124.607 124.607 126.698 -2.091 19806 273 1 . 1 1 74 74 GLN HA H 74 4.581 4.581 4.620 -0.039 19806 274 1 . 1 1 74 74 GLN CA C 74 54.689 54.689 54.626 0.062 19806 275 1 . 1 1 74 74 GLN CB C 74 29.490 29.490 30.900 -1.410 19806 276 1 . 1 1 75 75 GLU N N 75 122.962 122.962 120.047 2.915 19806 277 1 . 1 1 75 75 GLU HA H 75 4.059 4.059 4.356 -0.297 19806 278 1 . 1 1 75 75 GLU CA C 75 58.845 58.845 57.189 1.656 19806 279 1 . 1 1 75 75 GLU CB C 75 29.573 29.573 30.115 -0.542 19806 280 1 . 1 1 76 76 GLU N N 76 115.466 115.466 119.481 -4.015 19806 281 1 . 1 1 76 76 GLU HA H 76 4.308 4.308 4.434 -0.126 19806 282 1 . 1 1 76 76 GLU CA C 76 56.777 56.777 56.516 0.261 19806 283 1 . 1 1 76 76 GLU CB C 76 29.072 29.072 29.850 -0.778 19806 284 1 . 1 1 77 77 GLY N N 77 106.771 106.771 107.474 -0.703 19806 285 1 . 1 1 77 77 GLY CA C 77 45.014 45.014 44.994 0.020 19806 286 1 . 1 1 78 78 GLY N N 78 108.535 108.535 107.532 1.003 19806 287 1 . 1 1 78 78 GLY CA C 78 44.707 44.707 44.666 0.041 19806 288 1 . 1 1 79 79 ILE N N 79 121.066 121.066 121.515 -0.449 19806 289 1 . 1 1 79 79 ILE HA H 79 4.807 4.807 4.576 0.231 19806 290 1 . 1 1 79 79 ILE CA C 79 60.343 60.343 61.346 -1.003 19806 291 1 . 1 1 79 79 ILE CB C 79 39.220 39.220 38.039 1.181 19806 292 1 . 1 1 80 80 TYR N N 80 130.709 130.709 130.062 0.647 19806 293 1 . 1 1 80 80 TYR HA H 80 4.264 4.264 4.218 0.046 19806 294 1 . 1 1 80 80 TYR CA C 80 58.161 58.161 58.237 -0.076 19806 295 1 . 1 1 80 80 TYR CB C 80 40.621 40.621 38.799 1.822 19806 296 1 . 1 1 81 81 VAL N N 81 126.965 126.965 126.884 0.081 19806 297 1 . 1 1 81 81 VAL HA H 81 4.854 4.854 4.600 0.254 19806 298 1 . 1 1 81 81 VAL CA C 81 60.457 60.457 60.675 -0.218 19806 299 1 . 1 1 81 81 VAL CB C 81 35.004 35.004 35.275 -0.271 19806 300 1 . 1 1 82 82 SER N N 82 120.914 120.914 121.697 -0.783 19806 301 1 . 1 1 82 82 SER HA H 82 5.185 5.185 4.941 0.244 19806 302 1 . 1 1 82 82 SER CA C 82 55.260 55.260 57.338 -2.078 19806 303 1 . 1 1 82 82 SER CB C 82 64.785 64.785 63.874 0.911 19806 304 1 . 1 1 83 83 LYS N N 83 119.415 119.415 123.107 -3.692 19806 305 1 . 1 1 83 83 LYS HA H 83 4.778 4.778 4.695 0.083 19806 306 1 . 1 1 83 83 LYS CA C 83 54.759 54.759 54.647 0.112 19806 307 1 . 1 1 83 83 LYS CB C 83 35.514 35.514 36.085 -0.571 19806 308 1 . 1 1 84 84 PHE N N 84 119.220 119.220 118.297 0.923 19806 309 1 . 1 1 84 84 PHE HA H 84 5.441 5.441 5.100 0.341 19806 310 1 . 1 1 84 84 PHE CA C 84 58.414 58.414 57.638 0.776 19806 311 1 . 1 1 84 84 PHE CB C 84 37.523 37.523 39.082 -1.559 19806 312 1 . 1 1 85 85 THR N N 85 119.257 119.257 115.159 4.098 19806 313 1 . 1 1 85 85 THR HA H 85 4.057 4.057 4.265 -0.208 19806 314 1 . 1 1 85 85 THR CA C 85 62.660 62.660 62.809 -0.149 19806 315 1 . 1 1 85 85 THR CB C 85 67.698 67.698 69.461 -1.763 19806 316 1 . 1 1 86 86 LEU N N 86 121.612 121.612 122.370 -0.758 19806 317 1 . 1 1 86 86 LEU HA H 86 4.598 4.598 4.652 -0.054 19806 318 1 . 1 1 86 86 LEU CA C 86 55.245 55.245 54.768 0.477 19806 319 1 . 1 1 86 86 LEU CB C 86 44.657 44.657 44.677 -0.020 19806 320 1 . 1 1 87 87 ASN N N 87 127.684 127.684 121.674 6.010 19806 321 1 . 1 1 87 87 ASN HA H 87 5.011 5.011 4.725 0.286 19806 322 1 . 1 1 87 87 ASN CA C 87 51.299 51.299 52.596 -1.297 19806 323 1 . 1 1 87 87 ASN CB C 87 38.595 38.595 38.774 -0.179 19806 324 1 . 1 1 88 88 GLU N N 88 120.509 120.509 121.990 -1.481 19806 325 1 . 1 1 88 88 GLU HA H 88 4.857 4.857 4.672 0.185 19806 326 1 . 1 1 88 88 GLU CA C 88 54.382 54.382 54.351 0.031 19806 327 1 . 1 1 88 88 GLU CB C 88 29.808 29.808 30.553 -0.745 19806 328 1 . 1 1 89 89 PRO HA H 89 4.381 4.381 4.463 -0.081 19806 329 1 . 1 1 89 89 PRO CA C 89 65.898 65.898 65.021 0.877 19806 330 1 . 1 1 89 89 PRO CB C 89 32.351 32.351 32.229 0.123 19806 331 1 . 1 1 90 90 LYS N N 90 107.288 107.288 115.475 -8.187 19806 332 1 . 1 1 90 90 LYS HA H 90 4.684 4.684 4.586 0.098 19806 333 1 . 1 1 90 90 LYS CA C 90 54.979 54.979 55.710 -0.730 19806 334 1 . 1 1 90 90 LYS CB C 90 32.994 32.994 33.112 -0.118 19806 335 1 . 1 1 91 91 HIS N N 91 119.523 119.523 117.995 1.528 19806 336 1 . 1 1 91 91 HIS HA H 91 5.777 5.777 5.396 0.381 19806 337 1 . 1 1 91 91 HIS CA C 91 53.705 53.705 54.830 -1.125 19806 338 1 . 1 1 91 91 HIS CB C 91 32.194 32.194 32.355 -0.161 19806 339 1 . 1 1 92 92 LYS N N 92 122.527 122.527 125.560 -3.033 19806 340 1 . 1 1 92 92 LYS HA H 92 5.129 5.129 4.778 0.351 19806 341 1 . 1 1 92 92 LYS CA C 92 54.291 54.291 55.166 -0.875 19806 342 1 . 1 1 92 92 LYS CB C 92 37.479 37.479 35.855 1.624 19806 343 1 . 1 1 93 93 ILE N N 93 121.564 121.564 123.538 -1.974 19806 344 1 . 1 1 93 93 ILE HA H 93 5.310 5.310 4.548 0.761 19806 345 1 . 1 1 93 93 ILE CA C 93 61.137 61.137 60.377 0.760 19806 346 1 . 1 1 93 93 ILE CB C 93 41.088 41.088 40.284 0.804 19806 347 1 . 1 1 94 94 PHE N N 94 128.955 128.955 128.057 0.898 19806 348 1 . 1 1 94 94 PHE HA H 94 4.900 4.900 5.067 -0.167 19806 349 1 . 1 1 94 94 PHE CA C 94 55.843 55.843 56.044 -0.201 19806 350 1 . 1 1 95 95 GLU N N 95 124.809 124.809 126.223 -1.414 19806 351 1 . 1 1 95 95 GLU HA H 95 5.418 5.418 5.101 0.317 19806 352 1 . 1 1 95 95 GLU CA C 95 54.481 54.481 53.791 0.690 19806 353 1 . 1 1 95 95 GLU CB C 95 35.160 35.160 33.367 1.793 19806 354 1 . 1 1 96 96 ALA N N 96 123.759 123.759 123.506 0.253 19806 355 1 . 1 1 96 96 ALA HA H 96 5.379 5.379 5.012 0.367 19806 356 1 . 1 1 96 96 ALA CA C 96 49.541 49.541 50.492 -0.951 19806 357 1 . 1 1 96 96 ALA CB C 96 23.830 23.830 21.894 1.936 19806 358 1 . 1 1 97 97 GLY N N 97 106.592 106.592 108.458 -1.866 19806 359 1 . 1 1 97 97 GLY CA C 97 45.435 45.435 45.203 0.232 19806 360 1 . 1 1 98 98 TYR N N 98 119.250 119.250 119.656 -0.406 19806 361 1 . 1 1 98 98 TYR HA H 98 4.818 4.818 4.697 0.121 19806 362 1 . 1 1 98 98 TYR CA C 98 59.387 59.387 58.439 0.948 19806 363 1 . 1 1 98 98 TYR CB C 98 38.122 38.122 39.020 -0.898 19806 364 1 . 1 1 99 99 GLU N N 99 123.080 123.080 123.714 -0.634 19806 365 1 . 1 1 99 99 GLU HA H 99 4.009 4.009 4.085 -0.076 19806 366 1 . 1 1 99 99 GLU CA C 99 58.409 58.409 58.776 -0.367 19806 367 1 . 1 1 99 99 GLU CB C 99 30.254 30.254 29.987 0.267 19806 368 1 . 1 1 100 100 GLU N N 100 116.459 116.459 116.680 -0.221 19806 369 1 . 1 1 100 100 GLU HA H 100 4.036 4.036 4.505 -0.469 19806 370 1 . 1 1 100 100 GLU CA C 100 57.404 57.404 56.223 1.181 19806 371 1 . 1 1 100 100 GLU CB C 100 27.576 27.576 30.005 -2.429 19806 372 1 . 1 1 101 101 SER N N 101 113.069 113.069 115.288 -2.219 19806 373 1 . 1 1 101 101 SER HA H 101 4.839 4.839 4.626 0.213 19806 374 1 . 1 1 101 101 SER CA C 101 56.024 56.024 57.375 -1.351 19806 375 1 . 1 1 101 101 SER CB C 101 64.806 64.806 64.732 0.074 19806 376 1 . 1 1 102 102 GLU N N 102 120.439 120.439 121.038 -0.599 19806 377 1 . 1 1 102 102 GLU HA H 102 4.389 4.389 4.452 -0.063 19806 378 1 . 1 1 102 102 GLU CA C 102 55.804 55.804 55.992 -0.188 19806 379 1 . 1 1 102 102 GLU CB C 102 29.985 29.985 30.314 -0.329 19806 380 1 . 1 1 103 103 VAL N N 103 118.899 118.899 115.876 3.023 19806 381 1 . 1 1 103 103 VAL HA H 103 4.086 4.086 4.101 -0.015 19806 382 1 . 1 1 103 103 VAL CA C 103 62.699 62.699 61.990 0.709 19806 383 1 . 1 1 103 103 VAL CB C 103 32.261 32.261 32.781 -0.520 19806 384 1 . 1 1 104 104 ASP N N 104 120.965 120.965 120.055 0.910 19806 385 1 . 1 1 104 104 ASP HA H 104 5.003 5.003 4.972 0.031 19806 386 1 . 1 1 104 104 ASP CA C 104 54.914 54.914 54.676 0.238 19806 387 1 . 1 1 104 104 ASP CB C 104 42.791 42.791 43.988 -1.197 19806 388 1 . 1 1 105 105 LEU N N 105 120.365 120.365 119.217 1.148 19806 389 1 . 1 1 105 105 LEU HA H 105 5.295 5.295 5.076 0.219 19806 390 1 . 1 1 105 105 LEU CA C 105 54.431 54.431 54.806 -0.375 19806 391 1 . 1 1 105 105 LEU CB C 105 46.001 46.001 45.170 0.831 19806 392 1 . 1 1 106 106 ARG N N 106 126.289 126.289 125.091 1.198 19806 393 1 . 1 1 106 106 ARG HA H 106 5.825 5.825 5.219 0.606 19806 394 1 . 1 1 106 106 ARG CA C 106 54.672 54.672 54.533 0.139 19806 395 1 . 1 1 106 106 ARG CB C 106 33.920 33.920 33.987 -0.067 19806 396 1 . 1 1 107 107 VAL N N 107 126.145 126.145 121.158 4.987 19806 397 1 . 1 1 107 107 VAL HA H 107 4.679 4.679 4.545 0.134 19806 398 1 . 1 1 107 107 VAL CA C 107 61.671 61.671 60.516 1.155 19806 399 1 . 1 1 107 107 VAL CB C 107 35.350 35.350 35.513 -0.163 19806 400 1 . 1 1 108 108 GLU N N 108 127.093 127.093 123.106 3.987 19806 401 1 . 1 1 108 108 GLU HA H 108 5.267 5.267 4.917 0.350 19806 402 1 . 1 1 108 108 GLU CA C 108 54.761 54.761 54.795 -0.034 19806 403 1 . 1 1 108 108 GLU CB C 108 32.567 32.567 33.657 -1.090 19806 404 1 . 1 1 109 109 PHE N N 109 124.592 124.592 121.397 3.195 19806 405 1 . 1 1 109 109 PHE HA H 109 6.028 6.028 5.334 0.694 19806 406 1 . 1 1 109 109 PHE CA C 109 55.945 55.945 56.561 -0.616 19806 407 1 . 1 1 109 109 PHE CB C 109 43.099 43.099 41.997 1.102 19806 408 1 . 1 1 110 110 GLU N N 110 122.143 122.143 122.025 0.118 19806 409 1 . 1 1 110 110 GLU HA H 110 5.193 5.193 5.344 -0.151 19806 410 1 . 1 1 110 110 GLU CA C 110 55.443 55.443 54.502 0.940 19806 411 1 . 1 1 110 110 GLU CB C 110 35.816 35.816 34.163 1.653 19806 412 1 . 1 1 111 111 LEU N N 111 129.616 129.616 124.589 5.027 19806 413 1 . 1 1 111 111 LEU HA H 111 3.808 3.808 3.776 0.032 19806 414 1 . 1 1 111 111 LEU CA C 111 53.470 53.470 54.633 -1.163 19806 415 1 . 1 1 111 111 LEU CB C 111 40.400 40.400 41.881 -1.481 19806 416 1 . 1 1 112 112 GLN N N 112 124.742 124.742 124.125 0.617 19806 417 1 . 1 1 112 112 GLN HA H 112 4.439 4.439 4.312 0.127 19806 418 1 . 1 1 112 112 GLN CA C 112 55.802 55.802 54.529 1.273 19806 419 1 . 1 1 112 112 GLN CB C 112 28.753 28.753 29.869 -1.117 19806 420 1 . 1 1 113 113 ALA N N 113 121.195 121.195 124.010 -2.815 19806 421 1 . 1 1 113 113 ALA HA H 113 4.048 4.048 4.049 -0.001 19806 422 1 . 1 1 113 113 ALA CA C 113 54.518 54.518 53.909 0.609 19806 423 1 . 1 1 113 113 ALA CB C 113 18.199 18.199 18.567 -0.368 19806 424 1 . 1 1 114 114 ASP N N 114 114.525 114.525 117.097 -2.572 19806 425 1 . 1 1 114 114 ASP HA H 114 4.399 4.399 4.440 -0.041 19806 426 1 . 1 1 114 114 ASP CA C 114 52.908 52.908 54.503 -1.595 19806 427 1 . 1 1 114 114 ASP CB C 114 39.058 39.058 40.766 -1.708 19806 428 1 . 1 1 115 115 GLY N N 115 107.526 107.526 106.446 1.080 19806 429 1 . 1 1 115 115 GLY CA C 115 45.784 45.784 45.303 0.481 19806 430 1 . 1 1 116 116 LYS N N 116 118.818 118.818 119.696 -0.878 19806 431 1 . 1 1 116 116 LYS HA H 116 4.450 4.450 4.679 -0.229 19806 432 1 . 1 1 116 116 LYS CA C 116 54.171 54.171 54.679 -0.508 19806 433 1 . 1 1 116 116 LYS CB C 116 35.039 35.039 34.688 0.351 19806 434 1 . 1 1 117 117 TRP N N 117 118.939 118.939 122.679 -3.740 19806 435 1 . 1 1 117 117 TRP CA C 117 56.956 56.956 57.564 -0.608 19806 436 1 . 1 1 118 118 TYR N N 118 112.644 112.644 119.904 -7.260 19806 437 1 . 1 1 118 118 TYR HA H 118 5.277 5.277 4.899 0.378 19806 438 1 . 1 1 118 118 TYR CA C 118 56.219 56.219 56.883 -0.664 19806 439 1 . 1 1 118 118 TYR CB C 118 43.282 43.282 41.887 1.395 19806 440 1 . 1 1 119 119 VAL N N 119 119.842 119.842 122.295 -2.453 19806 441 1 . 1 1 119 119 VAL HA H 119 4.515 4.515 4.408 0.107 19806 442 1 . 1 1 119 119 VAL CA C 119 62.442 62.442 63.283 -0.841 19806 443 1 . 1 1 120 120 VAL N N 120 114.552 114.552 116.724 -2.172 19806 444 1 . 1 1 120 120 VAL HA H 120 4.738 4.738 4.507 0.231 19806 445 1 . 1 1 120 120 VAL CA C 120 59.595 59.595 60.679 -1.084 19806 446 1 . 1 1 120 120 VAL CB C 120 32.852 32.852 33.052 -0.200 19806 447 1 . 1 1 121 121 ASP N N 121 118.234 118.234 119.549 -1.315 19806 448 1 . 1 1 121 121 ASP HA H 121 5.263 5.263 4.883 0.379 19806 449 1 . 1 1 121 121 ASP CA C 121 53.663 53.663 53.974 -0.311 19806 450 1 . 1 1 121 121 ASP CB C 121 43.887 43.887 44.531 -0.644 19806 451 1 . 1 1 122 122 CYS N N 122 121.036 121.036 123.515 -2.479 19806 452 1 . 1 1 122 122 CYS HA H 122 5.571 5.571 4.776 0.795 19806 453 1 . 1 1 122 122 CYS CA C 122 57.052 57.052 58.012 -0.960 19806 454 1 . 1 1 122 122 CYS CB C 122 30.834 30.834 28.183 2.651 19806 455 1 . 1 1 123 123 TYR N N 123 127.672 127.672 126.560 1.112 19806 456 1 . 1 1 123 123 TYR HA H 123 5.010 5.010 4.780 0.230 19806 457 1 . 1 1 123 123 TYR CA C 123 57.169 57.169 58.342 -1.173 19806 458 1 . 1 1 123 123 TYR CB C 123 41.408 41.408 41.527 -0.119 19806 459 1 . 1 1 124 124 THR N N 124 120.833 120.833 119.449 1.384 19806 460 1 . 1 1 124 124 THR HA H 124 4.987 4.987 4.767 0.221 19806 461 1 . 1 1 124 124 THR CA C 124 57.153 57.153 60.219 -3.066 19806 462 1 . 1 1 124 124 THR CB C 124 68.607 68.607 70.893 -2.286 19806 463 1 . 1 1 125 125 GLY N N 125 114.347 114.347 111.881 2.466 19806 464 1 . 1 1 125 125 GLY CA C 125 46.328 46.328 46.453 -0.125 19806 465 1 . 1 1 126 126 TRP N N 126 119.918 119.918 121.805 -1.887 19806 466 1 . 1 1 126 126 TRP HA H 126 4.070 4.070 4.058 0.013 19806 467 1 . 1 1 126 126 TRP CA C 126 60.564 60.564 59.012 1.552 19806 468 1 . 1 1 126 126 TRP CB C 126 29.639 29.639 29.353 0.286 19806 469 1 . 1 1 127 127 TYR N N 127 113.911 113.911 114.066 -0.155 19806 470 1 . 1 1 127 127 TYR HA H 127 4.994 4.994 4.721 0.273 19806 471 1 . 1 1 127 127 TYR CA C 127 53.384 53.384 57.110 -3.726 19806 472 1 . 1 1 127 127 TYR CB C 127 38.584 38.584 37.981 0.603 19806 473 1 . 1 1 128 128 GLY N N 128 105.181 105.181 107.750 -2.569 19806 474 1 . 1 1 128 128 GLY CA C 128 45.189 45.189 44.245 0.944 19806 475 1 . 1 1 129 129 TYR N N 129 116.588 116.588 119.761 -3.173 19806 476 1 . 1 1 129 129 TYR HA H 129 4.664 4.664 4.520 0.144 19806 477 1 . 1 1 129 129 TYR CA C 129 59.565 59.565 58.494 1.071 19806 478 1 . 1 1 129 129 TYR CB C 129 38.853 38.853 36.833 2.020 19806 479 1 . 1 1 130 130 ASP N N 130 115.195 115.195 119.684 -4.489 19806 480 1 . 1 1 130 130 ASP HA H 130 4.385 4.385 4.706 -0.321 19806 481 1 . 1 1 130 130 ASP CA C 130 53.130 53.130 54.814 -1.684 19806 482 1 . 1 1 130 130 ASP CB C 130 38.685 38.685 42.298 -3.612 19806 483 1 . 1 1 131 131 LEU N N 131 124.887 124.887 121.699 3.188 19806 484 1 . 1 1 131 131 LEU HA H 131 4.481 4.481 4.864 -0.383 19806 485 1 . 1 1 131 131 LEU CA C 131 53.605 53.605 52.202 1.403 19806 486 1 . 1 1 131 131 LEU CB C 131 42.441 42.441 43.258 -0.817 19806 487 1 . 1 1 132 132 PRO HA H 132 4.683 4.683 4.757 -0.074 19806 488 1 . 1 1 132 132 PRO CA C 132 127.065 127.065 61.708 65.357 19806 489 1 . 1 1 132 132 PRO CB C 132 32.327 32.327 33.186 -0.859 19806 490 1 . 1 1 133 133 ILE N N 133 123.765 123.765 119.957 3.808 19806 491 1 . 1 1 133 133 ILE HA H 133 3.729 3.729 3.721 0.008 19806 492 1 . 1 1 133 133 ILE CA C 133 64.860 64.860 63.351 1.509 19806 493 1 . 1 1 133 133 ILE CB C 133 38.063 38.063 38.152 -0.089 19806 494 1 . 1 1 134 134 GLY N N 134 107.030 107.030 106.556 0.474 19806 495 1 . 1 1 134 134 GLY CA C 134 45.976 45.976 45.818 0.158 19806 496 1 . 1 1 135 135 GLU N N 135 116.566 116.566 121.390 -4.824 19806 497 1 . 1 1 135 135 GLU HA H 135 4.664 4.664 4.310 0.354 19806 498 1 . 1 1 135 135 GLU CA C 135 55.414 55.414 56.947 -1.533 19806 499 1 . 1 1 135 135 GLU CB C 135 30.195 30.195 29.285 0.910 19806 500 1 . 1 1 136 136 LEU N N 136 124.239 124.239 122.106 2.133 19806 501 1 . 1 1 136 136 LEU HA H 136 4.044 4.044 3.904 0.140 19806 502 1 . 1 1 136 136 LEU CA C 136 59.116 59.116 58.438 0.678 19806 503 1 . 1 1 136 136 LEU CB C 136 41.007 41.007 41.595 -0.588 19806 504 1 . 1 1 137 137 LYS N N 137 117.225 117.225 116.934 0.291 19806 505 1 . 1 1 137 137 LYS HA H 137 3.863 3.863 3.806 0.057 19806 506 1 . 1 1 137 137 LYS CA C 137 60.455 60.455 59.506 0.949 19806 507 1 . 1 1 137 137 LYS CB C 137 31.203 31.203 31.551 -0.348 19806 508 1 . 1 1 138 138 GLN N N 138 118.718 118.718 118.841 -0.123 19806 509 1 . 1 1 138 138 GLN HA H 138 4.052 4.052 4.102 -0.050 19806 510 1 . 1 1 138 138 GLN CA C 138 57.875 57.875 58.618 -0.743 19806 511 1 . 1 1 138 138 GLN CB C 138 28.235 28.235 28.016 0.219 19806 512 1 . 1 1 139 139 THR N N 139 117.970 117.970 116.946 1.024 19806 513 1 . 1 1 139 139 THR HA H 139 4.532 4.532 3.955 0.577 19806 514 1 . 1 1 139 139 THR CA C 139 68.145 68.145 66.822 1.323 19806 515 1 . 1 1 139 139 THR CB C 139 68.103 68.103 68.340 -0.237 19806 516 1 . 1 1 140 140 ILE N N 140 120.391 120.391 121.767 -1.376 19806 517 1 . 1 1 140 140 ILE HA H 140 3.727 3.727 3.842 -0.115 19806 518 1 . 1 1 140 140 ILE CA C 140 65.256 65.256 64.705 0.550 19806 519 1 . 1 1 140 140 ILE CB C 140 38.113 38.113 37.490 0.623 19806 520 1 . 1 1 141 141 GLN N N 141 118.917 118.917 118.618 0.299 19806 521 1 . 1 1 141 141 GLN HA H 141 4.015 4.015 3.924 0.091 19806 522 1 . 1 1 141 141 GLN CA C 141 58.371 58.371 58.903 -0.532 19806 523 1 . 1 1 141 141 GLN CB C 141 27.347 27.347 28.231 -0.884 19806 524 1 . 1 1 142 142 ASN N N 142 119.936 119.936 118.077 1.859 19806 525 1 . 1 1 142 142 ASN HA H 142 4.515 4.515 4.560 -0.045 19806 526 1 . 1 1 142 142 ASN CA C 142 55.799 55.799 55.814 -0.015 19806 527 1 . 1 1 142 142 ASN CB C 142 37.630 37.630 38.307 -0.677 19806 528 1 . 1 1 143 143 VAL N N 143 123.195 123.195 119.725 3.470 19806 529 1 . 1 1 143 143 VAL HA H 143 2.716 2.716 3.245 -0.529 19806 530 1 . 1 1 143 143 VAL CA C 143 66.497 66.497 66.118 0.380 19806 531 1 . 1 1 143 143 VAL CB C 143 30.989 30.989 30.947 0.042 19806 532 1 . 1 1 144 144 LYS N N 144 120.348 120.348 118.545 1.803 19806 533 1 . 1 1 144 144 LYS HA H 144 3.881 3.881 4.019 -0.139 19806 534 1 . 1 1 144 144 LYS CA C 144 60.123 60.123 59.627 0.496 19806 535 1 . 1 1 144 144 LYS CB C 144 31.882 31.882 32.136 -0.254 19806 536 1 . 1 1 145 145 GLU N N 145 119.220 119.220 119.045 0.175 19806 537 1 . 1 1 145 145 GLU HA H 145 4.183 4.183 4.108 0.075 19806 538 1 . 1 1 145 145 GLU CA C 145 59.178 59.178 59.133 0.045 19806 539 1 . 1 1 145 145 GLU CB C 145 29.071 29.071 29.614 -0.543 19806 540 1 . 1 1 146 146 GLU N N 146 121.420 121.420 119.900 1.520 19806 541 1 . 1 1 146 146 GLU HA H 146 4.277 4.277 4.086 0.191 19806 542 1 . 1 1 146 146 GLU CA C 146 59.118 59.118 59.360 -0.242 19806 543 1 . 1 1 146 146 GLU CB C 146 28.342 28.342 29.468 -1.126 19806 544 1 . 1 1 147 147 ASN N N 147 119.197 119.197 117.458 1.739 19806 545 1 . 1 1 147 147 ASN HA H 147 4.568 4.568 4.599 -0.031 19806 546 1 . 1 1 147 147 ASN CA C 147 54.151 54.151 55.733 -1.582 19806 547 1 . 1 1 147 147 ASN CB C 147 37.373 37.373 37.956 -0.583 19806 548 1 . 1 1 148 148 ALA N N 148 123.672 123.672 122.327 1.345 19806 549 1 . 1 1 148 148 ALA HA H 148 4.123 4.123 4.298 -0.175 19806 550 1 . 1 1 148 148 ALA CA C 148 55.133 55.133 54.585 0.548 19806 551 1 . 1 1 148 148 ALA CB C 148 17.607 17.607 18.361 -0.754 19806 552 1 . 1 1 149 149 ALA N N 149 119.979 119.979 121.774 -1.795 19806 553 1 . 1 1 149 149 ALA HA H 149 4.261 4.261 4.110 0.151 19806 554 1 . 1 1 149 149 ALA CA C 149 54.645 54.645 54.607 0.038 19806 555 1 . 1 1 149 149 ALA CB C 149 17.738 17.738 18.560 -0.822 19806 556 1 . 1 1 150 150 PHE N N 150 119.592 119.592 119.872 -0.280 19806 557 1 . 1 1 150 150 PHE HA H 150 4.224 4.224 4.132 0.092 19806 558 1 . 1 1 150 150 PHE CA C 150 61.008 61.008 61.455 -0.447 19806 559 1 . 1 1 150 150 PHE CB C 150 39.062 39.062 39.404 -0.342 19806 560 1 . 1 1 151 151 LYS N N 151 116.869 116.869 118.333 -1.464 19806 561 1 . 1 1 151 151 LYS HA H 151 3.906 3.906 4.232 -0.326 19806 562 1 . 1 1 151 151 LYS CA C 151 58.770 58.770 58.611 0.159 19806 563 1 . 1 1 151 151 LYS CB C 151 32.741 32.741 32.062 0.679 19806 564 1 . 1 1 152 152 GLU N N 152 115.868 115.868 119.473 -3.605 19806 565 1 . 1 1 152 152 GLU HA H 152 4.053 4.053 4.132 -0.079 19806 566 1 . 1 1 152 152 GLU CA C 152 58.656 58.656 58.647 0.009 19806 567 1 . 1 1 152 152 GLU CB C 152 29.753 29.753 29.943 -0.190 19806 568 1 . 1 1 153 153 ILE N N 153 110.437 110.437 117.499 -7.062 19806 569 1 . 1 1 153 153 ILE HA H 153 4.176 4.176 3.906 0.270 19806 570 1 . 1 1 153 153 ILE CA C 153 61.034 61.034 62.603 -1.569 19806 571 1 . 1 1 153 153 ILE CB C 153 39.272 39.272 39.330 -0.058 19806 572 1 . 1 1 154 154 HIS N N 154 117.779 117.779 116.452 1.327 19806 573 1 . 1 1 154 154 HIS HA H 154 5.174 5.174 4.984 0.190 19806 574 1 . 1 1 154 154 HIS CA C 154 51.616 51.616 52.565 -0.949 19806 575 1 . 1 1 154 154 HIS CB C 154 28.547 28.547 29.730 -1.183 19806 stop_ save_