data_25767 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25767 _Entry.PDB_ID 2N6K 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 25767 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 ALA N N 2 122.811 122.811 123.053 -0.242 25767 2 1 1 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.152 -0.129 25767 3 1 1 . 1 1 2 2 ALA C C 2 179.915 179.915 179.474 0.441 25767 4 1 1 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.526 -0.409 25767 5 1 1 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.470 0.069 25767 6 1 1 . 1 1 2 2 ALA H H 2 8.509 8.509 8.415 0.094 25767 7 1 1 . 1 1 3 3 SER N N 3 115.308 115.308 114.060 1.248 25767 8 1 1 . 1 1 3 3 SER HA H 3 4.097 4.097 4.056 0.042 25767 9 1 1 . 1 1 3 3 SER C C 3 176.706 176.706 176.347 0.359 25767 10 1 1 . 1 1 3 3 SER CA C 3 60.665 60.665 61.357 -0.692 25767 11 1 1 . 1 1 3 3 SER CB C 3 62.710 62.710 62.417 0.293 25767 12 1 1 . 1 1 3 3 SER H H 3 7.996 7.996 8.554 -0.558 25767 13 1 1 . 1 1 4 4 ASN N N 4 122.688 122.688 121.311 1.377 25767 14 1 1 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.378 -0.074 25767 15 1 1 . 1 1 4 4 ASN C C 4 176.258 176.258 177.061 -0.803 25767 16 1 1 . 1 1 4 4 ASN CA C 4 55.701 55.701 55.922 -0.221 25767 17 1 1 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.618 0.559 25767 18 1 1 . 1 1 4 4 ASN H H 4 8.075 8.075 8.092 -0.017 25767 19 1 1 . 1 1 5 5 ALA N N 5 121.900 121.900 121.842 0.058 25767 20 1 1 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.109 -0.534 25767 21 1 1 . 1 1 5 5 ALA C C 5 178.475 178.475 179.352 -0.877 25767 22 1 1 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.962 0.871 25767 23 1 1 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.128 -0.513 25767 24 1 1 . 1 1 5 5 ALA H H 5 8.659 8.659 7.681 0.978 25767 25 1 1 . 1 1 6 6 ALA N N 6 117.768 117.768 121.668 -3.900 25767 26 1 1 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.974 -0.187 25767 27 1 1 . 1 1 6 6 ALA C C 6 180.494 180.494 179.449 1.045 25767 28 1 1 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.076 0.274 25767 29 1 1 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.208 -0.306 25767 30 1 1 . 1 1 6 6 ALA H H 6 7.864 7.864 7.757 0.107 25767 31 1 1 . 1 1 7 7 ARG N N 7 121.173 121.173 118.874 2.299 25767 32 1 1 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.098 -0.195 25767 33 1 1 . 1 1 7 7 ARG C C 7 179.189 179.189 178.527 0.662 25767 34 1 1 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.234 1.078 25767 35 1 1 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.716 -0.494 25767 36 1 1 . 1 1 7 7 ARG H H 7 7.514 7.514 7.922 -0.408 25767 37 1 1 . 1 1 8 8 VAL N N 8 122.979 122.979 120.365 2.614 25767 38 1 1 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.687 -0.434 25767 39 1 1 . 1 1 8 8 VAL C C 8 177.821 177.821 177.783 0.038 25767 40 1 1 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.981 0.791 25767 41 1 1 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.421 0.021 25767 42 1 1 . 1 1 8 8 VAL H H 8 8.101 8.101 7.726 0.375 25767 43 1 1 . 1 1 9 9 VAL N N 9 119.801 119.801 120.101 -0.300 25767 44 1 1 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.553 -0.287 25767 45 1 1 . 1 1 9 9 VAL C C 9 177.373 177.373 177.847 -0.474 25767 46 1 1 . 1 1 9 9 VAL CA C 9 67.484 67.484 67.113 0.371 25767 47 1 1 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.826 0.799 25767 48 1 1 . 1 1 9 9 VAL H H 9 8.362 8.362 7.983 0.379 25767 49 1 1 . 1 1 10 10 ALA N N 10 122.360 122.360 121.802 0.558 25767 50 1 1 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.057 -0.121 25767 51 1 1 . 1 1 10 10 ALA C C 10 180.762 180.762 179.664 1.098 25767 52 1 1 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.416 0.028 25767 53 1 1 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.258 -0.521 25767 54 1 1 . 1 1 10 10 ALA H H 10 7.776 7.776 7.824 -0.048 25767 55 1 1 . 1 1 11 11 THR N N 11 117.376 117.376 114.325 3.051 25767 56 1 1 . 1 1 11 11 THR HA H 11 3.816 3.816 4.089 -0.273 25767 57 1 1 . 1 1 11 11 THR C C 11 175.775 175.775 176.413 -0.638 25767 58 1 1 . 1 1 11 11 THR CA C 11 66.509 66.509 66.271 0.238 25767 59 1 1 . 1 1 11 11 THR CB C 11 68.588 68.588 68.812 -0.224 25767 60 1 1 . 1 1 11 11 THR H H 11 8.180 8.180 8.239 -0.059 25767 61 1 1 . 1 1 12 12 ALA N N 12 125.308 125.308 124.223 1.085 25767 62 1 1 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.785 0.212 25767 63 1 1 . 1 1 12 12 ALA C C 12 179.399 179.399 179.250 0.149 25767 64 1 1 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.545 0.531 25767 65 1 1 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.242 1.002 25767 66 1 1 . 1 1 12 12 ALA H H 12 8.671 8.671 8.648 0.023 25767 67 1 1 . 1 1 13 13 LYS N N 13 116.977 116.977 118.478 -1.501 25767 68 1 1 . 1 1 13 13 LYS C C 13 179.646 179.646 178.743 0.903 25767 69 1 1 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.799 -0.878 25767 70 1 1 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.179 -0.736 25767 71 1 1 . 1 1 13 13 LYS H H 13 8.061 8.061 7.780 0.281 25767 72 1 1 . 1 1 14 14 ASP N N 14 121.988 121.988 120.196 1.792 25767 73 1 1 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.471 -0.118 25767 74 1 1 . 1 1 14 14 ASP C C 14 179.446 179.446 178.709 0.737 25767 75 1 1 . 1 1 14 14 ASP CA C 14 57.509 57.509 57.071 0.438 25767 76 1 1 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.641 -0.639 25767 77 1 1 . 1 1 14 14 ASP H H 14 7.669 7.669 7.706 -0.037 25767 78 1 1 . 1 1 15 15 PHE N N 15 119.588 119.588 118.126 1.462 25767 79 1 1 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.215 0.129 25767 80 1 1 . 1 1 15 15 PHE C C 15 178.373 178.373 178.108 0.265 25767 81 1 1 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.351 0.886 25767 82 1 1 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.701 -1.205 25767 83 1 1 . 1 1 15 15 PHE H H 15 7.913 7.913 8.371 -0.458 25767 84 1 1 . 1 1 16 16 ASP N N 16 121.705 121.705 119.990 1.715 25767 85 1 1 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.446 -0.451 25767 86 1 1 . 1 1 16 16 ASP C C 16 180.071 180.071 178.944 1.127 25767 87 1 1 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.067 1.082 25767 88 1 1 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.413 1.074 25767 89 1 1 . 1 1 16 16 ASP H H 16 8.324 8.324 8.166 0.158 25767 90 1 1 . 1 1 17 17 LYS N N 17 118.825 118.825 119.598 -0.773 25767 91 1 1 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.085 -0.048 25767 92 1 1 . 1 1 17 17 LYS C C 17 178.407 178.407 177.932 0.475 25767 93 1 1 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.881 0.180 25767 94 1 1 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.555 0.029 25767 95 1 1 . 1 1 17 17 LYS H H 17 7.834 7.834 7.781 0.053 25767 96 1 1 . 1 1 18 18 VAL N N 18 110.562 110.562 117.164 -6.602 25767 97 1 1 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.017 0.499 25767 98 1 1 . 1 1 18 18 VAL C C 18 176.144 176.144 176.426 -0.282 25767 99 1 1 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.020 -2.146 25767 100 1 1 . 1 1 18 18 VAL CB C 18 31.160 31.160 32.012 -0.852 25767 101 1 1 . 1 1 18 18 VAL H H 18 7.185 7.185 7.531 -0.346 25767 102 1 1 . 1 1 19 19 GLY N N 19 109.272 109.272 107.150 2.122 25767 103 1 1 . 1 1 19 19 GLY C C 19 175.043 175.043 174.820 0.223 25767 104 1 1 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.252 0.579 25767 105 1 1 . 1 1 19 19 GLY H H 19 7.723 7.723 7.589 0.134 25767 106 1 1 . 1 1 20 20 LEU N N 20 125.428 125.428 121.571 3.857 25767 107 1 1 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.554 -0.234 25767 108 1 1 . 1 1 20 20 LEU C C 20 177.949 177.949 177.408 0.541 25767 109 1 1 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.379 -0.575 25767 110 1 1 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.509 0.408 25767 111 1 1 . 1 1 20 20 LEU H H 20 8.083 8.083 7.954 0.129 25767 112 1 1 . 1 1 21 21 GLY N N 21 107.804 107.804 110.118 -2.314 25767 113 1 1 . 1 1 21 21 GLY C C 21 176.278 176.278 176.148 0.130 25767 114 1 1 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.578 -0.284 25767 115 1 1 . 1 1 21 21 GLY H H 21 7.982 7.982 7.931 0.051 25767 116 1 1 . 1 1 22 22 ILE N N 22 121.319 121.319 121.669 -0.350 25767 117 1 1 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.799 0.111 25767 118 1 1 . 1 1 22 22 ILE C C 22 176.604 176.604 177.621 -1.017 25767 119 1 1 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.090 -1.644 25767 120 1 1 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.500 -0.934 25767 121 1 1 . 1 1 22 22 ILE H H 22 8.478 8.478 7.873 0.605 25767 122 1 1 . 1 1 23 23 ILE N N 23 120.377 120.377 119.647 0.730 25767 123 1 1 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.887 -0.174 25767 124 1 1 . 1 1 23 23 ILE C C 23 178.581 178.581 178.384 0.197 25767 125 1 1 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.133 1.113 25767 126 1 1 . 1 1 23 23 ILE CB C 23 36.199 36.199 36.219 -0.020 25767 127 1 1 . 1 1 23 23 ILE H H 23 6.869 6.869 7.738 -0.869 25767 128 1 1 . 1 1 24 24 GLY N N 24 103.449 103.449 109.118 -5.669 25767 129 1 1 . 1 1 24 24 GLY C C 24 175.308 175.308 175.589 -0.281 25767 130 1 1 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.342 0.601 25767 131 1 1 . 1 1 24 24 GLY H H 24 7.488 7.488 8.022 -0.534 25767 132 1 1 . 1 1 25 25 TYR N N 25 124.685 124.685 124.142 0.543 25767 133 1 1 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.563 0.103 25767 134 1 1 . 1 1 25 25 TYR C C 25 176.208 176.208 177.296 -1.088 25767 135 1 1 . 1 1 25 25 TYR CA C 25 61.371 61.371 60.992 0.379 25767 136 1 1 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.575 -0.308 25767 137 1 1 . 1 1 25 25 TYR H H 25 7.931 7.931 8.160 -0.229 25767 138 1 1 . 1 1 26 26 TYR N N 26 117.001 117.001 119.892 -2.891 25767 139 1 1 . 1 1 26 26 TYR HA H 26 3.941 3.941 4.014 -0.073 25767 140 1 1 . 1 1 26 26 TYR C C 26 178.753 178.753 177.483 1.270 25767 141 1 1 . 1 1 26 26 TYR CA C 26 64.260 64.260 61.871 2.389 25767 142 1 1 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.902 -1.381 25767 143 1 1 . 1 1 26 26 TYR H H 26 7.693 7.693 7.961 -0.268 25767 144 1 1 . 1 1 27 27 LEU N N 27 118.657 118.657 118.753 -0.096 25767 145 1 1 . 1 1 27 27 LEU HA H 27 4.311 4.311 3.988 0.323 25767 146 1 1 . 1 1 27 27 LEU CA C 27 58.297 58.297 58.072 0.225 25767 147 1 1 . 1 1 27 27 LEU CB C 27 42.723 42.723 41.095 1.628 25767 148 1 1 . 1 1 27 27 LEU H H 27 8.339 8.339 8.725 -0.386 25767 149 1 1 . 1 1 28 28 GLN N N 28 118.593 118.593 118.972 -0.379 25767 150 1 1 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.838 -0.187 25767 151 1 1 . 1 1 28 28 GLN C C 28 177.282 177.282 178.564 -1.282 25767 152 1 1 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.812 0.017 25767 153 1 1 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.326 1.322 25767 154 1 1 . 1 1 28 28 GLN H H 28 7.970 7.970 8.066 -0.096 25767 155 1 1 . 1 1 29 29 LEU N N 29 122.111 122.111 119.712 2.399 25767 156 1 1 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.696 0.248 25767 157 1 1 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.581 1.085 25767 158 1 1 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.299 0.709 25767 159 1 1 . 1 1 29 29 LEU H H 29 7.979 7.979 7.395 0.584 25767 160 1 1 . 1 1 30 30 TYR N N 30 119.283 119.283 120.011 -0.728 25767 161 1 1 . 1 1 30 30 TYR C C 30 175.775 175.775 177.191 -1.416 25767 162 1 1 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.710 -1.616 25767 163 1 1 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.281 0.792 25767 164 1 1 . 1 1 30 30 TYR H H 30 8.093 8.093 7.521 0.572 25767 165 1 1 . 1 1 31 31 ALA N N 31 121.327 121.327 121.933 -0.606 25767 166 1 1 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.855 -0.487 25767 167 1 1 . 1 1 31 31 ALA C C 31 178.955 178.955 179.104 -0.149 25767 168 1 1 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.153 0.394 25767 169 1 1 . 1 1 31 31 ALA CB C 31 17.963 17.963 17.816 0.147 25767 170 1 1 . 1 1 31 31 ALA H H 31 8.394 8.394 8.031 0.363 25767 171 1 1 . 1 1 32 32 VAL N N 32 116.757 116.757 118.577 -1.820 25767 172 1 1 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.474 -0.214 25767 173 1 1 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.805 1.857 25767 174 1 1 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.742 -0.771 25767 175 1 1 . 1 1 32 32 VAL H H 32 8.020 8.020 7.575 0.445 25767 176 1 1 . 1 1 33 33 GLU N N 33 118.775 118.775 119.652 -0.877 25767 177 1 1 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.799 0.190 25767 178 1 1 . 1 1 33 33 GLU C C 33 179.746 179.746 178.875 0.871 25767 179 1 1 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.436 0.567 25767 180 1 1 . 1 1 33 33 GLU H H 33 7.358 7.358 7.564 -0.206 25767 181 1 1 . 1 1 34 34 LEU N N 34 120.632 120.632 120.810 -0.178 25767 182 1 1 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.788 -0.139 25767 183 1 1 . 1 1 34 34 LEU C C 34 180.336 180.336 178.068 2.268 25767 184 1 1 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.613 0.062 25767 185 1 1 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.689 -0.101 25767 186 1 1 . 1 1 34 34 LEU H H 34 8.390 8.390 7.669 0.721 25767 187 1 1 . 1 1 35 35 ILE N N 35 121.240 121.240 118.930 2.310 25767 188 1 1 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.774 -0.232 25767 189 1 1 . 1 1 35 35 ILE C C 35 178.604 178.604 178.979 -0.375 25767 190 1 1 . 1 1 35 35 ILE CA C 35 65.547 65.547 65.062 0.485 25767 191 1 1 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.855 0.876 25767 192 1 1 . 1 1 35 35 ILE H H 35 8.129 8.129 7.599 0.530 25767 193 1 1 . 1 1 36 36 LEU N N 36 115.637 115.637 119.068 -3.431 25767 194 1 1 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.042 -0.034 25767 195 1 1 . 1 1 36 36 LEU C C 36 178.001 178.001 178.167 -0.166 25767 196 1 1 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.072 -0.995 25767 197 1 1 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.335 -1.401 25767 198 1 1 . 1 1 36 36 LEU H H 36 8.416 8.416 7.832 0.584 25767 199 1 1 . 1 1 37 37 SER N N 37 114.106 114.106 110.181 3.925 25767 200 1 1 . 1 1 37 37 SER HA H 37 3.991 3.991 4.404 -0.413 25767 201 1 1 . 1 1 37 37 SER C C 37 173.997 173.997 173.897 0.100 25767 202 1 1 . 1 1 37 37 SER CA C 37 60.311 60.311 58.905 1.406 25767 203 1 1 . 1 1 37 37 SER CB C 37 63.746 63.746 63.410 0.336 25767 204 1 1 . 1 1 37 37 SER H H 37 7.517 7.517 7.672 -0.155 25767 205 1 1 . 1 1 38 38 GLU N N 38 123.003 123.003 121.377 1.626 25767 206 1 1 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.356 0.013 25767 207 1 1 . 1 1 38 38 GLU C C 38 175.780 175.780 175.574 0.206 25767 208 1 1 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.549 -0.184 25767 209 1 1 . 1 1 38 38 GLU CB C 38 30.293 30.293 31.067 -0.774 25767 210 1 1 . 1 1 38 38 GLU H H 38 7.151 7.151 7.398 -0.247 25767 211 1 1 . 1 1 39 39 GLU N N 39 126.166 126.166 123.507 2.659 25767 212 1 1 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.107 -0.099 25767 213 1 1 . 1 1 39 39 GLU C C 39 176.652 176.652 175.778 0.874 25767 214 1 1 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.228 1.970 25767 215 1 1 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.265 -0.230 25767 216 1 1 . 1 1 39 39 GLU H H 39 8.587 8.587 8.414 0.173 25767 217 1 1 . 1 1 40 40 ASP N N 40 120.047 120.047 122.160 -2.113 25767 218 1 1 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.445 0.105 25767 219 1 1 . 1 1 40 40 ASP C C 40 175.035 175.035 175.844 -0.809 25767 220 1 1 . 1 1 40 40 ASP CA C 40 53.368 53.368 54.979 -1.611 25767 221 1 1 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.921 -0.898 25767 222 1 1 . 1 1 40 40 ASP H H 40 8.504 8.504 8.505 -0.001 25767 223 1 1 . 1 1 41 41 ARG N N 41 120.671 120.671 124.767 -4.096 25767 224 1 1 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.566 -0.177 25767 225 1 1 . 1 1 41 41 ARG C C 41 175.755 175.755 175.603 0.152 25767 226 1 1 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.505 0.503 25767 227 1 1 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.105 -0.556 25767 228 1 1 . 1 1 41 41 ARG H H 41 7.672 7.672 8.112 -0.440 25767 229 1 1 . 1 1 42 42 SER N N 42 120.330 120.330 116.486 3.844 25767 230 1 1 . 1 1 42 42 SER HA H 42 3.837 3.837 4.353 -0.516 25767 231 1 1 . 1 1 42 42 SER CA C 42 57.326 57.326 58.614 -1.288 25767 232 1 1 . 1 1 42 42 SER CB C 42 65.762 65.762 63.673 2.089 25767 233 1 1 . 1 1 42 42 SER H H 42 8.544 8.544 8.348 0.196 25767 234 1 1 . 1 1 43 43 GLN HA H 43 3.989 3.989 3.942 0.047 25767 235 1 1 . 1 1 43 43 GLN C C 43 178.907 178.907 178.153 0.754 25767 236 1 1 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.897 0.473 25767 237 1 1 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.570 -0.608 25767 238 1 1 . 1 1 44 44 GLU N N 44 120.328 120.328 119.837 0.491 25767 239 1 1 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.932 0.081 25767 240 1 1 . 1 1 44 44 GLU C C 44 179.824 179.824 178.499 1.325 25767 241 1 1 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.538 0.507 25767 242 1 1 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.225 -0.577 25767 243 1 1 . 1 1 44 44 GLU H H 44 8.938 8.938 8.557 0.381 25767 244 1 1 . 1 1 45 45 MET N N 45 121.030 121.030 117.391 3.639 25767 245 1 1 . 1 1 45 45 MET HA H 45 4.412 4.412 4.242 0.170 25767 246 1 1 . 1 1 45 45 MET C C 45 180.357 180.357 178.115 2.242 25767 247 1 1 . 1 1 45 45 MET CA C 45 57.209 57.209 57.836 -0.627 25767 248 1 1 . 1 1 45 45 MET CB C 45 32.436 32.436 31.834 0.602 25767 249 1 1 . 1 1 45 45 MET H H 45 7.756 7.756 7.911 -0.155 25767 250 1 1 . 1 1 46 46 THR N N 46 120.008 120.008 113.699 6.309 25767 251 1 1 . 1 1 46 46 THR HA H 46 4.071 4.071 3.989 0.082 25767 252 1 1 . 1 1 46 46 THR CA C 46 67.096 67.096 66.217 0.879 25767 253 1 1 . 1 1 46 46 THR CB C 46 68.954 68.954 68.312 0.642 25767 254 1 1 . 1 1 46 46 THR H H 46 8.187 8.187 7.672 0.515 25767 255 1 1 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.116 -0.007 25767 256 1 1 . 1 1 47 47 ALA C C 47 180.118 180.118 179.585 0.533 25767 257 1 1 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.965 0.374 25767 258 1 1 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.240 -0.408 25767 259 1 1 . 1 1 47 47 ALA H H 47 8.238 8.238 7.735 0.503 25767 260 1 1 . 1 1 48 48 LEU N N 48 122.093 122.093 119.168 2.925 25767 261 1 1 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.030 0.233 25767 262 1 1 . 1 1 48 48 LEU C C 48 179.103 179.103 179.325 -0.222 25767 263 1 1 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.424 0.316 25767 264 1 1 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.476 -0.680 25767 265 1 1 . 1 1 48 48 LEU H H 48 7.778 7.778 7.681 0.097 25767 266 1 1 . 1 1 49 49 ALA N N 49 120.130 120.130 121.389 -1.259 25767 267 1 1 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.957 -0.236 25767 268 1 1 . 1 1 49 49 ALA C C 49 178.676 178.676 179.397 -0.721 25767 269 1 1 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.411 0.310 25767 270 1 1 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.126 -0.299 25767 271 1 1 . 1 1 49 49 ALA H H 49 8.432 8.432 8.207 0.225 25767 272 1 1 . 1 1 50 50 THR N N 50 113.333 113.333 112.168 1.165 25767 273 1 1 . 1 1 50 50 THR HA H 50 3.895 3.895 3.883 0.012 25767 274 1 1 . 1 1 50 50 THR C C 50 174.948 174.948 176.593 -1.645 25767 275 1 1 . 1 1 50 50 THR CA C 50 67.334 67.334 66.443 0.891 25767 276 1 1 . 1 1 50 50 THR CB C 50 68.864 68.864 68.555 0.309 25767 277 1 1 . 1 1 50 50 THR H H 50 7.857 7.857 7.766 0.091 25767 278 1 1 . 1 1 51 51 GLU N N 51 122.698 122.698 122.686 0.012 25767 279 1 1 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.016 0.052 25767 280 1 1 . 1 1 51 51 GLU C C 51 179.997 179.997 178.769 1.228 25767 281 1 1 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.121 0.312 25767 282 1 1 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.638 -0.121 25767 283 1 1 . 1 1 51 51 GLU H H 51 7.817 7.817 7.651 0.166 25767 284 1 1 . 1 1 52 52 LEU N N 52 121.100 121.100 121.128 -0.028 25767 285 1 1 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.056 0.073 25767 286 1 1 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.717 0.172 25767 287 1 1 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.766 0.181 25767 288 1 1 . 1 1 52 52 LEU H H 52 8.628 8.628 7.922 0.706 25767 289 1 1 . 1 1 53 53 LEU N N 53 119.935 119.935 120.011 -0.076 25767 290 1 1 . 1 1 53 53 LEU C C 53 179.671 179.671 178.328 1.343 25767 291 1 1 . 1 1 53 53 LEU H H 53 8.303 8.303 7.738 0.565 25767 292 1 1 . 1 1 54 54 ASP N N 54 120.339 120.339 118.681 1.658 25767 293 1 1 . 1 1 54 54 ASP C C 54 179.106 179.106 178.358 0.748 25767 294 1 1 . 1 1 54 54 ASP H H 54 7.901 7.901 7.951 -0.050 25767 295 1 1 . 1 1 55 55 THR N N 55 120.237 120.237 117.017 3.220 25767 296 1 1 . 1 1 55 55 THR HA H 55 3.696 3.696 4.049 -0.353 25767 297 1 1 . 1 1 55 55 THR CA C 55 67.340 67.340 67.006 0.334 25767 298 1 1 . 1 1 55 55 THR CB C 55 68.151 68.151 68.634 -0.483 25767 299 1 1 . 1 1 55 55 THR H H 55 8.262 8.262 7.711 0.551 25767 300 1 1 . 1 1 56 56 ILE N N 56 123.953 123.953 122.383 1.570 25767 301 1 1 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.846 -0.003 25767 302 1 1 . 1 1 56 56 ILE CA C 56 65.894 65.894 63.456 2.438 25767 303 1 1 . 1 1 56 56 ILE CB C 56 38.133 38.133 36.457 1.676 25767 304 1 1 . 1 1 56 56 ILE H H 56 8.930 8.930 7.739 1.191 25767 305 1 1 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.765 -0.184 25767 306 1 1 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.136 -0.105 25767 307 1 1 . 1 1 58 58 ALA C C 58 179.875 179.875 179.482 0.393 25767 308 1 1 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.790 0.476 25767 309 1 1 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.327 -0.342 25767 310 1 1 . 1 1 58 58 ALA H H 58 7.764 7.764 8.521 -0.757 25767 311 1 1 . 1 1 59 59 PHE N N 59 121.988 121.988 120.206 1.782 25767 312 1 1 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.171 0.055 25767 313 1 1 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.118 0.321 25767 314 1 1 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.263 0.100 25767 315 1 1 . 1 1 59 59 PHE H H 59 8.159 8.159 8.627 -0.468 25767 316 1 1 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.811 -0.270 25767 317 1 1 . 1 1 60 60 LYS C C 60 179.438 179.438 178.952 0.486 25767 318 1 1 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.474 0.662 25767 319 1 1 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.407 -0.349 25767 320 1 1 . 1 1 61 61 LYS N N 61 119.262 119.262 118.244 1.018 25767 321 1 1 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.179 -0.234 25767 322 1 1 . 1 1 61 61 LYS C C 61 178.730 178.730 178.460 0.270 25767 323 1 1 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.585 1.457 25767 324 1 1 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.072 0.570 25767 325 1 1 . 1 1 61 61 LYS H H 61 7.832 7.832 7.903 -0.071 25767 326 1 1 . 1 1 62 62 GLU N N 62 120.790 120.790 120.558 0.232 25767 327 1 1 . 1 1 62 62 GLU HA H 62 3.935 3.935 4.002 -0.067 25767 328 1 1 . 1 1 62 62 GLU C C 62 178.424 178.424 178.118 0.306 25767 329 1 1 . 1 1 62 62 GLU CA C 62 58.714 58.714 59.023 -0.309 25767 330 1 1 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.262 -0.032 25767 331 1 1 . 1 1 62 62 GLU H H 62 7.982 7.982 8.105 -0.123 25767 332 1 1 . 1 1 63 63 ILE N N 63 118.463 118.463 116.480 1.983 25767 333 1 1 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.790 -0.101 25767 334 1 1 . 1 1 63 63 ILE C C 63 177.555 177.555 177.248 0.307 25767 335 1 1 . 1 1 63 63 ILE CA C 63 61.499 61.499 63.052 -1.553 25767 336 1 1 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.571 -2.047 25767 337 1 1 . 1 1 63 63 ILE H H 63 7.732 7.732 7.332 0.400 25767 338 1 1 . 1 1 64 64 GLY N N 64 107.973 107.973 107.163 0.810 25767 339 1 1 . 1 1 64 64 GLY C C 64 175.271 175.271 175.062 0.209 25767 340 1 1 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.149 -0.247 25767 341 1 1 . 1 1 64 64 GLY H H 64 7.661 7.661 7.842 -0.181 25767 342 1 1 . 1 1 65 65 GLY N N 65 108.464 108.464 107.219 1.245 25767 343 1 1 . 1 1 65 65 GLY C C 65 174.800 174.800 175.438 -0.638 25767 344 1 1 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.275 0.371 25767 345 1 1 . 1 1 65 65 GLY H H 65 7.808 7.808 7.979 -0.171 25767 346 1 1 . 1 1 66 66 GLU N N 66 121.162 121.162 121.386 -0.224 25767 347 1 1 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.034 0.071 25767 348 1 1 . 1 1 66 66 GLU C C 66 177.230 177.230 178.753 -1.523 25767 349 1 1 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.197 -1.973 25767 350 1 1 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.601 0.391 25767 351 1 1 . 1 1 66 66 GLU H H 66 8.203 8.203 7.796 0.407 25767 352 1 1 . 1 1 67 67 SER N N 67 116.468 116.468 116.180 0.288 25767 353 1 1 . 1 1 67 67 SER HA H 67 4.249 4.249 4.234 0.015 25767 354 1 1 . 1 1 67 67 SER C C 67 174.640 174.640 176.629 -1.989 25767 355 1 1 . 1 1 67 67 SER CA C 67 58.930 58.930 61.183 -2.253 25767 356 1 1 . 1 1 67 67 SER CB C 67 63.912 63.912 62.936 0.976 25767 357 1 1 . 1 1 67 67 SER H H 67 8.206 8.206 8.274 -0.068 25767 358 1 1 . 1 1 68 68 GLU N N 68 122.400 122.400 120.502 1.898 25767 359 1 1 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.025 0.128 25767 360 1 1 . 1 1 68 68 GLU C C 68 176.349 176.349 177.142 -0.793 25767 361 1 1 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.374 -1.551 25767 362 1 1 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.306 0.675 25767 363 1 1 . 1 1 68 68 GLU H H 68 8.168 8.168 8.461 -0.293 25767 364 1 1 . 1 1 69 69 ALA N N 69 124.342 124.342 120.241 4.101 25767 365 1 1 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.013 0.175 25767 366 1 1 . 1 1 69 69 ALA C C 69 178.027 178.027 178.211 -0.184 25767 367 1 1 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.883 -1.325 25767 368 1 1 . 1 1 69 69 ALA CB C 69 19.492 19.492 18.921 0.571 25767 369 1 1 . 1 1 69 69 ALA H H 69 7.939 7.939 7.407 0.532 25767 370 1 1 . 1 1 70 70 GLU N N 70 121.059 121.059 117.950 3.109 25767 371 1 1 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.454 -0.340 25767 372 1 1 . 1 1 70 70 GLU C C 70 176.519 176.519 175.344 1.175 25767 373 1 1 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.265 2.039 25767 374 1 1 . 1 1 70 70 GLU CB C 70 29.827 29.827 30.600 -0.773 25767 375 1 1 . 1 1 70 70 GLU H H 70 8.430 8.430 7.571 0.859 25767 376 1 1 . 1 1 71 71 ASP N N 71 120.274 120.274 123.232 -2.958 25767 377 1 1 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.345 0.187 25767 378 1 1 . 1 1 71 71 ASP C C 71 176.369 176.369 177.025 -0.656 25767 379 1 1 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.322 -1.071 25767 380 1 1 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.818 1.022 25767 381 1 1 . 1 1 71 71 ASP H H 71 8.305 8.305 9.085 -0.780 25767 382 1 1 . 1 1 72 72 SER N N 72 116.165 116.165 113.228 2.937 25767 383 1 1 . 1 1 72 72 SER HA H 72 4.241 4.241 4.047 0.194 25767 384 1 1 . 1 1 72 72 SER C C 72 174.567 174.567 175.713 -1.146 25767 385 1 1 . 1 1 72 72 SER CA C 72 59.031 59.031 61.755 -2.724 25767 386 1 1 . 1 1 72 72 SER CB C 72 64.040 64.040 63.387 0.653 25767 387 1 1 . 1 1 72 72 SER H H 72 7.964 7.964 8.217 -0.253 25767 388 1 1 . 1 1 73 73 ASP N N 73 122.440 122.440 123.094 -0.654 25767 389 1 1 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.441 0.093 25767 390 1 1 . 1 1 73 73 ASP C C 73 176.882 176.882 178.857 -1.975 25767 391 1 1 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.487 -3.045 25767 392 1 1 . 1 1 73 73 ASP CB C 73 41.336 41.336 40.302 1.034 25767 393 1 1 . 1 1 73 73 ASP H H 73 8.392 8.392 8.647 -0.255 25767 394 1 1 . 1 1 74 74 LYS N N 74 123.270 123.270 121.067 2.203 25767 395 1 1 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.226 -0.133 25767 396 1 1 . 1 1 74 74 LYS C C 74 177.608 177.608 178.710 -1.102 25767 397 1 1 . 1 1 74 74 LYS CA C 74 57.465 57.465 58.971 -1.506 25767 398 1 1 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.274 -0.128 25767 399 1 1 . 1 1 74 74 LYS H H 74 8.317 8.317 7.636 0.681 25767 400 1 1 . 1 1 75 75 SER N N 75 116.557 116.557 115.618 0.939 25767 401 1 1 . 1 1 75 75 SER HA H 75 4.197 4.197 4.234 -0.037 25767 402 1 1 . 1 1 75 75 SER C C 75 175.988 175.988 176.691 -0.703 25767 403 1 1 . 1 1 75 75 SER CA C 75 60.434 60.434 61.533 -1.099 25767 404 1 1 . 1 1 75 75 SER CB C 75 63.172 63.172 62.685 0.487 25767 405 1 1 . 1 1 75 75 SER H H 75 8.387 8.387 7.833 0.554 25767 406 1 1 . 1 1 76 76 LEU N N 76 123.910 123.910 121.414 2.496 25767 407 1 1 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.855 0.315 25767 408 1 1 . 1 1 76 76 LEU C C 76 178.083 178.083 179.050 -0.967 25767 409 1 1 . 1 1 76 76 LEU CA C 76 56.492 56.492 58.123 -1.631 25767 410 1 1 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.494 0.203 25767 411 1 1 . 1 1 76 76 LEU H H 76 8.059 8.059 7.816 0.243 25767 412 1 1 . 1 1 77 77 HIS N N 77 120.620 120.620 118.435 2.185 25767 413 1 1 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.253 0.035 25767 414 1 1 . 1 1 77 77 HIS C C 77 177.667 177.667 178.279 -0.612 25767 415 1 1 . 1 1 77 77 HIS CA C 77 58.422 58.422 60.142 -1.720 25767 416 1 1 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.696 0.568 25767 417 1 1 . 1 1 77 77 HIS H H 77 7.936 7.936 7.758 0.178 25767 418 1 1 . 1 1 78 78 VAL N N 78 121.774 121.774 120.043 1.731 25767 419 1 1 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.713 -0.036 25767 420 1 1 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.565 -0.959 25767 421 1 1 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.426 0.438 25767 422 1 1 . 1 1 78 78 VAL H H 78 7.916 7.916 8.258 -0.342 25767 423 1 1 . 1 1 79 79 MET N N 79 119.660 119.660 118.172 1.488 25767 424 1 1 . 1 1 79 79 MET HA H 79 3.925 3.925 4.139 -0.214 25767 425 1 1 . 1 1 79 79 MET C C 79 177.077 177.077 178.845 -1.768 25767 426 1 1 . 1 1 79 79 MET CA C 79 58.862 58.862 57.725 1.137 25767 427 1 1 . 1 1 79 79 MET CB C 79 32.852 32.852 31.012 1.840 25767 428 1 1 . 1 1 79 79 MET H H 79 8.149 8.149 8.615 -0.466 25767 429 1 1 . 1 1 80 80 ASN N N 80 117.337 117.337 118.302 -0.965 25767 430 1 1 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.696 -0.558 25767 431 1 1 . 1 1 80 80 ASN C C 80 178.133 178.133 177.760 0.373 25767 432 1 1 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.447 0.592 25767 433 1 1 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.362 0.633 25767 434 1 1 . 1 1 80 80 ASN H H 80 8.202 8.202 8.689 -0.487 25767 435 1 1 . 1 1 81 81 THR N N 81 115.517 115.517 118.036 -2.519 25767 436 1 1 . 1 1 81 81 THR HA H 81 3.896 3.896 4.074 -0.178 25767 437 1 1 . 1 1 81 81 THR C C 81 175.186 175.186 176.906 -1.720 25767 438 1 1 . 1 1 81 81 THR CA C 81 66.221 66.221 67.152 -0.931 25767 439 1 1 . 1 1 81 81 THR CB C 81 69.087 69.087 68.784 0.302 25767 440 1 1 . 1 1 81 81 THR H H 81 7.944 7.944 7.987 -0.043 25767 441 1 1 . 1 1 82 82 LEU N N 82 119.074 119.074 120.016 -0.942 25767 442 1 1 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.112 -0.131 25767 443 1 1 . 1 1 82 82 LEU C C 82 177.583 177.583 177.805 -0.222 25767 444 1 1 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.487 -0.947 25767 445 1 1 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.929 -0.136 25767 446 1 1 . 1 1 82 82 LEU H H 82 7.547 7.547 7.544 0.003 25767 447 1 1 . 1 1 83 83 ILE N N 83 118.085 118.085 115.911 2.174 25767 448 1 1 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.282 0.561 25767 449 1 1 . 1 1 83 83 ILE C C 83 176.413 176.413 177.303 -0.890 25767 450 1 1 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.264 -0.537 25767 451 1 1 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.167 -0.469 25767 452 1 1 . 1 1 83 83 ILE H H 83 7.409 7.409 7.469 -0.060 25767 453 1 1 . 1 1 84 84 HIS N N 84 116.152 116.152 115.561 0.591 25767 454 1 1 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.377 0.218 25767 455 1 1 . 1 1 84 84 HIS C C 84 175.707 175.707 175.481 0.226 25767 456 1 1 . 1 1 84 84 HIS CA C 84 58.628 58.628 58.312 0.316 25767 457 1 1 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.529 0.874 25767 458 1 1 . 1 1 84 84 HIS H H 84 7.194 7.194 7.941 -0.747 25767 459 1 1 . 1 1 85 85 ASP N N 85 122.322 122.322 119.777 2.545 25767 460 1 1 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.779 -0.245 25767 461 1 1 . 1 1 85 85 ASP C C 85 175.580 175.580 176.713 -1.133 25767 462 1 1 . 1 1 85 85 ASP CA C 85 53.345 53.345 52.973 0.372 25767 463 1 1 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.231 -0.113 25767 464 1 1 . 1 1 85 85 ASP H H 85 8.505 8.505 7.770 0.735 25767 465 1 1 . 1 1 86 86 GLN N N 86 122.783 122.783 126.537 -3.754 25767 466 1 1 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.144 -0.180 25767 467 1 1 . 1 1 86 86 GLN C C 86 178.581 178.581 177.905 0.676 25767 468 1 1 . 1 1 86 86 GLN CA C 86 57.954 57.954 58.996 -1.042 25767 469 1 1 . 1 1 86 86 GLN CB C 86 28.894 28.894 28.755 0.139 25767 470 1 1 . 1 1 86 86 GLN H H 86 8.803 8.803 8.630 0.173 25767 471 1 1 . 1 1 87 87 GLU N N 87 121.794 121.794 120.976 0.818 25767 472 1 1 . 1 1 87 87 GLU HA H 87 4.013 4.013 4.048 -0.035 25767 473 1 1 . 1 1 87 87 GLU C C 87 178.290 178.290 178.963 -0.673 25767 474 1 1 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.295 -0.257 25767 475 1 1 . 1 1 87 87 GLU CB C 87 28.980 28.980 28.981 -0.001 25767 476 1 1 . 1 1 87 87 GLU H H 87 8.072 8.072 8.164 -0.092 25767 477 1 1 . 1 1 88 88 LYS N N 88 119.345 119.345 119.393 -0.048 25767 478 1 1 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.115 -0.360 25767 479 1 1 . 1 1 88 88 LYS C C 88 180.040 180.040 178.447 1.593 25767 480 1 1 . 1 1 88 88 LYS CA C 88 59.411 59.411 59.017 0.394 25767 481 1 1 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.905 0.102 25767 482 1 1 . 1 1 88 88 LYS H H 88 7.588 7.588 8.533 -0.945 25767 483 1 1 . 1 1 89 89 ALA N N 89 123.933 123.933 121.724 2.209 25767 484 1 1 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.161 -0.422 25767 485 1 1 . 1 1 89 89 ALA C C 89 177.457 177.457 179.442 -1.985 25767 486 1 1 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.363 0.607 25767 487 1 1 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.355 0.301 25767 488 1 1 . 1 1 89 89 ALA H H 89 8.500 8.500 7.696 0.804 25767 489 1 1 . 1 1 90 90 LYS N N 90 119.244 119.244 119.876 -0.632 25767 490 1 1 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.955 0.089 25767 491 1 1 . 1 1 90 90 LYS C C 90 177.774 177.774 178.311 -0.537 25767 492 1 1 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.427 -0.349 25767 493 1 1 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.621 -2.380 25767 494 1 1 . 1 1 90 90 LYS H H 90 6.845 6.845 7.739 -0.894 25767 495 1 1 . 1 1 91 91 ILE N N 91 117.718 117.718 119.838 -2.120 25767 496 1 1 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.683 -0.285 25767 497 1 1 . 1 1 91 91 ILE C C 91 177.670 177.670 177.159 0.511 25767 498 1 1 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.447 -0.449 25767 499 1 1 . 1 1 91 91 ILE CB C 91 37.801 37.801 36.873 0.928 25767 500 1 1 . 1 1 91 91 ILE H H 91 7.293 7.293 7.731 -0.438 25767 501 1 1 . 1 1 92 92 TYR N N 92 121.868 121.868 121.690 0.178 25767 502 1 1 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.073 0.050 25767 503 1 1 . 1 1 92 92 TYR C C 92 178.781 178.781 177.693 1.088 25767 504 1 1 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.444 -0.802 25767 505 1 1 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.570 0.651 25767 506 1 1 . 1 1 92 92 TYR H H 92 8.016 8.016 7.783 0.233 25767 507 1 1 . 1 1 93 93 MET N N 93 118.984 118.984 118.806 0.178 25767 508 1 1 . 1 1 93 93 MET HA H 93 3.952 3.952 4.074 -0.122 25767 509 1 1 . 1 1 93 93 MET C C 93 179.925 179.925 178.517 1.408 25767 510 1 1 . 1 1 93 93 MET CA C 93 57.589 57.589 59.681 -2.092 25767 511 1 1 . 1 1 93 93 MET CB C 93 30.752 30.752 32.705 -1.953 25767 512 1 1 . 1 1 93 93 MET H H 93 8.464 8.464 8.059 0.405 25767 513 1 1 . 1 1 94 94 LEU N N 94 125.441 125.441 120.106 5.335 25767 514 1 1 . 1 1 94 94 LEU HA H 94 3.870 3.870 3.830 0.040 25767 515 1 1 . 1 1 94 94 LEU C C 94 177.937 177.937 179.378 -1.441 25767 516 1 1 . 1 1 94 94 LEU CA C 94 58.761 58.761 57.885 0.876 25767 517 1 1 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.098 0.664 25767 518 1 1 . 1 1 94 94 LEU H H 94 8.927 8.927 8.654 0.273 25767 519 1 1 . 1 1 95 95 ASN N N 95 119.066 119.066 117.865 1.201 25767 520 1 1 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.408 -0.146 25767 521 1 1 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.061 0.212 25767 522 1 1 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.307 -0.702 25767 523 1 1 . 1 1 95 95 ASN H H 95 8.691 8.691 8.091 0.600 25767 524 1 1 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.633 0.032 25767 525 1 1 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.081 0.990 25767 526 1 1 . 1 1 96 96 PHE H H 96 8.317 8.317 8.092 0.225 25767 527 1 1 . 1 1 97 97 THR N N 97 118.178 118.178 117.002 1.176 25767 528 1 1 . 1 1 97 97 THR HA H 97 3.338 3.338 3.797 -0.459 25767 529 1 1 . 1 1 97 97 THR C C 97 176.074 176.074 176.716 -0.642 25767 530 1 1 . 1 1 97 97 THR CA C 97 67.986 67.986 67.309 0.677 25767 531 1 1 . 1 1 97 97 THR H H 97 8.214 8.214 9.041 -0.827 25767 532 1 1 . 1 1 98 98 MET N N 98 120.097 120.097 121.325 -1.228 25767 533 1 1 . 1 1 98 98 MET HA H 98 4.403 4.403 4.332 0.071 25767 534 1 1 . 1 1 98 98 MET C C 98 178.696 178.696 177.433 1.263 25767 535 1 1 . 1 1 98 98 MET CA C 98 57.029 57.029 59.477 -2.448 25767 536 1 1 . 1 1 98 98 MET CB C 98 29.898 29.898 32.447 -2.549 25767 537 1 1 . 1 1 98 98 MET H H 98 8.885 8.885 8.181 0.704 25767 538 1 1 . 1 1 99 99 SER N N 99 114.959 114.959 116.063 -1.104 25767 539 1 1 . 1 1 99 99 SER HA H 99 4.199 4.199 4.111 0.088 25767 540 1 1 . 1 1 99 99 SER C C 99 176.565 176.565 176.648 -0.083 25767 541 1 1 . 1 1 99 99 SER CA C 99 61.965 61.965 60.985 0.980 25767 542 1 1 . 1 1 99 99 SER CB C 99 62.565 62.565 63.040 -0.475 25767 543 1 1 . 1 1 99 99 SER H H 99 7.515 7.515 7.723 -0.208 25767 544 1 1 . 1 1 100 100 LEU N N 100 125.380 125.380 124.205 1.175 25767 545 1 1 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.832 -0.056 25767 546 1 1 . 1 1 100 100 LEU C C 100 177.689 177.689 178.197 -0.508 25767 547 1 1 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.569 0.488 25767 548 1 1 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.410 0.140 25767 549 1 1 . 1 1 100 100 LEU H H 100 7.400 7.400 8.425 -1.025 25767 550 1 1 . 1 1 101 101 TYR N N 101 120.597 120.597 119.936 0.661 25767 551 1 1 . 1 1 101 101 TYR HA H 101 4.116 4.116 4.106 0.010 25767 552 1 1 . 1 1 101 101 TYR C C 101 176.825 176.825 177.131 -0.306 25767 553 1 1 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.394 -0.506 25767 554 1 1 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.502 0.491 25767 555 1 1 . 1 1 101 101 TYR H H 101 8.880 8.880 8.213 0.667 25767 556 1 1 . 1 1 102 102 ASN N N 102 116.869 116.869 116.786 0.083 25767 557 1 1 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.320 -0.154 25767 558 1 1 . 1 1 102 102 ASN C C 102 179.089 179.089 177.984 1.105 25767 559 1 1 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.144 0.068 25767 560 1 1 . 1 1 102 102 ASN CB C 102 37.734 37.734 37.809 -0.075 25767 561 1 1 . 1 1 102 102 ASN H H 102 8.543 8.543 8.056 0.487 25767 562 1 1 . 1 1 103 103 GLU N N 103 121.259 121.259 120.231 1.028 25767 563 1 1 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.936 0.050 25767 564 1 1 . 1 1 103 103 GLU C C 103 179.968 179.968 178.647 1.321 25767 565 1 1 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.213 0.304 25767 566 1 1 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.415 0.135 25767 567 1 1 . 1 1 103 103 GLU H H 103 7.872 7.872 8.289 -0.417 25767 568 1 1 . 1 1 104 104 LYS N N 104 120.268 120.268 120.951 -0.683 25767 569 1 1 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.171 -0.125 25767 570 1 1 . 1 1 104 104 LYS C C 104 178.355 178.355 178.759 -0.404 25767 571 1 1 . 1 1 104 104 LYS CA C 104 56.735 56.735 59.193 -2.458 25767 572 1 1 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.283 -3.170 25767 573 1 1 . 1 1 104 104 LYS H H 104 8.384 8.384 7.779 0.605 25767 574 1 1 . 1 1 105 105 LEU N N 105 121.622 121.622 119.183 2.439 25767 575 1 1 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.641 0.100 25767 576 1 1 . 1 1 105 105 LEU C C 105 180.552 180.552 178.809 1.743 25767 577 1 1 . 1 1 105 105 LEU CA C 105 58.172 58.172 57.714 0.458 25767 578 1 1 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.473 -0.443 25767 579 1 1 . 1 1 105 105 LEU H H 105 8.400 8.400 7.717 0.683 25767 580 1 1 . 1 1 106 106 LYS N N 106 119.498 119.498 118.308 1.190 25767 581 1 1 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.849 0.065 25767 582 1 1 . 1 1 106 106 LYS C C 106 178.419 178.419 178.982 -0.563 25767 583 1 1 . 1 1 106 106 LYS CA C 106 59.383 59.383 60.008 -0.625 25767 584 1 1 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.947 -0.139 25767 585 1 1 . 1 1 106 106 LYS H H 106 7.067 7.067 7.509 -0.442 25767 586 1 1 . 1 1 107 107 GLN N N 107 121.405 121.405 119.001 2.404 25767 587 1 1 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.980 -0.129 25767 588 1 1 . 1 1 107 107 GLN C C 107 177.935 177.935 178.922 -0.987 25767 589 1 1 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.775 -0.294 25767 590 1 1 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.527 -1.729 25767 591 1 1 . 1 1 107 107 GLN H H 107 7.460 7.460 7.761 -0.301 25767 592 1 1 . 1 1 108 108 LEU N N 108 119.561 119.561 118.979 0.582 25767 593 1 1 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.908 -0.107 25767 594 1 1 . 1 1 108 108 LEU C C 108 179.195 179.195 178.270 0.925 25767 595 1 1 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.475 0.918 25767 596 1 1 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.732 -0.466 25767 597 1 1 . 1 1 108 108 LEU H H 108 8.208 8.208 7.777 0.431 25767 598 1 1 . 1 1 109 109 LYS N N 109 118.535 118.535 116.999 1.536 25767 599 1 1 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.206 0.046 25767 600 1 1 . 1 1 109 109 LYS C C 109 177.726 177.726 178.166 -0.440 25767 601 1 1 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.912 -0.182 25767 602 1 1 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.803 -0.393 25767 603 1 1 . 1 1 109 109 LYS H H 109 7.168 7.168 7.598 -0.430 25767 604 1 1 . 1 1 110 110 ASP N N 110 117.463 117.463 117.009 0.454 25767 605 1 1 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.613 -0.008 25767 606 1 1 . 1 1 110 110 ASP C C 110 177.360 177.360 176.822 0.538 25767 607 1 1 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.998 0.898 25767 608 1 1 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.598 0.979 25767 609 1 1 . 1 1 110 110 ASP H H 110 7.861 7.861 8.414 -0.553 25767 610 1 1 . 1 1 111 111 GLY N N 111 113.059 113.059 108.476 4.583 25767 611 1 1 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.826 -0.774 25767 612 1 1 . 1 1 111 111 GLY H H 111 8.479 8.479 7.835 0.644 25767 613 1 1 . 1 1 112 112 PRO HA H 112 4.463 4.463 3.967 0.496 25767 614 1 1 . 1 1 112 112 PRO C C 112 175.090 175.090 175.776 -0.686 25767 615 1 1 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.131 -0.767 25767 616 1 1 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.631 2.219 25767 617 1 1 . 1 1 113 113 TRP N N 113 123.164 123.164 121.507 1.657 25767 618 1 1 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.769 -0.059 25767 619 1 1 . 1 1 113 113 TRP C C 113 174.605 174.605 175.469 -0.864 25767 620 1 1 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.166 0.739 25767 621 1 1 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.197 -2.904 25767 622 1 1 . 1 1 113 113 TRP H H 113 8.687 8.687 8.264 0.423 25767 623 1 1 . 1 1 114 114 ASP N N 114 121.356 121.356 122.089 -0.733 25767 624 1 1 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.873 -0.012 25767 625 1 1 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.333 -0.084 25767 626 1 1 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.334 -1.192 25767 627 1 1 . 1 1 114 114 ASP H H 114 6.985 6.985 8.229 -1.244 25767 628 1 1 . 1 1 115 115 VAL N N 115 118.649 118.649 119.942 -1.293 25767 629 1 1 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.867 -0.025 25767 630 1 1 . 1 1 115 115 VAL C C 115 177.739 177.739 177.492 0.247 25767 631 1 1 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.450 0.119 25767 632 1 1 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.206 -0.529 25767 633 1 1 . 1 1 115 115 VAL H H 115 8.206 8.206 8.400 -0.195 25767 634 1 1 . 1 1 116 116 MET N N 116 120.401 120.401 117.714 2.687 25767 635 1 1 . 1 1 116 116 MET HA H 116 4.303 4.303 4.225 0.078 25767 636 1 1 . 1 1 116 116 MET C C 116 179.269 179.269 178.262 1.007 25767 637 1 1 . 1 1 116 116 MET CA C 116 57.634 57.634 58.952 -1.318 25767 638 1 1 . 1 1 116 116 MET CB C 116 30.414 30.414 31.961 -1.547 25767 639 1 1 . 1 1 116 116 MET H H 116 7.642 7.642 8.151 -0.509 25767 640 1 1 . 1 1 117 117 LEU N N 117 125.503 125.503 119.464 6.039 25767 641 1 1 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.157 0.088 25767 642 1 1 . 1 1 117 117 LEU C C 117 178.445 178.445 179.313 -0.868 25767 643 1 1 . 1 1 117 117 LEU CA C 117 58.200 58.200 58.275 -0.075 25767 644 1 1 . 1 1 117 117 LEU CB C 117 40.089 40.089 40.886 -0.797 25767 645 1 1 . 1 1 117 117 LEU H H 117 8.157 8.157 7.683 0.474 25767 646 1 1 . 1 1 118 118 LYS N N 118 119.052 119.052 119.170 -0.118 25767 647 1 1 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.968 -0.163 25767 648 1 1 . 1 1 118 118 LYS C C 118 178.251 178.251 179.457 -1.206 25767 649 1 1 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.154 0.372 25767 650 1 1 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.176 -0.048 25767 651 1 1 . 1 1 118 118 LYS H H 118 7.400 7.400 7.498 -0.098 25767 652 1 1 . 1 1 119 119 ARG N N 119 117.999 117.999 119.022 -1.023 25767 653 1 1 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.303 -0.083 25767 654 1 1 . 1 1 119 119 ARG C C 119 180.441 180.441 179.154 1.287 25767 655 1 1 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.676 0.141 25767 656 1 1 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.259 -0.174 25767 657 1 1 . 1 1 119 119 ARG H H 119 8.265 8.265 8.030 0.235 25767 658 1 1 . 1 1 120 120 SER N N 120 118.073 118.073 115.770 2.303 25767 659 1 1 . 1 1 120 120 SER HA H 120 4.182 4.182 4.373 -0.191 25767 660 1 1 . 1 1 120 120 SER C C 120 176.215 176.215 176.439 -0.224 25767 661 1 1 . 1 1 120 120 SER CA C 120 62.817 62.817 62.148 0.669 25767 662 1 1 . 1 1 120 120 SER CB C 120 63.550 63.550 62.939 0.611 25767 663 1 1 . 1 1 120 120 SER H H 120 8.633 8.633 7.958 0.675 25767 664 1 1 . 1 1 121 121 LEU N N 121 125.029 125.029 122.936 2.093 25767 665 1 1 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.037 0.182 25767 666 1 1 . 1 1 121 121 LEU C C 121 179.679 179.679 178.815 0.864 25767 667 1 1 . 1 1 121 121 LEU CA C 121 58.849 58.849 57.837 1.012 25767 668 1 1 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.379 -0.605 25767 669 1 1 . 1 1 121 121 LEU H H 121 8.313 8.313 7.980 0.333 25767 670 1 1 . 1 1 122 122 TRP N N 122 120.217 120.217 119.325 0.892 25767 671 1 1 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.422 -0.082 25767 672 1 1 . 1 1 122 122 TRP C C 122 177.527 177.527 178.802 -1.275 25767 673 1 1 . 1 1 122 122 TRP CA C 122 61.758 61.758 61.201 0.557 25767 674 1 1 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.084 0.564 25767 675 1 1 . 1 1 122 122 TRP H H 122 7.928 7.928 7.880 0.048 25767 676 1 1 . 1 1 123 123 CYS N N 123 119.669 119.669 118.985 0.684 25767 677 1 1 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.431 -0.224 25767 678 1 1 . 1 1 123 123 CYS C C 123 177.057 177.057 177.162 -0.105 25767 679 1 1 . 1 1 123 123 CYS CA C 123 62.600 62.600 62.613 -0.013 25767 680 1 1 . 1 1 123 123 CYS CB C 123 25.899 25.899 26.389 -0.490 25767 681 1 1 . 1 1 123 123 CYS H H 123 8.273 8.273 8.225 0.048 25767 682 1 1 . 1 1 124 124 CYS N N 124 116.898 116.898 119.899 -3.001 25767 683 1 1 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.094 -0.246 25767 684 1 1 . 1 1 124 124 CYS C C 124 175.759 175.759 176.870 -1.111 25767 685 1 1 . 1 1 124 124 CYS CA C 124 65.653 65.653 65.218 0.436 25767 686 1 1 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.501 0.016 25767 687 1 1 . 1 1 124 124 CYS H H 124 8.122 8.122 8.661 -0.539 25767 688 1 1 . 1 1 125 125 ILE N N 125 120.498 120.498 120.518 -0.020 25767 689 1 1 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.799 -0.211 25767 690 1 1 . 1 1 125 125 ILE C C 125 179.337 179.337 177.767 1.570 25767 691 1 1 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.824 1.770 25767 692 1 1 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.591 0.088 25767 693 1 1 . 1 1 125 125 ILE H H 125 8.092 8.092 8.147 -0.055 25767 694 1 1 . 1 1 126 126 ASP N N 126 125.084 125.084 121.432 3.652 25767 695 1 1 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.488 0.129 25767 696 1 1 . 1 1 126 126 ASP C C 126 178.299 178.299 179.115 -0.816 25767 697 1 1 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.267 1.737 25767 698 1 1 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.195 0.101 25767 699 1 1 . 1 1 126 126 ASP H H 126 9.049 9.049 7.936 1.113 25767 700 1 1 . 1 1 127 127 LEU N N 127 122.591 122.591 120.133 2.458 25767 701 1 1 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.779 0.088 25767 702 1 1 . 1 1 127 127 LEU C C 127 179.655 179.655 178.928 0.727 25767 703 1 1 . 1 1 127 127 LEU CA C 127 58.661 58.661 58.001 0.660 25767 704 1 1 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.523 0.671 25767 705 1 1 . 1 1 127 127 LEU H H 127 8.888 8.888 7.786 1.102 25767 706 1 1 . 1 1 128 128 PHE N N 128 117.498 117.498 118.096 -0.598 25767 707 1 1 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.187 0.135 25767 708 1 1 . 1 1 128 128 PHE C C 128 178.533 178.533 178.086 0.447 25767 709 1 1 . 1 1 128 128 PHE CA C 128 60.932 60.932 61.916 -0.984 25767 710 1 1 . 1 1 128 128 PHE CB C 128 39.053 39.053 38.434 0.620 25767 711 1 1 . 1 1 128 128 PHE H H 128 8.947 8.947 7.900 1.047 25767 712 1 1 . 1 1 129 129 SER N N 129 115.398 115.398 115.886 -0.488 25767 713 1 1 . 1 1 129 129 SER HA H 129 4.046 4.046 4.304 -0.258 25767 714 1 1 . 1 1 129 129 SER C C 129 175.168 175.168 176.904 -1.736 25767 715 1 1 . 1 1 129 129 SER CA C 129 63.015 63.015 61.544 1.471 25767 716 1 1 . 1 1 129 129 SER H H 129 8.578 8.578 9.068 -0.490 25767 717 1 1 . 1 1 130 130 CYS N N 130 125.556 125.556 122.113 3.443 25767 718 1 1 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.329 -0.220 25767 719 1 1 . 1 1 130 130 CYS C C 130 175.294 175.294 176.534 -1.240 25767 720 1 1 . 1 1 130 130 CYS CA C 130 61.438 61.438 62.486 -1.048 25767 721 1 1 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.312 -0.263 25767 722 1 1 . 1 1 130 130 CYS H H 130 8.289 8.289 8.153 0.136 25767 723 1 1 . 1 1 131 131 ILE N N 131 120.232 120.232 121.519 -1.287 25767 724 1 1 . 1 1 131 131 ILE HA H 131 4.033 4.033 4.174 -0.141 25767 725 1 1 . 1 1 131 131 ILE C C 131 177.297 177.297 178.657 -1.360 25767 726 1 1 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.632 -0.980 25767 727 1 1 . 1 1 131 131 ILE CB C 131 39.102 39.102 38.029 1.073 25767 728 1 1 . 1 1 131 131 ILE H H 131 7.943 7.943 7.811 0.132 25767 729 1 1 . 1 1 132 132 LEU N N 132 116.422 116.422 120.598 -4.176 25767 730 1 1 . 1 1 132 132 LEU HA H 132 3.845 3.845 4.067 -0.222 25767 731 1 1 . 1 1 132 132 LEU C C 132 177.816 177.816 178.547 -0.731 25767 732 1 1 . 1 1 132 132 LEU CA C 132 57.078 57.078 58.195 -1.117 25767 733 1 1 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.645 0.568 25767 734 1 1 . 1 1 132 132 LEU H H 132 7.846 7.846 8.377 -0.531 25767 735 1 1 . 1 1 133 133 HIS N N 133 116.929 116.929 118.459 -1.530 25767 736 1 1 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.302 -0.163 25767 737 1 1 . 1 1 133 133 HIS C C 133 178.669 178.669 177.666 1.003 25767 738 1 1 . 1 1 133 133 HIS CA C 133 59.736 59.736 60.008 -0.272 25767 739 1 1 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.373 2.779 25767 740 1 1 . 1 1 133 133 HIS H H 133 7.822 7.822 8.199 -0.377 25767 741 1 1 . 1 1 134 134 LEU N N 134 116.898 116.898 119.752 -2.854 25767 742 1 1 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.183 -0.450 25767 743 1 1 . 1 1 134 134 LEU C C 134 179.402 179.402 178.922 0.480 25767 744 1 1 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.707 -0.480 25767 745 1 1 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.187 -2.648 25767 746 1 1 . 1 1 134 134 LEU H H 134 8.688 8.688 7.976 0.712 25767 747 1 1 . 1 1 135 135 TRP N N 135 115.602 115.602 117.728 -2.126 25767 748 1 1 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.629 0.379 25767 749 1 1 . 1 1 135 135 TRP C C 135 175.022 175.022 177.958 -2.936 25767 750 1 1 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.119 1.307 25767 751 1 1 . 1 1 135 135 TRP CB C 135 27.085 27.085 28.900 -1.815 25767 752 1 1 . 1 1 135 135 TRP H H 135 7.638 7.638 8.658 -1.020 25767 753 1 1 . 1 1 136 136 LYS N N 136 119.721 119.721 123.075 -3.354 25767 754 1 1 . 1 1 136 136 LYS HA H 136 3.816 3.816 4.032 -0.216 25767 755 1 1 . 1 1 136 136 LYS C C 136 178.279 178.279 178.422 -0.143 25767 756 1 1 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.223 0.970 25767 757 1 1 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.758 1.299 25767 758 1 1 . 1 1 136 136 LYS H H 136 6.538 6.538 8.246 -1.708 25767 759 1 1 . 1 1 137 137 GLU N N 137 115.407 115.407 116.218 -0.811 25767 760 1 1 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.148 0.019 25767 761 1 1 . 1 1 137 137 GLU C C 137 176.700 176.700 177.300 -0.600 25767 762 1 1 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.619 -0.769 25767 763 1 1 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.087 0.073 25767 764 1 1 . 1 1 137 137 GLU H H 137 8.596 8.596 8.256 0.340 25767 765 1 1 . 1 1 138 138 ASN N N 138 116.669 116.669 116.511 0.158 25767 766 1 1 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.845 0.061 25767 767 1 1 . 1 1 138 138 ASN C C 138 173.481 173.481 174.889 -1.408 25767 768 1 1 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.901 -1.087 25767 769 1 1 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.726 1.111 25767 770 1 1 . 1 1 138 138 ASN H H 138 8.343 8.343 8.237 0.106 25767 771 1 1 . 1 1 139 139 ILE N N 139 120.703 120.703 120.890 -0.187 25767 772 1 1 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.246 0.098 25767 773 1 1 . 1 1 139 139 ILE C C 139 175.241 175.241 175.697 -0.456 25767 774 1 1 . 1 1 139 139 ILE CA C 139 60.792 60.792 58.568 2.224 25767 775 1 1 . 1 1 139 139 ILE CB C 139 40.274 40.274 38.700 1.574 25767 776 1 1 . 1 1 139 139 ILE H H 139 7.167 7.167 7.594 -0.427 25767 777 1 1 . 1 1 140 140 SER N N 140 123.284 123.284 120.592 2.692 25767 778 1 1 . 1 1 140 140 SER HA H 140 4.345 4.345 4.543 -0.198 25767 779 1 1 . 1 1 140 140 SER CA C 140 58.095 58.095 57.516 0.579 25767 780 1 1 . 1 1 140 140 SER CB C 140 65.370 65.370 64.301 1.069 25767 781 1 1 . 1 1 140 140 SER H H 140 8.727 8.727 8.599 0.128 25767 782 1 1 . 1 1 142 142 THR N N 142 113.868 113.868 115.125 -1.257 25767 783 1 1 . 1 1 142 142 THR HA H 142 3.976 3.976 4.198 -0.222 25767 784 1 1 . 1 1 142 142 THR C C 142 177.559 177.559 176.743 0.816 25767 785 1 1 . 1 1 142 142 THR CA C 142 66.007 66.007 65.242 0.765 25767 786 1 1 . 1 1 142 142 THR CB C 142 68.530 68.530 68.307 0.223 25767 787 1 1 . 1 1 142 142 THR H H 142 8.243 8.243 8.016 0.227 25767 788 1 1 . 1 1 143 143 SER N N 143 120.786 120.786 116.744 4.042 25767 789 1 1 . 1 1 143 143 SER C C 143 175.844 175.844 176.569 -0.725 25767 790 1 1 . 1 1 143 143 SER CA C 143 62.102 62.102 61.733 0.369 25767 791 1 1 . 1 1 143 143 SER CB C 143 63.086 63.086 62.729 0.357 25767 792 1 1 . 1 1 143 143 SER H H 143 7.915 7.915 8.158 -0.243 25767 793 1 1 . 1 1 144 144 THR N N 144 120.946 120.946 117.579 3.367 25767 794 1 1 . 1 1 144 144 THR HA H 144 4.299 4.299 4.011 0.288 25767 795 1 1 . 1 1 144 144 THR C C 144 175.874 175.874 175.957 -0.083 25767 796 1 1 . 1 1 144 144 THR CA C 144 67.487 67.487 66.779 0.708 25767 797 1 1 . 1 1 144 144 THR CB C 144 68.485 68.485 68.737 -0.252 25767 798 1 1 . 1 1 144 144 THR H H 144 8.746 8.746 8.414 0.332 25767 799 1 1 . 1 1 145 145 ASN N N 145 120.069 120.069 119.666 0.403 25767 800 1 1 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.401 -0.093 25767 801 1 1 . 1 1 145 145 ASN C C 145 177.917 177.917 177.464 0.453 25767 802 1 1 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.832 -0.495 25767 803 1 1 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.590 -0.490 25767 804 1 1 . 1 1 145 145 ASN H H 145 7.940 7.940 7.832 0.108 25767 805 1 1 . 1 1 146 146 SER N N 146 116.905 116.905 116.675 0.230 25767 806 1 1 . 1 1 146 146 SER HA H 146 3.936 3.936 4.138 -0.202 25767 807 1 1 . 1 1 146 146 SER C C 146 176.963 176.963 176.624 0.339 25767 808 1 1 . 1 1 146 146 SER CA C 146 61.997 61.997 61.584 0.413 25767 809 1 1 . 1 1 146 146 SER CB C 146 62.879 62.879 63.179 -0.300 25767 810 1 1 . 1 1 146 146 SER H H 146 7.951 7.951 7.810 0.141 25767 811 1 1 . 1 1 147 147 LEU N N 147 123.253 123.253 122.680 0.573 25767 812 1 1 . 1 1 147 147 LEU HA H 147 3.875 3.875 3.980 -0.105 25767 813 1 1 . 1 1 147 147 LEU C C 147 178.726 178.726 178.348 0.378 25767 814 1 1 . 1 1 147 147 LEU CA C 147 58.580 58.580 57.561 1.019 25767 815 1 1 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.798 -0.938 25767 816 1 1 . 1 1 147 147 LEU H H 147 8.168 8.168 7.633 0.535 25767 817 1 1 . 1 1 148 148 GLN N N 148 118.212 118.212 118.360 -0.148 25767 818 1 1 . 1 1 148 148 GLN HA H 148 3.817 3.817 3.965 -0.148 25767 819 1 1 . 1 1 148 148 GLN C C 148 179.686 179.686 178.690 0.996 25767 820 1 1 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.778 0.465 25767 821 1 1 . 1 1 148 148 GLN CB C 148 27.720 27.720 28.060 -0.340 25767 822 1 1 . 1 1 148 148 GLN H H 148 8.295 8.295 8.747 -0.452 25767 823 1 1 . 1 1 149 149 LYS N N 149 120.770 120.770 120.275 0.495 25767 824 1 1 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.960 -0.059 25767 825 1 1 . 1 1 149 149 LYS C C 149 178.006 178.006 179.061 -1.055 25767 826 1 1 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.575 -0.043 25767 827 1 1 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.194 -0.302 25767 828 1 1 . 1 1 149 149 LYS H H 149 7.955 7.955 8.055 -0.100 25767 829 1 1 . 1 1 150 150 ARG N N 150 119.244 119.244 119.324 -0.080 25767 830 1 1 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.967 -0.127 25767 831 1 1 . 1 1 150 150 ARG C C 150 178.858 178.858 178.806 0.052 25767 832 1 1 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.194 0.177 25767 833 1 1 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.863 -1.059 25767 834 1 1 . 1 1 150 150 ARG H H 150 7.020 7.020 7.554 -0.534 25767 835 1 1 . 1 1 151 151 ILE N N 151 121.183 121.183 119.674 1.509 25767 836 1 1 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.716 -0.357 25767 837 1 1 . 1 1 151 151 ILE C C 151 177.327 177.327 177.725 -0.398 25767 838 1 1 . 1 1 151 151 ILE CA C 151 67.196 67.196 62.686 4.510 25767 839 1 1 . 1 1 151 151 ILE CB C 151 38.272 38.272 36.476 1.796 25767 840 1 1 . 1 1 151 151 ILE H H 151 7.574 7.574 7.735 -0.161 25767 841 1 1 . 1 1 152 152 LYS N N 152 119.521 119.521 121.150 -1.629 25767 842 1 1 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.889 -0.116 25767 843 1 1 . 1 1 152 152 LYS C C 152 178.016 178.016 178.781 -0.765 25767 844 1 1 . 1 1 152 152 LYS CA C 152 59.830 59.830 60.104 -0.274 25767 845 1 1 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.261 -0.680 25767 846 1 1 . 1 1 152 152 LYS H H 152 7.629 7.629 7.734 -0.105 25767 847 1 1 . 1 1 153 153 TYR N N 153 120.178 120.178 120.474 -0.296 25767 848 1 1 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.142 -0.070 25767 849 1 1 . 1 1 153 153 TYR C C 153 178.195 178.195 178.041 0.154 25767 850 1 1 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.689 -0.373 25767 851 1 1 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.532 -1.259 25767 852 1 1 . 1 1 153 153 TYR H H 153 8.407 8.407 7.821 0.586 25767 853 1 1 . 1 1 154 154 CYS N N 154 117.013 117.013 117.976 -0.963 25767 854 1 1 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.227 -0.155 25767 855 1 1 . 1 1 154 154 CYS C C 154 176.827 176.827 177.156 -0.329 25767 856 1 1 . 1 1 154 154 CYS CA C 154 65.780 65.780 63.782 1.998 25767 857 1 1 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.559 0.601 25767 858 1 1 . 1 1 154 154 CYS H H 154 8.291 8.291 7.937 0.354 25767 859 1 1 . 1 1 155 155 LYS N N 155 118.753 118.753 121.291 -2.538 25767 860 1 1 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.886 -0.215 25767 861 1 1 . 1 1 155 155 LYS C C 155 179.904 179.904 178.683 1.221 25767 862 1 1 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.543 0.941 25767 863 1 1 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.287 -0.344 25767 864 1 1 . 1 1 155 155 LYS H H 155 7.934 7.934 8.323 -0.389 25767 865 1 1 . 1 1 156 156 ILE N N 156 123.873 123.873 120.681 3.192 25767 866 1 1 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.594 -0.010 25767 867 1 1 . 1 1 156 156 ILE C C 156 179.501 179.501 177.821 1.680 25767 868 1 1 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.529 -0.289 25767 869 1 1 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.944 -0.302 25767 870 1 1 . 1 1 156 156 ILE H H 156 8.314 8.314 8.590 -0.276 25767 871 1 1 . 1 1 157 157 TYR N N 157 121.132 121.132 119.907 1.225 25767 872 1 1 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.945 0.220 25767 873 1 1 . 1 1 157 157 TYR C C 157 178.558 178.558 177.352 1.206 25767 874 1 1 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.831 0.279 25767 875 1 1 . 1 1 157 157 TYR H H 157 8.442 8.442 7.580 0.862 25767 876 1 1 . 1 1 158 158 LEU N N 158 120.964 120.964 120.077 0.887 25767 877 1 1 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.793 0.119 25767 878 1 1 . 1 1 158 158 LEU C C 158 180.130 180.130 178.543 1.587 25767 879 1 1 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.511 1.175 25767 880 1 1 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.562 0.168 25767 881 1 1 . 1 1 158 158 LEU H H 158 8.469 8.469 7.775 0.694 25767 882 1 1 . 1 1 159 159 SER N N 159 116.653 116.653 114.972 1.681 25767 883 1 1 . 1 1 159 159 SER HA H 159 4.246 4.246 4.020 0.226 25767 884 1 1 . 1 1 159 159 SER CA C 159 61.460 61.460 61.989 -0.529 25767 885 1 1 . 1 1 159 159 SER CB C 159 62.849 62.849 62.787 0.062 25767 886 1 1 . 1 1 159 159 SER H H 159 7.758 7.758 8.429 -0.671 25767 887 1 1 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.028 -1.655 25767 888 1 1 . 1 1 160 160 LYS CB C 160 29.832 29.832 32.001 -2.169 25767 889 1 1 . 1 1 160 160 LYS H H 160 8.425 8.425 7.714 0.711 25767 890 1 1 . 1 1 161 161 LEU N N 161 121.686 121.686 118.671 3.015 25767 891 1 1 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.892 0.271 25767 892 1 1 . 1 1 161 161 LEU C C 161 180.224 180.224 179.213 1.011 25767 893 1 1 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.273 0.311 25767 894 1 1 . 1 1 161 161 LEU CB C 161 41.462 41.462 40.942 0.520 25767 895 1 1 . 1 1 161 161 LEU H H 161 8.323 8.323 7.577 0.746 25767 896 1 1 . 1 1 162 162 ALA N N 162 123.102 123.102 121.245 1.857 25767 897 1 1 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.092 0.038 25767 898 1 1 . 1 1 162 162 ALA C C 162 179.487 179.487 179.219 0.268 25767 899 1 1 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.582 0.162 25767 900 1 1 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.518 -0.115 25767 901 1 1 . 1 1 162 162 ALA H H 162 7.978 7.978 7.495 0.483 25767 902 1 1 . 1 1 163 163 LYS N N 163 116.069 116.069 116.698 -0.629 25767 903 1 1 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.229 -0.006 25767 904 1 1 . 1 1 163 163 LYS C C 163 176.987 176.987 177.013 -0.026 25767 905 1 1 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.510 0.097 25767 906 1 1 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.844 0.362 25767 907 1 1 . 1 1 163 163 LYS H H 163 7.697 7.697 7.633 0.064 25767 908 1 1 . 1 1 164 164 GLY N N 164 108.540 108.540 106.200 2.340 25767 909 1 1 . 1 1 164 164 GLY C C 164 174.721 174.721 174.530 0.191 25767 910 1 1 . 1 1 164 164 GLY CA C 164 45.791 45.791 45.148 0.643 25767 911 1 1 . 1 1 164 164 GLY H H 164 7.772 7.772 7.378 0.394 25767 912 1 1 . 1 1 165 165 GLU N N 165 119.886 119.886 120.190 -0.304 25767 913 1 1 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.414 -0.364 25767 914 1 1 . 1 1 165 165 GLU C C 165 176.027 176.027 175.358 0.669 25767 915 1 1 . 1 1 165 165 GLU CA C 165 56.853 56.853 54.709 2.144 25767 916 1 1 . 1 1 165 165 GLU CB C 165 30.338 30.338 31.021 -0.683 25767 917 1 1 . 1 1 165 165 GLU H H 165 8.065 8.065 7.781 0.284 25767 918 1 1 . 1 1 166 166 ILE N N 166 117.926 117.926 119.884 -1.958 25767 919 1 1 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.918 -0.016 25767 920 1 1 . 1 1 166 166 ILE C C 166 174.138 174.138 176.743 -2.605 25767 921 1 1 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.653 1.802 25767 922 1 1 . 1 1 166 166 ILE CB C 166 40.202 40.202 38.852 1.350 25767 923 1 1 . 1 1 166 166 ILE H H 166 7.282 7.282 8.145 -0.863 25767 924 1 2 . 1 1 2 2 ALA N N 2 122.811 122.811 122.612 0.199 25767 925 1 2 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.106 -0.083 25767 926 1 2 . 1 1 2 2 ALA C C 2 179.915 179.915 179.652 0.263 25767 927 1 2 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.489 -0.372 25767 928 1 2 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.706 -0.167 25767 929 1 2 . 1 1 2 2 ALA H H 2 8.509 8.509 9.062 -0.553 25767 930 1 2 . 1 1 3 3 SER N N 3 115.308 115.308 114.956 0.352 25767 931 1 2 . 1 1 3 3 SER HA H 3 4.097 4.097 4.061 0.036 25767 932 1 2 . 1 1 3 3 SER C C 3 176.706 176.706 176.582 0.124 25767 933 1 2 . 1 1 3 3 SER CA C 3 60.665 60.665 61.473 -0.808 25767 934 1 2 . 1 1 3 3 SER CB C 3 62.710 62.710 62.583 0.127 25767 935 1 2 . 1 1 3 3 SER H H 3 7.996 7.996 8.724 -0.728 25767 936 1 2 . 1 1 4 4 ASN N N 4 122.688 122.688 120.113 2.575 25767 937 1 2 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.357 -0.053 25767 938 1 2 . 1 1 4 4 ASN C C 4 176.258 176.258 176.949 -0.691 25767 939 1 2 . 1 1 4 4 ASN CA C 4 55.701 55.701 55.993 -0.292 25767 940 1 2 . 1 1 4 4 ASN CB C 4 38.177 38.177 38.118 0.059 25767 941 1 2 . 1 1 4 4 ASN H H 4 8.075 8.075 8.224 -0.149 25767 942 1 2 . 1 1 5 5 ALA N N 5 121.900 121.900 122.833 -0.933 25767 943 1 2 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.001 -0.426 25767 944 1 2 . 1 1 5 5 ALA C C 5 178.475 178.475 178.926 -0.451 25767 945 1 2 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.994 0.839 25767 946 1 2 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.376 -0.761 25767 947 1 2 . 1 1 5 5 ALA H H 5 8.659 8.659 7.656 1.003 25767 948 1 2 . 1 1 6 6 ALA N N 6 117.768 117.768 121.558 -3.790 25767 949 1 2 . 1 1 6 6 ALA HA H 6 3.787 3.787 4.004 -0.217 25767 950 1 2 . 1 1 6 6 ALA C C 6 180.494 180.494 179.469 1.025 25767 951 1 2 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.023 0.327 25767 952 1 2 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.235 -0.333 25767 953 1 2 . 1 1 6 6 ALA H H 6 7.864 7.864 7.780 0.084 25767 954 1 2 . 1 1 7 7 ARG N N 7 121.173 121.173 119.172 2.001 25767 955 1 2 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.100 -0.197 25767 956 1 2 . 1 1 7 7 ARG C C 7 179.189 179.189 178.531 0.658 25767 957 1 2 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.320 0.992 25767 958 1 2 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.679 -0.457 25767 959 1 2 . 1 1 7 7 ARG H H 7 7.514 7.514 7.947 -0.433 25767 960 1 2 . 1 1 8 8 VAL N N 8 122.979 122.979 119.971 3.008 25767 961 1 2 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.678 -0.425 25767 962 1 2 . 1 1 8 8 VAL C C 8 177.821 177.821 177.640 0.181 25767 963 1 2 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.827 0.945 25767 964 1 2 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.692 -0.251 25767 965 1 2 . 1 1 8 8 VAL H H 8 8.101 8.101 7.743 0.358 25767 966 1 2 . 1 1 9 9 VAL N N 9 119.801 119.801 120.051 -0.250 25767 967 1 2 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.618 -0.352 25767 968 1 2 . 1 1 9 9 VAL C C 9 177.373 177.373 177.949 -0.576 25767 969 1 2 . 1 1 9 9 VAL CA C 9 67.484 67.484 66.482 1.002 25767 970 1 2 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.701 0.924 25767 971 1 2 . 1 1 9 9 VAL H H 9 8.362 8.362 7.817 0.545 25767 972 1 2 . 1 1 10 10 ALA N N 10 122.360 122.360 122.072 0.288 25767 973 1 2 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.089 -0.153 25767 974 1 2 . 1 1 10 10 ALA C C 10 180.762 180.762 179.745 1.017 25767 975 1 2 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.491 -0.047 25767 976 1 2 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.243 -0.506 25767 977 1 2 . 1 1 10 10 ALA H H 10 7.776 7.776 7.849 -0.073 25767 978 1 2 . 1 1 11 11 THR N N 11 117.376 117.376 114.801 2.575 25767 979 1 2 . 1 1 11 11 THR HA H 11 3.816 3.816 4.042 -0.226 25767 980 1 2 . 1 1 11 11 THR C C 11 175.775 175.775 176.495 -0.720 25767 981 1 2 . 1 1 11 11 THR CA C 11 66.509 66.509 66.533 -0.024 25767 982 1 2 . 1 1 11 11 THR CB C 11 68.588 68.588 68.887 -0.299 25767 983 1 2 . 1 1 11 11 THR H H 11 8.180 8.180 8.169 0.011 25767 984 1 2 . 1 1 12 12 ALA N N 12 125.308 125.308 124.203 1.105 25767 985 1 2 . 1 1 12 12 ALA HA H 12 3.997 3.997 4.107 -0.110 25767 986 1 2 . 1 1 12 12 ALA C C 12 179.399 179.399 179.413 -0.014 25767 987 1 2 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.644 0.432 25767 988 1 2 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.340 0.904 25767 989 1 2 . 1 1 12 12 ALA H H 12 8.671 8.671 8.641 0.030 25767 990 1 2 . 1 1 13 13 LYS N N 13 116.977 116.977 118.515 -1.538 25767 991 1 2 . 1 1 13 13 LYS C C 13 179.646 179.646 178.677 0.969 25767 992 1 2 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.801 -0.880 25767 993 1 2 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.148 -0.705 25767 994 1 2 . 1 1 13 13 LYS H H 13 8.061 8.061 7.725 0.336 25767 995 1 2 . 1 1 14 14 ASP N N 14 121.988 121.988 120.084 1.904 25767 996 1 2 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.393 -0.040 25767 997 1 2 . 1 1 14 14 ASP C C 14 179.446 179.446 178.449 0.997 25767 998 1 2 . 1 1 14 14 ASP CA C 14 57.509 57.509 56.912 0.597 25767 999 1 2 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.391 -0.390 25767 1000 1 2 . 1 1 14 14 ASP H H 14 7.669 7.669 7.662 0.007 25767 1001 1 2 . 1 1 15 15 PHE N N 15 119.588 119.588 118.225 1.363 25767 1002 1 2 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.173 0.171 25767 1003 1 2 . 1 1 15 15 PHE C C 15 178.373 178.373 177.908 0.465 25767 1004 1 2 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.898 0.339 25767 1005 1 2 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.894 -1.398 25767 1006 1 2 . 1 1 15 15 PHE H H 15 7.913 7.913 7.857 0.056 25767 1007 1 2 . 1 1 16 16 ASP N N 16 121.705 121.705 119.859 1.846 25767 1008 1 2 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.425 -0.430 25767 1009 1 2 . 1 1 16 16 ASP C C 16 180.071 180.071 178.472 1.599 25767 1010 1 2 . 1 1 16 16 ASP CA C 16 58.149 58.149 56.941 1.208 25767 1011 1 2 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.674 0.813 25767 1012 1 2 . 1 1 16 16 ASP H H 16 8.324 8.324 7.968 0.356 25767 1013 1 2 . 1 1 17 17 LYS N N 17 118.825 118.825 118.551 0.274 25767 1014 1 2 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.098 -0.061 25767 1015 1 2 . 1 1 17 17 LYS C C 17 178.407 178.407 178.363 0.044 25767 1016 1 2 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.651 0.410 25767 1017 1 2 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.568 0.016 25767 1018 1 2 . 1 1 17 17 LYS H H 17 7.834 7.834 7.682 0.152 25767 1019 1 2 . 1 1 18 18 VAL N N 18 110.562 110.562 116.717 -6.155 25767 1020 1 2 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.056 0.460 25767 1021 1 2 . 1 1 18 18 VAL C C 18 176.144 176.144 176.525 -0.381 25767 1022 1 2 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.385 -2.511 25767 1023 1 2 . 1 1 18 18 VAL CB C 18 31.160 31.160 32.166 -1.006 25767 1024 1 2 . 1 1 18 18 VAL H H 18 7.185 7.185 7.504 -0.319 25767 1025 1 2 . 1 1 19 19 GLY N N 19 109.272 109.272 106.826 2.446 25767 1026 1 2 . 1 1 19 19 GLY C C 19 175.043 175.043 175.036 0.007 25767 1027 1 2 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.658 0.173 25767 1028 1 2 . 1 1 19 19 GLY H H 19 7.723 7.723 7.658 0.065 25767 1029 1 2 . 1 1 20 20 LEU N N 20 125.428 125.428 122.834 2.594 25767 1030 1 2 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.730 -0.410 25767 1031 1 2 . 1 1 20 20 LEU C C 20 177.949 177.949 177.054 0.895 25767 1032 1 2 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.362 -0.558 25767 1033 1 2 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.923 -0.006 25767 1034 1 2 . 1 1 20 20 LEU H H 20 8.083 8.083 7.908 0.175 25767 1035 1 2 . 1 1 21 21 GLY N N 21 107.804 107.804 109.760 -1.956 25767 1036 1 2 . 1 1 21 21 GLY C C 21 176.278 176.278 176.244 0.034 25767 1037 1 2 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.546 -0.252 25767 1038 1 2 . 1 1 21 21 GLY H H 21 7.982 7.982 7.880 0.102 25767 1039 1 2 . 1 1 22 22 ILE N N 22 121.319 121.319 121.773 -0.454 25767 1040 1 2 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.864 0.046 25767 1041 1 2 . 1 1 22 22 ILE C C 22 176.604 176.604 177.583 -0.979 25767 1042 1 2 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.358 -1.911 25767 1043 1 2 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.873 -1.307 25767 1044 1 2 . 1 1 22 22 ILE H H 22 8.478 8.478 7.926 0.552 25767 1045 1 2 . 1 1 23 23 ILE N N 23 120.377 120.377 119.606 0.771 25767 1046 1 2 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.847 -0.134 25767 1047 1 2 . 1 1 23 23 ILE C C 23 178.581 178.581 178.572 0.009 25767 1048 1 2 . 1 1 23 23 ILE CA C 23 64.246 64.246 62.393 1.853 25767 1049 1 2 . 1 1 23 23 ILE CB C 23 36.199 36.199 35.685 0.514 25767 1050 1 2 . 1 1 23 23 ILE H H 23 6.869 6.869 7.663 -0.794 25767 1051 1 2 . 1 1 24 24 GLY N N 24 103.449 103.449 107.943 -4.494 25767 1052 1 2 . 1 1 24 24 GLY C C 24 175.308 175.308 175.685 -0.377 25767 1053 1 2 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.094 0.849 25767 1054 1 2 . 1 1 24 24 GLY H H 24 7.488 7.488 7.479 0.009 25767 1055 1 2 . 1 1 25 25 TYR N N 25 124.685 124.685 124.147 0.538 25767 1056 1 2 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.833 -0.167 25767 1057 1 2 . 1 1 25 25 TYR C C 25 176.208 176.208 177.027 -0.819 25767 1058 1 2 . 1 1 25 25 TYR CA C 25 61.371 61.371 60.616 0.755 25767 1059 1 2 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.062 0.205 25767 1060 1 2 . 1 1 25 25 TYR H H 25 7.931 7.931 8.058 -0.127 25767 1061 1 2 . 1 1 26 26 TYR N N 26 117.001 117.001 119.765 -2.764 25767 1062 1 2 . 1 1 26 26 TYR HA H 26 3.941 3.941 3.915 0.026 25767 1063 1 2 . 1 1 26 26 TYR C C 26 178.753 178.753 177.404 1.349 25767 1064 1 2 . 1 1 26 26 TYR CA C 26 64.260 64.260 62.057 2.203 25767 1065 1 2 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.649 -1.128 25767 1066 1 2 . 1 1 26 26 TYR H H 26 7.693 7.693 7.839 -0.146 25767 1067 1 2 . 1 1 27 27 LEU N N 27 118.657 118.657 116.986 1.671 25767 1068 1 2 . 1 1 27 27 LEU HA H 27 4.311 4.311 3.996 0.315 25767 1069 1 2 . 1 1 27 27 LEU CA C 27 58.297 58.297 57.920 0.377 25767 1070 1 2 . 1 1 27 27 LEU CB C 27 42.723 42.723 40.864 1.859 25767 1071 1 2 . 1 1 27 27 LEU H H 27 8.339 8.339 7.821 0.518 25767 1072 1 2 . 1 1 28 28 GLN N N 28 118.593 118.593 118.835 -0.242 25767 1073 1 2 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.798 -0.147 25767 1074 1 2 . 1 1 28 28 GLN C C 28 177.282 177.282 178.481 -1.199 25767 1075 1 2 . 1 1 28 28 GLN CA C 28 58.829 58.829 59.076 -0.247 25767 1076 1 2 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.512 1.136 25767 1077 1 2 . 1 1 28 28 GLN H H 28 7.970 7.970 7.592 0.378 25767 1078 1 2 . 1 1 29 29 LEU N N 29 122.111 122.111 119.605 2.506 25767 1079 1 2 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.691 0.253 25767 1080 1 2 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.603 1.063 25767 1081 1 2 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.244 0.764 25767 1082 1 2 . 1 1 29 29 LEU H H 29 7.979 7.979 7.370 0.609 25767 1083 1 2 . 1 1 30 30 TYR N N 30 119.283 119.283 119.941 -0.658 25767 1084 1 2 . 1 1 30 30 TYR C C 30 175.775 175.775 177.218 -1.443 25767 1085 1 2 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.673 -1.579 25767 1086 1 2 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.226 0.847 25767 1087 1 2 . 1 1 30 30 TYR H H 30 8.093 8.093 7.506 0.587 25767 1088 1 2 . 1 1 31 31 ALA N N 31 121.327 121.327 122.079 -0.752 25767 1089 1 2 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.812 -0.444 25767 1090 1 2 . 1 1 31 31 ALA C C 31 178.955 178.955 178.955 0.000 25767 1091 1 2 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.335 0.212 25767 1092 1 2 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.284 -0.321 25767 1093 1 2 . 1 1 31 31 ALA H H 31 8.394 8.394 8.265 0.129 25767 1094 1 2 . 1 1 32 32 VAL N N 32 116.757 116.757 116.576 0.181 25767 1095 1 2 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.544 -0.284 25767 1096 1 2 . 1 1 32 32 VAL CA C 32 67.662 67.662 66.254 1.408 25767 1097 1 2 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.384 -0.413 25767 1098 1 2 . 1 1 32 32 VAL H H 32 8.020 8.020 7.541 0.479 25767 1099 1 2 . 1 1 33 33 GLU N N 33 118.775 118.775 120.030 -1.255 25767 1100 1 2 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.816 0.173 25767 1101 1 2 . 1 1 33 33 GLU C C 33 179.746 179.746 178.856 0.890 25767 1102 1 2 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.245 0.758 25767 1103 1 2 . 1 1 33 33 GLU H H 33 7.358 7.358 7.461 -0.103 25767 1104 1 2 . 1 1 34 34 LEU N N 34 120.632 120.632 120.838 -0.206 25767 1105 1 2 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.797 -0.148 25767 1106 1 2 . 1 1 34 34 LEU C C 34 180.336 180.336 178.092 2.244 25767 1107 1 2 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.626 0.049 25767 1108 1 2 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.687 -0.099 25767 1109 1 2 . 1 1 34 34 LEU H H 34 8.390 8.390 7.825 0.565 25767 1110 1 2 . 1 1 35 35 ILE N N 35 121.240 121.240 119.032 2.208 25767 1111 1 2 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.612 -0.070 25767 1112 1 2 . 1 1 35 35 ILE C C 35 178.604 178.604 178.963 -0.359 25767 1113 1 2 . 1 1 35 35 ILE CA C 35 65.547 65.547 65.127 0.420 25767 1114 1 2 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.844 0.886 25767 1115 1 2 . 1 1 35 35 ILE H H 35 8.129 8.129 7.488 0.641 25767 1116 1 2 . 1 1 36 36 LEU N N 36 115.637 115.637 118.852 -3.215 25767 1117 1 2 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.038 -0.030 25767 1118 1 2 . 1 1 36 36 LEU C C 36 178.001 178.001 178.198 -0.197 25767 1119 1 2 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.145 -1.069 25767 1120 1 2 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.329 -1.395 25767 1121 1 2 . 1 1 36 36 LEU H H 36 8.416 8.416 7.791 0.625 25767 1122 1 2 . 1 1 37 37 SER N N 37 114.106 114.106 110.448 3.658 25767 1123 1 2 . 1 1 37 37 SER HA H 37 3.991 3.991 4.415 -0.424 25767 1124 1 2 . 1 1 37 37 SER C C 37 173.997 173.997 174.028 -0.031 25767 1125 1 2 . 1 1 37 37 SER CA C 37 60.311 60.311 58.981 1.330 25767 1126 1 2 . 1 1 37 37 SER CB C 37 63.746 63.746 63.494 0.252 25767 1127 1 2 . 1 1 37 37 SER H H 37 7.517 7.517 7.696 -0.179 25767 1128 1 2 . 1 1 38 38 GLU N N 38 123.003 123.003 121.731 1.272 25767 1129 1 2 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.389 -0.020 25767 1130 1 2 . 1 1 38 38 GLU C C 38 175.780 175.780 175.451 0.329 25767 1131 1 2 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.297 0.068 25767 1132 1 2 . 1 1 38 38 GLU CB C 38 30.293 30.293 31.052 -0.759 25767 1133 1 2 . 1 1 38 38 GLU H H 38 7.151 7.151 7.376 -0.225 25767 1134 1 2 . 1 1 39 39 GLU N N 39 126.166 126.166 122.863 3.303 25767 1135 1 2 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.144 -0.135 25767 1136 1 2 . 1 1 39 39 GLU C C 39 176.652 176.652 175.632 1.020 25767 1137 1 2 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.547 1.651 25767 1138 1 2 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.342 -0.307 25767 1139 1 2 . 1 1 39 39 GLU H H 39 8.587 8.587 8.467 0.120 25767 1140 1 2 . 1 1 40 40 ASP N N 40 120.047 120.047 120.833 -0.786 25767 1141 1 2 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.461 0.089 25767 1142 1 2 . 1 1 40 40 ASP C C 40 175.035 175.035 175.852 -0.817 25767 1143 1 2 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.129 -1.761 25767 1144 1 2 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.857 -0.834 25767 1145 1 2 . 1 1 40 40 ASP H H 40 8.504 8.504 8.490 0.014 25767 1146 1 2 . 1 1 41 41 ARG N N 41 120.671 120.671 122.592 -1.921 25767 1147 1 2 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.618 -0.229 25767 1148 1 2 . 1 1 41 41 ARG C C 41 175.755 175.755 176.111 -0.356 25767 1149 1 2 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.709 0.299 25767 1150 1 2 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.480 -0.931 25767 1151 1 2 . 1 1 41 41 ARG H H 41 7.672 7.672 8.292 -0.620 25767 1152 1 2 . 1 1 42 42 SER N N 42 120.330 120.330 116.527 3.803 25767 1153 1 2 . 1 1 42 42 SER HA H 42 3.837 3.837 4.355 -0.518 25767 1154 1 2 . 1 1 42 42 SER CA C 42 57.326 57.326 59.007 -1.681 25767 1155 1 2 . 1 1 42 42 SER CB C 42 65.762 65.762 64.232 1.530 25767 1156 1 2 . 1 1 42 42 SER H H 42 8.544 8.544 8.283 0.261 25767 1157 1 2 . 1 1 43 43 GLN HA H 43 3.989 3.989 4.017 -0.028 25767 1158 1 2 . 1 1 43 43 GLN C C 43 178.907 178.907 178.011 0.896 25767 1159 1 2 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.968 0.402 25767 1160 1 2 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.645 -0.682 25767 1161 1 2 . 1 1 44 44 GLU N N 44 120.328 120.328 119.354 0.974 25767 1162 1 2 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.991 0.022 25767 1163 1 2 . 1 1 44 44 GLU C C 44 179.824 179.824 178.774 1.050 25767 1164 1 2 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.344 0.701 25767 1165 1 2 . 1 1 44 44 GLU CB C 44 28.648 28.648 28.782 -0.134 25767 1166 1 2 . 1 1 44 44 GLU H H 44 8.938 8.938 8.161 0.777 25767 1167 1 2 . 1 1 45 45 MET N N 45 121.030 121.030 118.470 2.560 25767 1168 1 2 . 1 1 45 45 MET HA H 45 4.412 4.412 4.176 0.236 25767 1169 1 2 . 1 1 45 45 MET C C 45 180.357 180.357 177.426 2.931 25767 1170 1 2 . 1 1 45 45 MET CA C 45 57.209 57.209 59.269 -2.060 25767 1171 1 2 . 1 1 45 45 MET CB C 45 32.436 32.436 32.334 0.102 25767 1172 1 2 . 1 1 45 45 MET H H 45 7.756 7.756 7.786 -0.030 25767 1173 1 2 . 1 1 46 46 THR N N 46 120.008 120.008 115.913 4.095 25767 1174 1 2 . 1 1 46 46 THR HA H 46 4.071 4.071 3.828 0.243 25767 1175 1 2 . 1 1 46 46 THR CA C 46 67.096 67.096 67.559 -0.463 25767 1176 1 2 . 1 1 46 46 THR CB C 46 68.954 68.954 68.295 0.659 25767 1177 1 2 . 1 1 46 46 THR H H 46 8.187 8.187 7.775 0.412 25767 1178 1 2 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.113 -0.004 25767 1179 1 2 . 1 1 47 47 ALA C C 47 180.118 180.118 179.034 1.084 25767 1180 1 2 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.896 0.443 25767 1181 1 2 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.428 -0.596 25767 1182 1 2 . 1 1 47 47 ALA H H 47 8.238 8.238 7.736 0.502 25767 1183 1 2 . 1 1 48 48 LEU N N 48 122.093 122.093 120.573 1.520 25767 1184 1 2 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.056 0.207 25767 1185 1 2 . 1 1 48 48 LEU C C 48 179.103 179.103 178.622 0.481 25767 1186 1 2 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.490 0.250 25767 1187 1 2 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.694 -0.898 25767 1188 1 2 . 1 1 48 48 LEU H H 48 7.778 7.778 7.568 0.210 25767 1189 1 2 . 1 1 49 49 ALA N N 49 120.130 120.130 120.518 -0.388 25767 1190 1 2 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.930 -0.209 25767 1191 1 2 . 1 1 49 49 ALA C C 49 178.676 178.676 179.439 -0.763 25767 1192 1 2 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.363 0.358 25767 1193 1 2 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.041 -0.214 25767 1194 1 2 . 1 1 49 49 ALA H H 49 8.432 8.432 8.290 0.142 25767 1195 1 2 . 1 1 50 50 THR N N 50 113.333 113.333 115.470 -2.137 25767 1196 1 2 . 1 1 50 50 THR HA H 50 3.895 3.895 3.820 0.075 25767 1197 1 2 . 1 1 50 50 THR C C 50 174.948 174.948 176.436 -1.488 25767 1198 1 2 . 1 1 50 50 THR CA C 50 67.334 67.334 67.964 -0.630 25767 1199 1 2 . 1 1 50 50 THR CB C 50 68.864 68.864 68.625 0.239 25767 1200 1 2 . 1 1 50 50 THR H H 50 7.857 7.857 7.880 -0.023 25767 1201 1 2 . 1 1 51 51 GLU N N 51 122.698 122.698 122.139 0.559 25767 1202 1 2 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.014 0.054 25767 1203 1 2 . 1 1 51 51 GLU C C 51 179.997 179.997 178.756 1.241 25767 1204 1 2 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.459 -0.026 25767 1205 1 2 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.571 -0.054 25767 1206 1 2 . 1 1 51 51 GLU H H 51 7.817 7.817 7.620 0.197 25767 1207 1 2 . 1 1 52 52 LEU N N 52 121.100 121.100 119.425 1.675 25767 1208 1 2 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.063 0.066 25767 1209 1 2 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.492 0.397 25767 1210 1 2 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.650 0.297 25767 1211 1 2 . 1 1 52 52 LEU H H 52 8.628 8.628 7.682 0.946 25767 1212 1 2 . 1 1 53 53 LEU N N 53 119.935 119.935 120.334 -0.399 25767 1213 1 2 . 1 1 53 53 LEU C C 53 179.671 179.671 178.350 1.321 25767 1214 1 2 . 1 1 53 53 LEU H H 53 8.303 8.303 7.744 0.559 25767 1215 1 2 . 1 1 54 54 ASP N N 54 120.339 120.339 118.365 1.974 25767 1216 1 2 . 1 1 54 54 ASP C C 54 179.106 179.106 178.324 0.782 25767 1217 1 2 . 1 1 54 54 ASP H H 54 7.901 7.901 7.923 -0.022 25767 1218 1 2 . 1 1 55 55 THR N N 55 120.237 120.237 116.901 3.336 25767 1219 1 2 . 1 1 55 55 THR HA H 55 3.696 3.696 4.053 -0.357 25767 1220 1 2 . 1 1 55 55 THR CA C 55 67.340 67.340 66.542 0.798 25767 1221 1 2 . 1 1 55 55 THR CB C 55 68.151 68.151 68.350 -0.199 25767 1222 1 2 . 1 1 55 55 THR H H 55 8.262 8.262 7.695 0.567 25767 1223 1 2 . 1 1 56 56 ILE N N 56 123.953 123.953 122.297 1.656 25767 1224 1 2 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.723 0.120 25767 1225 1 2 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.783 0.111 25767 1226 1 2 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.630 0.503 25767 1227 1 2 . 1 1 56 56 ILE H H 56 8.930 8.930 7.704 1.226 25767 1228 1 2 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.407 0.174 25767 1229 1 2 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.153 -0.122 25767 1230 1 2 . 1 1 58 58 ALA C C 58 179.875 179.875 179.398 0.477 25767 1231 1 2 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.792 0.474 25767 1232 1 2 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.355 -0.369 25767 1233 1 2 . 1 1 58 58 ALA H H 58 7.764 7.764 8.491 -0.727 25767 1234 1 2 . 1 1 59 59 PHE N N 59 121.988 121.988 119.870 2.118 25767 1235 1 2 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.128 0.098 25767 1236 1 2 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.654 -0.215 25767 1237 1 2 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.273 0.090 25767 1238 1 2 . 1 1 59 59 PHE H H 59 8.159 8.159 8.623 -0.464 25767 1239 1 2 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.956 -0.415 25767 1240 1 2 . 1 1 60 60 LYS C C 60 179.438 179.438 178.951 0.487 25767 1241 1 2 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.559 0.577 25767 1242 1 2 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.367 -0.309 25767 1243 1 2 . 1 1 61 61 LYS N N 61 119.262 119.262 116.984 2.278 25767 1244 1 2 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.215 -0.270 25767 1245 1 2 . 1 1 61 61 LYS C C 61 178.730 178.730 177.580 1.150 25767 1246 1 2 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.343 1.699 25767 1247 1 2 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.013 0.629 25767 1248 1 2 . 1 1 61 61 LYS H H 61 7.832 7.832 7.861 -0.029 25767 1249 1 2 . 1 1 62 62 GLU N N 62 120.790 120.790 120.836 -0.046 25767 1250 1 2 . 1 1 62 62 GLU HA H 62 3.935 3.935 3.941 -0.006 25767 1251 1 2 . 1 1 62 62 GLU C C 62 178.424 178.424 178.038 0.386 25767 1252 1 2 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.795 -0.081 25767 1253 1 2 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.239 -0.009 25767 1254 1 2 . 1 1 62 62 GLU H H 62 7.982 7.982 7.642 0.340 25767 1255 1 2 . 1 1 63 63 ILE N N 63 118.463 118.463 117.257 1.206 25767 1256 1 2 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.762 -0.073 25767 1257 1 2 . 1 1 63 63 ILE C C 63 177.555 177.555 177.169 0.386 25767 1258 1 2 . 1 1 63 63 ILE CA C 63 61.499 61.499 62.737 -1.238 25767 1259 1 2 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.410 -1.886 25767 1260 1 2 . 1 1 63 63 ILE H H 63 7.732 7.732 7.331 0.401 25767 1261 1 2 . 1 1 64 64 GLY N N 64 107.973 107.973 107.240 0.733 25767 1262 1 2 . 1 1 64 64 GLY C C 64 175.271 175.271 174.914 0.357 25767 1263 1 2 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.255 -0.353 25767 1264 1 2 . 1 1 64 64 GLY H H 64 7.661 7.661 7.869 -0.208 25767 1265 1 2 . 1 1 65 65 GLY N N 65 108.464 108.464 107.022 1.442 25767 1266 1 2 . 1 1 65 65 GLY C C 65 174.800 174.800 175.824 -1.024 25767 1267 1 2 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.627 0.019 25767 1268 1 2 . 1 1 65 65 GLY H H 65 7.808 7.808 8.068 -0.260 25767 1269 1 2 . 1 1 66 66 GLU N N 66 121.162 121.162 121.191 -0.029 25767 1270 1 2 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.031 0.074 25767 1271 1 2 . 1 1 66 66 GLU C C 66 177.230 177.230 178.819 -1.589 25767 1272 1 2 . 1 1 66 66 GLU CA C 66 57.224 57.224 58.926 -1.702 25767 1273 1 2 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.445 0.547 25767 1274 1 2 . 1 1 66 66 GLU H H 66 8.203 8.203 7.756 0.447 25767 1275 1 2 . 1 1 67 67 SER N N 67 116.468 116.468 114.962 1.506 25767 1276 1 2 . 1 1 67 67 SER HA H 67 4.249 4.249 4.182 0.067 25767 1277 1 2 . 1 1 67 67 SER C C 67 174.640 174.640 176.355 -1.715 25767 1278 1 2 . 1 1 67 67 SER CA C 67 58.930 58.930 60.526 -1.596 25767 1279 1 2 . 1 1 67 67 SER CB C 67 63.912 63.912 62.722 1.190 25767 1280 1 2 . 1 1 67 67 SER H H 67 8.206 8.206 8.138 0.068 25767 1281 1 2 . 1 1 68 68 GLU N N 68 122.400 122.400 120.403 1.997 25767 1282 1 2 . 1 1 68 68 GLU HA H 68 4.153 4.153 3.979 0.174 25767 1283 1 2 . 1 1 68 68 GLU C C 68 176.349 176.349 177.080 -0.731 25767 1284 1 2 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.729 -1.906 25767 1285 1 2 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.267 0.714 25767 1286 1 2 . 1 1 68 68 GLU H H 68 8.168 8.168 8.537 -0.369 25767 1287 1 2 . 1 1 69 69 ALA N N 69 124.342 124.342 120.091 4.251 25767 1288 1 2 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.101 0.087 25767 1289 1 2 . 1 1 69 69 ALA C C 69 178.027 178.027 178.109 -0.082 25767 1290 1 2 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.679 -1.121 25767 1291 1 2 . 1 1 69 69 ALA CB C 69 19.492 19.492 19.103 0.389 25767 1292 1 2 . 1 1 69 69 ALA H H 69 7.939 7.939 7.370 0.569 25767 1293 1 2 . 1 1 70 70 GLU N N 70 121.059 121.059 117.919 3.140 25767 1294 1 2 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.399 -0.285 25767 1295 1 2 . 1 1 70 70 GLU C C 70 176.519 176.519 174.986 1.533 25767 1296 1 2 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.541 1.763 25767 1297 1 2 . 1 1 70 70 GLU CB C 70 29.827 29.827 31.351 -1.524 25767 1298 1 2 . 1 1 70 70 GLU H H 70 8.430 8.430 7.615 0.815 25767 1299 1 2 . 1 1 71 71 ASP N N 71 120.274 120.274 121.760 -1.486 25767 1300 1 2 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.301 0.231 25767 1301 1 2 . 1 1 71 71 ASP C C 71 176.369 176.369 176.866 -0.497 25767 1302 1 2 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.298 -1.047 25767 1303 1 2 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.525 1.315 25767 1304 1 2 . 1 1 71 71 ASP H H 71 8.305 8.305 8.944 -0.639 25767 1305 1 2 . 1 1 72 72 SER N N 72 116.165 116.165 114.195 1.970 25767 1306 1 2 . 1 1 72 72 SER HA H 72 4.241 4.241 3.961 0.280 25767 1307 1 2 . 1 1 72 72 SER C C 72 174.567 174.567 175.518 -0.951 25767 1308 1 2 . 1 1 72 72 SER CA C 72 59.031 59.031 61.170 -2.139 25767 1309 1 2 . 1 1 72 72 SER CB C 72 64.040 64.040 63.337 0.703 25767 1310 1 2 . 1 1 72 72 SER H H 72 7.964 7.964 8.317 -0.353 25767 1311 1 2 . 1 1 73 73 ASP N N 73 122.440 122.440 121.975 0.465 25767 1312 1 2 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.026 0.508 25767 1313 1 2 . 1 1 73 73 ASP C C 73 176.882 176.882 177.831 -0.949 25767 1314 1 2 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.160 -2.716 25767 1315 1 2 . 1 1 73 73 ASP CB C 73 41.336 41.336 39.973 1.363 25767 1316 1 2 . 1 1 73 73 ASP H H 73 8.392 8.392 8.598 -0.206 25767 1317 1 2 . 1 1 74 74 LYS N N 74 123.270 123.270 120.293 2.977 25767 1318 1 2 . 1 1 74 74 LYS HA H 74 4.093 4.093 3.977 0.116 25767 1319 1 2 . 1 1 74 74 LYS C C 74 177.608 177.608 178.812 -1.204 25767 1320 1 2 . 1 1 74 74 LYS CA C 74 57.465 57.465 58.990 -1.525 25767 1321 1 2 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.595 -0.449 25767 1322 1 2 . 1 1 74 74 LYS H H 74 8.317 8.317 7.919 0.398 25767 1323 1 2 . 1 1 75 75 SER N N 75 116.557 116.557 116.208 0.349 25767 1324 1 2 . 1 1 75 75 SER HA H 75 4.197 4.197 4.156 0.041 25767 1325 1 2 . 1 1 75 75 SER C C 75 175.988 175.988 176.856 -0.868 25767 1326 1 2 . 1 1 75 75 SER CA C 75 60.434 60.434 62.225 -1.791 25767 1327 1 2 . 1 1 75 75 SER CB C 75 63.172 63.172 62.948 0.224 25767 1328 1 2 . 1 1 75 75 SER H H 75 8.387 8.387 8.272 0.115 25767 1329 1 2 . 1 1 76 76 LEU N N 76 123.910 123.910 121.536 2.374 25767 1330 1 2 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.914 0.256 25767 1331 1 2 . 1 1 76 76 LEU C C 76 178.083 178.083 178.672 -0.589 25767 1332 1 2 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.808 -1.316 25767 1333 1 2 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.565 0.133 25767 1334 1 2 . 1 1 76 76 LEU H H 76 8.059 8.059 8.346 -0.287 25767 1335 1 2 . 1 1 77 77 HIS N N 77 120.620 120.620 118.925 1.695 25767 1336 1 2 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.217 0.071 25767 1337 1 2 . 1 1 77 77 HIS C C 77 177.667 177.667 178.312 -0.645 25767 1338 1 2 . 1 1 77 77 HIS CA C 77 58.422 58.422 58.997 -0.575 25767 1339 1 2 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.862 0.402 25767 1340 1 2 . 1 1 77 77 HIS H H 77 7.936 7.936 7.885 0.051 25767 1341 1 2 . 1 1 78 78 VAL N N 78 121.774 121.774 119.501 2.273 25767 1342 1 2 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.666 0.011 25767 1343 1 2 . 1 1 78 78 VAL CA C 78 65.606 65.606 67.031 -1.425 25767 1344 1 2 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.601 0.263 25767 1345 1 2 . 1 1 78 78 VAL H H 78 7.916 7.916 7.931 -0.015 25767 1346 1 2 . 1 1 79 79 MET N N 79 119.660 119.660 118.605 1.055 25767 1347 1 2 . 1 1 79 79 MET HA H 79 3.925 3.925 4.005 -0.080 25767 1348 1 2 . 1 1 79 79 MET C C 79 177.077 177.077 178.572 -1.495 25767 1349 1 2 . 1 1 79 79 MET CA C 79 58.862 58.862 59.873 -1.010 25767 1350 1 2 . 1 1 79 79 MET CB C 79 32.852 32.852 32.336 0.516 25767 1351 1 2 . 1 1 79 79 MET H H 79 8.149 8.149 8.001 0.148 25767 1352 1 2 . 1 1 80 80 ASN N N 80 117.337 117.337 118.676 -1.339 25767 1353 1 2 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.833 -0.695 25767 1354 1 2 . 1 1 80 80 ASN C C 80 178.133 178.133 178.592 -0.459 25767 1355 1 2 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.044 0.995 25767 1356 1 2 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.747 0.249 25767 1357 1 2 . 1 1 80 80 ASN H H 80 8.202 8.202 8.901 -0.699 25767 1358 1 2 . 1 1 81 81 THR N N 81 115.517 115.517 119.152 -3.635 25767 1359 1 2 . 1 1 81 81 THR HA H 81 3.896 3.896 4.058 -0.162 25767 1360 1 2 . 1 1 81 81 THR C C 81 175.186 175.186 175.992 -0.806 25767 1361 1 2 . 1 1 81 81 THR CA C 81 66.221 66.221 67.363 -1.142 25767 1362 1 2 . 1 1 81 81 THR CB C 81 69.087 69.087 68.870 0.217 25767 1363 1 2 . 1 1 81 81 THR H H 81 7.944 7.944 8.226 -0.282 25767 1364 1 2 . 1 1 82 82 LEU N N 82 119.074 119.074 119.994 -0.920 25767 1365 1 2 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.057 -0.076 25767 1366 1 2 . 1 1 82 82 LEU C C 82 177.583 177.583 177.873 -0.290 25767 1367 1 2 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.332 -0.792 25767 1368 1 2 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.835 -0.042 25767 1369 1 2 . 1 1 82 82 LEU H H 82 7.547 7.547 7.575 -0.028 25767 1370 1 2 . 1 1 83 83 ILE N N 83 118.085 118.085 116.008 2.077 25767 1371 1 2 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.544 0.299 25767 1372 1 2 . 1 1 83 83 ILE C C 83 176.413 176.413 177.480 -1.067 25767 1373 1 2 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.483 -0.756 25767 1374 1 2 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.243 -0.545 25767 1375 1 2 . 1 1 83 83 ILE H H 83 7.409 7.409 7.614 -0.205 25767 1376 1 2 . 1 1 84 84 HIS N N 84 116.152 116.152 116.864 -0.712 25767 1377 1 2 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.379 0.216 25767 1378 1 2 . 1 1 84 84 HIS C C 84 175.707 175.707 175.708 -0.001 25767 1379 1 2 . 1 1 84 84 HIS CA C 84 58.628 58.628 58.748 -0.120 25767 1380 1 2 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.212 1.191 25767 1381 1 2 . 1 1 84 84 HIS H H 84 7.194 7.194 8.146 -0.952 25767 1382 1 2 . 1 1 85 85 ASP N N 85 122.322 122.322 120.264 2.058 25767 1383 1 2 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.729 -0.195 25767 1384 1 2 . 1 1 85 85 ASP C C 85 175.580 175.580 176.566 -0.986 25767 1385 1 2 . 1 1 85 85 ASP CA C 85 53.345 53.345 54.099 -0.754 25767 1386 1 2 . 1 1 85 85 ASP CB C 85 41.118 41.118 40.589 0.529 25767 1387 1 2 . 1 1 85 85 ASP H H 85 8.505 8.505 7.829 0.676 25767 1388 1 2 . 1 1 86 86 GLN N N 86 122.783 122.783 125.571 -2.788 25767 1389 1 2 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.043 -0.080 25767 1390 1 2 . 1 1 86 86 GLN C C 86 178.581 178.581 177.333 1.248 25767 1391 1 2 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.605 -1.651 25767 1392 1 2 . 1 1 86 86 GLN CB C 86 28.894 28.894 28.909 -0.015 25767 1393 1 2 . 1 1 86 86 GLN H H 86 8.803 8.803 8.627 0.176 25767 1394 1 2 . 1 1 87 87 GLU N N 87 121.794 121.794 118.869 2.925 25767 1395 1 2 . 1 1 87 87 GLU HA H 87 4.013 4.013 3.954 0.059 25767 1396 1 2 . 1 1 87 87 GLU C C 87 178.290 178.290 178.891 -0.601 25767 1397 1 2 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.808 -0.770 25767 1398 1 2 . 1 1 87 87 GLU CB C 87 28.980 28.980 28.418 0.562 25767 1399 1 2 . 1 1 87 87 GLU H H 87 8.072 8.072 8.887 -0.815 25767 1400 1 2 . 1 1 88 88 LYS N N 88 119.345 119.345 118.712 0.633 25767 1401 1 2 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.128 -0.373 25767 1402 1 2 . 1 1 88 88 LYS C C 88 180.040 180.040 178.859 1.181 25767 1403 1 2 . 1 1 88 88 LYS CA C 88 59.411 59.411 58.711 0.700 25767 1404 1 2 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.708 0.299 25767 1405 1 2 . 1 1 88 88 LYS H H 88 7.588 7.588 7.615 -0.027 25767 1406 1 2 . 1 1 89 89 ALA N N 89 123.933 123.933 122.585 1.348 25767 1407 1 2 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.189 -0.450 25767 1408 1 2 . 1 1 89 89 ALA C C 89 177.457 177.457 179.635 -2.178 25767 1409 1 2 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.304 0.666 25767 1410 1 2 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.250 0.406 25767 1411 1 2 . 1 1 89 89 ALA H H 89 8.500 8.500 7.700 0.800 25767 1412 1 2 . 1 1 90 90 LYS N N 90 119.244 119.244 119.755 -0.511 25767 1413 1 2 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.930 0.114 25767 1414 1 2 . 1 1 90 90 LYS C C 90 177.774 177.774 178.923 -1.149 25767 1415 1 2 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.841 -0.763 25767 1416 1 2 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.514 -2.273 25767 1417 1 2 . 1 1 90 90 LYS H H 90 6.845 6.845 8.058 -1.213 25767 1418 1 2 . 1 1 91 91 ILE N N 91 117.718 117.718 117.234 0.484 25767 1419 1 2 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.701 -0.303 25767 1420 1 2 . 1 1 91 91 ILE C C 91 177.670 177.670 177.507 0.163 25767 1421 1 2 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.657 -0.659 25767 1422 1 2 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.091 0.710 25767 1423 1 2 . 1 1 91 91 ILE H H 91 7.293 7.293 8.041 -0.748 25767 1424 1 2 . 1 1 92 92 TYR N N 92 121.868 121.868 121.928 -0.060 25767 1425 1 2 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.083 0.040 25767 1426 1 2 . 1 1 92 92 TYR C C 92 178.781 178.781 177.513 1.268 25767 1427 1 2 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.401 -0.759 25767 1428 1 2 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.721 0.500 25767 1429 1 2 . 1 1 92 92 TYR H H 92 8.016 8.016 8.178 -0.162 25767 1430 1 2 . 1 1 93 93 MET N N 93 118.984 118.984 117.421 1.563 25767 1431 1 2 . 1 1 93 93 MET HA H 93 3.952 3.952 4.063 -0.111 25767 1432 1 2 . 1 1 93 93 MET C C 93 179.925 179.925 178.527 1.398 25767 1433 1 2 . 1 1 93 93 MET CA C 93 57.589 57.589 57.190 0.399 25767 1434 1 2 . 1 1 93 93 MET CB C 93 30.752 30.752 31.444 -0.692 25767 1435 1 2 . 1 1 93 93 MET H H 93 8.464 8.464 8.717 -0.253 25767 1436 1 2 . 1 1 94 94 LEU N N 94 125.441 125.441 122.091 3.350 25767 1437 1 2 . 1 1 94 94 LEU HA H 94 3.870 3.870 3.883 -0.013 25767 1438 1 2 . 1 1 94 94 LEU C C 94 177.937 177.937 178.752 -0.815 25767 1439 1 2 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.028 0.733 25767 1440 1 2 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.513 0.249 25767 1441 1 2 . 1 1 94 94 LEU H H 94 8.927 8.927 8.439 0.488 25767 1442 1 2 . 1 1 95 95 ASN N N 95 119.066 119.066 117.657 1.409 25767 1443 1 2 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.357 -0.095 25767 1444 1 2 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.032 0.241 25767 1445 1 2 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.105 -0.500 25767 1446 1 2 . 1 1 95 95 ASN H H 95 8.691 8.691 8.405 0.286 25767 1447 1 2 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.259 0.406 25767 1448 1 2 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.426 0.645 25767 1449 1 2 . 1 1 96 96 PHE H H 96 8.317 8.317 8.018 0.299 25767 1450 1 2 . 1 1 97 97 THR N N 97 118.178 118.178 113.963 4.215 25767 1451 1 2 . 1 1 97 97 THR HA H 97 3.338 3.338 3.925 -0.587 25767 1452 1 2 . 1 1 97 97 THR C C 97 176.074 176.074 176.697 -0.623 25767 1453 1 2 . 1 1 97 97 THR CA C 97 67.986 67.986 66.348 1.638 25767 1454 1 2 . 1 1 97 97 THR H H 97 8.214 8.214 8.317 -0.103 25767 1455 1 2 . 1 1 98 98 MET N N 98 120.097 120.097 122.414 -2.317 25767 1456 1 2 . 1 1 98 98 MET HA H 98 4.403 4.403 4.015 0.388 25767 1457 1 2 . 1 1 98 98 MET C C 98 178.696 178.696 177.643 1.053 25767 1458 1 2 . 1 1 98 98 MET CA C 98 57.029 57.029 59.691 -2.662 25767 1459 1 2 . 1 1 98 98 MET CB C 98 29.898 29.898 32.488 -2.590 25767 1460 1 2 . 1 1 98 98 MET H H 98 8.885 8.885 8.362 0.523 25767 1461 1 2 . 1 1 99 99 SER N N 99 114.959 114.959 116.073 -1.114 25767 1462 1 2 . 1 1 99 99 SER HA H 99 4.199 4.199 4.122 0.077 25767 1463 1 2 . 1 1 99 99 SER C C 99 176.565 176.565 176.864 -0.299 25767 1464 1 2 . 1 1 99 99 SER CA C 99 61.965 61.965 62.147 -0.182 25767 1465 1 2 . 1 1 99 99 SER CB C 99 62.565 62.565 62.952 -0.387 25767 1466 1 2 . 1 1 99 99 SER H H 99 7.515 7.515 7.697 -0.182 25767 1467 1 2 . 1 1 100 100 LEU N N 100 125.380 125.380 122.225 3.155 25767 1468 1 2 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.954 -0.178 25767 1469 1 2 . 1 1 100 100 LEU C C 100 177.689 177.689 178.894 -1.205 25767 1470 1 2 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.645 0.412 25767 1471 1 2 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.560 -0.010 25767 1472 1 2 . 1 1 100 100 LEU H H 100 7.400 7.400 7.576 -0.176 25767 1473 1 2 . 1 1 101 101 TYR N N 101 120.597 120.597 120.723 -0.126 25767 1474 1 2 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.961 0.155 25767 1475 1 2 . 1 1 101 101 TYR C C 101 176.825 176.825 177.530 -0.705 25767 1476 1 2 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.591 -0.703 25767 1477 1 2 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.442 0.551 25767 1478 1 2 . 1 1 101 101 TYR H H 101 8.880 8.880 8.385 0.495 25767 1479 1 2 . 1 1 102 102 ASN N N 102 116.869 116.869 117.084 -0.215 25767 1480 1 2 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.257 -0.091 25767 1481 1 2 . 1 1 102 102 ASN C C 102 179.089 179.089 177.633 1.456 25767 1482 1 2 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.740 -0.528 25767 1483 1 2 . 1 1 102 102 ASN CB C 102 37.734 37.734 38.368 -0.634 25767 1484 1 2 . 1 1 102 102 ASN H H 102 8.543 8.543 8.002 0.541 25767 1485 1 2 . 1 1 103 103 GLU N N 103 121.259 121.259 120.547 0.712 25767 1486 1 2 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.902 0.084 25767 1487 1 2 . 1 1 103 103 GLU C C 103 179.968 179.968 178.802 1.166 25767 1488 1 2 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.543 -0.026 25767 1489 1 2 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.501 0.049 25767 1490 1 2 . 1 1 103 103 GLU H H 103 7.872 7.872 8.003 -0.131 25767 1491 1 2 . 1 1 104 104 LYS N N 104 120.268 120.268 119.708 0.560 25767 1492 1 2 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.177 -0.131 25767 1493 1 2 . 1 1 104 104 LYS C C 104 178.355 178.355 178.957 -0.602 25767 1494 1 2 . 1 1 104 104 LYS CA C 104 56.735 56.735 59.328 -2.593 25767 1495 1 2 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.401 -3.288 25767 1496 1 2 . 1 1 104 104 LYS H H 104 8.384 8.384 8.174 0.210 25767 1497 1 2 . 1 1 105 105 LEU N N 105 121.622 121.622 119.762 1.860 25767 1498 1 2 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.671 0.070 25767 1499 1 2 . 1 1 105 105 LEU C C 105 180.552 180.552 178.686 1.866 25767 1500 1 2 . 1 1 105 105 LEU CA C 105 58.172 58.172 57.917 0.255 25767 1501 1 2 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.299 -0.269 25767 1502 1 2 . 1 1 105 105 LEU H H 105 8.400 8.400 7.637 0.763 25767 1503 1 2 . 1 1 106 106 LYS N N 106 119.498 119.498 118.409 1.089 25767 1504 1 2 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.816 0.098 25767 1505 1 2 . 1 1 106 106 LYS C C 106 178.419 178.419 179.076 -0.657 25767 1506 1 2 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.833 -0.450 25767 1507 1 2 . 1 1 106 106 LYS CB C 106 31.808 31.808 32.014 -0.206 25767 1508 1 2 . 1 1 106 106 LYS H H 106 7.067 7.067 7.580 -0.513 25767 1509 1 2 . 1 1 107 107 GLN N N 107 121.405 121.405 118.853 2.552 25767 1510 1 2 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.965 -0.114 25767 1511 1 2 . 1 1 107 107 GLN C C 107 177.935 177.935 179.025 -1.090 25767 1512 1 2 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.633 -0.152 25767 1513 1 2 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.569 -1.771 25767 1514 1 2 . 1 1 107 107 GLN H H 107 7.460 7.460 7.726 -0.266 25767 1515 1 2 . 1 1 108 108 LEU N N 108 119.561 119.561 118.793 0.768 25767 1516 1 2 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.792 0.009 25767 1517 1 2 . 1 1 108 108 LEU C C 108 179.195 179.195 178.112 1.083 25767 1518 1 2 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.307 1.086 25767 1519 1 2 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.757 -0.491 25767 1520 1 2 . 1 1 108 108 LEU H H 108 8.208 8.208 8.081 0.127 25767 1521 1 2 . 1 1 109 109 LYS N N 109 118.535 118.535 116.609 1.926 25767 1522 1 2 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.148 0.104 25767 1523 1 2 . 1 1 109 109 LYS C C 109 177.726 177.726 177.977 -0.251 25767 1524 1 2 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.539 0.191 25767 1525 1 2 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.906 -0.496 25767 1526 1 2 . 1 1 109 109 LYS H H 109 7.168 7.168 7.617 -0.449 25767 1527 1 2 . 1 1 110 110 ASP N N 110 117.463 117.463 116.285 1.178 25767 1528 1 2 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.694 -0.089 25767 1529 1 2 . 1 1 110 110 ASP C C 110 177.360 177.360 176.496 0.864 25767 1530 1 2 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.443 1.454 25767 1531 1 2 . 1 1 110 110 ASP CB C 110 42.577 42.577 42.143 0.434 25767 1532 1 2 . 1 1 110 110 ASP H H 110 7.861 7.861 8.194 -0.333 25767 1533 1 2 . 1 1 111 111 GLY N N 111 113.059 113.059 108.945 4.114 25767 1534 1 2 . 1 1 111 111 GLY CA C 111 42.052 42.052 43.010 -0.958 25767 1535 1 2 . 1 1 111 111 GLY H H 111 8.479 8.479 7.706 0.773 25767 1536 1 2 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.082 0.381 25767 1537 1 2 . 1 1 112 112 PRO C C 112 175.090 175.090 175.669 -0.579 25767 1538 1 2 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.081 -0.718 25767 1539 1 2 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.820 2.030 25767 1540 1 2 . 1 1 113 113 TRP N N 113 123.164 123.164 121.664 1.500 25767 1541 1 2 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.721 -0.011 25767 1542 1 2 . 1 1 113 113 TRP C C 113 174.605 174.605 175.183 -0.578 25767 1543 1 2 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.262 0.643 25767 1544 1 2 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.400 -3.107 25767 1545 1 2 . 1 1 113 113 TRP H H 113 8.687 8.687 8.465 0.222 25767 1546 1 2 . 1 1 114 114 ASP N N 114 121.356 121.356 121.699 -0.343 25767 1547 1 2 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.938 -0.077 25767 1548 1 2 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.934 -0.685 25767 1549 1 2 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.236 -1.095 25767 1550 1 2 . 1 1 114 114 ASP H H 114 6.985 6.985 8.334 -1.349 25767 1551 1 2 . 1 1 115 115 VAL N N 115 118.649 118.649 118.779 -0.130 25767 1552 1 2 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.884 -0.042 25767 1553 1 2 . 1 1 115 115 VAL C C 115 177.739 177.739 177.389 0.350 25767 1554 1 2 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.484 0.085 25767 1555 1 2 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.178 -0.501 25767 1556 1 2 . 1 1 115 115 VAL H H 115 8.206 8.206 8.396 -0.190 25767 1557 1 2 . 1 1 116 116 MET N N 116 120.401 120.401 117.619 2.782 25767 1558 1 2 . 1 1 116 116 MET HA H 116 4.303 4.303 4.182 0.121 25767 1559 1 2 . 1 1 116 116 MET C C 116 179.269 179.269 178.182 1.087 25767 1560 1 2 . 1 1 116 116 MET CA C 116 57.634 57.634 59.002 -1.368 25767 1561 1 2 . 1 1 116 116 MET CB C 116 30.414 30.414 31.962 -1.548 25767 1562 1 2 . 1 1 116 116 MET H H 116 7.642 7.642 8.147 -0.505 25767 1563 1 2 . 1 1 117 117 LEU N N 117 125.503 125.503 119.028 6.475 25767 1564 1 2 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.068 0.177 25767 1565 1 2 . 1 1 117 117 LEU C C 117 178.445 178.445 179.242 -0.797 25767 1566 1 2 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.829 0.371 25767 1567 1 2 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.258 -1.169 25767 1568 1 2 . 1 1 117 117 LEU H H 117 8.157 8.157 7.560 0.597 25767 1569 1 2 . 1 1 118 118 LYS N N 118 119.052 119.052 118.900 0.152 25767 1570 1 2 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.975 -0.170 25767 1571 1 2 . 1 1 118 118 LYS C C 118 178.251 178.251 179.341 -1.090 25767 1572 1 2 . 1 1 118 118 LYS CA C 118 60.526 60.526 59.963 0.563 25767 1573 1 2 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.092 0.036 25767 1574 1 2 . 1 1 118 118 LYS H H 118 7.400 7.400 7.466 -0.066 25767 1575 1 2 . 1 1 119 119 ARG N N 119 117.999 117.999 119.114 -1.115 25767 1576 1 2 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.283 -0.063 25767 1577 1 2 . 1 1 119 119 ARG C C 119 180.441 180.441 179.080 1.361 25767 1578 1 2 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.660 0.157 25767 1579 1 2 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.245 -0.160 25767 1580 1 2 . 1 1 119 119 ARG H H 119 8.265 8.265 7.934 0.331 25767 1581 1 2 . 1 1 120 120 SER N N 120 118.073 118.073 116.168 1.905 25767 1582 1 2 . 1 1 120 120 SER HA H 120 4.182 4.182 4.337 -0.155 25767 1583 1 2 . 1 1 120 120 SER C C 120 176.215 176.215 176.526 -0.311 25767 1584 1 2 . 1 1 120 120 SER CA C 120 62.817 62.817 61.703 1.113 25767 1585 1 2 . 1 1 120 120 SER CB C 120 63.550 63.550 62.405 1.145 25767 1586 1 2 . 1 1 120 120 SER H H 120 8.633 8.633 7.974 0.659 25767 1587 1 2 . 1 1 121 121 LEU N N 121 125.029 125.029 123.044 1.985 25767 1588 1 2 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.002 0.217 25767 1589 1 2 . 1 1 121 121 LEU C C 121 179.679 179.679 178.732 0.947 25767 1590 1 2 . 1 1 121 121 LEU CA C 121 58.849 58.849 57.851 0.998 25767 1591 1 2 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.313 -0.539 25767 1592 1 2 . 1 1 121 121 LEU H H 121 8.313 8.313 7.630 0.683 25767 1593 1 2 . 1 1 122 122 TRP N N 122 120.217 120.217 119.765 0.452 25767 1594 1 2 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.394 -0.054 25767 1595 1 2 . 1 1 122 122 TRP C C 122 177.527 177.527 178.894 -1.367 25767 1596 1 2 . 1 1 122 122 TRP CA C 122 61.758 61.758 61.486 0.272 25767 1597 1 2 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.034 0.614 25767 1598 1 2 . 1 1 122 122 TRP H H 122 7.928 7.928 7.939 -0.011 25767 1599 1 2 . 1 1 123 123 CYS N N 123 119.669 119.669 118.651 1.018 25767 1600 1 2 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.315 -0.108 25767 1601 1 2 . 1 1 123 123 CYS C C 123 177.057 177.057 177.098 -0.041 25767 1602 1 2 . 1 1 123 123 CYS CA C 123 62.600 62.600 63.878 -1.278 25767 1603 1 2 . 1 1 123 123 CYS CB C 123 25.899 25.899 27.357 -1.458 25767 1604 1 2 . 1 1 123 123 CYS H H 123 8.273 8.273 8.202 0.071 25767 1605 1 2 . 1 1 124 124 CYS N N 124 116.898 116.898 119.989 -3.091 25767 1606 1 2 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.076 -0.228 25767 1607 1 2 . 1 1 124 124 CYS C C 124 175.759 175.759 177.028 -1.269 25767 1608 1 2 . 1 1 124 124 CYS CA C 124 65.653 65.653 64.867 0.786 25767 1609 1 2 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.649 -0.132 25767 1610 1 2 . 1 1 124 124 CYS H H 124 8.122 8.122 8.471 -0.349 25767 1611 1 2 . 1 1 125 125 ILE N N 125 120.498 120.498 120.440 0.058 25767 1612 1 2 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.628 -0.040 25767 1613 1 2 . 1 1 125 125 ILE C C 125 179.337 179.337 177.631 1.706 25767 1614 1 2 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.764 1.830 25767 1615 1 2 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.616 0.063 25767 1616 1 2 . 1 1 125 125 ILE H H 125 8.092 8.092 8.560 -0.468 25767 1617 1 2 . 1 1 126 126 ASP N N 126 125.084 125.084 121.491 3.593 25767 1618 1 2 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.489 0.128 25767 1619 1 2 . 1 1 126 126 ASP C C 126 178.299 178.299 179.170 -0.871 25767 1620 1 2 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.270 1.734 25767 1621 1 2 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.059 0.237 25767 1622 1 2 . 1 1 126 126 ASP H H 126 9.049 9.049 7.927 1.122 25767 1623 1 2 . 1 1 127 127 LEU N N 127 122.591 122.591 120.368 2.223 25767 1624 1 2 . 1 1 127 127 LEU HA H 127 3.867 3.867 4.030 -0.163 25767 1625 1 2 . 1 1 127 127 LEU C C 127 179.655 179.655 179.150 0.505 25767 1626 1 2 . 1 1 127 127 LEU CA C 127 58.661 58.661 58.060 0.601 25767 1627 1 2 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.829 0.365 25767 1628 1 2 . 1 1 127 127 LEU H H 127 8.888 8.888 7.809 1.079 25767 1629 1 2 . 1 1 128 128 PHE N N 128 117.498 117.498 118.706 -1.208 25767 1630 1 2 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.186 0.136 25767 1631 1 2 . 1 1 128 128 PHE C C 128 178.533 178.533 177.829 0.704 25767 1632 1 2 . 1 1 128 128 PHE CA C 128 60.932 60.932 62.322 -1.390 25767 1633 1 2 . 1 1 128 128 PHE CB C 128 39.053 39.053 39.344 -0.291 25767 1634 1 2 . 1 1 128 128 PHE H H 128 8.947 8.947 8.088 0.859 25767 1635 1 2 . 1 1 129 129 SER N N 129 115.398 115.398 115.814 -0.416 25767 1636 1 2 . 1 1 129 129 SER HA H 129 4.046 4.046 4.310 -0.264 25767 1637 1 2 . 1 1 129 129 SER C C 129 175.168 175.168 177.364 -2.196 25767 1638 1 2 . 1 1 129 129 SER CA C 129 63.015 63.015 61.994 1.021 25767 1639 1 2 . 1 1 129 129 SER H H 129 8.578 8.578 9.094 -0.516 25767 1640 1 2 . 1 1 130 130 CYS N N 130 125.556 125.556 121.753 3.803 25767 1641 1 2 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.332 -0.223 25767 1642 1 2 . 1 1 130 130 CYS C C 130 175.294 175.294 177.200 -1.906 25767 1643 1 2 . 1 1 130 130 CYS CA C 130 61.438 61.438 64.251 -2.813 25767 1644 1 2 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.333 -0.283 25767 1645 1 2 . 1 1 130 130 CYS H H 130 8.289 8.289 8.667 -0.378 25767 1646 1 2 . 1 1 131 131 ILE N N 131 120.232 120.232 121.133 -0.901 25767 1647 1 2 . 1 1 131 131 ILE HA H 131 4.033 4.033 4.061 -0.028 25767 1648 1 2 . 1 1 131 131 ILE C C 131 177.297 177.297 178.714 -1.417 25767 1649 1 2 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.630 -0.978 25767 1650 1 2 . 1 1 131 131 ILE CB C 131 39.102 39.102 38.023 1.079 25767 1651 1 2 . 1 1 131 131 ILE H H 131 7.943 7.943 8.076 -0.133 25767 1652 1 2 . 1 1 132 132 LEU N N 132 116.422 116.422 120.802 -4.380 25767 1653 1 2 . 1 1 132 132 LEU HA H 132 3.845 3.845 4.040 -0.195 25767 1654 1 2 . 1 1 132 132 LEU C C 132 177.816 177.816 178.478 -0.662 25767 1655 1 2 . 1 1 132 132 LEU CA C 132 57.078 57.078 58.219 -1.141 25767 1656 1 2 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.643 0.570 25767 1657 1 2 . 1 1 132 132 LEU H H 132 7.846 7.846 8.287 -0.441 25767 1658 1 2 . 1 1 133 133 HIS N N 133 116.929 116.929 118.952 -2.023 25767 1659 1 2 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.262 -0.123 25767 1660 1 2 . 1 1 133 133 HIS C C 133 178.669 178.669 177.471 1.198 25767 1661 1 2 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.973 -0.237 25767 1662 1 2 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.456 2.696 25767 1663 1 2 . 1 1 133 133 HIS H H 133 7.822 7.822 8.171 -0.349 25767 1664 1 2 . 1 1 134 134 LEU N N 134 116.898 116.898 120.113 -3.215 25767 1665 1 2 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.126 -0.393 25767 1666 1 2 . 1 1 134 134 LEU C C 134 179.402 179.402 179.064 0.338 25767 1667 1 2 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.837 -0.610 25767 1668 1 2 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.000 -2.461 25767 1669 1 2 . 1 1 134 134 LEU H H 134 8.688 8.688 7.819 0.869 25767 1670 1 2 . 1 1 135 135 TRP N N 135 115.602 115.602 117.832 -2.230 25767 1671 1 2 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.603 0.405 25767 1672 1 2 . 1 1 135 135 TRP C C 135 175.022 175.022 178.072 -3.050 25767 1673 1 2 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.255 1.171 25767 1674 1 2 . 1 1 135 135 TRP CB C 135 27.085 27.085 29.259 -2.174 25767 1675 1 2 . 1 1 135 135 TRP H H 135 7.638 7.638 8.455 -0.817 25767 1676 1 2 . 1 1 136 136 LYS N N 136 119.721 119.721 122.785 -3.064 25767 1677 1 2 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.957 -0.141 25767 1678 1 2 . 1 1 136 136 LYS C C 136 178.279 178.279 178.345 -0.066 25767 1679 1 2 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.741 0.452 25767 1680 1 2 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.822 1.235 25767 1681 1 2 . 1 1 136 136 LYS H H 136 6.538 6.538 8.445 -1.907 25767 1682 1 2 . 1 1 137 137 GLU N N 137 115.407 115.407 116.300 -0.893 25767 1683 1 2 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.139 0.028 25767 1684 1 2 . 1 1 137 137 GLU C C 137 176.700 176.700 177.408 -0.708 25767 1685 1 2 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.556 -0.706 25767 1686 1 2 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.057 0.103 25767 1687 1 2 . 1 1 137 137 GLU H H 137 8.596 8.596 8.127 0.469 25767 1688 1 2 . 1 1 138 138 ASN N N 138 116.669 116.669 116.495 0.174 25767 1689 1 2 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.827 0.079 25767 1690 1 2 . 1 1 138 138 ASN C C 138 173.481 173.481 174.854 -1.373 25767 1691 1 2 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.855 -1.041 25767 1692 1 2 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.620 1.217 25767 1693 1 2 . 1 1 138 138 ASN H H 138 8.343 8.343 8.224 0.119 25767 1694 1 2 . 1 1 139 139 ILE N N 139 120.703 120.703 120.415 0.288 25767 1695 1 2 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.301 0.043 25767 1696 1 2 . 1 1 139 139 ILE C C 139 175.241 175.241 175.934 -0.693 25767 1697 1 2 . 1 1 139 139 ILE CA C 139 60.792 60.792 58.527 2.265 25767 1698 1 2 . 1 1 139 139 ILE CB C 139 40.274 40.274 38.713 1.561 25767 1699 1 2 . 1 1 139 139 ILE H H 139 7.167 7.167 7.612 -0.445 25767 1700 1 2 . 1 1 140 140 SER N N 140 123.284 123.284 120.162 3.122 25767 1701 1 2 . 1 1 140 140 SER HA H 140 4.345 4.345 4.541 -0.196 25767 1702 1 2 . 1 1 140 140 SER CA C 140 58.095 58.095 57.443 0.652 25767 1703 1 2 . 1 1 140 140 SER CB C 140 65.370 65.370 65.114 0.256 25767 1704 1 2 . 1 1 140 140 SER H H 140 8.727 8.727 8.494 0.233 25767 1705 1 2 . 1 1 142 142 THR N N 142 113.868 113.868 115.123 -1.255 25767 1706 1 2 . 1 1 142 142 THR HA H 142 3.976 3.976 4.128 -0.152 25767 1707 1 2 . 1 1 142 142 THR C C 142 177.559 177.559 176.828 0.731 25767 1708 1 2 . 1 1 142 142 THR CA C 142 66.007 66.007 66.021 -0.014 25767 1709 1 2 . 1 1 142 142 THR CB C 142 68.530 68.530 68.336 0.194 25767 1710 1 2 . 1 1 142 142 THR H H 142 8.243 8.243 8.092 0.151 25767 1711 1 2 . 1 1 143 143 SER N N 143 120.786 120.786 118.428 2.358 25767 1712 1 2 . 1 1 143 143 SER C C 143 175.844 175.844 176.803 -0.959 25767 1713 1 2 . 1 1 143 143 SER CA C 143 62.102 62.102 61.876 0.226 25767 1714 1 2 . 1 1 143 143 SER CB C 143 63.086 63.086 62.443 0.643 25767 1715 1 2 . 1 1 143 143 SER H H 143 7.915 7.915 8.559 -0.644 25767 1716 1 2 . 1 1 144 144 THR N N 144 120.946 120.946 118.657 2.289 25767 1717 1 2 . 1 1 144 144 THR HA H 144 4.299 4.299 4.058 0.241 25767 1718 1 2 . 1 1 144 144 THR C C 144 175.874 175.874 175.881 -0.007 25767 1719 1 2 . 1 1 144 144 THR CA C 144 67.487 67.487 66.838 0.648 25767 1720 1 2 . 1 1 144 144 THR CB C 144 68.485 68.485 68.698 -0.213 25767 1721 1 2 . 1 1 144 144 THR H H 144 8.746 8.746 8.548 0.198 25767 1722 1 2 . 1 1 145 145 ASN N N 145 120.069 120.069 119.666 0.403 25767 1723 1 2 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.409 -0.101 25767 1724 1 2 . 1 1 145 145 ASN C C 145 177.917 177.917 177.481 0.436 25767 1725 1 2 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.643 -0.306 25767 1726 1 2 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.666 -0.566 25767 1727 1 2 . 1 1 145 145 ASN H H 145 7.940 7.940 7.886 0.054 25767 1728 1 2 . 1 1 146 146 SER N N 146 116.905 116.905 116.731 0.174 25767 1729 1 2 . 1 1 146 146 SER HA H 146 3.936 3.936 4.187 -0.251 25767 1730 1 2 . 1 1 146 146 SER C C 146 176.963 176.963 176.893 0.070 25767 1731 1 2 . 1 1 146 146 SER CA C 146 61.997 61.997 61.501 0.496 25767 1732 1 2 . 1 1 146 146 SER CB C 146 62.879 62.879 63.187 -0.308 25767 1733 1 2 . 1 1 146 146 SER H H 146 7.951 7.951 7.784 0.167 25767 1734 1 2 . 1 1 147 147 LEU N N 147 123.253 123.253 122.603 0.650 25767 1735 1 2 . 1 1 147 147 LEU HA H 147 3.875 3.875 4.001 -0.126 25767 1736 1 2 . 1 1 147 147 LEU C C 147 178.726 178.726 179.282 -0.556 25767 1737 1 2 . 1 1 147 147 LEU CA C 147 58.580 58.580 57.514 1.066 25767 1738 1 2 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.692 -0.832 25767 1739 1 2 . 1 1 147 147 LEU H H 147 8.168 8.168 7.674 0.494 25767 1740 1 2 . 1 1 148 148 GLN N N 148 118.212 118.212 118.461 -0.249 25767 1741 1 2 . 1 1 148 148 GLN HA H 148 3.817 3.817 4.044 -0.227 25767 1742 1 2 . 1 1 148 148 GLN C C 148 179.686 179.686 178.204 1.482 25767 1743 1 2 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.563 0.680 25767 1744 1 2 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.888 -0.168 25767 1745 1 2 . 1 1 148 148 GLN H H 148 8.295 8.295 8.834 -0.539 25767 1746 1 2 . 1 1 149 149 LYS N N 149 120.770 120.770 120.804 -0.034 25767 1747 1 2 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.969 -0.068 25767 1748 1 2 . 1 1 149 149 LYS C C 149 178.006 178.006 178.708 -0.702 25767 1749 1 2 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.142 0.390 25767 1750 1 2 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.225 -0.333 25767 1751 1 2 . 1 1 149 149 LYS H H 149 7.955 7.955 8.224 -0.269 25767 1752 1 2 . 1 1 150 150 ARG N N 150 119.244 119.244 118.961 0.283 25767 1753 1 2 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.959 -0.119 25767 1754 1 2 . 1 1 150 150 ARG C C 150 178.858 178.858 178.446 0.412 25767 1755 1 2 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.333 0.038 25767 1756 1 2 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.809 -1.005 25767 1757 1 2 . 1 1 150 150 ARG H H 150 7.020 7.020 7.521 -0.501 25767 1758 1 2 . 1 1 151 151 ILE N N 151 121.183 121.183 120.424 0.759 25767 1759 1 2 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.516 -0.157 25767 1760 1 2 . 1 1 151 151 ILE C C 151 177.327 177.327 177.906 -0.579 25767 1761 1 2 . 1 1 151 151 ILE CA C 151 67.196 67.196 65.141 2.054 25767 1762 1 2 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.544 0.728 25767 1763 1 2 . 1 1 151 151 ILE H H 151 7.574 7.574 7.672 -0.098 25767 1764 1 2 . 1 1 152 152 LYS N N 152 119.521 119.521 119.551 -0.030 25767 1765 1 2 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.943 -0.170 25767 1766 1 2 . 1 1 152 152 LYS C C 152 178.016 178.016 179.021 -1.005 25767 1767 1 2 . 1 1 152 152 LYS CA C 152 59.830 59.830 59.128 0.702 25767 1768 1 2 . 1 1 152 152 LYS CB C 152 31.581 31.581 31.706 -0.125 25767 1769 1 2 . 1 1 152 152 LYS H H 152 7.629 7.629 8.189 -0.560 25767 1770 1 2 . 1 1 153 153 TYR N N 153 120.178 120.178 121.263 -1.085 25767 1771 1 2 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.182 -0.110 25767 1772 1 2 . 1 1 153 153 TYR C C 153 178.195 178.195 177.905 0.290 25767 1773 1 2 . 1 1 153 153 TYR CA C 153 61.316 61.316 62.262 -0.946 25767 1774 1 2 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.348 -1.075 25767 1775 1 2 . 1 1 153 153 TYR H H 153 8.407 8.407 7.856 0.551 25767 1776 1 2 . 1 1 154 154 CYS N N 154 117.013 117.013 117.906 -0.893 25767 1777 1 2 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.005 0.067 25767 1778 1 2 . 1 1 154 154 CYS C C 154 176.827 176.827 176.460 0.367 25767 1779 1 2 . 1 1 154 154 CYS CA C 154 65.780 65.780 64.045 1.735 25767 1780 1 2 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.605 0.555 25767 1781 1 2 . 1 1 154 154 CYS H H 154 8.291 8.291 7.929 0.362 25767 1782 1 2 . 1 1 155 155 LYS N N 155 118.753 118.753 121.038 -2.285 25767 1783 1 2 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.846 -0.175 25767 1784 1 2 . 1 1 155 155 LYS C C 155 179.904 179.904 178.827 1.077 25767 1785 1 2 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.499 0.985 25767 1786 1 2 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.248 -0.305 25767 1787 1 2 . 1 1 155 155 LYS H H 155 7.934 7.934 7.985 -0.051 25767 1788 1 2 . 1 1 156 156 ILE N N 156 123.873 123.873 120.260 3.613 25767 1789 1 2 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.536 0.048 25767 1790 1 2 . 1 1 156 156 ILE C C 156 179.501 179.501 177.462 2.039 25767 1791 1 2 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.416 -0.176 25767 1792 1 2 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.924 -0.282 25767 1793 1 2 . 1 1 156 156 ILE H H 156 8.314 8.314 8.573 -0.259 25767 1794 1 2 . 1 1 157 157 TYR N N 157 121.132 121.132 119.854 1.278 25767 1795 1 2 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.944 0.221 25767 1796 1 2 . 1 1 157 157 TYR C C 157 178.558 178.558 177.384 1.174 25767 1797 1 2 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.944 0.166 25767 1798 1 2 . 1 1 157 157 TYR H H 157 8.442 8.442 7.612 0.830 25767 1799 1 2 . 1 1 158 158 LEU N N 158 120.964 120.964 119.650 1.314 25767 1800 1 2 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.801 0.111 25767 1801 1 2 . 1 1 158 158 LEU C C 158 180.130 180.130 178.614 1.516 25767 1802 1 2 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.699 0.987 25767 1803 1 2 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.501 0.229 25767 1804 1 2 . 1 1 158 158 LEU H H 158 8.469 8.469 7.734 0.735 25767 1805 1 2 . 1 1 159 159 SER N N 159 116.653 116.653 114.347 2.306 25767 1806 1 2 . 1 1 159 159 SER HA H 159 4.246 4.246 4.045 0.201 25767 1807 1 2 . 1 1 159 159 SER CA C 159 61.460 61.460 61.942 -0.482 25767 1808 1 2 . 1 1 159 159 SER CB C 159 62.849 62.849 62.855 -0.006 25767 1809 1 2 . 1 1 159 159 SER H H 159 7.758 7.758 8.331 -0.573 25767 1810 1 2 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.386 -2.013 25767 1811 1 2 . 1 1 160 160 LYS CB C 160 29.832 29.832 32.136 -2.304 25767 1812 1 2 . 1 1 160 160 LYS H H 160 8.425 8.425 7.550 0.875 25767 1813 1 2 . 1 1 161 161 LEU N N 161 121.686 121.686 118.901 2.785 25767 1814 1 2 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.799 0.364 25767 1815 1 2 . 1 1 161 161 LEU C C 161 180.224 180.224 178.936 1.288 25767 1816 1 2 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.626 -0.042 25767 1817 1 2 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.428 0.034 25767 1818 1 2 . 1 1 161 161 LEU H H 161 8.323 8.323 7.515 0.808 25767 1819 1 2 . 1 1 162 162 ALA N N 162 123.102 123.102 120.858 2.244 25767 1820 1 2 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.022 0.108 25767 1821 1 2 . 1 1 162 162 ALA C C 162 179.487 179.487 179.043 0.444 25767 1822 1 2 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.696 0.048 25767 1823 1 2 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.357 0.046 25767 1824 1 2 . 1 1 162 162 ALA H H 162 7.978 7.978 7.578 0.400 25767 1825 1 2 . 1 1 163 163 LYS N N 163 116.069 116.069 117.495 -1.426 25767 1826 1 2 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.227 -0.004 25767 1827 1 2 . 1 1 163 163 LYS C C 163 176.987 176.987 176.545 0.442 25767 1828 1 2 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.308 0.298 25767 1829 1 2 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.977 0.229 25767 1830 1 2 . 1 1 163 163 LYS H H 163 7.697 7.697 7.729 -0.032 25767 1831 1 2 . 1 1 164 164 GLY N N 164 108.540 108.540 106.662 1.878 25767 1832 1 2 . 1 1 164 164 GLY C C 164 174.721 174.721 173.753 0.968 25767 1833 1 2 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.811 0.980 25767 1834 1 2 . 1 1 164 164 GLY H H 164 7.772 7.772 7.446 0.326 25767 1835 1 2 . 1 1 165 165 GLU N N 165 119.886 119.886 120.722 -0.836 25767 1836 1 2 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.368 -0.318 25767 1837 1 2 . 1 1 165 165 GLU C C 165 176.027 176.027 175.040 0.987 25767 1838 1 2 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.084 1.769 25767 1839 1 2 . 1 1 165 165 GLU CB C 165 30.338 30.338 30.947 -0.609 25767 1840 1 2 . 1 1 165 165 GLU H H 165 8.065 8.065 7.767 0.298 25767 1841 1 2 . 1 1 166 166 ILE N N 166 117.926 117.926 122.800 -4.874 25767 1842 1 2 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.990 -0.088 25767 1843 1 2 . 1 1 166 166 ILE C C 166 174.138 174.138 176.679 -2.541 25767 1844 1 2 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.471 1.984 25767 1845 1 2 . 1 1 166 166 ILE CB C 166 40.202 40.202 38.809 1.393 25767 1846 1 2 . 1 1 166 166 ILE H H 166 7.282 7.282 8.175 -0.893 25767 1847 1 3 . 1 1 2 2 ALA N N 2 122.811 122.811 123.704 -0.893 25767 1848 1 3 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.046 -0.023 25767 1849 1 3 . 1 1 2 2 ALA C C 2 179.915 179.915 178.825 1.090 25767 1850 1 3 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.206 -0.089 25767 1851 1 3 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.385 0.154 25767 1852 1 3 . 1 1 2 2 ALA H H 2 8.509 8.509 8.675 -0.166 25767 1853 1 3 . 1 1 3 3 SER N N 3 115.308 115.308 113.993 1.315 25767 1854 1 3 . 1 1 3 3 SER HA H 3 4.097 4.097 4.130 -0.033 25767 1855 1 3 . 1 1 3 3 SER C C 3 176.706 176.706 176.292 0.414 25767 1856 1 3 . 1 1 3 3 SER CA C 3 60.665 60.665 61.014 -0.349 25767 1857 1 3 . 1 1 3 3 SER CB C 3 62.710 62.710 62.829 -0.119 25767 1858 1 3 . 1 1 3 3 SER H H 3 7.996 7.996 8.475 -0.479 25767 1859 1 3 . 1 1 4 4 ASN N N 4 122.688 122.688 120.142 2.546 25767 1860 1 3 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.418 -0.114 25767 1861 1 3 . 1 1 4 4 ASN C C 4 176.258 176.258 177.204 -0.946 25767 1862 1 3 . 1 1 4 4 ASN CA C 4 55.701 55.701 56.298 -0.597 25767 1863 1 3 . 1 1 4 4 ASN CB C 4 38.177 38.177 38.105 0.072 25767 1864 1 3 . 1 1 4 4 ASN H H 4 8.075 8.075 8.262 -0.187 25767 1865 1 3 . 1 1 5 5 ALA N N 5 121.900 121.900 121.610 0.290 25767 1866 1 3 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.118 -0.543 25767 1867 1 3 . 1 1 5 5 ALA C C 5 178.475 178.475 179.377 -0.902 25767 1868 1 3 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.943 0.890 25767 1869 1 3 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.131 -0.516 25767 1870 1 3 . 1 1 5 5 ALA H H 5 8.659 8.659 7.678 0.981 25767 1871 1 3 . 1 1 6 6 ALA N N 6 117.768 117.768 121.536 -3.768 25767 1872 1 3 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.997 -0.210 25767 1873 1 3 . 1 1 6 6 ALA C C 6 180.494 180.494 179.458 1.036 25767 1874 1 3 . 1 1 6 6 ALA CA C 6 55.350 55.350 54.989 0.361 25767 1875 1 3 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.254 -0.352 25767 1876 1 3 . 1 1 6 6 ALA H H 6 7.864 7.864 7.748 0.116 25767 1877 1 3 . 1 1 7 7 ARG N N 7 121.173 121.173 119.007 2.166 25767 1878 1 3 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.093 -0.190 25767 1879 1 3 . 1 1 7 7 ARG C C 7 179.189 179.189 178.531 0.658 25767 1880 1 3 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.185 1.127 25767 1881 1 3 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.650 -0.428 25767 1882 1 3 . 1 1 7 7 ARG H H 7 7.514 7.514 8.157 -0.643 25767 1883 1 3 . 1 1 8 8 VAL N N 8 122.979 122.979 119.954 3.025 25767 1884 1 3 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.765 -0.512 25767 1885 1 3 . 1 1 8 8 VAL C C 8 177.821 177.821 178.180 -0.359 25767 1886 1 3 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.097 1.675 25767 1887 1 3 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.153 0.288 25767 1888 1 3 . 1 1 8 8 VAL H H 8 8.101 8.101 7.756 0.345 25767 1889 1 3 . 1 1 9 9 VAL N N 9 119.801 119.801 120.235 -0.434 25767 1890 1 3 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.584 -0.318 25767 1891 1 3 . 1 1 9 9 VAL C C 9 177.373 177.373 177.531 -0.158 25767 1892 1 3 . 1 1 9 9 VAL CA C 9 67.484 67.484 65.893 1.591 25767 1893 1 3 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.508 1.117 25767 1894 1 3 . 1 1 9 9 VAL H H 9 8.362 8.362 7.715 0.647 25767 1895 1 3 . 1 1 10 10 ALA N N 10 122.360 122.360 121.556 0.804 25767 1896 1 3 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.034 -0.098 25767 1897 1 3 . 1 1 10 10 ALA C C 10 180.762 180.762 179.549 1.213 25767 1898 1 3 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.638 -0.194 25767 1899 1 3 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.221 -0.484 25767 1900 1 3 . 1 1 10 10 ALA H H 10 7.776 7.776 7.705 0.071 25767 1901 1 3 . 1 1 11 11 THR N N 11 117.376 117.376 112.217 5.159 25767 1902 1 3 . 1 1 11 11 THR HA H 11 3.816 3.816 4.054 -0.238 25767 1903 1 3 . 1 1 11 11 THR C C 11 175.775 175.775 176.417 -0.642 25767 1904 1 3 . 1 1 11 11 THR CA C 11 66.509 66.509 65.853 0.656 25767 1905 1 3 . 1 1 11 11 THR CB C 11 68.588 68.588 68.789 -0.201 25767 1906 1 3 . 1 1 11 11 THR H H 11 8.180 8.180 7.787 0.393 25767 1907 1 3 . 1 1 12 12 ALA N N 12 125.308 125.308 124.850 0.458 25767 1908 1 3 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.756 0.241 25767 1909 1 3 . 1 1 12 12 ALA C C 12 179.399 179.399 179.465 -0.066 25767 1910 1 3 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.398 0.678 25767 1911 1 3 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.262 0.982 25767 1912 1 3 . 1 1 12 12 ALA H H 12 8.671 8.671 8.340 0.331 25767 1913 1 3 . 1 1 13 13 LYS N N 13 116.977 116.977 118.057 -1.080 25767 1914 1 3 . 1 1 13 13 LYS C C 13 179.646 179.646 178.798 0.848 25767 1915 1 3 . 1 1 13 13 LYS CA C 13 58.921 58.921 60.062 -1.141 25767 1916 1 3 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.215 -0.772 25767 1917 1 3 . 1 1 13 13 LYS H H 13 8.061 8.061 8.036 0.025 25767 1918 1 3 . 1 1 14 14 ASP N N 14 121.988 121.988 120.081 1.907 25767 1919 1 3 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.502 -0.149 25767 1920 1 3 . 1 1 14 14 ASP C C 14 179.446 179.446 178.784 0.662 25767 1921 1 3 . 1 1 14 14 ASP CA C 14 57.509 57.509 56.997 0.512 25767 1922 1 3 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.672 -0.671 25767 1923 1 3 . 1 1 14 14 ASP H H 14 7.669 7.669 7.712 -0.043 25767 1924 1 3 . 1 1 15 15 PHE N N 15 119.588 119.588 118.388 1.200 25767 1925 1 3 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.232 0.112 25767 1926 1 3 . 1 1 15 15 PHE C C 15 178.373 178.373 178.074 0.299 25767 1927 1 3 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.048 1.189 25767 1928 1 3 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.740 -1.244 25767 1929 1 3 . 1 1 15 15 PHE H H 15 7.913 7.913 8.728 -0.815 25767 1930 1 3 . 1 1 16 16 ASP N N 16 121.705 121.705 119.956 1.749 25767 1931 1 3 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.422 -0.427 25767 1932 1 3 . 1 1 16 16 ASP C C 16 180.071 180.071 178.970 1.101 25767 1933 1 3 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.664 0.485 25767 1934 1 3 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.879 0.608 25767 1935 1 3 . 1 1 16 16 ASP H H 16 8.324 8.324 8.442 -0.118 25767 1936 1 3 . 1 1 17 17 LYS N N 17 118.825 118.825 119.020 -0.195 25767 1937 1 3 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.088 -0.051 25767 1938 1 3 . 1 1 17 17 LYS C C 17 178.407 178.407 178.037 0.370 25767 1939 1 3 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.995 0.066 25767 1940 1 3 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.583 0.001 25767 1941 1 3 . 1 1 17 17 LYS H H 17 7.834 7.834 7.719 0.115 25767 1942 1 3 . 1 1 18 18 VAL N N 18 110.562 110.562 117.229 -6.667 25767 1943 1 3 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.006 0.510 25767 1944 1 3 . 1 1 18 18 VAL C C 18 176.144 176.144 176.433 -0.289 25767 1945 1 3 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.010 -2.136 25767 1946 1 3 . 1 1 18 18 VAL CB C 18 31.160 31.160 32.113 -0.953 25767 1947 1 3 . 1 1 18 18 VAL H H 18 7.185 7.185 7.574 -0.389 25767 1948 1 3 . 1 1 19 19 GLY N N 19 109.272 109.272 107.287 1.985 25767 1949 1 3 . 1 1 19 19 GLY C C 19 175.043 175.043 174.492 0.551 25767 1950 1 3 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.536 0.295 25767 1951 1 3 . 1 1 19 19 GLY H H 19 7.723 7.723 7.813 -0.090 25767 1952 1 3 . 1 1 20 20 LEU N N 20 125.428 125.428 120.007 5.421 25767 1953 1 3 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.599 -0.279 25767 1954 1 3 . 1 1 20 20 LEU C C 20 177.949 177.949 177.697 0.252 25767 1955 1 3 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.251 -0.447 25767 1956 1 3 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.797 0.119 25767 1957 1 3 . 1 1 20 20 LEU H H 20 8.083 8.083 7.864 0.219 25767 1958 1 3 . 1 1 21 21 GLY N N 21 107.804 107.804 110.279 -2.475 25767 1959 1 3 . 1 1 21 21 GLY C C 21 176.278 176.278 176.433 -0.155 25767 1960 1 3 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.695 -0.401 25767 1961 1 3 . 1 1 21 21 GLY H H 21 7.982 7.982 7.842 0.140 25767 1962 1 3 . 1 1 22 22 ILE N N 22 121.319 121.319 121.684 -0.365 25767 1963 1 3 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.886 0.024 25767 1964 1 3 . 1 1 22 22 ILE C C 22 176.604 176.604 177.914 -1.310 25767 1965 1 3 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.286 -1.840 25767 1966 1 3 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.833 -1.267 25767 1967 1 3 . 1 1 22 22 ILE H H 22 8.478 8.478 8.066 0.412 25767 1968 1 3 . 1 1 23 23 ILE N N 23 120.377 120.377 120.100 0.277 25767 1969 1 3 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.931 -0.218 25767 1970 1 3 . 1 1 23 23 ILE C C 23 178.581 178.581 178.646 -0.065 25767 1971 1 3 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.825 0.421 25767 1972 1 3 . 1 1 23 23 ILE CB C 23 36.199 36.199 36.446 -0.246 25767 1973 1 3 . 1 1 23 23 ILE H H 23 6.869 6.869 7.554 -0.685 25767 1974 1 3 . 1 1 24 24 GLY N N 24 103.449 103.449 108.294 -4.845 25767 1975 1 3 . 1 1 24 24 GLY C C 24 175.308 175.308 175.715 -0.407 25767 1976 1 3 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.279 0.664 25767 1977 1 3 . 1 1 24 24 GLY H H 24 7.488 7.488 8.483 -0.995 25767 1978 1 3 . 1 1 25 25 TYR N N 25 124.685 124.685 124.229 0.456 25767 1979 1 3 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.900 -0.234 25767 1980 1 3 . 1 1 25 25 TYR C C 25 176.208 176.208 177.163 -0.955 25767 1981 1 3 . 1 1 25 25 TYR CA C 25 61.371 61.371 60.796 0.575 25767 1982 1 3 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.462 -0.195 25767 1983 1 3 . 1 1 25 25 TYR H H 25 7.931 7.931 8.114 -0.183 25767 1984 1 3 . 1 1 26 26 TYR N N 26 117.001 117.001 119.737 -2.736 25767 1985 1 3 . 1 1 26 26 TYR HA H 26 3.941 3.941 3.969 -0.028 25767 1986 1 3 . 1 1 26 26 TYR C C 26 178.753 178.753 177.471 1.282 25767 1987 1 3 . 1 1 26 26 TYR CA C 26 64.260 64.260 62.151 2.108 25767 1988 1 3 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.748 -1.227 25767 1989 1 3 . 1 1 26 26 TYR H H 26 7.693 7.693 7.933 -0.240 25767 1990 1 3 . 1 1 27 27 LEU N N 27 118.657 118.657 117.392 1.265 25767 1991 1 3 . 1 1 27 27 LEU HA H 27 4.311 4.311 4.009 0.302 25767 1992 1 3 . 1 1 27 27 LEU CA C 27 58.297 58.297 58.291 0.006 25767 1993 1 3 . 1 1 27 27 LEU CB C 27 42.723 42.723 40.617 2.106 25767 1994 1 3 . 1 1 27 27 LEU H H 27 8.339 8.339 8.057 0.282 25767 1995 1 3 . 1 1 28 28 GLN N N 28 118.593 118.593 118.845 -0.252 25767 1996 1 3 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.795 -0.144 25767 1997 1 3 . 1 1 28 28 GLN C C 28 177.282 177.282 178.502 -1.220 25767 1998 1 3 . 1 1 28 28 GLN CA C 28 58.829 58.829 59.062 -0.233 25767 1999 1 3 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.474 1.174 25767 2000 1 3 . 1 1 28 28 GLN H H 28 7.970 7.970 7.702 0.268 25767 2001 1 3 . 1 1 29 29 LEU N N 29 122.111 122.111 119.515 2.596 25767 2002 1 3 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.717 0.227 25767 2003 1 3 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.552 1.114 25767 2004 1 3 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.233 0.776 25767 2005 1 3 . 1 1 29 29 LEU H H 29 7.979 7.979 7.305 0.674 25767 2006 1 3 . 1 1 30 30 TYR N N 30 119.283 119.283 120.233 -0.950 25767 2007 1 3 . 1 1 30 30 TYR C C 30 175.775 175.775 177.260 -1.485 25767 2008 1 3 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.701 -1.607 25767 2009 1 3 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.374 0.699 25767 2010 1 3 . 1 1 30 30 TYR H H 30 8.093 8.093 7.597 0.496 25767 2011 1 3 . 1 1 31 31 ALA N N 31 121.327 121.327 122.279 -0.952 25767 2012 1 3 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.828 -0.460 25767 2013 1 3 . 1 1 31 31 ALA C C 31 178.955 178.955 178.824 0.131 25767 2014 1 3 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.326 0.221 25767 2015 1 3 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.190 -0.227 25767 2016 1 3 . 1 1 31 31 ALA H H 31 8.394 8.394 8.375 0.019 25767 2017 1 3 . 1 1 32 32 VAL N N 32 116.757 116.757 118.570 -1.813 25767 2018 1 3 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.485 -0.225 25767 2019 1 3 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.894 1.768 25767 2020 1 3 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.776 -0.805 25767 2021 1 3 . 1 1 32 32 VAL H H 32 8.020 8.020 7.615 0.405 25767 2022 1 3 . 1 1 33 33 GLU N N 33 118.775 118.775 119.605 -0.830 25767 2023 1 3 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.797 0.192 25767 2024 1 3 . 1 1 33 33 GLU C C 33 179.746 179.746 178.979 0.767 25767 2025 1 3 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.346 0.657 25767 2026 1 3 . 1 1 33 33 GLU H H 33 7.358 7.358 7.551 -0.193 25767 2027 1 3 . 1 1 34 34 LEU N N 34 120.632 120.632 121.218 -0.586 25767 2028 1 3 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.810 -0.161 25767 2029 1 3 . 1 1 34 34 LEU C C 34 180.336 180.336 178.170 2.166 25767 2030 1 3 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.835 -0.160 25767 2031 1 3 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.727 -0.139 25767 2032 1 3 . 1 1 34 34 LEU H H 34 8.390 8.390 7.759 0.631 25767 2033 1 3 . 1 1 35 35 ILE N N 35 121.240 121.240 119.073 2.167 25767 2034 1 3 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.555 -0.013 25767 2035 1 3 . 1 1 35 35 ILE C C 35 178.604 178.604 178.660 -0.056 25767 2036 1 3 . 1 1 35 35 ILE CA C 35 65.547 65.547 65.183 0.364 25767 2037 1 3 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.716 1.015 25767 2038 1 3 . 1 1 35 35 ILE H H 35 8.129 8.129 7.628 0.501 25767 2039 1 3 . 1 1 36 36 LEU N N 36 115.637 115.637 118.797 -3.160 25767 2040 1 3 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.002 0.006 25767 2041 1 3 . 1 1 36 36 LEU C C 36 178.001 178.001 178.165 -0.164 25767 2042 1 3 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.115 -1.040 25767 2043 1 3 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.080 -1.146 25767 2044 1 3 . 1 1 36 36 LEU H H 36 8.416 8.416 7.830 0.586 25767 2045 1 3 . 1 1 37 37 SER N N 37 114.106 114.106 111.397 2.709 25767 2046 1 3 . 1 1 37 37 SER HA H 37 3.991 3.991 4.291 -0.300 25767 2047 1 3 . 1 1 37 37 SER C C 37 173.997 173.997 174.969 -0.972 25767 2048 1 3 . 1 1 37 37 SER CA C 37 60.311 60.311 59.583 0.728 25767 2049 1 3 . 1 1 37 37 SER CB C 37 63.746 63.746 63.236 0.510 25767 2050 1 3 . 1 1 37 37 SER H H 37 7.517 7.517 7.575 -0.058 25767 2051 1 3 . 1 1 38 38 GLU N N 38 123.003 123.003 121.471 1.532 25767 2052 1 3 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.269 0.100 25767 2053 1 3 . 1 1 38 38 GLU C C 38 175.780 175.780 176.199 -0.419 25767 2054 1 3 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.969 -0.604 25767 2055 1 3 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.258 0.035 25767 2056 1 3 . 1 1 38 38 GLU H H 38 7.151 7.151 7.349 -0.198 25767 2057 1 3 . 1 1 39 39 GLU N N 39 126.166 126.166 122.507 3.659 25767 2058 1 3 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.106 -0.097 25767 2059 1 3 . 1 1 39 39 GLU C C 39 176.652 176.652 176.200 0.452 25767 2060 1 3 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.677 1.521 25767 2061 1 3 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.126 -0.091 25767 2062 1 3 . 1 1 39 39 GLU H H 39 8.587 8.587 8.435 0.152 25767 2063 1 3 . 1 1 40 40 ASP N N 40 120.047 120.047 121.090 -1.043 25767 2064 1 3 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.476 0.074 25767 2065 1 3 . 1 1 40 40 ASP C C 40 175.035 175.035 175.856 -0.821 25767 2066 1 3 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.225 -1.857 25767 2067 1 3 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.713 -0.690 25767 2068 1 3 . 1 1 40 40 ASP H H 40 8.504 8.504 8.552 -0.048 25767 2069 1 3 . 1 1 41 41 ARG N N 41 120.671 120.671 123.875 -3.204 25767 2070 1 3 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.654 -0.265 25767 2071 1 3 . 1 1 41 41 ARG C C 41 175.755 175.755 175.724 0.031 25767 2072 1 3 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.760 0.248 25767 2073 1 3 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.656 -1.107 25767 2074 1 3 . 1 1 41 41 ARG H H 41 7.672 7.672 8.229 -0.557 25767 2075 1 3 . 1 1 42 42 SER N N 42 120.330 120.330 115.988 4.342 25767 2076 1 3 . 1 1 42 42 SER HA H 42 3.837 3.837 4.400 -0.563 25767 2077 1 3 . 1 1 42 42 SER CA C 42 57.326 57.326 57.914 -0.588 25767 2078 1 3 . 1 1 42 42 SER CB C 42 65.762 65.762 64.210 1.552 25767 2079 1 3 . 1 1 42 42 SER H H 42 8.544 8.544 8.253 0.291 25767 2080 1 3 . 1 1 43 43 GLN HA H 43 3.989 3.989 3.991 -0.002 25767 2081 1 3 . 1 1 43 43 GLN C C 43 178.907 178.907 178.003 0.904 25767 2082 1 3 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.466 0.904 25767 2083 1 3 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.537 -0.574 25767 2084 1 3 . 1 1 44 44 GLU N N 44 120.328 120.328 120.332 -0.004 25767 2085 1 3 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.961 0.052 25767 2086 1 3 . 1 1 44 44 GLU C C 44 179.824 179.824 178.653 1.171 25767 2087 1 3 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.221 0.824 25767 2088 1 3 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.428 -0.780 25767 2089 1 3 . 1 1 44 44 GLU H H 44 8.938 8.938 7.649 1.289 25767 2090 1 3 . 1 1 45 45 MET N N 45 121.030 121.030 117.638 3.392 25767 2091 1 3 . 1 1 45 45 MET HA H 45 4.412 4.412 4.260 0.152 25767 2092 1 3 . 1 1 45 45 MET C C 45 180.357 180.357 178.319 2.038 25767 2093 1 3 . 1 1 45 45 MET CA C 45 57.209 57.209 57.767 -0.558 25767 2094 1 3 . 1 1 45 45 MET CB C 45 32.436 32.436 31.676 0.760 25767 2095 1 3 . 1 1 45 45 MET H H 45 7.756 7.756 7.820 -0.064 25767 2096 1 3 . 1 1 46 46 THR N N 46 120.008 120.008 116.058 3.950 25767 2097 1 3 . 1 1 46 46 THR HA H 46 4.071 4.071 3.897 0.174 25767 2098 1 3 . 1 1 46 46 THR CA C 46 67.096 67.096 67.367 -0.271 25767 2099 1 3 . 1 1 46 46 THR CB C 46 68.954 68.954 68.388 0.566 25767 2100 1 3 . 1 1 46 46 THR H H 46 8.187 8.187 7.431 0.756 25767 2101 1 3 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.103 0.006 25767 2102 1 3 . 1 1 47 47 ALA C C 47 180.118 180.118 179.160 0.958 25767 2103 1 3 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.985 0.354 25767 2104 1 3 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.295 -0.463 25767 2105 1 3 . 1 1 47 47 ALA H H 47 8.238 8.238 7.754 0.484 25767 2106 1 3 . 1 1 48 48 LEU N N 48 122.093 122.093 119.218 2.875 25767 2107 1 3 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.026 0.237 25767 2108 1 3 . 1 1 48 48 LEU C C 48 179.103 179.103 179.354 -0.251 25767 2109 1 3 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.434 0.306 25767 2110 1 3 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.504 -0.708 25767 2111 1 3 . 1 1 48 48 LEU H H 48 7.778 7.778 7.669 0.109 25767 2112 1 3 . 1 1 49 49 ALA N N 49 120.130 120.130 121.944 -1.814 25767 2113 1 3 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.958 -0.237 25767 2114 1 3 . 1 1 49 49 ALA C C 49 178.676 178.676 179.444 -0.768 25767 2115 1 3 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.452 0.269 25767 2116 1 3 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.023 -0.196 25767 2117 1 3 . 1 1 49 49 ALA H H 49 8.432 8.432 8.436 -0.004 25767 2118 1 3 . 1 1 50 50 THR N N 50 113.333 113.333 115.148 -1.815 25767 2119 1 3 . 1 1 50 50 THR HA H 50 3.895 3.895 3.875 0.020 25767 2120 1 3 . 1 1 50 50 THR C C 50 174.948 174.948 176.477 -1.529 25767 2121 1 3 . 1 1 50 50 THR CA C 50 67.334 67.334 67.436 -0.102 25767 2122 1 3 . 1 1 50 50 THR CB C 50 68.864 68.864 68.400 0.464 25767 2123 1 3 . 1 1 50 50 THR H H 50 7.857 7.857 7.876 -0.019 25767 2124 1 3 . 1 1 51 51 GLU N N 51 122.698 122.698 122.057 0.641 25767 2125 1 3 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.028 0.040 25767 2126 1 3 . 1 1 51 51 GLU C C 51 179.997 179.997 178.587 1.410 25767 2127 1 3 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.239 0.194 25767 2128 1 3 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.650 -0.133 25767 2129 1 3 . 1 1 51 51 GLU H H 51 7.817 7.817 7.587 0.230 25767 2130 1 3 . 1 1 52 52 LEU N N 52 121.100 121.100 121.351 -0.251 25767 2131 1 3 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.048 0.081 25767 2132 1 3 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.834 0.055 25767 2133 1 3 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.743 0.204 25767 2134 1 3 . 1 1 52 52 LEU H H 52 8.628 8.628 7.949 0.679 25767 2135 1 3 . 1 1 53 53 LEU N N 53 119.935 119.935 119.817 0.118 25767 2136 1 3 . 1 1 53 53 LEU C C 53 179.671 179.671 178.340 1.331 25767 2137 1 3 . 1 1 53 53 LEU H H 53 8.303 8.303 7.807 0.496 25767 2138 1 3 . 1 1 54 54 ASP N N 54 120.339 120.339 118.858 1.481 25767 2139 1 3 . 1 1 54 54 ASP C C 54 179.106 179.106 178.420 0.686 25767 2140 1 3 . 1 1 54 54 ASP H H 54 7.901 7.901 7.904 -0.003 25767 2141 1 3 . 1 1 55 55 THR N N 55 120.237 120.237 117.361 2.876 25767 2142 1 3 . 1 1 55 55 THR HA H 55 3.696 3.696 4.005 -0.309 25767 2143 1 3 . 1 1 55 55 THR CA C 55 67.340 67.340 67.318 0.022 25767 2144 1 3 . 1 1 55 55 THR CB C 55 68.151 68.151 68.790 -0.639 25767 2145 1 3 . 1 1 55 55 THR H H 55 8.262 8.262 7.800 0.462 25767 2146 1 3 . 1 1 56 56 ILE N N 56 123.953 123.953 122.422 1.531 25767 2147 1 3 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.698 0.145 25767 2148 1 3 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.678 0.216 25767 2149 1 3 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.669 0.464 25767 2150 1 3 . 1 1 56 56 ILE H H 56 8.930 8.930 7.711 1.219 25767 2151 1 3 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.437 0.144 25767 2152 1 3 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.156 -0.125 25767 2153 1 3 . 1 1 58 58 ALA C C 58 179.875 179.875 179.442 0.433 25767 2154 1 3 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.834 0.432 25767 2155 1 3 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.362 -0.377 25767 2156 1 3 . 1 1 58 58 ALA H H 58 7.764 7.764 8.521 -0.757 25767 2157 1 3 . 1 1 59 59 PHE N N 59 121.988 121.988 120.044 1.944 25767 2158 1 3 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.172 0.054 25767 2159 1 3 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.405 0.034 25767 2160 1 3 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.346 0.016 25767 2161 1 3 . 1 1 59 59 PHE H H 59 8.159 8.159 8.602 -0.443 25767 2162 1 3 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.942 -0.401 25767 2163 1 3 . 1 1 60 60 LYS C C 60 179.438 179.438 178.824 0.614 25767 2164 1 3 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.596 0.540 25767 2165 1 3 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.497 -0.439 25767 2166 1 3 . 1 1 61 61 LYS N N 61 119.262 119.262 118.181 1.081 25767 2167 1 3 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.196 -0.251 25767 2168 1 3 . 1 1 61 61 LYS C C 61 178.730 178.730 178.382 0.348 25767 2169 1 3 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.548 1.494 25767 2170 1 3 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.077 0.565 25767 2171 1 3 . 1 1 61 61 LYS H H 61 7.832 7.832 8.110 -0.278 25767 2172 1 3 . 1 1 62 62 GLU N N 62 120.790 120.790 120.403 0.387 25767 2173 1 3 . 1 1 62 62 GLU HA H 62 3.935 3.935 3.994 -0.059 25767 2174 1 3 . 1 1 62 62 GLU C C 62 178.424 178.424 178.059 0.365 25767 2175 1 3 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.979 -0.265 25767 2176 1 3 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.246 -0.016 25767 2177 1 3 . 1 1 62 62 GLU H H 62 7.982 7.982 8.112 -0.130 25767 2178 1 3 . 1 1 63 63 ILE N N 63 118.463 118.463 116.729 1.734 25767 2179 1 3 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.797 -0.108 25767 2180 1 3 . 1 1 63 63 ILE C C 63 177.555 177.555 177.254 0.301 25767 2181 1 3 . 1 1 63 63 ILE CA C 63 61.499 61.499 62.940 -1.440 25767 2182 1 3 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.573 -2.049 25767 2183 1 3 . 1 1 63 63 ILE H H 63 7.732 7.732 7.358 0.374 25767 2184 1 3 . 1 1 64 64 GLY N N 64 107.973 107.973 106.868 1.105 25767 2185 1 3 . 1 1 64 64 GLY C C 64 175.271 175.271 175.100 0.171 25767 2186 1 3 . 1 1 64 64 GLY CA C 64 45.902 45.902 45.654 0.248 25767 2187 1 3 . 1 1 64 64 GLY H H 64 7.661 7.661 7.742 -0.081 25767 2188 1 3 . 1 1 65 65 GLY N N 65 108.464 108.464 107.540 0.924 25767 2189 1 3 . 1 1 65 65 GLY C C 65 174.800 174.800 175.390 -0.590 25767 2190 1 3 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.250 0.396 25767 2191 1 3 . 1 1 65 65 GLY H H 65 7.808 7.808 8.152 -0.344 25767 2192 1 3 . 1 1 66 66 GLU N N 66 121.162 121.162 120.889 0.273 25767 2193 1 3 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.032 0.073 25767 2194 1 3 . 1 1 66 66 GLU C C 66 177.230 177.230 178.695 -1.465 25767 2195 1 3 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.249 -2.025 25767 2196 1 3 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.566 0.426 25767 2197 1 3 . 1 1 66 66 GLU H H 66 8.203 8.203 7.786 0.417 25767 2198 1 3 . 1 1 67 67 SER N N 67 116.468 116.468 116.019 0.449 25767 2199 1 3 . 1 1 67 67 SER HA H 67 4.249 4.249 4.228 0.021 25767 2200 1 3 . 1 1 67 67 SER C C 67 174.640 174.640 176.467 -1.827 25767 2201 1 3 . 1 1 67 67 SER CA C 67 58.930 58.930 61.378 -2.448 25767 2202 1 3 . 1 1 67 67 SER CB C 67 63.912 63.912 62.862 1.050 25767 2203 1 3 . 1 1 67 67 SER H H 67 8.206 8.206 8.541 -0.335 25767 2204 1 3 . 1 1 68 68 GLU N N 68 122.400 122.400 120.851 1.549 25767 2205 1 3 . 1 1 68 68 GLU HA H 68 4.153 4.153 3.970 0.183 25767 2206 1 3 . 1 1 68 68 GLU C C 68 176.349 176.349 177.210 -0.861 25767 2207 1 3 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.445 -1.622 25767 2208 1 3 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.349 0.632 25767 2209 1 3 . 1 1 68 68 GLU H H 68 8.168 8.168 8.504 -0.336 25767 2210 1 3 . 1 1 69 69 ALA N N 69 124.342 124.342 120.350 3.992 25767 2211 1 3 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.013 0.175 25767 2212 1 3 . 1 1 69 69 ALA C C 69 178.027 178.027 178.258 -0.231 25767 2213 1 3 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.921 -1.363 25767 2214 1 3 . 1 1 69 69 ALA CB C 69 19.492 19.492 18.819 0.673 25767 2215 1 3 . 1 1 69 69 ALA H H 69 7.939 7.939 7.342 0.597 25767 2216 1 3 . 1 1 70 70 GLU N N 70 121.059 121.059 117.584 3.475 25767 2217 1 3 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.494 -0.380 25767 2218 1 3 . 1 1 70 70 GLU C C 70 176.519 176.519 175.499 1.020 25767 2219 1 3 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.001 2.303 25767 2220 1 3 . 1 1 70 70 GLU CB C 70 29.827 29.827 30.625 -0.798 25767 2221 1 3 . 1 1 70 70 GLU H H 70 8.430 8.430 7.574 0.856 25767 2222 1 3 . 1 1 71 71 ASP N N 71 120.274 120.274 123.178 -2.904 25767 2223 1 3 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.295 0.237 25767 2224 1 3 . 1 1 71 71 ASP C C 71 176.369 176.369 177.066 -0.697 25767 2225 1 3 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.215 -0.964 25767 2226 1 3 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.814 1.026 25767 2227 1 3 . 1 1 71 71 ASP H H 71 8.305 8.305 8.971 -0.666 25767 2228 1 3 . 1 1 72 72 SER N N 72 116.165 116.165 114.601 1.564 25767 2229 1 3 . 1 1 72 72 SER HA H 72 4.241 4.241 4.033 0.208 25767 2230 1 3 . 1 1 72 72 SER C C 72 174.567 174.567 175.671 -1.104 25767 2231 1 3 . 1 1 72 72 SER CA C 72 59.031 59.031 61.488 -2.457 25767 2232 1 3 . 1 1 72 72 SER CB C 72 64.040 64.040 62.711 1.329 25767 2233 1 3 . 1 1 72 72 SER H H 72 7.964 7.964 8.266 -0.302 25767 2234 1 3 . 1 1 73 73 ASP N N 73 122.440 122.440 122.168 0.272 25767 2235 1 3 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.032 0.502 25767 2236 1 3 . 1 1 73 73 ASP C C 73 176.882 176.882 177.863 -0.981 25767 2237 1 3 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.147 -2.704 25767 2238 1 3 . 1 1 73 73 ASP CB C 73 41.336 41.336 39.909 1.427 25767 2239 1 3 . 1 1 73 73 ASP H H 73 8.392 8.392 8.577 -0.185 25767 2240 1 3 . 1 1 74 74 LYS N N 74 123.270 123.270 119.965 3.305 25767 2241 1 3 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.002 0.091 25767 2242 1 3 . 1 1 74 74 LYS C C 74 177.608 177.608 179.083 -1.475 25767 2243 1 3 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.334 -1.869 25767 2244 1 3 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.472 -0.326 25767 2245 1 3 . 1 1 74 74 LYS H H 74 8.317 8.317 7.387 0.930 25767 2246 1 3 . 1 1 75 75 SER N N 75 116.557 116.557 116.273 0.284 25767 2247 1 3 . 1 1 75 75 SER HA H 75 4.197 4.197 4.177 0.020 25767 2248 1 3 . 1 1 75 75 SER C C 75 175.988 175.988 176.619 -0.631 25767 2249 1 3 . 1 1 75 75 SER CA C 75 60.434 60.434 61.786 -1.352 25767 2250 1 3 . 1 1 75 75 SER CB C 75 63.172 63.172 62.605 0.567 25767 2251 1 3 . 1 1 75 75 SER H H 75 8.387 8.387 7.769 0.618 25767 2252 1 3 . 1 1 76 76 LEU N N 76 123.910 123.910 121.820 2.090 25767 2253 1 3 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.949 0.221 25767 2254 1 3 . 1 1 76 76 LEU C C 76 178.083 178.083 178.921 -0.838 25767 2255 1 3 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.888 -1.396 25767 2256 1 3 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.489 0.208 25767 2257 1 3 . 1 1 76 76 LEU H H 76 8.059 8.059 7.911 0.148 25767 2258 1 3 . 1 1 77 77 HIS N N 77 120.620 120.620 119.111 1.509 25767 2259 1 3 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.226 0.062 25767 2260 1 3 . 1 1 77 77 HIS C C 77 177.667 177.667 178.254 -0.587 25767 2261 1 3 . 1 1 77 77 HIS CA C 77 58.422 58.422 59.036 -0.614 25767 2262 1 3 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.912 0.352 25767 2263 1 3 . 1 1 77 77 HIS H H 77 7.936 7.936 7.984 -0.048 25767 2264 1 3 . 1 1 78 78 VAL N N 78 121.774 121.774 119.839 1.935 25767 2265 1 3 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.698 -0.021 25767 2266 1 3 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.487 -0.881 25767 2267 1 3 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.434 0.430 25767 2268 1 3 . 1 1 78 78 VAL H H 78 7.916 7.916 8.036 -0.120 25767 2269 1 3 . 1 1 79 79 MET N N 79 119.660 119.660 118.469 1.191 25767 2270 1 3 . 1 1 79 79 MET HA H 79 3.925 3.925 4.029 -0.104 25767 2271 1 3 . 1 1 79 79 MET C C 79 177.077 177.077 178.595 -1.518 25767 2272 1 3 . 1 1 79 79 MET CA C 79 58.862 58.862 59.744 -0.882 25767 2273 1 3 . 1 1 79 79 MET CB C 79 32.852 32.852 32.215 0.637 25767 2274 1 3 . 1 1 79 79 MET H H 79 8.149 8.149 7.962 0.187 25767 2275 1 3 . 1 1 80 80 ASN N N 80 117.337 117.337 118.005 -0.668 25767 2276 1 3 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.853 -0.715 25767 2277 1 3 . 1 1 80 80 ASN C C 80 178.133 178.133 178.571 -0.438 25767 2278 1 3 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.491 0.548 25767 2279 1 3 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.512 0.484 25767 2280 1 3 . 1 1 80 80 ASN H H 80 8.202 8.202 8.867 -0.665 25767 2281 1 3 . 1 1 81 81 THR N N 81 115.517 115.517 118.310 -2.793 25767 2282 1 3 . 1 1 81 81 THR HA H 81 3.896 3.896 4.109 -0.213 25767 2283 1 3 . 1 1 81 81 THR C C 81 175.186 175.186 176.238 -1.052 25767 2284 1 3 . 1 1 81 81 THR CA C 81 66.221 66.221 67.556 -1.335 25767 2285 1 3 . 1 1 81 81 THR CB C 81 69.087 69.087 69.074 0.013 25767 2286 1 3 . 1 1 81 81 THR H H 81 7.944 7.944 8.263 -0.319 25767 2287 1 3 . 1 1 82 82 LEU N N 82 119.074 119.074 120.941 -1.867 25767 2288 1 3 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.098 -0.117 25767 2289 1 3 . 1 1 82 82 LEU C C 82 177.583 177.583 178.163 -0.580 25767 2290 1 3 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.373 -0.833 25767 2291 1 3 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.902 -0.109 25767 2292 1 3 . 1 1 82 82 LEU H H 82 7.547 7.547 7.875 -0.328 25767 2293 1 3 . 1 1 83 83 ILE N N 83 118.085 118.085 115.111 2.974 25767 2294 1 3 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.398 0.445 25767 2295 1 3 . 1 1 83 83 ILE C C 83 176.413 176.413 176.799 -0.386 25767 2296 1 3 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.279 -0.552 25767 2297 1 3 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.012 -0.314 25767 2298 1 3 . 1 1 83 83 ILE H H 83 7.409 7.409 7.713 -0.304 25767 2299 1 3 . 1 1 84 84 HIS N N 84 116.152 116.152 114.401 1.751 25767 2300 1 3 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.502 0.093 25767 2301 1 3 . 1 1 84 84 HIS C C 84 175.707 175.707 175.041 0.666 25767 2302 1 3 . 1 1 84 84 HIS CA C 84 58.628 58.628 57.523 1.105 25767 2303 1 3 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.919 0.484 25767 2304 1 3 . 1 1 84 84 HIS H H 84 7.194 7.194 7.655 -0.461 25767 2305 1 3 . 1 1 85 85 ASP N N 85 122.322 122.322 119.942 2.380 25767 2306 1 3 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.810 -0.276 25767 2307 1 3 . 1 1 85 85 ASP C C 85 175.580 175.580 176.683 -1.103 25767 2308 1 3 . 1 1 85 85 ASP CA C 85 53.345 53.345 52.835 0.510 25767 2309 1 3 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.008 0.110 25767 2310 1 3 . 1 1 85 85 ASP H H 85 8.505 8.505 8.026 0.479 25767 2311 1 3 . 1 1 86 86 GLN N N 86 122.783 122.783 125.826 -3.043 25767 2312 1 3 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.135 -0.172 25767 2313 1 3 . 1 1 86 86 GLN C C 86 178.581 178.581 178.360 0.221 25767 2314 1 3 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.566 -1.612 25767 2315 1 3 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.236 -0.342 25767 2316 1 3 . 1 1 86 86 GLN H H 86 8.803 8.803 8.758 0.045 25767 2317 1 3 . 1 1 87 87 GLU N N 87 121.794 121.794 119.902 1.892 25767 2318 1 3 . 1 1 87 87 GLU HA H 87 4.013 4.013 3.977 0.036 25767 2319 1 3 . 1 1 87 87 GLU C C 87 178.290 178.290 178.786 -0.496 25767 2320 1 3 . 1 1 87 87 GLU CA C 87 59.038 59.038 60.084 -1.046 25767 2321 1 3 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.370 -0.391 25767 2322 1 3 . 1 1 87 87 GLU H H 87 8.072 8.072 8.410 -0.338 25767 2323 1 3 . 1 1 88 88 LYS N N 88 119.345 119.345 119.019 0.326 25767 2324 1 3 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.142 -0.387 25767 2325 1 3 . 1 1 88 88 LYS C C 88 180.040 180.040 178.855 1.185 25767 2326 1 3 . 1 1 88 88 LYS CA C 88 59.411 59.411 59.008 0.404 25767 2327 1 3 . 1 1 88 88 LYS CB C 88 32.007 32.007 32.306 -0.299 25767 2328 1 3 . 1 1 88 88 LYS H H 88 7.588 7.588 7.756 -0.168 25767 2329 1 3 . 1 1 89 89 ALA N N 89 123.933 123.933 123.032 0.901 25767 2330 1 3 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.236 -0.497 25767 2331 1 3 . 1 1 89 89 ALA C C 89 177.457 177.457 179.474 -2.017 25767 2332 1 3 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.409 0.561 25767 2333 1 3 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.309 0.347 25767 2334 1 3 . 1 1 89 89 ALA H H 89 8.500 8.500 8.386 0.114 25767 2335 1 3 . 1 1 90 90 LYS N N 90 119.244 119.244 119.772 -0.528 25767 2336 1 3 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.983 0.061 25767 2337 1 3 . 1 1 90 90 LYS C C 90 177.774 177.774 178.840 -1.066 25767 2338 1 3 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.723 -0.645 25767 2339 1 3 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.582 -2.341 25767 2340 1 3 . 1 1 90 90 LYS H H 90 6.845 6.845 8.485 -1.640 25767 2341 1 3 . 1 1 91 91 ILE N N 91 117.718 117.718 117.302 0.416 25767 2342 1 3 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.701 -0.303 25767 2343 1 3 . 1 1 91 91 ILE C C 91 177.670 177.670 177.567 0.103 25767 2344 1 3 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.703 -0.705 25767 2345 1 3 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.116 0.685 25767 2346 1 3 . 1 1 91 91 ILE H H 91 7.293 7.293 7.717 -0.424 25767 2347 1 3 . 1 1 92 92 TYR N N 92 121.868 121.868 121.184 0.684 25767 2348 1 3 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.080 0.043 25767 2349 1 3 . 1 1 92 92 TYR C C 92 178.781 178.781 177.586 1.195 25767 2350 1 3 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.256 -0.614 25767 2351 1 3 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.735 0.486 25767 2352 1 3 . 1 1 92 92 TYR H H 92 8.016 8.016 8.239 -0.223 25767 2353 1 3 . 1 1 93 93 MET N N 93 118.984 118.984 119.104 -0.120 25767 2354 1 3 . 1 1 93 93 MET HA H 93 3.952 3.952 4.188 -0.236 25767 2355 1 3 . 1 1 93 93 MET C C 93 179.925 179.925 178.006 1.919 25767 2356 1 3 . 1 1 93 93 MET CA C 93 57.589 57.589 58.898 -1.310 25767 2357 1 3 . 1 1 93 93 MET CB C 93 30.752 30.752 32.730 -1.978 25767 2358 1 3 . 1 1 93 93 MET H H 93 8.464 8.464 8.760 -0.296 25767 2359 1 3 . 1 1 94 94 LEU N N 94 125.441 125.441 121.095 4.346 25767 2360 1 3 . 1 1 94 94 LEU HA H 94 3.870 3.870 3.872 -0.002 25767 2361 1 3 . 1 1 94 94 LEU C C 94 177.937 177.937 178.505 -0.568 25767 2362 1 3 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.477 0.284 25767 2363 1 3 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.382 0.380 25767 2364 1 3 . 1 1 94 94 LEU H H 94 8.927 8.927 8.707 0.220 25767 2365 1 3 . 1 1 95 95 ASN N N 95 119.066 119.066 117.629 1.437 25767 2366 1 3 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.381 -0.119 25767 2367 1 3 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.144 0.129 25767 2368 1 3 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.142 -0.536 25767 2369 1 3 . 1 1 95 95 ASN H H 95 8.691 8.691 8.336 0.355 25767 2370 1 3 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.279 0.386 25767 2371 1 3 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.592 0.479 25767 2372 1 3 . 1 1 96 96 PHE H H 96 8.317 8.317 7.984 0.333 25767 2373 1 3 . 1 1 97 97 THR N N 97 118.178 118.178 116.561 1.617 25767 2374 1 3 . 1 1 97 97 THR HA H 97 3.338 3.338 3.980 -0.642 25767 2375 1 3 . 1 1 97 97 THR C C 97 176.074 176.074 176.561 -0.487 25767 2376 1 3 . 1 1 97 97 THR CA C 97 67.986 67.986 67.040 0.946 25767 2377 1 3 . 1 1 97 97 THR H H 97 8.214 8.214 8.990 -0.776 25767 2378 1 3 . 1 1 98 98 MET N N 98 120.097 120.097 121.805 -1.708 25767 2379 1 3 . 1 1 98 98 MET HA H 98 4.403 4.403 4.067 0.336 25767 2380 1 3 . 1 1 98 98 MET C C 98 178.696 178.696 177.660 1.036 25767 2381 1 3 . 1 1 98 98 MET CA C 98 57.029 57.029 59.514 -2.485 25767 2382 1 3 . 1 1 98 98 MET CB C 98 29.898 29.898 32.434 -2.536 25767 2383 1 3 . 1 1 98 98 MET H H 98 8.885 8.885 8.564 0.321 25767 2384 1 3 . 1 1 99 99 SER N N 99 114.959 114.959 116.192 -1.233 25767 2385 1 3 . 1 1 99 99 SER HA H 99 4.199 4.199 4.046 0.152 25767 2386 1 3 . 1 1 99 99 SER C C 99 176.565 176.565 176.515 0.050 25767 2387 1 3 . 1 1 99 99 SER CA C 99 61.965 61.965 61.459 0.506 25767 2388 1 3 . 1 1 99 99 SER CB C 99 62.565 62.565 62.932 -0.367 25767 2389 1 3 . 1 1 99 99 SER H H 99 7.515 7.515 7.635 -0.120 25767 2390 1 3 . 1 1 100 100 LEU N N 100 125.380 125.380 123.742 1.638 25767 2391 1 3 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.897 -0.121 25767 2392 1 3 . 1 1 100 100 LEU C C 100 177.689 177.689 177.916 -0.227 25767 2393 1 3 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.463 0.594 25767 2394 1 3 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.620 -0.070 25767 2395 1 3 . 1 1 100 100 LEU H H 100 7.400 7.400 8.011 -0.611 25767 2396 1 3 . 1 1 101 101 TYR N N 101 120.597 120.597 119.765 0.832 25767 2397 1 3 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.930 0.186 25767 2398 1 3 . 1 1 101 101 TYR C C 101 176.825 176.825 177.315 -0.490 25767 2399 1 3 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.570 -0.682 25767 2400 1 3 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.314 0.679 25767 2401 1 3 . 1 1 101 101 TYR H H 101 8.880 8.880 8.164 0.716 25767 2402 1 3 . 1 1 102 102 ASN N N 102 116.869 116.869 117.013 -0.144 25767 2403 1 3 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.294 -0.128 25767 2404 1 3 . 1 1 102 102 ASN C C 102 179.089 179.089 177.942 1.147 25767 2405 1 3 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.206 0.006 25767 2406 1 3 . 1 1 102 102 ASN CB C 102 37.734 37.734 37.705 0.029 25767 2407 1 3 . 1 1 102 102 ASN H H 102 8.543 8.543 8.094 0.449 25767 2408 1 3 . 1 1 103 103 GLU N N 103 121.259 121.259 120.337 0.922 25767 2409 1 3 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.924 0.062 25767 2410 1 3 . 1 1 103 103 GLU C C 103 179.968 179.968 178.695 1.273 25767 2411 1 3 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.340 0.177 25767 2412 1 3 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.483 0.066 25767 2413 1 3 . 1 1 103 103 GLU H H 103 7.872 7.872 8.266 -0.394 25767 2414 1 3 . 1 1 104 104 LYS N N 104 120.268 120.268 120.138 0.130 25767 2415 1 3 . 1 1 104 104 LYS HA H 104 4.046 4.046 3.941 0.105 25767 2416 1 3 . 1 1 104 104 LYS C C 104 178.355 178.355 178.780 -0.425 25767 2417 1 3 . 1 1 104 104 LYS CA C 104 56.735 56.735 59.079 -2.344 25767 2418 1 3 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.467 -3.354 25767 2419 1 3 . 1 1 104 104 LYS H H 104 8.384 8.384 7.859 0.525 25767 2420 1 3 . 1 1 105 105 LEU N N 105 121.622 121.622 120.688 0.934 25767 2421 1 3 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.606 0.135 25767 2422 1 3 . 1 1 105 105 LEU C C 105 180.552 180.552 178.405 2.147 25767 2423 1 3 . 1 1 105 105 LEU CA C 105 58.172 58.172 57.936 0.236 25767 2424 1 3 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.474 -0.444 25767 2425 1 3 . 1 1 105 105 LEU H H 105 8.400 8.400 8.193 0.207 25767 2426 1 3 . 1 1 106 106 LYS N N 106 119.498 119.498 117.520 1.978 25767 2427 1 3 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.871 0.043 25767 2428 1 3 . 1 1 106 106 LYS C C 106 178.419 178.419 179.060 -0.641 25767 2429 1 3 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.035 0.348 25767 2430 1 3 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.376 0.432 25767 2431 1 3 . 1 1 106 106 LYS H H 106 7.067 7.067 7.608 -0.541 25767 2432 1 3 . 1 1 107 107 GLN N N 107 121.405 121.405 118.762 2.643 25767 2433 1 3 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.986 -0.135 25767 2434 1 3 . 1 1 107 107 GLN C C 107 177.935 177.935 178.928 -0.993 25767 2435 1 3 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.284 0.197 25767 2436 1 3 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.108 -1.310 25767 2437 1 3 . 1 1 107 107 GLN H H 107 7.460 7.460 7.560 -0.100 25767 2438 1 3 . 1 1 108 108 LEU N N 108 119.561 119.561 118.908 0.653 25767 2439 1 3 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.866 -0.065 25767 2440 1 3 . 1 1 108 108 LEU C C 108 179.195 179.195 178.230 0.965 25767 2441 1 3 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.334 1.058 25767 2442 1 3 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.663 -0.397 25767 2443 1 3 . 1 1 108 108 LEU H H 108 8.208 8.208 7.900 0.308 25767 2444 1 3 . 1 1 109 109 LYS N N 109 118.535 118.535 116.703 1.832 25767 2445 1 3 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.379 -0.127 25767 2446 1 3 . 1 1 109 109 LYS C C 109 177.726 177.726 177.895 -0.169 25767 2447 1 3 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.612 0.118 25767 2448 1 3 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.974 -0.564 25767 2449 1 3 . 1 1 109 109 LYS H H 109 7.168 7.168 7.491 -0.323 25767 2450 1 3 . 1 1 110 110 ASP N N 110 117.463 117.463 116.495 0.968 25767 2451 1 3 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.679 -0.074 25767 2452 1 3 . 1 1 110 110 ASP C C 110 177.360 177.360 176.621 0.739 25767 2453 1 3 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.648 1.248 25767 2454 1 3 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.918 0.659 25767 2455 1 3 . 1 1 110 110 ASP H H 110 7.861 7.861 8.316 -0.455 25767 2456 1 3 . 1 1 111 111 GLY N N 111 113.059 113.059 108.788 4.271 25767 2457 1 3 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.911 -0.859 25767 2458 1 3 . 1 1 111 111 GLY H H 111 8.479 8.479 7.785 0.694 25767 2459 1 3 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.007 0.456 25767 2460 1 3 . 1 1 112 112 PRO C C 112 175.090 175.090 175.595 -0.505 25767 2461 1 3 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.251 -0.887 25767 2462 1 3 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.597 2.253 25767 2463 1 3 . 1 1 113 113 TRP N N 113 123.164 123.164 122.217 0.947 25767 2464 1 3 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.770 -0.060 25767 2465 1 3 . 1 1 113 113 TRP C C 113 174.605 174.605 175.575 -0.970 25767 2466 1 3 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.193 0.712 25767 2467 1 3 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.725 -3.432 25767 2468 1 3 . 1 1 113 113 TRP H H 113 8.687 8.687 8.274 0.413 25767 2469 1 3 . 1 1 114 114 ASP N N 114 121.356 121.356 122.439 -1.083 25767 2470 1 3 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.859 0.002 25767 2471 1 3 . 1 1 114 114 ASP CA C 114 52.249 52.249 53.026 -0.777 25767 2472 1 3 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.219 -1.078 25767 2473 1 3 . 1 1 114 114 ASP H H 114 6.985 6.985 8.346 -1.361 25767 2474 1 3 . 1 1 115 115 VAL N N 115 118.649 118.649 119.267 -0.618 25767 2475 1 3 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.917 -0.075 25767 2476 1 3 . 1 1 115 115 VAL C C 115 177.739 177.739 177.486 0.253 25767 2477 1 3 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.653 -0.084 25767 2478 1 3 . 1 1 115 115 VAL CB C 115 31.677 31.677 31.947 -0.270 25767 2479 1 3 . 1 1 115 115 VAL H H 115 8.206 8.206 8.448 -0.242 25767 2480 1 3 . 1 1 116 116 MET N N 116 120.401 120.401 118.211 2.190 25767 2481 1 3 . 1 1 116 116 MET HA H 116 4.303 4.303 4.226 0.077 25767 2482 1 3 . 1 1 116 116 MET C C 116 179.269 179.269 178.427 0.842 25767 2483 1 3 . 1 1 116 116 MET CA C 116 57.634 57.634 59.020 -1.386 25767 2484 1 3 . 1 1 116 116 MET CB C 116 30.414 30.414 31.846 -1.431 25767 2485 1 3 . 1 1 116 116 MET H H 116 7.642 7.642 8.138 -0.496 25767 2486 1 3 . 1 1 117 117 LEU N N 117 125.503 125.503 119.554 5.949 25767 2487 1 3 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.117 0.128 25767 2488 1 3 . 1 1 117 117 LEU C C 117 178.445 178.445 179.430 -0.985 25767 2489 1 3 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.775 0.425 25767 2490 1 3 . 1 1 117 117 LEU CB C 117 40.089 40.089 40.712 -0.623 25767 2491 1 3 . 1 1 117 117 LEU H H 117 8.157 8.157 7.577 0.580 25767 2492 1 3 . 1 1 118 118 LYS N N 118 119.052 119.052 119.331 -0.279 25767 2493 1 3 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.921 -0.116 25767 2494 1 3 . 1 1 118 118 LYS C C 118 178.251 178.251 179.374 -1.123 25767 2495 1 3 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.395 0.131 25767 2496 1 3 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.248 -0.120 25767 2497 1 3 . 1 1 118 118 LYS H H 118 7.400 7.400 7.544 -0.144 25767 2498 1 3 . 1 1 119 119 ARG N N 119 117.999 117.999 118.901 -0.902 25767 2499 1 3 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.286 -0.066 25767 2500 1 3 . 1 1 119 119 ARG C C 119 180.441 180.441 179.046 1.395 25767 2501 1 3 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.613 0.204 25767 2502 1 3 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.265 -0.180 25767 2503 1 3 . 1 1 119 119 ARG H H 119 8.265 8.265 8.036 0.229 25767 2504 1 3 . 1 1 120 120 SER N N 120 118.073 118.073 115.905 2.168 25767 2505 1 3 . 1 1 120 120 SER HA H 120 4.182 4.182 4.317 -0.135 25767 2506 1 3 . 1 1 120 120 SER C C 120 176.215 176.215 176.657 -0.442 25767 2507 1 3 . 1 1 120 120 SER CA C 120 62.817 62.817 62.057 0.760 25767 2508 1 3 . 1 1 120 120 SER CB C 120 63.550 63.550 62.759 0.791 25767 2509 1 3 . 1 1 120 120 SER H H 120 8.633 8.633 7.917 0.716 25767 2510 1 3 . 1 1 121 121 LEU N N 121 125.029 125.029 123.038 1.991 25767 2511 1 3 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.015 0.204 25767 2512 1 3 . 1 1 121 121 LEU C C 121 179.679 179.679 178.797 0.882 25767 2513 1 3 . 1 1 121 121 LEU CA C 121 58.849 58.849 57.870 0.979 25767 2514 1 3 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.411 -0.637 25767 2515 1 3 . 1 1 121 121 LEU H H 121 8.313 8.313 7.962 0.351 25767 2516 1 3 . 1 1 122 122 TRP N N 122 120.217 120.217 119.510 0.707 25767 2517 1 3 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.429 -0.089 25767 2518 1 3 . 1 1 122 122 TRP C C 122 177.527 177.527 178.863 -1.336 25767 2519 1 3 . 1 1 122 122 TRP CA C 122 61.758 61.758 60.926 0.832 25767 2520 1 3 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.065 0.583 25767 2521 1 3 . 1 1 122 122 TRP H H 122 7.928 7.928 7.937 -0.009 25767 2522 1 3 . 1 1 123 123 CYS N N 123 119.669 119.669 118.563 1.106 25767 2523 1 3 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.205 0.002 25767 2524 1 3 . 1 1 123 123 CYS C C 123 177.057 177.057 177.128 -0.071 25767 2525 1 3 . 1 1 123 123 CYS CA C 123 62.600 62.600 63.101 -0.501 25767 2526 1 3 . 1 1 123 123 CYS CB C 123 25.899 25.899 26.311 -0.412 25767 2527 1 3 . 1 1 123 123 CYS H H 123 8.273 8.273 8.324 -0.051 25767 2528 1 3 . 1 1 124 124 CYS N N 124 116.898 116.898 119.942 -3.044 25767 2529 1 3 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.157 -0.309 25767 2530 1 3 . 1 1 124 124 CYS C C 124 175.759 175.759 176.793 -1.034 25767 2531 1 3 . 1 1 124 124 CYS CA C 124 65.653 65.653 64.665 0.988 25767 2532 1 3 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.289 0.228 25767 2533 1 3 . 1 1 124 124 CYS H H 124 8.122 8.122 8.454 -0.332 25767 2534 1 3 . 1 1 125 125 ILE N N 125 120.498 120.498 121.185 -0.687 25767 2535 1 3 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.613 -0.025 25767 2536 1 3 . 1 1 125 125 ILE C C 125 179.337 179.337 177.434 1.903 25767 2537 1 3 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.888 1.706 25767 2538 1 3 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.442 0.237 25767 2539 1 3 . 1 1 125 125 ILE H H 125 8.092 8.092 8.451 -0.359 25767 2540 1 3 . 1 1 126 126 ASP N N 126 125.084 125.084 119.740 5.344 25767 2541 1 3 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.461 0.156 25767 2542 1 3 . 1 1 126 126 ASP C C 126 178.299 178.299 178.732 -0.433 25767 2543 1 3 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.350 1.654 25767 2544 1 3 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.328 -0.032 25767 2545 1 3 . 1 1 126 126 ASP H H 126 9.049 9.049 8.154 0.895 25767 2546 1 3 . 1 1 127 127 LEU N N 127 122.591 122.591 121.326 1.265 25767 2547 1 3 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.949 -0.082 25767 2548 1 3 . 1 1 127 127 LEU C C 127 179.655 179.655 177.980 1.675 25767 2549 1 3 . 1 1 127 127 LEU CA C 127 58.661 58.661 57.888 0.773 25767 2550 1 3 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.814 0.380 25767 2551 1 3 . 1 1 127 127 LEU H H 127 8.888 8.888 7.800 1.088 25767 2552 1 3 . 1 1 128 128 PHE N N 128 117.498 117.498 119.136 -1.638 25767 2553 1 3 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.080 0.242 25767 2554 1 3 . 1 1 128 128 PHE C C 128 178.533 178.533 177.446 1.087 25767 2555 1 3 . 1 1 128 128 PHE CA C 128 60.932 60.932 62.092 -1.160 25767 2556 1 3 . 1 1 128 128 PHE CB C 128 39.053 39.053 39.080 -0.027 25767 2557 1 3 . 1 1 128 128 PHE H H 128 8.947 8.947 8.099 0.848 25767 2558 1 3 . 1 1 129 129 SER N N 129 115.398 115.398 115.573 -0.175 25767 2559 1 3 . 1 1 129 129 SER HA H 129 4.046 4.046 4.218 -0.172 25767 2560 1 3 . 1 1 129 129 SER C C 129 175.168 175.168 176.708 -1.540 25767 2561 1 3 . 1 1 129 129 SER CA C 129 63.015 63.015 61.490 1.525 25767 2562 1 3 . 1 1 129 129 SER H H 129 8.578 8.578 8.500 0.078 25767 2563 1 3 . 1 1 130 130 CYS N N 130 125.556 125.556 120.327 5.229 25767 2564 1 3 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.247 -0.138 25767 2565 1 3 . 1 1 130 130 CYS C C 130 175.294 175.294 177.145 -1.851 25767 2566 1 3 . 1 1 130 130 CYS CA C 130 61.438 61.438 64.819 -3.381 25767 2567 1 3 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.072 -0.022 25767 2568 1 3 . 1 1 130 130 CYS H H 130 8.289 8.289 8.306 -0.017 25767 2569 1 3 . 1 1 131 131 ILE N N 131 120.232 120.232 121.416 -1.184 25767 2570 1 3 . 1 1 131 131 ILE HA H 131 4.033 4.033 3.900 0.133 25767 2571 1 3 . 1 1 131 131 ILE C C 131 177.297 177.297 178.634 -1.337 25767 2572 1 3 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.758 -1.106 25767 2573 1 3 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.727 1.375 25767 2574 1 3 . 1 1 131 131 ILE H H 131 7.943 7.943 7.650 0.293 25767 2575 1 3 . 1 1 132 132 LEU N N 132 116.422 116.422 119.541 -3.119 25767 2576 1 3 . 1 1 132 132 LEU HA H 132 3.845 3.845 3.971 -0.126 25767 2577 1 3 . 1 1 132 132 LEU C C 132 177.816 177.816 179.055 -1.239 25767 2578 1 3 . 1 1 132 132 LEU CA C 132 57.078 57.078 58.279 -1.201 25767 2579 1 3 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.382 0.831 25767 2580 1 3 . 1 1 132 132 LEU H H 132 7.846 7.846 7.695 0.151 25767 2581 1 3 . 1 1 133 133 HIS N N 133 116.929 116.929 118.978 -2.049 25767 2582 1 3 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.204 -0.065 25767 2583 1 3 . 1 1 133 133 HIS C C 133 178.669 178.669 177.460 1.209 25767 2584 1 3 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.786 -0.050 25767 2585 1 3 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.343 2.809 25767 2586 1 3 . 1 1 133 133 HIS H H 133 7.822 7.822 8.411 -0.589 25767 2587 1 3 . 1 1 134 134 LEU N N 134 116.898 116.898 119.467 -2.569 25767 2588 1 3 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.039 -0.306 25767 2589 1 3 . 1 1 134 134 LEU C C 134 179.402 179.402 178.547 0.855 25767 2590 1 3 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.691 -0.464 25767 2591 1 3 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.258 -2.719 25767 2592 1 3 . 1 1 134 134 LEU H H 134 8.688 8.688 8.018 0.670 25767 2593 1 3 . 1 1 135 135 TRP N N 135 115.602 115.602 117.619 -2.017 25767 2594 1 3 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.594 0.414 25767 2595 1 3 . 1 1 135 135 TRP C C 135 175.022 175.022 177.947 -2.925 25767 2596 1 3 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.001 1.425 25767 2597 1 3 . 1 1 135 135 TRP CB C 135 27.085 27.085 28.989 -1.904 25767 2598 1 3 . 1 1 135 135 TRP H H 135 7.638 7.638 8.299 -0.661 25767 2599 1 3 . 1 1 136 136 LYS N N 136 119.721 119.721 122.832 -3.111 25767 2600 1 3 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.989 -0.173 25767 2601 1 3 . 1 1 136 136 LYS C C 136 178.279 178.279 178.590 -0.311 25767 2602 1 3 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.287 0.906 25767 2603 1 3 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.616 1.441 25767 2604 1 3 . 1 1 136 136 LYS H H 136 6.538 6.538 8.263 -1.725 25767 2605 1 3 . 1 1 137 137 GLU N N 137 115.407 115.407 115.550 -0.143 25767 2606 1 3 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.157 0.010 25767 2607 1 3 . 1 1 137 137 GLU C C 137 176.700 176.700 177.316 -0.616 25767 2608 1 3 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.513 -0.663 25767 2609 1 3 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.076 0.084 25767 2610 1 3 . 1 1 137 137 GLU H H 137 8.596 8.596 8.222 0.374 25767 2611 1 3 . 1 1 138 138 ASN N N 138 116.669 116.669 116.980 -0.311 25767 2612 1 3 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.818 0.088 25767 2613 1 3 . 1 1 138 138 ASN C C 138 173.481 173.481 174.980 -1.499 25767 2614 1 3 . 1 1 138 138 ASN CA C 138 52.814 52.814 54.111 -1.297 25767 2615 1 3 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.780 1.057 25767 2616 1 3 . 1 1 138 138 ASN H H 138 8.343 8.343 8.162 0.181 25767 2617 1 3 . 1 1 139 139 ILE N N 139 120.703 120.703 119.737 0.966 25767 2618 1 3 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.262 0.082 25767 2619 1 3 . 1 1 139 139 ILE C C 139 175.241 175.241 174.974 0.267 25767 2620 1 3 . 1 1 139 139 ILE CA C 139 60.792 60.792 60.381 0.411 25767 2621 1 3 . 1 1 139 139 ILE CB C 139 40.274 40.274 40.550 -0.276 25767 2622 1 3 . 1 1 139 139 ILE H H 139 7.167 7.167 7.428 -0.261 25767 2623 1 3 . 1 1 140 140 SER N N 140 123.284 123.284 119.831 3.453 25767 2624 1 3 . 1 1 140 140 SER HA H 140 4.345 4.345 4.553 -0.208 25767 2625 1 3 . 1 1 140 140 SER CA C 140 58.095 58.095 57.341 0.754 25767 2626 1 3 . 1 1 140 140 SER CB C 140 65.370 65.370 65.255 0.115 25767 2627 1 3 . 1 1 140 140 SER H H 140 8.727 8.727 8.450 0.277 25767 2628 1 3 . 1 1 142 142 THR N N 142 113.868 113.868 115.731 -1.863 25767 2629 1 3 . 1 1 142 142 THR HA H 142 3.976 3.976 4.083 -0.107 25767 2630 1 3 . 1 1 142 142 THR C C 142 177.559 177.559 176.805 0.754 25767 2631 1 3 . 1 1 142 142 THR CA C 142 66.007 66.007 66.548 -0.541 25767 2632 1 3 . 1 1 142 142 THR CB C 142 68.530 68.530 68.712 -0.182 25767 2633 1 3 . 1 1 142 142 THR H H 142 8.243 8.243 8.063 0.180 25767 2634 1 3 . 1 1 143 143 SER N N 143 120.786 120.786 118.420 2.366 25767 2635 1 3 . 1 1 143 143 SER C C 143 175.844 175.844 176.679 -0.835 25767 2636 1 3 . 1 1 143 143 SER CA C 143 62.102 62.102 62.405 -0.303 25767 2637 1 3 . 1 1 143 143 SER CB C 143 63.086 63.086 62.837 0.249 25767 2638 1 3 . 1 1 143 143 SER H H 143 7.915 7.915 8.412 -0.497 25767 2639 1 3 . 1 1 144 144 THR N N 144 120.946 120.946 117.862 3.084 25767 2640 1 3 . 1 1 144 144 THR HA H 144 4.299 4.299 4.099 0.200 25767 2641 1 3 . 1 1 144 144 THR C C 144 175.874 175.874 175.992 -0.118 25767 2642 1 3 . 1 1 144 144 THR CA C 144 67.487 67.487 66.688 0.799 25767 2643 1 3 . 1 1 144 144 THR CB C 144 68.485 68.485 68.837 -0.352 25767 2644 1 3 . 1 1 144 144 THR H H 144 8.746 8.746 8.544 0.202 25767 2645 1 3 . 1 1 145 145 ASN N N 145 120.069 120.069 119.269 0.800 25767 2646 1 3 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.377 -0.069 25767 2647 1 3 . 1 1 145 145 ASN C C 145 177.917 177.917 177.537 0.380 25767 2648 1 3 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.720 -0.383 25767 2649 1 3 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.664 -0.564 25767 2650 1 3 . 1 1 145 145 ASN H H 145 7.940 7.940 7.965 -0.025 25767 2651 1 3 . 1 1 146 146 SER N N 146 116.905 116.905 116.762 0.143 25767 2652 1 3 . 1 1 146 146 SER HA H 146 3.936 3.936 4.127 -0.191 25767 2653 1 3 . 1 1 146 146 SER C C 146 176.963 176.963 176.537 0.426 25767 2654 1 3 . 1 1 146 146 SER CA C 146 61.997 61.997 62.438 -0.441 25767 2655 1 3 . 1 1 146 146 SER CB C 146 62.879 62.879 63.164 -0.285 25767 2656 1 3 . 1 1 146 146 SER H H 146 7.951 7.951 7.776 0.175 25767 2657 1 3 . 1 1 147 147 LEU N N 147 123.253 123.253 121.755 1.498 25767 2658 1 3 . 1 1 147 147 LEU HA H 147 3.875 3.875 3.999 -0.124 25767 2659 1 3 . 1 1 147 147 LEU C C 147 178.726 178.726 178.954 -0.228 25767 2660 1 3 . 1 1 147 147 LEU CA C 147 58.580 58.580 58.408 0.172 25767 2661 1 3 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.759 -0.899 25767 2662 1 3 . 1 1 147 147 LEU H H 147 8.168 8.168 7.638 0.530 25767 2663 1 3 . 1 1 148 148 GLN N N 148 118.212 118.212 118.080 0.132 25767 2664 1 3 . 1 1 148 148 GLN HA H 148 3.817 3.817 3.989 -0.172 25767 2665 1 3 . 1 1 148 148 GLN C C 148 179.686 179.686 178.509 1.177 25767 2666 1 3 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.619 0.624 25767 2667 1 3 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.922 -0.203 25767 2668 1 3 . 1 1 148 148 GLN H H 148 8.295 8.295 8.625 -0.330 25767 2669 1 3 . 1 1 149 149 LYS N N 149 120.770 120.770 120.423 0.347 25767 2670 1 3 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.959 -0.058 25767 2671 1 3 . 1 1 149 149 LYS C C 149 178.006 178.006 179.088 -1.082 25767 2672 1 3 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.636 -0.104 25767 2673 1 3 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.155 -0.263 25767 2674 1 3 . 1 1 149 149 LYS H H 149 7.955 7.955 8.111 -0.156 25767 2675 1 3 . 1 1 150 150 ARG N N 150 119.244 119.244 119.080 0.164 25767 2676 1 3 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.986 -0.146 25767 2677 1 3 . 1 1 150 150 ARG C C 150 178.858 178.858 178.838 0.020 25767 2678 1 3 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.188 0.183 25767 2679 1 3 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.940 -1.136 25767 2680 1 3 . 1 1 150 150 ARG H H 150 7.020 7.020 7.534 -0.514 25767 2681 1 3 . 1 1 151 151 ILE N N 151 121.183 121.183 119.956 1.227 25767 2682 1 3 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.596 -0.237 25767 2683 1 3 . 1 1 151 151 ILE C C 151 177.327 177.327 177.841 -0.514 25767 2684 1 3 . 1 1 151 151 ILE CA C 151 67.196 67.196 64.963 2.233 25767 2685 1 3 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.479 0.793 25767 2686 1 3 . 1 1 151 151 ILE H H 151 7.574 7.574 7.687 -0.113 25767 2687 1 3 . 1 1 152 152 LYS N N 152 119.521 119.521 119.893 -0.372 25767 2688 1 3 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.932 -0.159 25767 2689 1 3 . 1 1 152 152 LYS C C 152 178.016 178.016 178.859 -0.843 25767 2690 1 3 . 1 1 152 152 LYS CA C 152 59.830 59.830 59.173 0.657 25767 2691 1 3 . 1 1 152 152 LYS CB C 152 31.581 31.581 31.618 -0.037 25767 2692 1 3 . 1 1 152 152 LYS H H 152 7.629 7.629 7.959 -0.330 25767 2693 1 3 . 1 1 153 153 TYR N N 153 120.178 120.178 121.088 -0.910 25767 2694 1 3 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.159 -0.087 25767 2695 1 3 . 1 1 153 153 TYR C C 153 178.195 178.195 177.821 0.374 25767 2696 1 3 . 1 1 153 153 TYR CA C 153 61.316 61.316 62.151 -0.835 25767 2697 1 3 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.311 -1.038 25767 2698 1 3 . 1 1 153 153 TYR H H 153 8.407 8.407 7.816 0.591 25767 2699 1 3 . 1 1 154 154 CYS N N 154 117.013 117.013 118.544 -1.531 25767 2700 1 3 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.325 -0.253 25767 2701 1 3 . 1 1 154 154 CYS C C 154 176.827 176.827 177.100 -0.273 25767 2702 1 3 . 1 1 154 154 CYS CA C 154 65.780 65.780 62.367 3.413 25767 2703 1 3 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.314 0.846 25767 2704 1 3 . 1 1 154 154 CYS H H 154 8.291 8.291 7.762 0.529 25767 2705 1 3 . 1 1 155 155 LYS N N 155 118.753 118.753 120.813 -2.060 25767 2706 1 3 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.835 -0.164 25767 2707 1 3 . 1 1 155 155 LYS C C 155 179.904 179.904 179.044 0.860 25767 2708 1 3 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.636 0.848 25767 2709 1 3 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.235 -0.292 25767 2710 1 3 . 1 1 155 155 LYS H H 155 7.934 7.934 8.177 -0.243 25767 2711 1 3 . 1 1 156 156 ILE N N 156 123.873 123.873 120.641 3.232 25767 2712 1 3 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.560 0.024 25767 2713 1 3 . 1 1 156 156 ILE C C 156 179.501 179.501 177.460 2.041 25767 2714 1 3 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.593 -0.353 25767 2715 1 3 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.895 -0.253 25767 2716 1 3 . 1 1 156 156 ILE H H 156 8.314 8.314 8.613 -0.299 25767 2717 1 3 . 1 1 157 157 TYR N N 157 121.132 121.132 119.832 1.300 25767 2718 1 3 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.886 0.279 25767 2719 1 3 . 1 1 157 157 TYR C C 157 178.558 178.558 177.405 1.153 25767 2720 1 3 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.749 0.361 25767 2721 1 3 . 1 1 157 157 TYR H H 157 8.442 8.442 7.725 0.717 25767 2722 1 3 . 1 1 158 158 LEU N N 158 120.964 120.964 119.878 1.086 25767 2723 1 3 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.803 0.109 25767 2724 1 3 . 1 1 158 158 LEU C C 158 180.130 180.130 178.668 1.462 25767 2725 1 3 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.763 0.923 25767 2726 1 3 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.492 0.238 25767 2727 1 3 . 1 1 158 158 LEU H H 158 8.469 8.469 7.916 0.553 25767 2728 1 3 . 1 1 159 159 SER N N 159 116.653 116.653 114.494 2.159 25767 2729 1 3 . 1 1 159 159 SER HA H 159 4.246 4.246 4.056 0.190 25767 2730 1 3 . 1 1 159 159 SER CA C 159 61.460 61.460 61.739 -0.279 25767 2731 1 3 . 1 1 159 159 SER CB C 159 62.849 62.849 62.584 0.265 25767 2732 1 3 . 1 1 159 159 SER H H 159 7.758 7.758 8.287 -0.529 25767 2733 1 3 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.212 -1.839 25767 2734 1 3 . 1 1 160 160 LYS CB C 160 29.832 29.832 31.996 -2.164 25767 2735 1 3 . 1 1 160 160 LYS H H 160 8.425 8.425 7.342 1.083 25767 2736 1 3 . 1 1 161 161 LEU N N 161 121.686 121.686 118.340 3.346 25767 2737 1 3 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.754 0.409 25767 2738 1 3 . 1 1 161 161 LEU C C 161 180.224 180.224 178.784 1.440 25767 2739 1 3 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.082 0.502 25767 2740 1 3 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.445 0.017 25767 2741 1 3 . 1 1 161 161 LEU H H 161 8.323 8.323 7.344 0.979 25767 2742 1 3 . 1 1 162 162 ALA N N 162 123.102 123.102 121.177 1.925 25767 2743 1 3 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.088 0.042 25767 2744 1 3 . 1 1 162 162 ALA C C 162 179.487 179.487 179.123 0.364 25767 2745 1 3 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.691 0.053 25767 2746 1 3 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.474 -0.071 25767 2747 1 3 . 1 1 162 162 ALA H H 162 7.978 7.978 7.721 0.257 25767 2748 1 3 . 1 1 163 163 LYS N N 163 116.069 116.069 116.468 -0.399 25767 2749 1 3 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.260 -0.037 25767 2750 1 3 . 1 1 163 163 LYS C C 163 176.987 176.987 176.691 0.296 25767 2751 1 3 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.367 0.239 25767 2752 1 3 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.699 0.507 25767 2753 1 3 . 1 1 163 163 LYS H H 163 7.697 7.697 7.713 -0.016 25767 2754 1 3 . 1 1 164 164 GLY N N 164 108.540 108.540 107.101 1.439 25767 2755 1 3 . 1 1 164 164 GLY C C 164 174.721 174.721 173.855 0.866 25767 2756 1 3 . 1 1 164 164 GLY CA C 164 45.791 45.791 45.013 0.778 25767 2757 1 3 . 1 1 164 164 GLY H H 164 7.772 7.772 7.410 0.362 25767 2758 1 3 . 1 1 165 165 GLU N N 165 119.886 119.886 120.936 -1.050 25767 2759 1 3 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.355 -0.305 25767 2760 1 3 . 1 1 165 165 GLU C C 165 176.027 176.027 174.696 1.331 25767 2761 1 3 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.656 1.197 25767 2762 1 3 . 1 1 165 165 GLU CB C 165 30.338 30.338 30.688 -0.350 25767 2763 1 3 . 1 1 165 165 GLU H H 165 8.065 8.065 7.638 0.427 25767 2764 1 3 . 1 1 166 166 ILE N N 166 117.926 117.926 124.348 -6.422 25767 2765 1 3 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.985 -0.083 25767 2766 1 3 . 1 1 166 166 ILE C C 166 174.138 174.138 174.203 -0.065 25767 2767 1 3 . 1 1 166 166 ILE CA C 166 60.455 60.455 60.431 0.024 25767 2768 1 3 . 1 1 166 166 ILE CB C 166 40.202 40.202 40.568 -0.366 25767 2769 1 3 . 1 1 166 166 ILE H H 166 7.282 7.282 8.097 -0.815 25767 2770 1 4 . 1 1 2 2 ALA N N 2 122.811 122.811 123.781 -0.970 25767 2771 1 4 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.248 -0.225 25767 2772 1 4 . 1 1 2 2 ALA C C 2 179.915 179.915 178.869 1.046 25767 2773 1 4 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.047 0.070 25767 2774 1 4 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.453 0.086 25767 2775 1 4 . 1 1 2 2 ALA H H 2 8.509 8.509 8.524 -0.015 25767 2776 1 4 . 1 1 3 3 SER N N 3 115.308 115.308 114.097 1.211 25767 2777 1 4 . 1 1 3 3 SER HA H 3 4.097 4.097 4.116 -0.019 25767 2778 1 4 . 1 1 3 3 SER C C 3 176.706 176.706 176.993 -0.287 25767 2779 1 4 . 1 1 3 3 SER CA C 3 60.665 60.665 61.079 -0.414 25767 2780 1 4 . 1 1 3 3 SER CB C 3 62.710 62.710 62.442 0.268 25767 2781 1 4 . 1 1 3 3 SER H H 3 7.996 7.996 8.366 -0.370 25767 2782 1 4 . 1 1 4 4 ASN N N 4 122.688 122.688 121.459 1.229 25767 2783 1 4 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.360 -0.056 25767 2784 1 4 . 1 1 4 4 ASN C C 4 176.258 176.258 177.272 -1.014 25767 2785 1 4 . 1 1 4 4 ASN CA C 4 55.701 55.701 56.269 -0.568 25767 2786 1 4 . 1 1 4 4 ASN CB C 4 38.177 38.177 38.181 -0.004 25767 2787 1 4 . 1 1 4 4 ASN H H 4 8.075 8.075 8.197 -0.122 25767 2788 1 4 . 1 1 5 5 ALA N N 5 121.900 121.900 122.887 -0.987 25767 2789 1 4 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.007 -0.432 25767 2790 1 4 . 1 1 5 5 ALA C C 5 178.475 178.475 178.947 -0.472 25767 2791 1 4 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.964 0.869 25767 2792 1 4 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.427 -0.812 25767 2793 1 4 . 1 1 5 5 ALA H H 5 8.659 8.659 7.695 0.964 25767 2794 1 4 . 1 1 6 6 ALA N N 6 117.768 117.768 121.783 -4.015 25767 2795 1 4 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.977 -0.190 25767 2796 1 4 . 1 1 6 6 ALA C C 6 180.494 180.494 179.429 1.065 25767 2797 1 4 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.133 0.217 25767 2798 1 4 . 1 1 6 6 ALA CB C 6 17.902 17.902 17.991 -0.089 25767 2799 1 4 . 1 1 6 6 ALA H H 6 7.864 7.864 7.945 -0.081 25767 2800 1 4 . 1 1 7 7 ARG N N 7 121.173 121.173 119.119 2.054 25767 2801 1 4 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.085 -0.182 25767 2802 1 4 . 1 1 7 7 ARG C C 7 179.189 179.189 178.657 0.532 25767 2803 1 4 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.773 0.539 25767 2804 1 4 . 1 1 7 7 ARG CB C 7 29.222 29.222 30.005 -0.782 25767 2805 1 4 . 1 1 7 7 ARG H H 7 7.514 7.514 8.200 -0.685 25767 2806 1 4 . 1 1 8 8 VAL N N 8 122.979 122.979 120.038 2.941 25767 2807 1 4 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.635 -0.382 25767 2808 1 4 . 1 1 8 8 VAL C C 8 177.821 177.821 177.772 0.049 25767 2809 1 4 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.998 0.774 25767 2810 1 4 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.793 -0.351 25767 2811 1 4 . 1 1 8 8 VAL H H 8 8.101 8.101 7.729 0.372 25767 2812 1 4 . 1 1 9 9 VAL N N 9 119.801 119.801 120.014 -0.213 25767 2813 1 4 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.546 -0.280 25767 2814 1 4 . 1 1 9 9 VAL C C 9 177.373 177.373 177.774 -0.401 25767 2815 1 4 . 1 1 9 9 VAL CA C 9 67.484 67.484 66.930 0.554 25767 2816 1 4 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.978 0.647 25767 2817 1 4 . 1 1 9 9 VAL H H 9 8.362 8.362 7.980 0.382 25767 2818 1 4 . 1 1 10 10 ALA N N 10 122.360 122.360 121.718 0.642 25767 2819 1 4 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.049 -0.113 25767 2820 1 4 . 1 1 10 10 ALA C C 10 180.762 180.762 179.636 1.126 25767 2821 1 4 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.393 0.051 25767 2822 1 4 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.233 -0.496 25767 2823 1 4 . 1 1 10 10 ALA H H 10 7.776 7.776 7.807 -0.031 25767 2824 1 4 . 1 1 11 11 THR N N 11 117.376 117.376 114.296 3.080 25767 2825 1 4 . 1 1 11 11 THR HA H 11 3.816 3.816 4.087 -0.271 25767 2826 1 4 . 1 1 11 11 THR C C 11 175.775 175.775 176.359 -0.584 25767 2827 1 4 . 1 1 11 11 THR CA C 11 66.509 66.509 66.184 0.325 25767 2828 1 4 . 1 1 11 11 THR CB C 11 68.588 68.588 68.765 -0.177 25767 2829 1 4 . 1 1 11 11 THR H H 11 8.180 8.180 7.870 0.310 25767 2830 1 4 . 1 1 12 12 ALA N N 12 125.308 125.308 124.306 1.002 25767 2831 1 4 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.737 0.260 25767 2832 1 4 . 1 1 12 12 ALA C C 12 179.399 179.399 179.243 0.156 25767 2833 1 4 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.508 0.568 25767 2834 1 4 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.228 1.016 25767 2835 1 4 . 1 1 12 12 ALA H H 12 8.671 8.671 8.474 0.197 25767 2836 1 4 . 1 1 13 13 LYS N N 13 116.977 116.977 118.415 -1.438 25767 2837 1 4 . 1 1 13 13 LYS C C 13 179.646 179.646 178.743 0.903 25767 2838 1 4 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.796 -0.875 25767 2839 1 4 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.178 -0.735 25767 2840 1 4 . 1 1 13 13 LYS H H 13 8.061 8.061 7.749 0.312 25767 2841 1 4 . 1 1 14 14 ASP N N 14 121.988 121.988 120.112 1.876 25767 2842 1 4 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.479 -0.126 25767 2843 1 4 . 1 1 14 14 ASP C C 14 179.446 179.446 178.724 0.722 25767 2844 1 4 . 1 1 14 14 ASP CA C 14 57.509 57.509 57.044 0.465 25767 2845 1 4 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.637 -0.636 25767 2846 1 4 . 1 1 14 14 ASP H H 14 7.669 7.669 7.702 -0.033 25767 2847 1 4 . 1 1 15 15 PHE N N 15 119.588 119.588 118.244 1.344 25767 2848 1 4 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.234 0.110 25767 2849 1 4 . 1 1 15 15 PHE C C 15 178.373 178.373 178.056 0.317 25767 2850 1 4 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.208 1.029 25767 2851 1 4 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.651 -1.155 25767 2852 1 4 . 1 1 15 15 PHE H H 15 7.913 7.913 8.317 -0.404 25767 2853 1 4 . 1 1 16 16 ASP N N 16 121.705 121.705 119.994 1.711 25767 2854 1 4 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.466 -0.471 25767 2855 1 4 . 1 1 16 16 ASP C C 16 180.071 180.071 179.021 1.050 25767 2856 1 4 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.148 1.001 25767 2857 1 4 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.448 1.039 25767 2858 1 4 . 1 1 16 16 ASP H H 16 8.324 8.324 8.112 0.212 25767 2859 1 4 . 1 1 17 17 LYS N N 17 118.825 118.825 119.165 -0.340 25767 2860 1 4 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.092 -0.055 25767 2861 1 4 . 1 1 17 17 LYS C C 17 178.407 178.407 177.873 0.534 25767 2862 1 4 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.905 0.156 25767 2863 1 4 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.524 0.060 25767 2864 1 4 . 1 1 17 17 LYS H H 17 7.834 7.834 7.757 0.077 25767 2865 1 4 . 1 1 18 18 VAL N N 18 110.562 110.562 117.265 -6.703 25767 2866 1 4 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.060 0.456 25767 2867 1 4 . 1 1 18 18 VAL C C 18 176.144 176.144 176.642 -0.498 25767 2868 1 4 . 1 1 18 18 VAL CA C 18 60.874 60.874 62.386 -1.512 25767 2869 1 4 . 1 1 18 18 VAL CB C 18 31.160 31.160 31.622 -0.462 25767 2870 1 4 . 1 1 18 18 VAL H H 18 7.185 7.185 7.574 -0.389 25767 2871 1 4 . 1 1 19 19 GLY N N 19 109.272 109.272 106.920 2.352 25767 2872 1 4 . 1 1 19 19 GLY C C 19 175.043 175.043 174.999 0.044 25767 2873 1 4 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.385 0.446 25767 2874 1 4 . 1 1 19 19 GLY H H 19 7.723 7.723 7.806 -0.083 25767 2875 1 4 . 1 1 20 20 LEU N N 20 125.428 125.428 122.679 2.749 25767 2876 1 4 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.693 -0.373 25767 2877 1 4 . 1 1 20 20 LEU C C 20 177.949 177.949 177.234 0.715 25767 2878 1 4 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.316 -0.512 25767 2879 1 4 . 1 1 20 20 LEU CB C 20 39.917 39.917 38.994 0.923 25767 2880 1 4 . 1 1 20 20 LEU H H 20 8.083 8.083 8.067 0.016 25767 2881 1 4 . 1 1 21 21 GLY N N 21 107.804 107.804 110.080 -2.276 25767 2882 1 4 . 1 1 21 21 GLY C C 21 176.278 176.278 176.350 -0.072 25767 2883 1 4 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.656 -0.362 25767 2884 1 4 . 1 1 21 21 GLY H H 21 7.982 7.982 7.945 0.037 25767 2885 1 4 . 1 1 22 22 ILE N N 22 121.319 121.319 121.693 -0.374 25767 2886 1 4 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.857 0.053 25767 2887 1 4 . 1 1 22 22 ILE C C 22 176.604 176.604 177.678 -1.074 25767 2888 1 4 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.333 -1.887 25767 2889 1 4 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.721 -1.155 25767 2890 1 4 . 1 1 22 22 ILE H H 22 8.478 8.478 8.039 0.439 25767 2891 1 4 . 1 1 23 23 ILE N N 23 120.377 120.377 119.733 0.644 25767 2892 1 4 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.826 -0.113 25767 2893 1 4 . 1 1 23 23 ILE C C 23 178.581 178.581 178.358 0.223 25767 2894 1 4 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.490 0.756 25767 2895 1 4 . 1 1 23 23 ILE CB C 23 36.199 36.199 36.230 -0.031 25767 2896 1 4 . 1 1 23 23 ILE H H 23 6.869 6.869 7.606 -0.737 25767 2897 1 4 . 1 1 24 24 GLY N N 24 103.449 103.449 108.607 -5.158 25767 2898 1 4 . 1 1 24 24 GLY C C 24 175.308 175.308 175.677 -0.369 25767 2899 1 4 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.244 0.699 25767 2900 1 4 . 1 1 24 24 GLY H H 24 7.488 7.488 7.893 -0.405 25767 2901 1 4 . 1 1 25 25 TYR N N 25 124.685 124.685 124.215 0.470 25767 2902 1 4 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.641 0.025 25767 2903 1 4 . 1 1 25 25 TYR C C 25 176.208 176.208 177.299 -1.091 25767 2904 1 4 . 1 1 25 25 TYR CA C 25 61.371 61.371 61.140 0.231 25767 2905 1 4 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.367 -0.100 25767 2906 1 4 . 1 1 25 25 TYR H H 25 7.931 7.931 8.186 -0.255 25767 2907 1 4 . 1 1 26 26 TYR N N 26 117.001 117.001 119.706 -2.705 25767 2908 1 4 . 1 1 26 26 TYR HA H 26 3.941 3.941 4.007 -0.066 25767 2909 1 4 . 1 1 26 26 TYR C C 26 178.753 178.753 177.504 1.249 25767 2910 1 4 . 1 1 26 26 TYR CA C 26 64.260 64.260 61.939 2.321 25767 2911 1 4 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.961 -1.440 25767 2912 1 4 . 1 1 26 26 TYR H H 26 7.693 7.693 7.927 -0.234 25767 2913 1 4 . 1 1 27 27 LEU N N 27 118.657 118.657 119.167 -0.510 25767 2914 1 4 . 1 1 27 27 LEU HA H 27 4.311 4.311 3.999 0.312 25767 2915 1 4 . 1 1 27 27 LEU CA C 27 58.297 58.297 58.365 -0.068 25767 2916 1 4 . 1 1 27 27 LEU CB C 27 42.723 42.723 41.046 1.677 25767 2917 1 4 . 1 1 27 27 LEU H H 27 8.339 8.339 8.741 -0.402 25767 2918 1 4 . 1 1 28 28 GLN N N 28 118.593 118.593 118.727 -0.134 25767 2919 1 4 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.780 -0.129 25767 2920 1 4 . 1 1 28 28 GLN C C 28 177.282 177.282 178.460 -1.178 25767 2921 1 4 . 1 1 28 28 GLN CA C 28 58.829 58.829 59.172 -0.344 25767 2922 1 4 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.610 1.038 25767 2923 1 4 . 1 1 28 28 GLN H H 28 7.970 7.970 8.238 -0.268 25767 2924 1 4 . 1 1 29 29 LEU N N 29 122.111 122.111 119.695 2.416 25767 2925 1 4 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.721 0.223 25767 2926 1 4 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.598 1.068 25767 2927 1 4 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.330 0.678 25767 2928 1 4 . 1 1 29 29 LEU H H 29 7.979 7.979 7.404 0.575 25767 2929 1 4 . 1 1 30 30 TYR N N 30 119.283 119.283 120.048 -0.765 25767 2930 1 4 . 1 1 30 30 TYR C C 30 175.775 175.775 177.217 -1.442 25767 2931 1 4 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.780 -1.686 25767 2932 1 4 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.354 0.719 25767 2933 1 4 . 1 1 30 30 TYR H H 30 8.093 8.093 7.567 0.526 25767 2934 1 4 . 1 1 31 31 ALA N N 31 121.327 121.327 122.163 -0.836 25767 2935 1 4 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.851 -0.483 25767 2936 1 4 . 1 1 31 31 ALA C C 31 178.955 178.955 178.843 0.112 25767 2937 1 4 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.310 0.237 25767 2938 1 4 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.188 -0.225 25767 2939 1 4 . 1 1 31 31 ALA H H 31 8.394 8.394 8.300 0.094 25767 2940 1 4 . 1 1 32 32 VAL N N 32 116.757 116.757 118.598 -1.841 25767 2941 1 4 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.488 -0.228 25767 2942 1 4 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.838 1.825 25767 2943 1 4 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.756 -0.785 25767 2944 1 4 . 1 1 32 32 VAL H H 32 8.020 8.020 7.609 0.411 25767 2945 1 4 . 1 1 33 33 GLU N N 33 118.775 118.775 119.591 -0.816 25767 2946 1 4 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.779 0.210 25767 2947 1 4 . 1 1 33 33 GLU C C 33 179.746 179.746 178.954 0.792 25767 2948 1 4 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.329 0.674 25767 2949 1 4 . 1 1 33 33 GLU H H 33 7.358 7.358 7.540 -0.182 25767 2950 1 4 . 1 1 34 34 LEU N N 34 120.632 120.632 121.417 -0.785 25767 2951 1 4 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.837 -0.188 25767 2952 1 4 . 1 1 34 34 LEU C C 34 180.336 180.336 178.408 1.928 25767 2953 1 4 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.648 0.027 25767 2954 1 4 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.791 -0.203 25767 2955 1 4 . 1 1 34 34 LEU H H 34 8.390 8.390 7.730 0.660 25767 2956 1 4 . 1 1 35 35 ILE N N 35 121.240 121.240 118.769 2.471 25767 2957 1 4 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.560 -0.018 25767 2958 1 4 . 1 1 35 35 ILE C C 35 178.604 178.604 178.533 0.071 25767 2959 1 4 . 1 1 35 35 ILE CA C 35 65.547 65.547 65.232 0.315 25767 2960 1 4 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.668 1.063 25767 2961 1 4 . 1 1 35 35 ILE H H 35 8.129 8.129 7.630 0.499 25767 2962 1 4 . 1 1 36 36 LEU N N 36 115.637 115.637 118.517 -2.880 25767 2963 1 4 . 1 1 36 36 LEU HA H 36 4.008 4.008 3.983 0.025 25767 2964 1 4 . 1 1 36 36 LEU C C 36 178.001 178.001 177.881 0.120 25767 2965 1 4 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.276 -1.200 25767 2966 1 4 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.242 -1.308 25767 2967 1 4 . 1 1 36 36 LEU H H 36 8.416 8.416 7.841 0.575 25767 2968 1 4 . 1 1 37 37 SER N N 37 114.106 114.106 111.882 2.224 25767 2969 1 4 . 1 1 37 37 SER HA H 37 3.991 3.991 4.217 -0.226 25767 2970 1 4 . 1 1 37 37 SER C C 37 173.997 173.997 175.256 -1.259 25767 2971 1 4 . 1 1 37 37 SER CA C 37 60.311 60.311 59.088 1.223 25767 2972 1 4 . 1 1 37 37 SER CB C 37 63.746 63.746 63.622 0.124 25767 2973 1 4 . 1 1 37 37 SER H H 37 7.517 7.517 7.528 -0.011 25767 2974 1 4 . 1 1 38 38 GLU N N 38 123.003 123.003 122.014 0.989 25767 2975 1 4 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.239 0.130 25767 2976 1 4 . 1 1 38 38 GLU C C 38 175.780 175.780 175.809 -0.029 25767 2977 1 4 . 1 1 38 38 GLU CA C 38 55.365 55.365 56.351 -0.986 25767 2978 1 4 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.318 -0.025 25767 2979 1 4 . 1 1 38 38 GLU H H 38 7.151 7.151 7.449 -0.298 25767 2980 1 4 . 1 1 39 39 GLU N N 39 126.166 126.166 122.416 3.750 25767 2981 1 4 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.111 -0.102 25767 2982 1 4 . 1 1 39 39 GLU C C 39 176.652 176.652 176.098 0.554 25767 2983 1 4 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.602 1.596 25767 2984 1 4 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.096 -0.061 25767 2985 1 4 . 1 1 39 39 GLU H H 39 8.587 8.587 8.447 0.140 25767 2986 1 4 . 1 1 40 40 ASP N N 40 120.047 120.047 121.222 -1.175 25767 2987 1 4 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.472 0.078 25767 2988 1 4 . 1 1 40 40 ASP C C 40 175.035 175.035 175.852 -0.817 25767 2989 1 4 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.217 -1.849 25767 2990 1 4 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.684 -0.661 25767 2991 1 4 . 1 1 40 40 ASP H H 40 8.504 8.504 8.552 -0.048 25767 2992 1 4 . 1 1 41 41 ARG N N 41 120.671 120.671 123.801 -3.130 25767 2993 1 4 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.636 -0.247 25767 2994 1 4 . 1 1 41 41 ARG C C 41 175.755 175.755 175.974 -0.219 25767 2995 1 4 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.658 0.349 25767 2996 1 4 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.146 -0.597 25767 2997 1 4 . 1 1 41 41 ARG H H 41 7.672 7.672 8.294 -0.622 25767 2998 1 4 . 1 1 42 42 SER N N 42 120.330 120.330 115.814 4.516 25767 2999 1 4 . 1 1 42 42 SER HA H 42 3.837 3.837 4.388 -0.551 25767 3000 1 4 . 1 1 42 42 SER CA C 42 57.326 57.326 58.346 -1.020 25767 3001 1 4 . 1 1 42 42 SER CB C 42 65.762 65.762 64.139 1.623 25767 3002 1 4 . 1 1 42 42 SER H H 42 8.544 8.544 8.227 0.317 25767 3003 1 4 . 1 1 43 43 GLN HA H 43 3.989 3.989 4.016 -0.027 25767 3004 1 4 . 1 1 43 43 GLN C C 43 178.907 178.907 177.864 1.043 25767 3005 1 4 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.597 0.773 25767 3006 1 4 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.675 -0.712 25767 3007 1 4 . 1 1 44 44 GLU N N 44 120.328 120.328 120.229 0.099 25767 3008 1 4 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.962 0.051 25767 3009 1 4 . 1 1 44 44 GLU C C 44 179.824 179.824 178.652 1.172 25767 3010 1 4 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.208 0.837 25767 3011 1 4 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.296 -0.648 25767 3012 1 4 . 1 1 44 44 GLU H H 44 8.938 8.938 7.939 0.999 25767 3013 1 4 . 1 1 45 45 MET N N 45 121.030 121.030 117.736 3.294 25767 3014 1 4 . 1 1 45 45 MET HA H 45 4.412 4.412 4.249 0.163 25767 3015 1 4 . 1 1 45 45 MET C C 45 180.357 180.357 178.385 1.972 25767 3016 1 4 . 1 1 45 45 MET CA C 45 57.209 57.209 57.715 -0.506 25767 3017 1 4 . 1 1 45 45 MET CB C 45 32.436 32.436 31.881 0.555 25767 3018 1 4 . 1 1 45 45 MET H H 45 7.756 7.756 7.717 0.039 25767 3019 1 4 . 1 1 46 46 THR N N 46 120.008 120.008 115.840 4.168 25767 3020 1 4 . 1 1 46 46 THR HA H 46 4.071 4.071 3.925 0.146 25767 3021 1 4 . 1 1 46 46 THR CA C 46 67.096 67.096 66.466 0.630 25767 3022 1 4 . 1 1 46 46 THR CB C 46 68.954 68.954 68.254 0.701 25767 3023 1 4 . 1 1 46 46 THR H H 46 8.187 8.187 7.457 0.730 25767 3024 1 4 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.123 -0.014 25767 3025 1 4 . 1 1 47 47 ALA C C 47 180.118 180.118 179.325 0.793 25767 3026 1 4 . 1 1 47 47 ALA CA C 47 55.339 55.339 55.025 0.314 25767 3027 1 4 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.183 -0.351 25767 3028 1 4 . 1 1 47 47 ALA H H 47 8.238 8.238 8.171 0.067 25767 3029 1 4 . 1 1 48 48 LEU N N 48 122.093 122.093 119.268 2.825 25767 3030 1 4 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.015 0.248 25767 3031 1 4 . 1 1 48 48 LEU C C 48 179.103 179.103 179.307 -0.204 25767 3032 1 4 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.471 0.270 25767 3033 1 4 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.498 -0.702 25767 3034 1 4 . 1 1 48 48 LEU H H 48 7.778 7.778 7.643 0.135 25767 3035 1 4 . 1 1 49 49 ALA N N 49 120.130 120.130 121.716 -1.586 25767 3036 1 4 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.935 -0.214 25767 3037 1 4 . 1 1 49 49 ALA C C 49 178.676 178.676 179.426 -0.750 25767 3038 1 4 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.339 0.382 25767 3039 1 4 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.035 -0.208 25767 3040 1 4 . 1 1 49 49 ALA H H 49 8.432 8.432 8.204 0.228 25767 3041 1 4 . 1 1 50 50 THR N N 50 113.333 113.333 115.458 -2.125 25767 3042 1 4 . 1 1 50 50 THR HA H 50 3.895 3.895 3.822 0.073 25767 3043 1 4 . 1 1 50 50 THR C C 50 174.948 174.948 176.531 -1.583 25767 3044 1 4 . 1 1 50 50 THR CA C 50 67.334 67.334 67.315 0.019 25767 3045 1 4 . 1 1 50 50 THR CB C 50 68.864 68.864 68.620 0.244 25767 3046 1 4 . 1 1 50 50 THR H H 50 7.857 7.857 7.789 0.068 25767 3047 1 4 . 1 1 51 51 GLU N N 51 122.698 122.698 122.323 0.375 25767 3048 1 4 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.023 0.045 25767 3049 1 4 . 1 1 51 51 GLU C C 51 179.997 179.997 178.668 1.329 25767 3050 1 4 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.289 0.144 25767 3051 1 4 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.720 -0.203 25767 3052 1 4 . 1 1 51 51 GLU H H 51 7.817 7.817 7.601 0.216 25767 3053 1 4 . 1 1 52 52 LEU N N 52 121.100 121.100 121.219 -0.119 25767 3054 1 4 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.040 0.089 25767 3055 1 4 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.817 0.072 25767 3056 1 4 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.769 0.178 25767 3057 1 4 . 1 1 52 52 LEU H H 52 8.628 8.628 7.889 0.739 25767 3058 1 4 . 1 1 53 53 LEU N N 53 119.935 119.935 119.784 0.151 25767 3059 1 4 . 1 1 53 53 LEU C C 53 179.671 179.671 178.266 1.405 25767 3060 1 4 . 1 1 53 53 LEU H H 53 8.303 8.303 7.883 0.420 25767 3061 1 4 . 1 1 54 54 ASP N N 54 120.339 120.339 119.082 1.257 25767 3062 1 4 . 1 1 54 54 ASP C C 54 179.106 179.106 178.420 0.686 25767 3063 1 4 . 1 1 54 54 ASP H H 54 7.901 7.901 7.980 -0.079 25767 3064 1 4 . 1 1 55 55 THR N N 55 120.237 120.237 116.683 3.554 25767 3065 1 4 . 1 1 55 55 THR HA H 55 3.696 3.696 4.048 -0.352 25767 3066 1 4 . 1 1 55 55 THR CA C 55 67.340 67.340 66.823 0.517 25767 3067 1 4 . 1 1 55 55 THR CB C 55 68.151 68.151 68.527 -0.376 25767 3068 1 4 . 1 1 55 55 THR H H 55 8.262 8.262 7.690 0.572 25767 3069 1 4 . 1 1 56 56 ILE N N 56 123.953 123.953 122.641 1.312 25767 3070 1 4 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.737 0.106 25767 3071 1 4 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.862 0.032 25767 3072 1 4 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.751 0.382 25767 3073 1 4 . 1 1 56 56 ILE H H 56 8.930 8.930 7.721 1.209 25767 3074 1 4 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.782 -0.201 25767 3075 1 4 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.147 -0.116 25767 3076 1 4 . 1 1 58 58 ALA C C 58 179.875 179.875 179.466 0.409 25767 3077 1 4 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.752 0.514 25767 3078 1 4 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.326 -0.341 25767 3079 1 4 . 1 1 58 58 ALA H H 58 7.764 7.764 8.536 -0.772 25767 3080 1 4 . 1 1 59 59 PHE N N 59 121.988 121.988 120.215 1.773 25767 3081 1 4 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.169 0.057 25767 3082 1 4 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.265 0.174 25767 3083 1 4 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.293 0.070 25767 3084 1 4 . 1 1 59 59 PHE H H 59 8.159 8.159 8.473 -0.314 25767 3085 1 4 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.859 -0.318 25767 3086 1 4 . 1 1 60 60 LYS C C 60 179.438 179.438 178.946 0.492 25767 3087 1 4 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.500 0.636 25767 3088 1 4 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.428 -0.370 25767 3089 1 4 . 1 1 61 61 LYS N N 61 119.262 119.262 117.723 1.539 25767 3090 1 4 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.161 -0.216 25767 3091 1 4 . 1 1 61 61 LYS C C 61 178.730 178.730 177.161 1.569 25767 3092 1 4 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.542 1.500 25767 3093 1 4 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.093 0.549 25767 3094 1 4 . 1 1 61 61 LYS H H 61 7.832 7.832 7.718 0.114 25767 3095 1 4 . 1 1 62 62 GLU N N 62 120.790 120.790 118.381 2.409 25767 3096 1 4 . 1 1 62 62 GLU HA H 62 3.935 3.935 4.052 -0.117 25767 3097 1 4 . 1 1 62 62 GLU C C 62 178.424 178.424 178.200 0.224 25767 3098 1 4 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.627 0.087 25767 3099 1 4 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.672 -0.443 25767 3100 1 4 . 1 1 62 62 GLU H H 62 7.982 7.982 7.972 0.010 25767 3101 1 4 . 1 1 63 63 ILE N N 63 118.463 118.463 112.134 6.329 25767 3102 1 4 . 1 1 63 63 ILE HA H 63 3.689 3.689 4.073 -0.384 25767 3103 1 4 . 1 1 63 63 ILE C C 63 177.555 177.555 177.362 0.193 25767 3104 1 4 . 1 1 63 63 ILE CA C 63 61.499 61.499 62.520 -1.021 25767 3105 1 4 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.440 -1.916 25767 3106 1 4 . 1 1 63 63 ILE H H 63 7.732 7.732 7.186 0.546 25767 3107 1 4 . 1 1 64 64 GLY N N 64 107.973 107.973 109.087 -1.114 25767 3108 1 4 . 1 1 64 64 GLY C C 64 175.271 175.271 175.294 -0.023 25767 3109 1 4 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.012 -0.110 25767 3110 1 4 . 1 1 64 64 GLY H H 64 7.661 7.661 8.289 -0.628 25767 3111 1 4 . 1 1 65 65 GLY N N 65 108.464 108.464 106.882 1.582 25767 3112 1 4 . 1 1 65 65 GLY C C 65 174.800 174.800 175.352 -0.552 25767 3113 1 4 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.211 0.435 25767 3114 1 4 . 1 1 65 65 GLY H H 65 7.808 7.808 8.051 -0.243 25767 3115 1 4 . 1 1 66 66 GLU N N 66 121.162 121.162 120.808 0.354 25767 3116 1 4 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.098 0.007 25767 3117 1 4 . 1 1 66 66 GLU C C 66 177.230 177.230 178.426 -1.196 25767 3118 1 4 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.128 -1.904 25767 3119 1 4 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.656 0.336 25767 3120 1 4 . 1 1 66 66 GLU H H 66 8.203 8.203 7.776 0.427 25767 3121 1 4 . 1 1 67 67 SER N N 67 116.468 116.468 115.393 1.075 25767 3122 1 4 . 1 1 67 67 SER HA H 67 4.249 4.249 4.224 0.025 25767 3123 1 4 . 1 1 67 67 SER C C 67 174.640 174.640 176.177 -1.537 25767 3124 1 4 . 1 1 67 67 SER CA C 67 58.930 58.930 60.799 -1.869 25767 3125 1 4 . 1 1 67 67 SER CB C 67 63.912 63.912 62.673 1.239 25767 3126 1 4 . 1 1 67 67 SER H H 67 8.206 8.206 8.230 -0.024 25767 3127 1 4 . 1 1 68 68 GLU N N 68 122.400 122.400 119.139 3.261 25767 3128 1 4 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.125 0.028 25767 3129 1 4 . 1 1 68 68 GLU C C 68 176.349 176.349 176.580 -0.231 25767 3130 1 4 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.129 -1.306 25767 3131 1 4 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.647 0.334 25767 3132 1 4 . 1 1 68 68 GLU H H 68 8.168 8.168 8.235 -0.067 25767 3133 1 4 . 1 1 69 69 ALA N N 69 124.342 124.342 121.944 2.398 25767 3134 1 4 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.085 0.103 25767 3135 1 4 . 1 1 69 69 ALA C C 69 178.027 178.027 176.903 1.124 25767 3136 1 4 . 1 1 69 69 ALA CA C 69 52.558 52.558 52.597 -0.039 25767 3137 1 4 . 1 1 69 69 ALA CB C 69 19.492 19.492 19.097 0.395 25767 3138 1 4 . 1 1 69 69 ALA H H 69 7.939 7.939 7.394 0.545 25767 3139 1 4 . 1 1 70 70 GLU N N 70 121.059 121.059 118.706 2.353 25767 3140 1 4 . 1 1 70 70 GLU HA H 70 4.114 4.114 3.997 0.117 25767 3141 1 4 . 1 1 70 70 GLU C C 70 176.519 176.519 174.963 1.556 25767 3142 1 4 . 1 1 70 70 GLU CA C 70 57.304 57.304 57.089 0.215 25767 3143 1 4 . 1 1 70 70 GLU CB C 70 29.827 29.827 28.937 0.890 25767 3144 1 4 . 1 1 70 70 GLU H H 70 8.430 8.430 8.407 0.023 25767 3145 1 4 . 1 1 71 71 ASP N N 71 120.274 120.274 118.938 1.336 25767 3146 1 4 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.362 0.170 25767 3147 1 4 . 1 1 71 71 ASP C C 71 176.369 176.369 177.129 -0.760 25767 3148 1 4 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.016 -0.765 25767 3149 1 4 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.404 1.437 25767 3150 1 4 . 1 1 71 71 ASP H H 71 8.305 8.305 8.509 -0.204 25767 3151 1 4 . 1 1 72 72 SER N N 72 116.165 116.165 110.400 5.765 25767 3152 1 4 . 1 1 72 72 SER HA H 72 4.241 4.241 4.195 0.046 25767 3153 1 4 . 1 1 72 72 SER C C 72 174.567 174.567 175.942 -1.375 25767 3154 1 4 . 1 1 72 72 SER CA C 72 59.031 59.031 60.758 -1.727 25767 3155 1 4 . 1 1 72 72 SER CB C 72 64.040 64.040 63.683 0.357 25767 3156 1 4 . 1 1 72 72 SER H H 72 7.964 7.964 8.214 -0.250 25767 3157 1 4 . 1 1 73 73 ASP N N 73 122.440 122.440 123.282 -0.842 25767 3158 1 4 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.430 0.104 25767 3159 1 4 . 1 1 73 73 ASP C C 73 176.882 176.882 178.347 -1.465 25767 3160 1 4 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.463 -3.020 25767 3161 1 4 . 1 1 73 73 ASP CB C 73 41.336 41.336 40.179 1.157 25767 3162 1 4 . 1 1 73 73 ASP H H 73 8.392 8.392 8.638 -0.246 25767 3163 1 4 . 1 1 74 74 LYS N N 74 123.270 123.270 119.491 3.779 25767 3164 1 4 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.064 0.029 25767 3165 1 4 . 1 1 74 74 LYS C C 74 177.608 177.608 178.882 -1.274 25767 3166 1 4 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.850 -2.385 25767 3167 1 4 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.413 -0.267 25767 3168 1 4 . 1 1 74 74 LYS H H 74 8.317 8.317 7.685 0.632 25767 3169 1 4 . 1 1 75 75 SER N N 75 116.557 116.557 116.355 0.202 25767 3170 1 4 . 1 1 75 75 SER HA H 75 4.197 4.197 4.243 -0.046 25767 3171 1 4 . 1 1 75 75 SER C C 75 175.988 175.988 176.468 -0.480 25767 3172 1 4 . 1 1 75 75 SER CA C 75 60.434 60.434 61.663 -1.229 25767 3173 1 4 . 1 1 75 75 SER CB C 75 63.172 63.172 62.334 0.838 25767 3174 1 4 . 1 1 75 75 SER H H 75 8.387 8.387 8.080 0.307 25767 3175 1 4 . 1 1 76 76 LEU N N 76 123.910 123.910 122.854 1.056 25767 3176 1 4 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.996 0.174 25767 3177 1 4 . 1 1 76 76 LEU C C 76 178.083 178.083 178.825 -0.742 25767 3178 1 4 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.928 -1.436 25767 3179 1 4 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.501 0.196 25767 3180 1 4 . 1 1 76 76 LEU H H 76 8.059 8.059 8.313 -0.254 25767 3181 1 4 . 1 1 77 77 HIS N N 77 120.620 120.620 119.519 1.101 25767 3182 1 4 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.270 0.018 25767 3183 1 4 . 1 1 77 77 HIS C C 77 177.667 177.667 177.913 -0.246 25767 3184 1 4 . 1 1 77 77 HIS CA C 77 58.422 58.422 59.970 -1.548 25767 3185 1 4 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.828 0.436 25767 3186 1 4 . 1 1 77 77 HIS H H 77 7.936 7.936 8.165 -0.229 25767 3187 1 4 . 1 1 78 78 VAL N N 78 121.774 121.774 119.767 2.007 25767 3188 1 4 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.493 0.184 25767 3189 1 4 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.957 -1.351 25767 3190 1 4 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.890 -0.025 25767 3191 1 4 . 1 1 78 78 VAL H H 78 7.916 7.916 7.938 -0.022 25767 3192 1 4 . 1 1 79 79 MET N N 79 119.660 119.660 117.516 2.144 25767 3193 1 4 . 1 1 79 79 MET HA H 79 3.925 3.925 4.099 -0.174 25767 3194 1 4 . 1 1 79 79 MET C C 79 177.077 177.077 178.803 -1.726 25767 3195 1 4 . 1 1 79 79 MET CA C 79 58.862 58.862 57.305 1.557 25767 3196 1 4 . 1 1 79 79 MET CB C 79 32.852 32.852 31.064 1.788 25767 3197 1 4 . 1 1 79 79 MET H H 79 8.149 8.149 8.054 0.095 25767 3198 1 4 . 1 1 80 80 ASN N N 80 117.337 117.337 118.543 -1.206 25767 3199 1 4 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.736 -0.598 25767 3200 1 4 . 1 1 80 80 ASN C C 80 178.133 178.133 178.277 -0.144 25767 3201 1 4 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.309 0.730 25767 3202 1 4 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.556 0.440 25767 3203 1 4 . 1 1 80 80 ASN H H 80 8.202 8.202 8.714 -0.512 25767 3204 1 4 . 1 1 81 81 THR N N 81 115.517 115.517 118.159 -2.642 25767 3205 1 4 . 1 1 81 81 THR HA H 81 3.896 3.896 3.925 -0.029 25767 3206 1 4 . 1 1 81 81 THR C C 81 175.186 175.186 176.557 -1.371 25767 3207 1 4 . 1 1 81 81 THR CA C 81 66.221 66.221 66.510 -0.289 25767 3208 1 4 . 1 1 81 81 THR CB C 81 69.087 69.087 68.607 0.480 25767 3209 1 4 . 1 1 81 81 THR H H 81 7.944 7.944 7.954 -0.010 25767 3210 1 4 . 1 1 82 82 LEU N N 82 119.074 119.074 119.950 -0.876 25767 3211 1 4 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.052 -0.071 25767 3212 1 4 . 1 1 82 82 LEU C C 82 177.583 177.583 177.954 -0.371 25767 3213 1 4 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.232 -0.692 25767 3214 1 4 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.838 -0.045 25767 3215 1 4 . 1 1 82 82 LEU H H 82 7.547 7.547 7.495 0.052 25767 3216 1 4 . 1 1 83 83 ILE N N 83 118.085 118.085 115.517 2.568 25767 3217 1 4 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.461 0.382 25767 3218 1 4 . 1 1 83 83 ILE C C 83 176.413 176.413 177.299 -0.886 25767 3219 1 4 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.547 -0.820 25767 3220 1 4 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.242 -0.544 25767 3221 1 4 . 1 1 83 83 ILE H H 83 7.409 7.409 7.472 -0.063 25767 3222 1 4 . 1 1 84 84 HIS N N 84 116.152 116.152 115.752 0.400 25767 3223 1 4 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.363 0.232 25767 3224 1 4 . 1 1 84 84 HIS C C 84 175.707 175.707 175.555 0.152 25767 3225 1 4 . 1 1 84 84 HIS CA C 84 58.628 58.628 58.422 0.206 25767 3226 1 4 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.499 0.904 25767 3227 1 4 . 1 1 84 84 HIS H H 84 7.194 7.194 7.918 -0.724 25767 3228 1 4 . 1 1 85 85 ASP N N 85 122.322 122.322 119.268 3.054 25767 3229 1 4 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.753 -0.219 25767 3230 1 4 . 1 1 85 85 ASP C C 85 175.580 175.580 176.607 -1.027 25767 3231 1 4 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.332 0.013 25767 3232 1 4 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.511 -0.393 25767 3233 1 4 . 1 1 85 85 ASP H H 85 8.505 8.505 7.797 0.708 25767 3234 1 4 . 1 1 86 86 GLN N N 86 122.783 122.783 127.220 -4.437 25767 3235 1 4 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.108 -0.145 25767 3236 1 4 . 1 1 86 86 GLN C C 86 178.581 178.581 177.881 0.700 25767 3237 1 4 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.319 -1.365 25767 3238 1 4 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.256 -0.362 25767 3239 1 4 . 1 1 86 86 GLN H H 86 8.803 8.803 8.843 -0.040 25767 3240 1 4 . 1 1 87 87 GLU N N 87 121.794 121.794 119.621 2.173 25767 3241 1 4 . 1 1 87 87 GLU HA H 87 4.013 4.013 4.026 -0.013 25767 3242 1 4 . 1 1 87 87 GLU C C 87 178.290 178.290 178.894 -0.604 25767 3243 1 4 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.948 -0.910 25767 3244 1 4 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.253 -0.273 25767 3245 1 4 . 1 1 87 87 GLU H H 87 8.072 8.072 8.320 -0.248 25767 3246 1 4 . 1 1 88 88 LYS N N 88 119.345 119.345 118.245 1.100 25767 3247 1 4 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.117 -0.362 25767 3248 1 4 . 1 1 88 88 LYS C C 88 180.040 180.040 178.693 1.347 25767 3249 1 4 . 1 1 88 88 LYS CA C 88 59.411 59.411 58.962 0.449 25767 3250 1 4 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.610 0.397 25767 3251 1 4 . 1 1 88 88 LYS H H 88 7.588 7.588 8.076 -0.488 25767 3252 1 4 . 1 1 89 89 ALA N N 89 123.933 123.933 122.660 1.273 25767 3253 1 4 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.232 -0.493 25767 3254 1 4 . 1 1 89 89 ALA C C 89 177.457 177.457 179.569 -2.112 25767 3255 1 4 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.175 0.795 25767 3256 1 4 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.291 0.365 25767 3257 1 4 . 1 1 89 89 ALA H H 89 8.500 8.500 7.375 1.125 25767 3258 1 4 . 1 1 90 90 LYS N N 90 119.244 119.244 119.915 -0.671 25767 3259 1 4 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.867 0.177 25767 3260 1 4 . 1 1 90 90 LYS C C 90 177.774 177.774 178.620 -0.846 25767 3261 1 4 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.593 -0.514 25767 3262 1 4 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.480 -2.239 25767 3263 1 4 . 1 1 90 90 LYS H H 90 6.845 6.845 7.961 -1.116 25767 3264 1 4 . 1 1 91 91 ILE N N 91 117.718 117.718 117.182 0.536 25767 3265 1 4 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.622 -0.224 25767 3266 1 4 . 1 1 91 91 ILE C C 91 177.670 177.670 177.467 0.203 25767 3267 1 4 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.879 -0.881 25767 3268 1 4 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.159 0.642 25767 3269 1 4 . 1 1 91 91 ILE H H 91 7.293 7.293 7.991 -0.698 25767 3270 1 4 . 1 1 92 92 TYR N N 92 121.868 121.868 121.405 0.463 25767 3271 1 4 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.057 0.066 25767 3272 1 4 . 1 1 92 92 TYR C C 92 178.781 178.781 177.521 1.260 25767 3273 1 4 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.310 -0.669 25767 3274 1 4 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.740 0.481 25767 3275 1 4 . 1 1 92 92 TYR H H 92 8.016 8.016 7.821 0.195 25767 3276 1 4 . 1 1 93 93 MET N N 93 118.984 118.984 118.247 0.737 25767 3277 1 4 . 1 1 93 93 MET HA H 93 3.952 3.952 4.019 -0.067 25767 3278 1 4 . 1 1 93 93 MET C C 93 179.925 179.925 178.229 1.696 25767 3279 1 4 . 1 1 93 93 MET CA C 93 57.589 57.589 59.316 -1.727 25767 3280 1 4 . 1 1 93 93 MET CB C 93 30.752 30.752 32.657 -1.905 25767 3281 1 4 . 1 1 93 93 MET H H 93 8.464 8.464 8.455 0.009 25767 3282 1 4 . 1 1 94 94 LEU N N 94 125.441 125.441 121.861 3.580 25767 3283 1 4 . 1 1 94 94 LEU HA H 94 3.870 3.870 3.902 -0.032 25767 3284 1 4 . 1 1 94 94 LEU C C 94 177.937 177.937 179.275 -1.338 25767 3285 1 4 . 1 1 94 94 LEU CA C 94 58.761 58.761 57.976 0.785 25767 3286 1 4 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.615 0.147 25767 3287 1 4 . 1 1 94 94 LEU H H 94 8.927 8.927 8.838 0.089 25767 3288 1 4 . 1 1 95 95 ASN N N 95 119.066 119.066 118.500 0.566 25767 3289 1 4 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.340 -0.078 25767 3290 1 4 . 1 1 95 95 ASN CA C 95 56.273 56.273 55.901 0.372 25767 3291 1 4 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.092 -0.487 25767 3292 1 4 . 1 1 95 95 ASN H H 95 8.691 8.691 8.278 0.413 25767 3293 1 4 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.315 0.350 25767 3294 1 4 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.170 0.901 25767 3295 1 4 . 1 1 96 96 PHE H H 96 8.317 8.317 7.911 0.406 25767 3296 1 4 . 1 1 97 97 THR N N 97 118.178 118.178 115.369 2.809 25767 3297 1 4 . 1 1 97 97 THR HA H 97 3.338 3.338 3.965 -0.627 25767 3298 1 4 . 1 1 97 97 THR C C 97 176.074 176.074 176.773 -0.699 25767 3299 1 4 . 1 1 97 97 THR CA C 97 67.986 67.986 65.905 2.081 25767 3300 1 4 . 1 1 97 97 THR H H 97 8.214 8.214 8.746 -0.532 25767 3301 1 4 . 1 1 98 98 MET N N 98 120.097 120.097 121.409 -1.312 25767 3302 1 4 . 1 1 98 98 MET HA H 98 4.403 4.403 4.338 0.065 25767 3303 1 4 . 1 1 98 98 MET C C 98 178.696 178.696 178.777 -0.081 25767 3304 1 4 . 1 1 98 98 MET CA C 98 57.029 57.029 57.289 -0.260 25767 3305 1 4 . 1 1 98 98 MET CB C 98 29.898 29.898 31.205 -1.307 25767 3306 1 4 . 1 1 98 98 MET H H 98 8.885 8.885 8.364 0.521 25767 3307 1 4 . 1 1 99 99 SER N N 99 114.959 114.959 115.953 -0.994 25767 3308 1 4 . 1 1 99 99 SER HA H 99 4.199 4.199 4.216 -0.017 25767 3309 1 4 . 1 1 99 99 SER C C 99 176.565 176.565 176.766 -0.201 25767 3310 1 4 . 1 1 99 99 SER CA C 99 61.965 61.965 61.009 0.956 25767 3311 1 4 . 1 1 99 99 SER CB C 99 62.565 62.565 62.840 -0.275 25767 3312 1 4 . 1 1 99 99 SER H H 99 7.515 7.515 7.949 -0.434 25767 3313 1 4 . 1 1 100 100 LEU N N 100 125.380 125.380 123.657 1.723 25767 3314 1 4 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.870 -0.094 25767 3315 1 4 . 1 1 100 100 LEU C C 100 177.689 177.689 177.834 -0.145 25767 3316 1 4 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.651 0.406 25767 3317 1 4 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.381 0.169 25767 3318 1 4 . 1 1 100 100 LEU H H 100 7.400 7.400 8.286 -0.886 25767 3319 1 4 . 1 1 101 101 TYR N N 101 120.597 120.597 119.680 0.917 25767 3320 1 4 . 1 1 101 101 TYR HA H 101 4.116 4.116 4.068 0.048 25767 3321 1 4 . 1 1 101 101 TYR C C 101 176.825 176.825 177.382 -0.557 25767 3322 1 4 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.218 -0.330 25767 3323 1 4 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.478 0.515 25767 3324 1 4 . 1 1 101 101 TYR H H 101 8.880 8.880 8.997 -0.117 25767 3325 1 4 . 1 1 102 102 ASN N N 102 116.869 116.869 116.409 0.460 25767 3326 1 4 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.284 -0.118 25767 3327 1 4 . 1 1 102 102 ASN C C 102 179.089 179.089 177.727 1.362 25767 3328 1 4 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.023 0.189 25767 3329 1 4 . 1 1 102 102 ASN CB C 102 37.734 37.734 37.687 0.047 25767 3330 1 4 . 1 1 102 102 ASN H H 102 8.543 8.543 7.955 0.588 25767 3331 1 4 . 1 1 103 103 GLU N N 103 121.259 121.259 120.915 0.344 25767 3332 1 4 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.972 0.014 25767 3333 1 4 . 1 1 103 103 GLU C C 103 179.968 179.968 178.632 1.336 25767 3334 1 4 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.201 0.316 25767 3335 1 4 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.400 0.150 25767 3336 1 4 . 1 1 103 103 GLU H H 103 7.872 7.872 7.900 -0.028 25767 3337 1 4 . 1 1 104 104 LYS N N 104 120.268 120.268 119.512 0.756 25767 3338 1 4 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.162 -0.116 25767 3339 1 4 . 1 1 104 104 LYS C C 104 178.355 178.355 178.923 -0.568 25767 3340 1 4 . 1 1 104 104 LYS CA C 104 56.735 56.735 59.232 -2.497 25767 3341 1 4 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.242 -3.129 25767 3342 1 4 . 1 1 104 104 LYS H H 104 8.384 8.384 7.525 0.859 25767 3343 1 4 . 1 1 105 105 LEU N N 105 121.622 121.622 119.431 2.191 25767 3344 1 4 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.718 0.023 25767 3345 1 4 . 1 1 105 105 LEU C C 105 180.552 180.552 178.546 2.006 25767 3346 1 4 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.270 -0.098 25767 3347 1 4 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.259 -0.229 25767 3348 1 4 . 1 1 105 105 LEU H H 105 8.400 8.400 7.663 0.737 25767 3349 1 4 . 1 1 106 106 LYS N N 106 119.498 119.498 118.000 1.498 25767 3350 1 4 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.910 0.004 25767 3351 1 4 . 1 1 106 106 LYS C C 106 178.419 178.419 179.205 -0.786 25767 3352 1 4 . 1 1 106 106 LYS CA C 106 59.383 59.383 58.920 0.462 25767 3353 1 4 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.459 0.349 25767 3354 1 4 . 1 1 106 106 LYS H H 106 7.067 7.067 7.621 -0.554 25767 3355 1 4 . 1 1 107 107 GLN N N 107 121.405 121.405 118.812 2.593 25767 3356 1 4 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.929 -0.078 25767 3357 1 4 . 1 1 107 107 GLN C C 107 177.935 177.935 178.764 -0.829 25767 3358 1 4 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.988 -0.507 25767 3359 1 4 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.504 -1.706 25767 3360 1 4 . 1 1 107 107 GLN H H 107 7.460 7.460 7.823 -0.363 25767 3361 1 4 . 1 1 108 108 LEU N N 108 119.561 119.561 118.767 0.794 25767 3362 1 4 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.743 0.058 25767 3363 1 4 . 1 1 108 108 LEU C C 108 179.195 179.195 178.083 1.112 25767 3364 1 4 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.356 1.037 25767 3365 1 4 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.677 -0.411 25767 3366 1 4 . 1 1 108 108 LEU H H 108 8.208 8.208 7.815 0.393 25767 3367 1 4 . 1 1 109 109 LYS N N 109 118.535 118.535 116.769 1.766 25767 3368 1 4 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.182 0.070 25767 3369 1 4 . 1 1 109 109 LYS C C 109 177.726 177.726 178.048 -0.322 25767 3370 1 4 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.617 0.112 25767 3371 1 4 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.831 -0.421 25767 3372 1 4 . 1 1 109 109 LYS H H 109 7.168 7.168 7.471 -0.303 25767 3373 1 4 . 1 1 110 110 ASP N N 110 117.463 117.463 116.912 0.551 25767 3374 1 4 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.611 -0.006 25767 3375 1 4 . 1 1 110 110 ASP C C 110 177.360 177.360 176.709 0.651 25767 3376 1 4 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.994 0.902 25767 3377 1 4 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.600 0.977 25767 3378 1 4 . 1 1 110 110 ASP H H 110 7.861 7.861 8.385 -0.524 25767 3379 1 4 . 1 1 111 111 GLY N N 111 113.059 113.059 108.305 4.754 25767 3380 1 4 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.718 -0.666 25767 3381 1 4 . 1 1 111 111 GLY H H 111 8.479 8.479 7.761 0.718 25767 3382 1 4 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.007 0.456 25767 3383 1 4 . 1 1 112 112 PRO C C 112 175.090 175.090 175.709 -0.619 25767 3384 1 4 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.185 -0.821 25767 3385 1 4 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.713 2.137 25767 3386 1 4 . 1 1 113 113 TRP N N 113 123.164 123.164 121.936 1.228 25767 3387 1 4 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.719 -0.009 25767 3388 1 4 . 1 1 113 113 TRP C C 113 174.605 174.605 175.209 -0.604 25767 3389 1 4 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.179 0.726 25767 3390 1 4 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.174 -2.881 25767 3391 1 4 . 1 1 113 113 TRP H H 113 8.687 8.687 8.537 0.150 25767 3392 1 4 . 1 1 114 114 ASP N N 114 121.356 121.356 121.870 -0.514 25767 3393 1 4 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.957 -0.096 25767 3394 1 4 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.919 -0.670 25767 3395 1 4 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.169 -1.028 25767 3396 1 4 . 1 1 114 114 ASP H H 114 6.985 6.985 8.283 -1.298 25767 3397 1 4 . 1 1 115 115 VAL N N 115 118.649 118.649 118.469 0.180 25767 3398 1 4 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.871 -0.029 25767 3399 1 4 . 1 1 115 115 VAL C C 115 177.739 177.739 177.427 0.312 25767 3400 1 4 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.660 -0.091 25767 3401 1 4 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.242 -0.565 25767 3402 1 4 . 1 1 115 115 VAL H H 115 8.206 8.206 8.356 -0.150 25767 3403 1 4 . 1 1 116 116 MET N N 116 120.401 120.401 117.975 2.426 25767 3404 1 4 . 1 1 116 116 MET HA H 116 4.303 4.303 4.216 0.087 25767 3405 1 4 . 1 1 116 116 MET C C 116 179.269 179.269 178.206 1.063 25767 3406 1 4 . 1 1 116 116 MET CA C 116 57.634 57.634 58.941 -1.307 25767 3407 1 4 . 1 1 116 116 MET CB C 116 30.414 30.414 31.956 -1.542 25767 3408 1 4 . 1 1 116 116 MET H H 116 7.642 7.642 8.157 -0.515 25767 3409 1 4 . 1 1 117 117 LEU N N 117 125.503 125.503 119.308 6.195 25767 3410 1 4 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.096 0.149 25767 3411 1 4 . 1 1 117 117 LEU C C 117 178.445 178.445 179.189 -0.744 25767 3412 1 4 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.909 0.291 25767 3413 1 4 . 1 1 117 117 LEU CB C 117 40.089 40.089 40.618 -0.529 25767 3414 1 4 . 1 1 117 117 LEU H H 117 8.157 8.157 7.647 0.510 25767 3415 1 4 . 1 1 118 118 LYS N N 118 119.052 119.052 119.627 -0.575 25767 3416 1 4 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.956 -0.151 25767 3417 1 4 . 1 1 118 118 LYS C C 118 178.251 178.251 179.276 -1.025 25767 3418 1 4 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.181 0.345 25767 3419 1 4 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.141 -0.013 25767 3420 1 4 . 1 1 118 118 LYS H H 118 7.400 7.400 7.554 -0.154 25767 3421 1 4 . 1 1 119 119 ARG N N 119 117.999 117.999 119.415 -1.416 25767 3422 1 4 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.324 -0.104 25767 3423 1 4 . 1 1 119 119 ARG C C 119 180.441 180.441 179.119 1.322 25767 3424 1 4 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.572 0.245 25767 3425 1 4 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.219 -0.134 25767 3426 1 4 . 1 1 119 119 ARG H H 119 8.265 8.265 7.992 0.273 25767 3427 1 4 . 1 1 120 120 SER N N 120 118.073 118.073 115.890 2.183 25767 3428 1 4 . 1 1 120 120 SER HA H 120 4.182 4.182 4.320 -0.138 25767 3429 1 4 . 1 1 120 120 SER C C 120 176.215 176.215 177.024 -0.809 25767 3430 1 4 . 1 1 120 120 SER CA C 120 62.817 62.817 61.986 0.831 25767 3431 1 4 . 1 1 120 120 SER CB C 120 63.550 63.550 63.218 0.332 25767 3432 1 4 . 1 1 120 120 SER H H 120 8.633 8.633 7.850 0.783 25767 3433 1 4 . 1 1 121 121 LEU N N 121 125.029 125.029 123.942 1.087 25767 3434 1 4 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.066 0.153 25767 3435 1 4 . 1 1 121 121 LEU C C 121 179.679 179.679 177.578 2.101 25767 3436 1 4 . 1 1 121 121 LEU CA C 121 58.849 58.849 58.436 0.413 25767 3437 1 4 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.600 -0.826 25767 3438 1 4 . 1 1 121 121 LEU H H 121 8.313 8.313 8.149 0.164 25767 3439 1 4 . 1 1 122 122 TRP N N 122 120.217 120.217 119.199 1.018 25767 3440 1 4 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.341 -0.001 25767 3441 1 4 . 1 1 122 122 TRP C C 122 177.527 177.527 178.843 -1.316 25767 3442 1 4 . 1 1 122 122 TRP CA C 122 61.758 61.758 60.756 1.002 25767 3443 1 4 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.111 0.537 25767 3444 1 4 . 1 1 122 122 TRP H H 122 7.928 7.928 8.064 -0.136 25767 3445 1 4 . 1 1 123 123 CYS N N 123 119.669 119.669 118.212 1.457 25767 3446 1 4 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.191 0.016 25767 3447 1 4 . 1 1 123 123 CYS C C 123 177.057 177.057 177.169 -0.112 25767 3448 1 4 . 1 1 123 123 CYS CA C 123 62.600 62.600 62.952 -0.352 25767 3449 1 4 . 1 1 123 123 CYS CB C 123 25.899 25.899 25.923 -0.024 25767 3450 1 4 . 1 1 123 123 CYS H H 123 8.273 8.273 8.249 0.024 25767 3451 1 4 . 1 1 124 124 CYS N N 124 116.898 116.898 120.114 -3.216 25767 3452 1 4 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.268 -0.420 25767 3453 1 4 . 1 1 124 124 CYS C C 124 175.759 175.759 177.077 -1.318 25767 3454 1 4 . 1 1 124 124 CYS CA C 124 65.653 65.653 63.877 1.776 25767 3455 1 4 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.268 0.249 25767 3456 1 4 . 1 1 124 124 CYS H H 124 8.122 8.122 7.900 0.222 25767 3457 1 4 . 1 1 125 125 ILE N N 125 120.498 120.498 120.515 -0.017 25767 3458 1 4 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.778 -0.190 25767 3459 1 4 . 1 1 125 125 ILE C C 125 179.337 179.337 177.649 1.688 25767 3460 1 4 . 1 1 125 125 ILE CA C 125 67.594 67.594 66.018 1.576 25767 3461 1 4 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.434 0.245 25767 3462 1 4 . 1 1 125 125 ILE H H 125 8.092 8.092 8.254 -0.162 25767 3463 1 4 . 1 1 126 126 ASP N N 126 125.084 125.084 120.791 4.293 25767 3464 1 4 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.437 0.180 25767 3465 1 4 . 1 1 126 126 ASP C C 126 178.299 178.299 178.553 -0.254 25767 3466 1 4 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.301 1.703 25767 3467 1 4 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.647 -0.351 25767 3468 1 4 . 1 1 126 126 ASP H H 126 9.049 9.049 8.322 0.727 25767 3469 1 4 . 1 1 127 127 LEU N N 127 122.591 122.591 119.773 2.818 25767 3470 1 4 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.917 -0.050 25767 3471 1 4 . 1 1 127 127 LEU C C 127 179.655 179.655 179.303 0.352 25767 3472 1 4 . 1 1 127 127 LEU CA C 127 58.661 58.661 57.715 0.946 25767 3473 1 4 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.781 0.413 25767 3474 1 4 . 1 1 127 127 LEU H H 127 8.888 8.888 7.676 1.212 25767 3475 1 4 . 1 1 128 128 PHE N N 128 117.498 117.498 118.576 -1.078 25767 3476 1 4 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.120 0.202 25767 3477 1 4 . 1 1 128 128 PHE C C 128 178.533 178.533 178.272 0.261 25767 3478 1 4 . 1 1 128 128 PHE CA C 128 60.932 60.932 62.485 -1.553 25767 3479 1 4 . 1 1 128 128 PHE CB C 128 39.053 39.053 38.612 0.441 25767 3480 1 4 . 1 1 128 128 PHE H H 128 8.947 8.947 7.985 0.962 25767 3481 1 4 . 1 1 129 129 SER N N 129 115.398 115.398 115.470 -0.072 25767 3482 1 4 . 1 1 129 129 SER HA H 129 4.046 4.046 4.303 -0.257 25767 3483 1 4 . 1 1 129 129 SER C C 129 175.168 175.168 176.783 -1.615 25767 3484 1 4 . 1 1 129 129 SER CA C 129 63.015 63.015 62.376 0.639 25767 3485 1 4 . 1 1 129 129 SER H H 129 8.578 8.578 8.907 -0.329 25767 3486 1 4 . 1 1 130 130 CYS N N 130 125.556 125.556 120.009 5.547 25767 3487 1 4 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.324 -0.215 25767 3488 1 4 . 1 1 130 130 CYS C C 130 175.294 175.294 176.832 -1.538 25767 3489 1 4 . 1 1 130 130 CYS CA C 130 61.438 61.438 61.590 -0.152 25767 3490 1 4 . 1 1 130 130 CYS CB C 130 27.050 27.050 26.619 0.431 25767 3491 1 4 . 1 1 130 130 CYS H H 130 8.289 8.289 8.199 0.090 25767 3492 1 4 . 1 1 131 131 ILE N N 131 120.232 120.232 122.800 -2.568 25767 3493 1 4 . 1 1 131 131 ILE HA H 131 4.033 4.033 4.066 -0.033 25767 3494 1 4 . 1 1 131 131 ILE C C 131 177.297 177.297 178.849 -1.552 25767 3495 1 4 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.319 -0.666 25767 3496 1 4 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.900 1.202 25767 3497 1 4 . 1 1 131 131 ILE H H 131 7.943 7.943 7.814 0.129 25767 3498 1 4 . 1 1 132 132 LEU N N 132 116.422 116.422 119.367 -2.945 25767 3499 1 4 . 1 1 132 132 LEU HA H 132 3.845 3.845 3.992 -0.147 25767 3500 1 4 . 1 1 132 132 LEU C C 132 177.816 177.816 179.113 -1.297 25767 3501 1 4 . 1 1 132 132 LEU CA C 132 57.078 57.078 58.082 -1.004 25767 3502 1 4 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.529 0.684 25767 3503 1 4 . 1 1 132 132 LEU H H 132 7.846 7.846 8.356 -0.510 25767 3504 1 4 . 1 1 133 133 HIS N N 133 116.929 116.929 119.204 -2.275 25767 3505 1 4 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.265 -0.126 25767 3506 1 4 . 1 1 133 133 HIS C C 133 178.669 178.669 177.418 1.251 25767 3507 1 4 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.943 -0.207 25767 3508 1 4 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.537 2.615 25767 3509 1 4 . 1 1 133 133 HIS H H 133 7.822 7.822 8.193 -0.371 25767 3510 1 4 . 1 1 134 134 LEU N N 134 116.898 116.898 119.934 -3.036 25767 3511 1 4 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.209 -0.476 25767 3512 1 4 . 1 1 134 134 LEU C C 134 179.402 179.402 179.071 0.331 25767 3513 1 4 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.818 -0.591 25767 3514 1 4 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.179 -2.640 25767 3515 1 4 . 1 1 134 134 LEU H H 134 8.688 8.688 7.987 0.701 25767 3516 1 4 . 1 1 135 135 TRP N N 135 115.602 115.602 118.036 -2.434 25767 3517 1 4 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.639 0.369 25767 3518 1 4 . 1 1 135 135 TRP C C 135 175.022 175.022 178.084 -3.062 25767 3519 1 4 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.521 0.905 25767 3520 1 4 . 1 1 135 135 TRP CB C 135 27.085 27.085 29.183 -2.098 25767 3521 1 4 . 1 1 135 135 TRP H H 135 7.638 7.638 8.427 -0.789 25767 3522 1 4 . 1 1 136 136 LYS N N 136 119.721 119.721 122.953 -3.232 25767 3523 1 4 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.974 -0.158 25767 3524 1 4 . 1 1 136 136 LYS C C 136 178.279 178.279 178.326 -0.047 25767 3525 1 4 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.790 0.403 25767 3526 1 4 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.852 1.205 25767 3527 1 4 . 1 1 136 136 LYS H H 136 6.538 6.538 8.451 -1.913 25767 3528 1 4 . 1 1 137 137 GLU N N 137 115.407 115.407 116.037 -0.630 25767 3529 1 4 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.141 0.026 25767 3530 1 4 . 1 1 137 137 GLU C C 137 176.700 176.700 177.374 -0.674 25767 3531 1 4 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.537 -0.687 25767 3532 1 4 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.019 0.141 25767 3533 1 4 . 1 1 137 137 GLU H H 137 8.596 8.596 8.185 0.411 25767 3534 1 4 . 1 1 138 138 ASN N N 138 116.669 116.669 116.420 0.249 25767 3535 1 4 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.828 0.078 25767 3536 1 4 . 1 1 138 138 ASN C C 138 173.481 173.481 174.907 -1.426 25767 3537 1 4 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.907 -1.093 25767 3538 1 4 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.652 1.185 25767 3539 1 4 . 1 1 138 138 ASN H H 138 8.343 8.343 8.182 0.161 25767 3540 1 4 . 1 1 139 139 ILE N N 139 120.703 120.703 121.629 -0.926 25767 3541 1 4 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.279 0.065 25767 3542 1 4 . 1 1 139 139 ILE C C 139 175.241 175.241 175.460 -0.219 25767 3543 1 4 . 1 1 139 139 ILE CA C 139 60.792 60.792 58.639 2.153 25767 3544 1 4 . 1 1 139 139 ILE CB C 139 40.274 40.274 38.550 1.724 25767 3545 1 4 . 1 1 139 139 ILE H H 139 7.167 7.167 7.636 -0.469 25767 3546 1 4 . 1 1 140 140 SER N N 140 123.284 123.284 120.442 2.842 25767 3547 1 4 . 1 1 140 140 SER HA H 140 4.345 4.345 4.523 -0.178 25767 3548 1 4 . 1 1 140 140 SER CA C 140 58.095 58.095 57.184 0.912 25767 3549 1 4 . 1 1 140 140 SER CB C 140 65.370 65.370 64.399 0.971 25767 3550 1 4 . 1 1 140 140 SER H H 140 8.727 8.727 8.621 0.106 25767 3551 1 4 . 1 1 142 142 THR N N 142 113.868 113.868 115.287 -1.419 25767 3552 1 4 . 1 1 142 142 THR HA H 142 3.976 3.976 4.250 -0.274 25767 3553 1 4 . 1 1 142 142 THR C C 142 177.559 177.559 176.889 0.670 25767 3554 1 4 . 1 1 142 142 THR CA C 142 66.007 66.007 65.581 0.426 25767 3555 1 4 . 1 1 142 142 THR CB C 142 68.530 68.530 68.199 0.331 25767 3556 1 4 . 1 1 142 142 THR H H 142 8.243 8.243 8.143 0.100 25767 3557 1 4 . 1 1 143 143 SER N N 143 120.786 120.786 118.015 2.771 25767 3558 1 4 . 1 1 143 143 SER C C 143 175.844 175.844 176.776 -0.932 25767 3559 1 4 . 1 1 143 143 SER CA C 143 62.102 62.102 62.115 -0.013 25767 3560 1 4 . 1 1 143 143 SER CB C 143 63.086 63.086 62.594 0.492 25767 3561 1 4 . 1 1 143 143 SER H H 143 7.915 7.915 8.182 -0.267 25767 3562 1 4 . 1 1 144 144 THR N N 144 120.946 120.946 118.361 2.585 25767 3563 1 4 . 1 1 144 144 THR HA H 144 4.299 4.299 4.000 0.299 25767 3564 1 4 . 1 1 144 144 THR C C 144 175.874 175.874 176.092 -0.218 25767 3565 1 4 . 1 1 144 144 THR CA C 144 67.487 67.487 66.894 0.593 25767 3566 1 4 . 1 1 144 144 THR CB C 144 68.485 68.485 68.587 -0.102 25767 3567 1 4 . 1 1 144 144 THR H H 144 8.746 8.746 8.658 0.088 25767 3568 1 4 . 1 1 145 145 ASN N N 145 120.069 120.069 119.606 0.463 25767 3569 1 4 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.432 -0.124 25767 3570 1 4 . 1 1 145 145 ASN C C 145 177.917 177.917 177.440 0.477 25767 3571 1 4 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.583 -0.246 25767 3572 1 4 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.483 -0.383 25767 3573 1 4 . 1 1 145 145 ASN H H 145 7.940 7.940 7.785 0.155 25767 3574 1 4 . 1 1 146 146 SER N N 146 116.905 116.905 116.716 0.189 25767 3575 1 4 . 1 1 146 146 SER HA H 146 3.936 3.936 4.178 -0.242 25767 3576 1 4 . 1 1 146 146 SER C C 146 176.963 176.963 176.779 0.184 25767 3577 1 4 . 1 1 146 146 SER CA C 146 61.997 61.997 61.975 0.022 25767 3578 1 4 . 1 1 146 146 SER CB C 146 62.879 62.879 63.042 -0.163 25767 3579 1 4 . 1 1 146 146 SER H H 146 7.951 7.951 7.701 0.250 25767 3580 1 4 . 1 1 147 147 LEU N N 147 123.253 123.253 121.844 1.409 25767 3581 1 4 . 1 1 147 147 LEU HA H 147 3.875 3.875 3.916 -0.041 25767 3582 1 4 . 1 1 147 147 LEU C C 147 178.726 178.726 179.175 -0.449 25767 3583 1 4 . 1 1 147 147 LEU CA C 147 58.580 58.580 57.822 0.758 25767 3584 1 4 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.791 -0.931 25767 3585 1 4 . 1 1 147 147 LEU H H 147 8.168 8.168 7.789 0.379 25767 3586 1 4 . 1 1 148 148 GLN N N 148 118.212 118.212 117.850 0.362 25767 3587 1 4 . 1 1 148 148 GLN HA H 148 3.817 3.817 4.033 -0.216 25767 3588 1 4 . 1 1 148 148 GLN C C 148 179.686 179.686 178.215 1.471 25767 3589 1 4 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.287 0.956 25767 3590 1 4 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.752 -0.032 25767 3591 1 4 . 1 1 148 148 GLN H H 148 8.295 8.295 8.733 -0.438 25767 3592 1 4 . 1 1 149 149 LYS N N 149 120.770 120.770 120.945 -0.175 25767 3593 1 4 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.920 -0.019 25767 3594 1 4 . 1 1 149 149 LYS C C 149 178.006 178.006 178.643 -0.637 25767 3595 1 4 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.596 -0.064 25767 3596 1 4 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.414 -0.522 25767 3597 1 4 . 1 1 149 149 LYS H H 149 7.955 7.955 8.420 -0.465 25767 3598 1 4 . 1 1 150 150 ARG N N 150 119.244 119.244 119.119 0.125 25767 3599 1 4 . 1 1 150 150 ARG HA H 150 3.840 3.840 4.007 -0.167 25767 3600 1 4 . 1 1 150 150 ARG C C 150 178.858 178.858 178.711 0.147 25767 3601 1 4 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.222 0.149 25767 3602 1 4 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.942 -1.138 25767 3603 1 4 . 1 1 150 150 ARG H H 150 7.020 7.020 7.617 -0.597 25767 3604 1 4 . 1 1 151 151 ILE N N 151 121.183 121.183 119.677 1.506 25767 3605 1 4 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.500 -0.141 25767 3606 1 4 . 1 1 151 151 ILE C C 151 177.327 177.327 177.914 -0.587 25767 3607 1 4 . 1 1 151 151 ILE CA C 151 67.196 67.196 64.886 2.310 25767 3608 1 4 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.619 0.653 25767 3609 1 4 . 1 1 151 151 ILE H H 151 7.574 7.574 7.655 -0.081 25767 3610 1 4 . 1 1 152 152 LYS N N 152 119.521 119.521 120.690 -1.169 25767 3611 1 4 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.873 -0.100 25767 3612 1 4 . 1 1 152 152 LYS C C 152 178.016 178.016 178.533 -0.517 25767 3613 1 4 . 1 1 152 152 LYS CA C 152 59.830 59.830 59.910 -0.080 25767 3614 1 4 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.243 -0.662 25767 3615 1 4 . 1 1 152 152 LYS H H 152 7.629 7.629 8.107 -0.478 25767 3616 1 4 . 1 1 153 153 TYR N N 153 120.178 120.178 120.366 -0.188 25767 3617 1 4 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.127 -0.055 25767 3618 1 4 . 1 1 153 153 TYR C C 153 178.195 178.195 177.820 0.375 25767 3619 1 4 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.708 -0.392 25767 3620 1 4 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.401 -1.128 25767 3621 1 4 . 1 1 153 153 TYR H H 153 8.407 8.407 7.812 0.595 25767 3622 1 4 . 1 1 154 154 CYS N N 154 117.013 117.013 118.172 -1.159 25767 3623 1 4 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.091 -0.019 25767 3624 1 4 . 1 1 154 154 CYS C C 154 176.827 176.827 177.174 -0.347 25767 3625 1 4 . 1 1 154 154 CYS CA C 154 65.780 65.780 63.066 2.714 25767 3626 1 4 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.903 0.257 25767 3627 1 4 . 1 1 154 154 CYS H H 154 8.291 8.291 7.795 0.496 25767 3628 1 4 . 1 1 155 155 LYS N N 155 118.753 118.753 120.408 -1.655 25767 3629 1 4 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.819 -0.148 25767 3630 1 4 . 1 1 155 155 LYS C C 155 179.904 179.904 178.742 1.162 25767 3631 1 4 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.401 1.083 25767 3632 1 4 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.198 -0.255 25767 3633 1 4 . 1 1 155 155 LYS H H 155 7.934 7.934 7.987 -0.053 25767 3634 1 4 . 1 1 156 156 ILE N N 156 123.873 123.873 121.203 2.670 25767 3635 1 4 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.614 -0.030 25767 3636 1 4 . 1 1 156 156 ILE C C 156 179.501 179.501 177.915 1.586 25767 3637 1 4 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.585 -0.345 25767 3638 1 4 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.949 -0.307 25767 3639 1 4 . 1 1 156 156 ILE H H 156 8.314 8.314 8.505 -0.191 25767 3640 1 4 . 1 1 157 157 TYR N N 157 121.132 121.132 119.878 1.254 25767 3641 1 4 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.952 0.213 25767 3642 1 4 . 1 1 157 157 TYR C C 157 178.558 178.558 177.415 1.143 25767 3643 1 4 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.787 0.323 25767 3644 1 4 . 1 1 157 157 TYR H H 157 8.442 8.442 7.593 0.849 25767 3645 1 4 . 1 1 158 158 LEU N N 158 120.964 120.964 120.073 0.891 25767 3646 1 4 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.842 0.070 25767 3647 1 4 . 1 1 158 158 LEU C C 158 180.130 180.130 178.527 1.603 25767 3648 1 4 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.564 1.122 25767 3649 1 4 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.632 0.098 25767 3650 1 4 . 1 1 158 158 LEU H H 158 8.469 8.469 7.785 0.684 25767 3651 1 4 . 1 1 159 159 SER N N 159 116.653 116.653 114.623 2.030 25767 3652 1 4 . 1 1 159 159 SER HA H 159 4.246 4.246 4.015 0.231 25767 3653 1 4 . 1 1 159 159 SER CA C 159 61.460 61.460 61.753 -0.293 25767 3654 1 4 . 1 1 159 159 SER CB C 159 62.849 62.849 62.795 0.054 25767 3655 1 4 . 1 1 159 159 SER H H 159 7.758 7.758 8.448 -0.690 25767 3656 1 4 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.099 -1.726 25767 3657 1 4 . 1 1 160 160 LYS CB C 160 29.832 29.832 31.958 -2.126 25767 3658 1 4 . 1 1 160 160 LYS H H 160 8.425 8.425 7.354 1.071 25767 3659 1 4 . 1 1 161 161 LEU N N 161 121.686 121.686 118.734 2.952 25767 3660 1 4 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.795 0.368 25767 3661 1 4 . 1 1 161 161 LEU C C 161 180.224 180.224 179.134 1.090 25767 3662 1 4 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.286 0.298 25767 3663 1 4 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.499 -0.037 25767 3664 1 4 . 1 1 161 161 LEU H H 161 8.323 8.323 7.556 0.767 25767 3665 1 4 . 1 1 162 162 ALA N N 162 123.102 123.102 120.990 2.112 25767 3666 1 4 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.075 0.055 25767 3667 1 4 . 1 1 162 162 ALA C C 162 179.487 179.487 179.129 0.358 25767 3668 1 4 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.691 0.053 25767 3669 1 4 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.486 -0.083 25767 3670 1 4 . 1 1 162 162 ALA H H 162 7.978 7.978 7.560 0.418 25767 3671 1 4 . 1 1 163 163 LYS N N 163 116.069 116.069 116.299 -0.230 25767 3672 1 4 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.265 -0.042 25767 3673 1 4 . 1 1 163 163 LYS C C 163 176.987 176.987 176.583 0.404 25767 3674 1 4 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.259 0.347 25767 3675 1 4 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.708 0.498 25767 3676 1 4 . 1 1 163 163 LYS H H 163 7.697 7.697 7.725 -0.028 25767 3677 1 4 . 1 1 164 164 GLY N N 164 108.540 108.540 107.232 1.308 25767 3678 1 4 . 1 1 164 164 GLY C C 164 174.721 174.721 173.874 0.847 25767 3679 1 4 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.871 0.920 25767 3680 1 4 . 1 1 164 164 GLY H H 164 7.772 7.772 7.579 0.193 25767 3681 1 4 . 1 1 165 165 GLU N N 165 119.886 119.886 120.611 -0.725 25767 3682 1 4 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.353 -0.303 25767 3683 1 4 . 1 1 165 165 GLU C C 165 176.027 176.027 175.013 1.014 25767 3684 1 4 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.102 1.752 25767 3685 1 4 . 1 1 165 165 GLU CB C 165 30.338 30.338 30.929 -0.591 25767 3686 1 4 . 1 1 165 165 GLU H H 165 8.065 8.065 7.874 0.191 25767 3687 1 4 . 1 1 166 166 ILE N N 166 117.926 117.926 122.779 -4.853 25767 3688 1 4 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.913 -0.011 25767 3689 1 4 . 1 1 166 166 ILE C C 166 174.138 174.138 176.563 -2.425 25767 3690 1 4 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.523 1.932 25767 3691 1 4 . 1 1 166 166 ILE CB C 166 40.202 40.202 38.689 1.513 25767 3692 1 4 . 1 1 166 166 ILE H H 166 7.282 7.282 8.146 -0.864 25767 3693 1 5 . 1 1 2 2 ALA N N 2 122.811 122.811 123.780 -0.969 25767 3694 1 5 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.156 -0.133 25767 3695 1 5 . 1 1 2 2 ALA C C 2 179.915 179.915 179.565 0.350 25767 3696 1 5 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.210 -0.093 25767 3697 1 5 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.489 0.050 25767 3698 1 5 . 1 1 2 2 ALA H H 2 8.509 8.509 8.440 0.069 25767 3699 1 5 . 1 1 3 3 SER N N 3 115.308 115.308 114.533 0.775 25767 3700 1 5 . 1 1 3 3 SER HA H 3 4.097 4.097 4.108 -0.011 25767 3701 1 5 . 1 1 3 3 SER C C 3 176.706 176.706 176.317 0.389 25767 3702 1 5 . 1 1 3 3 SER CA C 3 60.665 60.665 61.876 -1.210 25767 3703 1 5 . 1 1 3 3 SER CB C 3 62.710 62.710 62.325 0.385 25767 3704 1 5 . 1 1 3 3 SER H H 3 7.996 7.996 8.459 -0.463 25767 3705 1 5 . 1 1 4 4 ASN N N 4 122.688 122.688 120.364 2.324 25767 3706 1 5 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.405 -0.101 25767 3707 1 5 . 1 1 4 4 ASN C C 4 176.258 176.258 177.159 -0.901 25767 3708 1 5 . 1 1 4 4 ASN CA C 4 55.701 55.701 56.092 -0.390 25767 3709 1 5 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.739 0.438 25767 3710 1 5 . 1 1 4 4 ASN H H 4 8.075 8.075 7.564 0.511 25767 3711 1 5 . 1 1 5 5 ALA N N 5 121.900 121.900 121.820 0.080 25767 3712 1 5 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.107 -0.532 25767 3713 1 5 . 1 1 5 5 ALA C C 5 178.475 178.475 179.428 -0.953 25767 3714 1 5 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.938 0.895 25767 3715 1 5 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.205 -0.590 25767 3716 1 5 . 1 1 5 5 ALA H H 5 8.659 8.659 7.683 0.976 25767 3717 1 5 . 1 1 6 6 ALA N N 6 117.768 117.768 121.641 -3.873 25767 3718 1 5 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.991 -0.204 25767 3719 1 5 . 1 1 6 6 ALA C C 6 180.494 180.494 179.389 1.105 25767 3720 1 5 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.052 0.298 25767 3721 1 5 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.024 -0.122 25767 3722 1 5 . 1 1 6 6 ALA H H 6 7.864 7.864 8.212 -0.348 25767 3723 1 5 . 1 1 7 7 ARG N N 7 121.173 121.173 119.454 1.719 25767 3724 1 5 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.100 -0.197 25767 3725 1 5 . 1 1 7 7 ARG C C 7 179.189 179.189 178.683 0.506 25767 3726 1 5 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.908 0.404 25767 3727 1 5 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.985 -0.763 25767 3728 1 5 . 1 1 7 7 ARG H H 7 7.514 7.514 8.311 -0.797 25767 3729 1 5 . 1 1 8 8 VAL N N 8 122.979 122.979 119.569 3.410 25767 3730 1 5 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.728 -0.475 25767 3731 1 5 . 1 1 8 8 VAL C C 8 177.821 177.821 178.183 -0.362 25767 3732 1 5 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.575 1.197 25767 3733 1 5 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.319 0.122 25767 3734 1 5 . 1 1 8 8 VAL H H 8 8.101 8.101 7.647 0.454 25767 3735 1 5 . 1 1 9 9 VAL N N 9 119.801 119.801 120.532 -0.731 25767 3736 1 5 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.522 -0.256 25767 3737 1 5 . 1 1 9 9 VAL C C 9 177.373 177.373 177.552 -0.179 25767 3738 1 5 . 1 1 9 9 VAL CA C 9 67.484 67.484 67.358 0.126 25767 3739 1 5 . 1 1 9 9 VAL CB C 9 31.625 31.625 31.243 0.382 25767 3740 1 5 . 1 1 9 9 VAL H H 9 8.362 8.362 8.042 0.320 25767 3741 1 5 . 1 1 10 10 ALA N N 10 122.360 122.360 121.283 1.077 25767 3742 1 5 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.046 -0.110 25767 3743 1 5 . 1 1 10 10 ALA C C 10 180.762 180.762 179.674 1.088 25767 3744 1 5 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.512 -0.068 25767 3745 1 5 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.117 -0.380 25767 3746 1 5 . 1 1 10 10 ALA H H 10 7.776 7.776 8.035 -0.259 25767 3747 1 5 . 1 1 11 11 THR N N 11 117.376 117.376 114.515 2.861 25767 3748 1 5 . 1 1 11 11 THR HA H 11 3.816 3.816 4.160 -0.344 25767 3749 1 5 . 1 1 11 11 THR C C 11 175.775 175.775 176.277 -0.502 25767 3750 1 5 . 1 1 11 11 THR CA C 11 66.509 66.509 65.683 0.826 25767 3751 1 5 . 1 1 11 11 THR CB C 11 68.588 68.588 68.710 -0.122 25767 3752 1 5 . 1 1 11 11 THR H H 11 8.180 8.180 7.746 0.434 25767 3753 1 5 . 1 1 12 12 ALA N N 12 125.308 125.308 124.669 0.639 25767 3754 1 5 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.633 0.364 25767 3755 1 5 . 1 1 12 12 ALA C C 12 179.399 179.399 179.291 0.108 25767 3756 1 5 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.563 0.513 25767 3757 1 5 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.170 1.074 25767 3758 1 5 . 1 1 12 12 ALA H H 12 8.671 8.671 8.534 0.137 25767 3759 1 5 . 1 1 13 13 LYS N N 13 116.977 116.977 117.520 -0.543 25767 3760 1 5 . 1 1 13 13 LYS C C 13 179.646 179.646 178.780 0.866 25767 3761 1 5 . 1 1 13 13 LYS CA C 13 58.921 58.921 60.033 -1.112 25767 3762 1 5 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.158 -0.715 25767 3763 1 5 . 1 1 13 13 LYS H H 13 8.061 8.061 7.742 0.319 25767 3764 1 5 . 1 1 14 14 ASP N N 14 121.988 121.988 120.113 1.875 25767 3765 1 5 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.497 -0.144 25767 3766 1 5 . 1 1 14 14 ASP C C 14 179.446 179.446 178.749 0.697 25767 3767 1 5 . 1 1 14 14 ASP CA C 14 57.509 57.509 57.031 0.478 25767 3768 1 5 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.649 -0.648 25767 3769 1 5 . 1 1 14 14 ASP H H 14 7.669 7.669 7.726 -0.057 25767 3770 1 5 . 1 1 15 15 PHE N N 15 119.588 119.588 118.376 1.212 25767 3771 1 5 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.170 0.174 25767 3772 1 5 . 1 1 15 15 PHE C C 15 178.373 178.373 177.854 0.519 25767 3773 1 5 . 1 1 15 15 PHE CA C 15 62.237 62.237 60.824 1.413 25767 3774 1 5 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.484 -0.988 25767 3775 1 5 . 1 1 15 15 PHE H H 15 7.913 7.913 8.583 -0.670 25767 3776 1 5 . 1 1 16 16 ASP N N 16 121.705 121.705 119.649 2.056 25767 3777 1 5 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.470 -0.475 25767 3778 1 5 . 1 1 16 16 ASP C C 16 180.071 180.071 179.480 0.591 25767 3779 1 5 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.212 0.937 25767 3780 1 5 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.701 0.786 25767 3781 1 5 . 1 1 16 16 ASP H H 16 8.324 8.324 8.037 0.287 25767 3782 1 5 . 1 1 17 17 LYS N N 17 118.825 118.825 119.633 -0.808 25767 3783 1 5 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.097 -0.060 25767 3784 1 5 . 1 1 17 17 LYS C C 17 178.407 178.407 177.966 0.441 25767 3785 1 5 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.945 0.116 25767 3786 1 5 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.561 0.023 25767 3787 1 5 . 1 1 17 17 LYS H H 17 7.834 7.834 7.762 0.072 25767 3788 1 5 . 1 1 18 18 VAL N N 18 110.562 110.562 117.435 -6.873 25767 3789 1 5 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.044 0.472 25767 3790 1 5 . 1 1 18 18 VAL C C 18 176.144 176.144 176.517 -0.373 25767 3791 1 5 . 1 1 18 18 VAL CA C 18 60.874 60.874 62.886 -2.012 25767 3792 1 5 . 1 1 18 18 VAL CB C 18 31.160 31.160 31.870 -0.710 25767 3793 1 5 . 1 1 18 18 VAL H H 18 7.185 7.185 7.556 -0.371 25767 3794 1 5 . 1 1 19 19 GLY N N 19 109.272 109.272 107.134 2.138 25767 3795 1 5 . 1 1 19 19 GLY C C 19 175.043 175.043 174.946 0.097 25767 3796 1 5 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.425 0.406 25767 3797 1 5 . 1 1 19 19 GLY H H 19 7.723 7.723 7.852 -0.129 25767 3798 1 5 . 1 1 20 20 LEU N N 20 125.428 125.428 121.740 3.688 25767 3799 1 5 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.601 -0.281 25767 3800 1 5 . 1 1 20 20 LEU C C 20 177.949 177.949 177.377 0.572 25767 3801 1 5 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.249 -0.445 25767 3802 1 5 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.363 0.554 25767 3803 1 5 . 1 1 20 20 LEU H H 20 8.083 8.083 7.964 0.119 25767 3804 1 5 . 1 1 21 21 GLY N N 21 107.804 107.804 110.506 -2.702 25767 3805 1 5 . 1 1 21 21 GLY C C 21 176.278 176.278 176.328 -0.050 25767 3806 1 5 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.782 -0.488 25767 3807 1 5 . 1 1 21 21 GLY H H 21 7.982 7.982 8.010 -0.028 25767 3808 1 5 . 1 1 22 22 ILE N N 22 121.319 121.319 122.297 -0.978 25767 3809 1 5 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.895 0.015 25767 3810 1 5 . 1 1 22 22 ILE C C 22 176.604 176.604 178.082 -1.478 25767 3811 1 5 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.517 -2.071 25767 3812 1 5 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.839 -1.273 25767 3813 1 5 . 1 1 22 22 ILE H H 22 8.478 8.478 8.162 0.316 25767 3814 1 5 . 1 1 23 23 ILE N N 23 120.377 120.377 120.501 -0.124 25767 3815 1 5 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.934 -0.221 25767 3816 1 5 . 1 1 23 23 ILE C C 23 178.581 178.581 178.603 -0.022 25767 3817 1 5 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.688 0.558 25767 3818 1 5 . 1 1 23 23 ILE CB C 23 36.199 36.199 36.275 -0.076 25767 3819 1 5 . 1 1 23 23 ILE H H 23 6.869 6.869 8.082 -1.213 25767 3820 1 5 . 1 1 24 24 GLY N N 24 103.449 103.449 108.520 -5.071 25767 3821 1 5 . 1 1 24 24 GLY C C 24 175.308 175.308 175.914 -0.606 25767 3822 1 5 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.398 0.545 25767 3823 1 5 . 1 1 24 24 GLY H H 24 7.488 7.488 8.885 -1.397 25767 3824 1 5 . 1 1 25 25 TYR N N 25 124.685 124.685 123.701 0.984 25767 3825 1 5 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.704 -0.038 25767 3826 1 5 . 1 1 25 25 TYR C C 25 176.208 176.208 176.757 -0.549 25767 3827 1 5 . 1 1 25 25 TYR CA C 25 61.371 61.371 61.578 -0.207 25767 3828 1 5 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.168 0.099 25767 3829 1 5 . 1 1 25 25 TYR H H 25 7.931 7.931 8.108 -0.177 25767 3830 1 5 . 1 1 26 26 TYR N N 26 117.001 117.001 120.050 -3.049 25767 3831 1 5 . 1 1 26 26 TYR HA H 26 3.941 3.941 4.029 -0.088 25767 3832 1 5 . 1 1 26 26 TYR C C 26 178.753 178.753 177.556 1.197 25767 3833 1 5 . 1 1 26 26 TYR CA C 26 64.260 64.260 62.031 2.229 25767 3834 1 5 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.886 -1.365 25767 3835 1 5 . 1 1 26 26 TYR H H 26 7.693 7.693 7.978 -0.285 25767 3836 1 5 . 1 1 27 27 LEU N N 27 118.657 118.657 117.685 0.972 25767 3837 1 5 . 1 1 27 27 LEU HA H 27 4.311 4.311 4.042 0.269 25767 3838 1 5 . 1 1 27 27 LEU CA C 27 58.297 58.297 57.873 0.423 25767 3839 1 5 . 1 1 27 27 LEU CB C 27 42.723 42.723 41.017 1.706 25767 3840 1 5 . 1 1 27 27 LEU H H 27 8.339 8.339 8.314 0.025 25767 3841 1 5 . 1 1 28 28 GLN N N 28 118.593 118.593 119.560 -0.967 25767 3842 1 5 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.915 -0.264 25767 3843 1 5 . 1 1 28 28 GLN C C 28 177.282 177.282 178.203 -0.921 25767 3844 1 5 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.544 0.285 25767 3845 1 5 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.068 1.580 25767 3846 1 5 . 1 1 28 28 GLN H H 28 7.970 7.970 7.859 0.111 25767 3847 1 5 . 1 1 29 29 LEU N N 29 122.111 122.111 119.396 2.715 25767 3848 1 5 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.712 0.232 25767 3849 1 5 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.541 1.125 25767 3850 1 5 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.237 0.771 25767 3851 1 5 . 1 1 29 29 LEU H H 29 7.979 7.979 7.294 0.685 25767 3852 1 5 . 1 1 30 30 TYR N N 30 119.283 119.283 120.138 -0.855 25767 3853 1 5 . 1 1 30 30 TYR C C 30 175.775 175.775 177.240 -1.465 25767 3854 1 5 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.880 -1.786 25767 3855 1 5 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.283 0.790 25767 3856 1 5 . 1 1 30 30 TYR H H 30 8.093 8.093 7.463 0.630 25767 3857 1 5 . 1 1 31 31 ALA N N 31 121.327 121.327 121.653 -0.326 25767 3858 1 5 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.894 -0.526 25767 3859 1 5 . 1 1 31 31 ALA C C 31 178.955 178.955 179.182 -0.227 25767 3860 1 5 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.078 0.470 25767 3861 1 5 . 1 1 31 31 ALA CB C 31 17.963 17.963 17.929 0.034 25767 3862 1 5 . 1 1 31 31 ALA H H 31 8.394 8.394 8.166 0.228 25767 3863 1 5 . 1 1 32 32 VAL N N 32 116.757 116.757 118.482 -1.725 25767 3864 1 5 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.503 -0.243 25767 3865 1 5 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.517 2.145 25767 3866 1 5 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.114 -0.143 25767 3867 1 5 . 1 1 32 32 VAL H H 32 8.020 8.020 7.604 0.416 25767 3868 1 5 . 1 1 33 33 GLU N N 33 118.775 118.775 119.885 -1.110 25767 3869 1 5 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.851 0.138 25767 3870 1 5 . 1 1 33 33 GLU C C 33 179.746 179.746 179.124 0.622 25767 3871 1 5 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.419 0.584 25767 3872 1 5 . 1 1 33 33 GLU H H 33 7.358 7.358 7.499 -0.141 25767 3873 1 5 . 1 1 34 34 LEU N N 34 120.632 120.632 119.562 1.070 25767 3874 1 5 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.890 -0.241 25767 3875 1 5 . 1 1 34 34 LEU C C 34 180.336 180.336 178.796 1.540 25767 3876 1 5 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.188 0.487 25767 3877 1 5 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.029 0.559 25767 3878 1 5 . 1 1 34 34 LEU H H 34 8.390 8.390 7.291 1.099 25767 3879 1 5 . 1 1 35 35 ILE N N 35 121.240 121.240 119.132 2.108 25767 3880 1 5 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.643 -0.101 25767 3881 1 5 . 1 1 35 35 ILE C C 35 178.604 178.604 179.360 -0.756 25767 3882 1 5 . 1 1 35 35 ILE CA C 35 65.547 65.547 65.057 0.490 25767 3883 1 5 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.972 0.759 25767 3884 1 5 . 1 1 35 35 ILE H H 35 8.129 8.129 7.495 0.634 25767 3885 1 5 . 1 1 36 36 LEU N N 36 115.637 115.637 118.975 -3.338 25767 3886 1 5 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.036 -0.028 25767 3887 1 5 . 1 1 36 36 LEU C C 36 178.001 178.001 178.146 -0.145 25767 3888 1 5 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.055 -0.979 25767 3889 1 5 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.499 -1.565 25767 3890 1 5 . 1 1 36 36 LEU H H 36 8.416 8.416 8.007 0.409 25767 3891 1 5 . 1 1 37 37 SER N N 37 114.106 114.106 110.241 3.865 25767 3892 1 5 . 1 1 37 37 SER HA H 37 3.991 3.991 4.324 -0.333 25767 3893 1 5 . 1 1 37 37 SER C C 37 173.997 173.997 174.299 -0.302 25767 3894 1 5 . 1 1 37 37 SER CA C 37 60.311 60.311 58.802 1.509 25767 3895 1 5 . 1 1 37 37 SER CB C 37 63.746 63.746 63.417 0.329 25767 3896 1 5 . 1 1 37 37 SER H H 37 7.517 7.517 7.720 -0.203 25767 3897 1 5 . 1 1 38 38 GLU N N 38 123.003 123.003 121.311 1.692 25767 3898 1 5 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.340 0.029 25767 3899 1 5 . 1 1 38 38 GLU C C 38 175.780 175.780 176.298 -0.518 25767 3900 1 5 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.835 -0.470 25767 3901 1 5 . 1 1 38 38 GLU CB C 38 30.293 30.293 31.016 -0.723 25767 3902 1 5 . 1 1 38 38 GLU H H 38 7.151 7.151 7.407 -0.256 25767 3903 1 5 . 1 1 39 39 GLU N N 39 126.166 126.166 122.672 3.494 25767 3904 1 5 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.132 -0.123 25767 3905 1 5 . 1 1 39 39 GLU C C 39 176.652 176.652 175.980 0.672 25767 3906 1 5 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.485 1.713 25767 3907 1 5 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.361 -0.326 25767 3908 1 5 . 1 1 39 39 GLU H H 39 8.587 8.587 8.416 0.171 25767 3909 1 5 . 1 1 40 40 ASP N N 40 120.047 120.047 121.170 -1.123 25767 3910 1 5 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.443 0.107 25767 3911 1 5 . 1 1 40 40 ASP C C 40 175.035 175.035 175.927 -0.892 25767 3912 1 5 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.130 -1.762 25767 3913 1 5 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.880 -0.857 25767 3914 1 5 . 1 1 40 40 ASP H H 40 8.504 8.504 8.467 0.037 25767 3915 1 5 . 1 1 41 41 ARG N N 41 120.671 120.671 123.830 -3.159 25767 3916 1 5 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.599 -0.210 25767 3917 1 5 . 1 1 41 41 ARG C C 41 175.755 175.755 175.327 0.428 25767 3918 1 5 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.497 0.511 25767 3919 1 5 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.251 -0.702 25767 3920 1 5 . 1 1 41 41 ARG H H 41 7.672 7.672 8.142 -0.470 25767 3921 1 5 . 1 1 42 42 SER N N 42 120.330 120.330 115.540 4.790 25767 3922 1 5 . 1 1 42 42 SER HA H 42 3.837 3.837 4.368 -0.531 25767 3923 1 5 . 1 1 42 42 SER CA C 42 57.326 57.326 58.081 -0.755 25767 3924 1 5 . 1 1 42 42 SER CB C 42 65.762 65.762 64.164 1.598 25767 3925 1 5 . 1 1 42 42 SER H H 42 8.544 8.544 8.236 0.308 25767 3926 1 5 . 1 1 43 43 GLN HA H 43 3.989 3.989 3.956 0.033 25767 3927 1 5 . 1 1 43 43 GLN C C 43 178.907 178.907 177.860 1.047 25767 3928 1 5 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.743 0.627 25767 3929 1 5 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.479 -0.516 25767 3930 1 5 . 1 1 44 44 GLU N N 44 120.328 120.328 119.084 1.244 25767 3931 1 5 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.972 0.041 25767 3932 1 5 . 1 1 44 44 GLU C C 44 179.824 179.824 178.466 1.358 25767 3933 1 5 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.036 1.009 25767 3934 1 5 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.009 -0.361 25767 3935 1 5 . 1 1 44 44 GLU H H 44 8.938 8.938 7.676 1.262 25767 3936 1 5 . 1 1 45 45 MET N N 45 121.030 121.030 118.334 2.696 25767 3937 1 5 . 1 1 45 45 MET HA H 45 4.412 4.412 4.323 0.089 25767 3938 1 5 . 1 1 45 45 MET C C 45 180.357 180.357 178.154 2.203 25767 3939 1 5 . 1 1 45 45 MET CA C 45 57.209 57.209 57.474 -0.265 25767 3940 1 5 . 1 1 45 45 MET CB C 45 32.436 32.436 32.017 0.419 25767 3941 1 5 . 1 1 45 45 MET H H 45 7.756 7.756 7.901 -0.145 25767 3942 1 5 . 1 1 46 46 THR N N 46 120.008 120.008 113.961 6.047 25767 3943 1 5 . 1 1 46 46 THR HA H 46 4.071 4.071 3.952 0.119 25767 3944 1 5 . 1 1 46 46 THR CA C 46 67.096 67.096 66.462 0.634 25767 3945 1 5 . 1 1 46 46 THR CB C 46 68.954 68.954 68.484 0.470 25767 3946 1 5 . 1 1 46 46 THR H H 46 8.187 8.187 7.517 0.670 25767 3947 1 5 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.101 0.008 25767 3948 1 5 . 1 1 47 47 ALA C C 47 180.118 180.118 179.550 0.568 25767 3949 1 5 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.960 0.379 25767 3950 1 5 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.273 -0.441 25767 3951 1 5 . 1 1 47 47 ALA H H 47 8.238 8.238 7.925 0.313 25767 3952 1 5 . 1 1 48 48 LEU N N 48 122.093 122.093 119.317 2.776 25767 3953 1 5 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.016 0.247 25767 3954 1 5 . 1 1 48 48 LEU C C 48 179.103 179.103 179.310 -0.207 25767 3955 1 5 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.442 0.298 25767 3956 1 5 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.560 -0.764 25767 3957 1 5 . 1 1 48 48 LEU H H 48 7.778 7.778 7.653 0.125 25767 3958 1 5 . 1 1 49 49 ALA N N 49 120.130 120.130 121.666 -1.536 25767 3959 1 5 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.923 -0.202 25767 3960 1 5 . 1 1 49 49 ALA C C 49 178.676 178.676 179.369 -0.693 25767 3961 1 5 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.403 0.318 25767 3962 1 5 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.036 -0.209 25767 3963 1 5 . 1 1 49 49 ALA H H 49 8.432 8.432 8.433 -0.001 25767 3964 1 5 . 1 1 50 50 THR N N 50 113.333 113.333 115.318 -1.985 25767 3965 1 5 . 1 1 50 50 THR HA H 50 3.895 3.895 3.819 0.076 25767 3966 1 5 . 1 1 50 50 THR C C 50 174.948 174.948 176.458 -1.510 25767 3967 1 5 . 1 1 50 50 THR CA C 50 67.334 67.334 67.878 -0.544 25767 3968 1 5 . 1 1 50 50 THR CB C 50 68.864 68.864 68.631 0.233 25767 3969 1 5 . 1 1 50 50 THR H H 50 7.857 7.857 7.799 0.058 25767 3970 1 5 . 1 1 51 51 GLU N N 51 122.698 122.698 122.278 0.420 25767 3971 1 5 . 1 1 51 51 GLU HA H 51 4.068 4.068 3.999 0.069 25767 3972 1 5 . 1 1 51 51 GLU C C 51 179.997 179.997 178.661 1.336 25767 3973 1 5 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.468 -0.035 25767 3974 1 5 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.617 -0.100 25767 3975 1 5 . 1 1 51 51 GLU H H 51 7.817 7.817 7.566 0.251 25767 3976 1 5 . 1 1 52 52 LEU N N 52 121.100 121.100 120.333 0.767 25767 3977 1 5 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.075 0.054 25767 3978 1 5 . 1 1 52 52 LEU CA C 52 57.889 57.889 58.003 -0.114 25767 3979 1 5 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.149 0.798 25767 3980 1 5 . 1 1 52 52 LEU H H 52 8.628 8.628 7.900 0.728 25767 3981 1 5 . 1 1 53 53 LEU N N 53 119.935 119.935 119.923 0.012 25767 3982 1 5 . 1 1 53 53 LEU C C 53 179.671 179.671 179.246 0.425 25767 3983 1 5 . 1 1 53 53 LEU H H 53 8.303 8.303 7.831 0.472 25767 3984 1 5 . 1 1 54 54 ASP N N 54 120.339 120.339 119.781 0.558 25767 3985 1 5 . 1 1 54 54 ASP C C 54 179.106 179.106 178.539 0.567 25767 3986 1 5 . 1 1 54 54 ASP H H 54 7.901 7.901 8.061 -0.160 25767 3987 1 5 . 1 1 55 55 THR N N 55 120.237 120.237 117.274 2.963 25767 3988 1 5 . 1 1 55 55 THR HA H 55 3.696 3.696 3.997 -0.301 25767 3989 1 5 . 1 1 55 55 THR CA C 55 67.340 67.340 67.256 0.084 25767 3990 1 5 . 1 1 55 55 THR CB C 55 68.151 68.151 68.809 -0.658 25767 3991 1 5 . 1 1 55 55 THR H H 55 8.262 8.262 7.770 0.492 25767 3992 1 5 . 1 1 56 56 ILE N N 56 123.953 123.953 121.936 2.017 25767 3993 1 5 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.604 0.239 25767 3994 1 5 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.733 0.161 25767 3995 1 5 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.549 0.584 25767 3996 1 5 . 1 1 56 56 ILE H H 56 8.930 8.930 7.613 1.317 25767 3997 1 5 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.393 0.188 25767 3998 1 5 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.147 -0.116 25767 3999 1 5 . 1 1 58 58 ALA C C 58 179.875 179.875 179.409 0.466 25767 4000 1 5 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.811 0.455 25767 4001 1 5 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.344 -0.359 25767 4002 1 5 . 1 1 58 58 ALA H H 58 7.764 7.764 8.414 -0.650 25767 4003 1 5 . 1 1 59 59 PHE N N 59 121.988 121.988 119.790 2.198 25767 4004 1 5 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.132 0.094 25767 4005 1 5 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.681 -0.242 25767 4006 1 5 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.273 0.090 25767 4007 1 5 . 1 1 59 59 PHE H H 59 8.159 8.159 8.493 -0.334 25767 4008 1 5 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.931 -0.390 25767 4009 1 5 . 1 1 60 60 LYS C C 60 179.438 179.438 178.785 0.653 25767 4010 1 5 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.651 0.485 25767 4011 1 5 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.322 -0.265 25767 4012 1 5 . 1 1 61 61 LYS N N 61 119.262 119.262 117.588 1.674 25767 4013 1 5 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.225 -0.280 25767 4014 1 5 . 1 1 61 61 LYS C C 61 178.730 178.730 177.697 1.033 25767 4015 1 5 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.135 1.907 25767 4016 1 5 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.082 0.560 25767 4017 1 5 . 1 1 61 61 LYS H H 61 7.832 7.832 7.925 -0.093 25767 4018 1 5 . 1 1 62 62 GLU N N 62 120.790 120.790 120.738 0.052 25767 4019 1 5 . 1 1 62 62 GLU HA H 62 3.935 3.935 3.967 -0.032 25767 4020 1 5 . 1 1 62 62 GLU C C 62 178.424 178.424 177.906 0.518 25767 4021 1 5 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.817 -0.103 25767 4022 1 5 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.241 -0.011 25767 4023 1 5 . 1 1 62 62 GLU H H 62 7.982 7.982 7.674 0.308 25767 4024 1 5 . 1 1 63 63 ILE N N 63 118.463 118.463 116.737 1.726 25767 4025 1 5 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.755 -0.066 25767 4026 1 5 . 1 1 63 63 ILE C C 63 177.555 177.555 177.388 0.167 25767 4027 1 5 . 1 1 63 63 ILE CA C 63 61.499 61.499 63.285 -1.786 25767 4028 1 5 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.597 -2.073 25767 4029 1 5 . 1 1 63 63 ILE H H 63 7.732 7.732 7.324 0.408 25767 4030 1 5 . 1 1 64 64 GLY N N 64 107.973 107.973 107.266 0.707 25767 4031 1 5 . 1 1 64 64 GLY C C 64 175.271 175.271 174.901 0.370 25767 4032 1 5 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.280 -0.378 25767 4033 1 5 . 1 1 64 64 GLY H H 64 7.661 7.661 7.924 -0.263 25767 4034 1 5 . 1 1 65 65 GLY N N 65 108.464 108.464 107.126 1.338 25767 4035 1 5 . 1 1 65 65 GLY C C 65 174.800 174.800 175.401 -0.601 25767 4036 1 5 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.532 0.114 25767 4037 1 5 . 1 1 65 65 GLY H H 65 7.808 7.808 7.846 -0.038 25767 4038 1 5 . 1 1 66 66 GLU N N 66 121.162 121.162 121.422 -0.260 25767 4039 1 5 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.038 0.067 25767 4040 1 5 . 1 1 66 66 GLU C C 66 177.230 177.230 178.713 -1.483 25767 4041 1 5 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.283 -2.059 25767 4042 1 5 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.671 0.321 25767 4043 1 5 . 1 1 66 66 GLU H H 66 8.203 8.203 7.884 0.319 25767 4044 1 5 . 1 1 67 67 SER N N 67 116.468 116.468 115.587 0.881 25767 4045 1 5 . 1 1 67 67 SER HA H 67 4.249 4.249 4.199 0.050 25767 4046 1 5 . 1 1 67 67 SER C C 67 174.640 174.640 176.590 -1.950 25767 4047 1 5 . 1 1 67 67 SER CA C 67 58.930 58.930 61.784 -2.854 25767 4048 1 5 . 1 1 67 67 SER CB C 67 63.912 63.912 63.122 0.790 25767 4049 1 5 . 1 1 67 67 SER H H 67 8.206 8.206 8.208 -0.002 25767 4050 1 5 . 1 1 68 68 GLU N N 68 122.400 122.400 120.342 2.058 25767 4051 1 5 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.016 0.137 25767 4052 1 5 . 1 1 68 68 GLU C C 68 176.349 176.349 177.499 -1.150 25767 4053 1 5 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.719 -1.896 25767 4054 1 5 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.340 0.641 25767 4055 1 5 . 1 1 68 68 GLU H H 68 8.168 8.168 8.483 -0.315 25767 4056 1 5 . 1 1 69 69 ALA N N 69 124.342 124.342 120.351 3.991 25767 4057 1 5 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.152 0.036 25767 4058 1 5 . 1 1 69 69 ALA C C 69 178.027 178.027 178.038 -0.011 25767 4059 1 5 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.687 -1.129 25767 4060 1 5 . 1 1 69 69 ALA CB C 69 19.492 19.492 19.266 0.226 25767 4061 1 5 . 1 1 69 69 ALA H H 69 7.939 7.939 7.444 0.495 25767 4062 1 5 . 1 1 70 70 GLU N N 70 121.059 121.059 117.479 3.580 25767 4063 1 5 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.421 -0.307 25767 4064 1 5 . 1 1 70 70 GLU C C 70 176.519 176.519 174.836 1.683 25767 4065 1 5 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.552 1.752 25767 4066 1 5 . 1 1 70 70 GLU CB C 70 29.827 29.827 31.971 -2.144 25767 4067 1 5 . 1 1 70 70 GLU H H 70 8.430 8.430 7.746 0.684 25767 4068 1 5 . 1 1 71 71 ASP N N 71 120.274 120.274 121.117 -0.843 25767 4069 1 5 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.348 0.184 25767 4070 1 5 . 1 1 71 71 ASP C C 71 176.369 176.369 177.044 -0.675 25767 4071 1 5 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.332 -1.081 25767 4072 1 5 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.555 1.285 25767 4073 1 5 . 1 1 71 71 ASP H H 71 8.305 8.305 8.876 -0.571 25767 4074 1 5 . 1 1 72 72 SER N N 72 116.165 116.165 112.348 3.817 25767 4075 1 5 . 1 1 72 72 SER HA H 72 4.241 4.241 4.190 0.051 25767 4076 1 5 . 1 1 72 72 SER C C 72 174.567 174.567 175.766 -1.199 25767 4077 1 5 . 1 1 72 72 SER CA C 72 59.031 59.031 60.881 -1.850 25767 4078 1 5 . 1 1 72 72 SER CB C 72 64.040 64.040 63.563 0.477 25767 4079 1 5 . 1 1 72 72 SER H H 72 7.964 7.964 8.554 -0.590 25767 4080 1 5 . 1 1 73 73 ASP N N 73 122.440 122.440 122.560 -0.120 25767 4081 1 5 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.422 0.112 25767 4082 1 5 . 1 1 73 73 ASP C C 73 176.882 176.882 178.380 -1.498 25767 4083 1 5 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.372 -2.929 25767 4084 1 5 . 1 1 73 73 ASP CB C 73 41.336 41.336 39.874 1.462 25767 4085 1 5 . 1 1 73 73 ASP H H 73 8.392 8.392 8.734 -0.342 25767 4086 1 5 . 1 1 74 74 LYS N N 74 123.270 123.270 119.648 3.622 25767 4087 1 5 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.031 0.062 25767 4088 1 5 . 1 1 74 74 LYS C C 74 177.608 177.608 178.618 -1.010 25767 4089 1 5 . 1 1 74 74 LYS CA C 74 57.465 57.465 60.206 -2.741 25767 4090 1 5 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.285 -0.139 25767 4091 1 5 . 1 1 74 74 LYS H H 74 8.317 8.317 8.207 0.110 25767 4092 1 5 . 1 1 75 75 SER N N 75 116.557 116.557 116.056 0.501 25767 4093 1 5 . 1 1 75 75 SER HA H 75 4.197 4.197 4.226 -0.029 25767 4094 1 5 . 1 1 75 75 SER C C 75 175.988 175.988 176.590 -0.602 25767 4095 1 5 . 1 1 75 75 SER CA C 75 60.434 60.434 61.439 -1.005 25767 4096 1 5 . 1 1 75 75 SER CB C 75 63.172 63.172 62.537 0.635 25767 4097 1 5 . 1 1 75 75 SER H H 75 8.387 8.387 7.983 0.404 25767 4098 1 5 . 1 1 76 76 LEU N N 76 123.910 123.910 122.964 0.946 25767 4099 1 5 . 1 1 76 76 LEU HA H 76 4.170 4.170 4.016 0.154 25767 4100 1 5 . 1 1 76 76 LEU C C 76 178.083 178.083 178.953 -0.870 25767 4101 1 5 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.858 -1.366 25767 4102 1 5 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.533 0.163 25767 4103 1 5 . 1 1 76 76 LEU H H 76 8.059 8.059 8.415 -0.356 25767 4104 1 5 . 1 1 77 77 HIS N N 77 120.620 120.620 119.637 0.983 25767 4105 1 5 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.252 0.036 25767 4106 1 5 . 1 1 77 77 HIS C C 77 177.667 177.667 177.739 -0.072 25767 4107 1 5 . 1 1 77 77 HIS CA C 77 58.422 58.422 59.893 -1.471 25767 4108 1 5 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.749 0.515 25767 4109 1 5 . 1 1 77 77 HIS H H 77 7.936 7.936 8.430 -0.493 25767 4110 1 5 . 1 1 78 78 VAL N N 78 121.774 121.774 119.643 2.131 25767 4111 1 5 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.587 0.090 25767 4112 1 5 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.167 -0.561 25767 4113 1 5 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.275 0.589 25767 4114 1 5 . 1 1 78 78 VAL H H 78 7.916 7.916 7.881 0.035 25767 4115 1 5 . 1 1 79 79 MET N N 79 119.660 119.660 118.019 1.641 25767 4116 1 5 . 1 1 79 79 MET HA H 79 3.925 3.925 4.006 -0.081 25767 4117 1 5 . 1 1 79 79 MET C C 79 177.077 177.077 178.548 -1.471 25767 4118 1 5 . 1 1 79 79 MET CA C 79 58.862 58.862 59.772 -0.910 25767 4119 1 5 . 1 1 79 79 MET CB C 79 32.852 32.852 32.208 0.644 25767 4120 1 5 . 1 1 79 79 MET H H 79 8.149 8.149 7.990 0.159 25767 4121 1 5 . 1 1 80 80 ASN N N 80 117.337 117.337 118.160 -0.823 25767 4122 1 5 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.826 -0.688 25767 4123 1 5 . 1 1 80 80 ASN C C 80 178.133 178.133 178.290 -0.157 25767 4124 1 5 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.753 0.286 25767 4125 1 5 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.939 0.057 25767 4126 1 5 . 1 1 80 80 ASN H H 80 8.202 8.202 8.773 -0.571 25767 4127 1 5 . 1 1 81 81 THR N N 81 115.517 115.517 118.051 -2.534 25767 4128 1 5 . 1 1 81 81 THR HA H 81 3.896 3.896 4.012 -0.116 25767 4129 1 5 . 1 1 81 81 THR C C 81 175.186 175.186 176.349 -1.163 25767 4130 1 5 . 1 1 81 81 THR CA C 81 66.221 66.221 66.782 -0.561 25767 4131 1 5 . 1 1 81 81 THR CB C 81 69.087 69.087 68.751 0.336 25767 4132 1 5 . 1 1 81 81 THR H H 81 7.944 7.944 7.956 -0.012 25767 4133 1 5 . 1 1 82 82 LEU N N 82 119.074 119.074 120.414 -1.340 25767 4134 1 5 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.062 -0.081 25767 4135 1 5 . 1 1 82 82 LEU C C 82 177.583 177.583 178.120 -0.537 25767 4136 1 5 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.285 -0.745 25767 4137 1 5 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.882 -0.089 25767 4138 1 5 . 1 1 82 82 LEU H H 82 7.547 7.547 7.633 -0.086 25767 4139 1 5 . 1 1 83 83 ILE N N 83 118.085 118.085 116.193 1.892 25767 4140 1 5 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.572 0.271 25767 4141 1 5 . 1 1 83 83 ILE C C 83 176.413 176.413 177.399 -0.986 25767 4142 1 5 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.993 -1.266 25767 4143 1 5 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.132 -0.434 25767 4144 1 5 . 1 1 83 83 ILE H H 83 7.409 7.409 7.793 -0.384 25767 4145 1 5 . 1 1 84 84 HIS N N 84 116.152 116.152 116.563 -0.411 25767 4146 1 5 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.443 0.152 25767 4147 1 5 . 1 1 84 84 HIS C C 84 175.707 175.707 175.623 0.084 25767 4148 1 5 . 1 1 84 84 HIS CA C 84 58.628 58.628 58.584 0.044 25767 4149 1 5 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.310 1.093 25767 4150 1 5 . 1 1 84 84 HIS H H 84 7.194 7.194 7.809 -0.615 25767 4151 1 5 . 1 1 85 85 ASP N N 85 122.322 122.322 120.607 1.715 25767 4152 1 5 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.784 -0.250 25767 4153 1 5 . 1 1 85 85 ASP C C 85 175.580 175.580 176.350 -0.770 25767 4154 1 5 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.921 -0.576 25767 4155 1 5 . 1 1 85 85 ASP CB C 85 41.118 41.118 40.413 0.705 25767 4156 1 5 . 1 1 85 85 ASP H H 85 8.505 8.505 7.927 0.578 25767 4157 1 5 . 1 1 86 86 GLN N N 86 122.783 122.783 124.951 -2.168 25767 4158 1 5 . 1 1 86 86 GLN HA H 86 3.963 3.963 3.991 -0.028 25767 4159 1 5 . 1 1 86 86 GLN C C 86 178.581 178.581 177.532 1.049 25767 4160 1 5 . 1 1 86 86 GLN CA C 86 57.954 57.954 60.121 -2.167 25767 4161 1 5 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.287 -0.393 25767 4162 1 5 . 1 1 86 86 GLN H H 86 8.803 8.803 8.433 0.370 25767 4163 1 5 . 1 1 87 87 GLU N N 87 121.794 121.794 119.560 2.234 25767 4164 1 5 . 1 1 87 87 GLU HA H 87 4.013 4.013 3.940 0.073 25767 4165 1 5 . 1 1 87 87 GLU C C 87 178.290 178.290 178.789 -0.499 25767 4166 1 5 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.742 -0.704 25767 4167 1 5 . 1 1 87 87 GLU CB C 87 28.980 28.980 28.720 0.260 25767 4168 1 5 . 1 1 87 87 GLU H H 87 8.072 8.072 8.876 -0.804 25767 4169 1 5 . 1 1 88 88 LYS N N 88 119.345 119.345 118.280 1.065 25767 4170 1 5 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.093 -0.338 25767 4171 1 5 . 1 1 88 88 LYS C C 88 180.040 180.040 178.807 1.233 25767 4172 1 5 . 1 1 88 88 LYS CA C 88 59.411 59.411 58.735 0.676 25767 4173 1 5 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.709 0.298 25767 4174 1 5 . 1 1 88 88 LYS H H 88 7.588 7.588 7.628 -0.041 25767 4175 1 5 . 1 1 89 89 ALA N N 89 123.933 123.933 122.383 1.550 25767 4176 1 5 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.178 -0.439 25767 4177 1 5 . 1 1 89 89 ALA C C 89 177.457 177.457 179.519 -2.062 25767 4178 1 5 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.183 0.787 25767 4179 1 5 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.218 0.438 25767 4180 1 5 . 1 1 89 89 ALA H H 89 8.500 8.500 7.710 0.790 25767 4181 1 5 . 1 1 90 90 LYS N N 90 119.244 119.244 120.201 -0.957 25767 4182 1 5 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.972 0.072 25767 4183 1 5 . 1 1 90 90 LYS C C 90 177.774 177.774 178.411 -0.637 25767 4184 1 5 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.605 -0.527 25767 4185 1 5 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.407 -2.166 25767 4186 1 5 . 1 1 90 90 LYS H H 90 6.845 6.845 8.102 -1.257 25767 4187 1 5 . 1 1 91 91 ILE N N 91 117.718 117.718 119.409 -1.691 25767 4188 1 5 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.731 -0.333 25767 4189 1 5 . 1 1 91 91 ILE C C 91 177.670 177.670 176.884 0.786 25767 4190 1 5 . 1 1 91 91 ILE CA C 91 63.998 63.998 63.469 0.528 25767 4191 1 5 . 1 1 91 91 ILE CB C 91 37.801 37.801 36.980 0.821 25767 4192 1 5 . 1 1 91 91 ILE H H 91 7.293 7.293 7.710 -0.417 25767 4193 1 5 . 1 1 92 92 TYR N N 92 121.868 121.868 122.471 -0.603 25767 4194 1 5 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.067 0.056 25767 4195 1 5 . 1 1 92 92 TYR C C 92 178.781 178.781 177.821 0.960 25767 4196 1 5 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.618 -0.976 25767 4197 1 5 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.636 0.585 25767 4198 1 5 . 1 1 92 92 TYR H H 92 8.016 8.016 7.872 0.144 25767 4199 1 5 . 1 1 93 93 MET N N 93 118.984 118.984 117.936 1.048 25767 4200 1 5 . 1 1 93 93 MET HA H 93 3.952 3.952 4.126 -0.174 25767 4201 1 5 . 1 1 93 93 MET C C 93 179.925 179.925 178.283 1.642 25767 4202 1 5 . 1 1 93 93 MET CA C 93 57.589 57.589 59.265 -1.676 25767 4203 1 5 . 1 1 93 93 MET CB C 93 30.752 30.752 32.705 -1.953 25767 4204 1 5 . 1 1 93 93 MET H H 93 8.464 8.464 8.726 -0.262 25767 4205 1 5 . 1 1 94 94 LEU N N 94 125.441 125.441 121.919 3.522 25767 4206 1 5 . 1 1 94 94 LEU HA H 94 3.870 3.870 4.025 -0.155 25767 4207 1 5 . 1 1 94 94 LEU C C 94 177.937 177.937 178.527 -0.590 25767 4208 1 5 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.153 0.608 25767 4209 1 5 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.605 0.158 25767 4210 1 5 . 1 1 94 94 LEU H H 94 8.927 8.927 8.387 0.540 25767 4211 1 5 . 1 1 95 95 ASN N N 95 119.066 119.066 117.503 1.563 25767 4212 1 5 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.378 -0.116 25767 4213 1 5 . 1 1 95 95 ASN CA C 95 56.273 56.273 55.920 0.353 25767 4214 1 5 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.095 -0.490 25767 4215 1 5 . 1 1 95 95 ASN H H 95 8.691 8.691 8.329 0.362 25767 4216 1 5 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.353 0.312 25767 4217 1 5 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.283 0.787 25767 4218 1 5 . 1 1 96 96 PHE H H 96 8.317 8.317 8.013 0.304 25767 4219 1 5 . 1 1 97 97 THR N N 97 118.178 118.178 115.122 3.056 25767 4220 1 5 . 1 1 97 97 THR HA H 97 3.338 3.338 3.942 -0.604 25767 4221 1 5 . 1 1 97 97 THR C C 97 176.074 176.074 176.916 -0.842 25767 4222 1 5 . 1 1 97 97 THR CA C 97 67.986 67.986 66.254 1.732 25767 4223 1 5 . 1 1 97 97 THR H H 97 8.214 8.214 8.614 -0.400 25767 4224 1 5 . 1 1 98 98 MET N N 98 120.097 120.097 121.284 -1.187 25767 4225 1 5 . 1 1 98 98 MET HA H 98 4.403 4.403 4.071 0.332 25767 4226 1 5 . 1 1 98 98 MET C C 98 178.696 178.696 178.426 0.270 25767 4227 1 5 . 1 1 98 98 MET CA C 98 57.029 57.029 59.843 -2.814 25767 4228 1 5 . 1 1 98 98 MET CB C 98 29.898 29.898 32.180 -2.282 25767 4229 1 5 . 1 1 98 98 MET H H 98 8.885 8.885 7.991 0.894 25767 4230 1 5 . 1 1 99 99 SER N N 99 114.959 114.959 115.796 -0.837 25767 4231 1 5 . 1 1 99 99 SER HA H 99 4.199 4.199 4.125 0.074 25767 4232 1 5 . 1 1 99 99 SER C C 99 176.565 176.565 176.572 -0.007 25767 4233 1 5 . 1 1 99 99 SER CA C 99 61.965 61.965 61.099 0.866 25767 4234 1 5 . 1 1 99 99 SER CB C 99 62.565 62.565 63.258 -0.693 25767 4235 1 5 . 1 1 99 99 SER H H 99 7.515 7.515 7.822 -0.307 25767 4236 1 5 . 1 1 100 100 LEU N N 100 125.380 125.380 124.582 0.798 25767 4237 1 5 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.834 -0.058 25767 4238 1 5 . 1 1 100 100 LEU C C 100 177.689 177.689 178.057 -0.368 25767 4239 1 5 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.478 0.579 25767 4240 1 5 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.356 0.194 25767 4241 1 5 . 1 1 100 100 LEU H H 100 7.400 7.400 8.276 -0.876 25767 4242 1 5 . 1 1 101 101 TYR N N 101 120.597 120.597 119.651 0.946 25767 4243 1 5 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.996 0.120 25767 4244 1 5 . 1 1 101 101 TYR C C 101 176.825 176.825 177.013 -0.188 25767 4245 1 5 . 1 1 101 101 TYR CA C 101 61.888 61.888 61.996 -0.108 25767 4246 1 5 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.230 0.763 25767 4247 1 5 . 1 1 101 101 TYR H H 101 8.880 8.880 8.702 0.178 25767 4248 1 5 . 1 1 102 102 ASN N N 102 116.869 116.869 116.573 0.296 25767 4249 1 5 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.183 -0.017 25767 4250 1 5 . 1 1 102 102 ASN C C 102 179.089 179.089 177.532 1.557 25767 4251 1 5 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.050 0.162 25767 4252 1 5 . 1 1 102 102 ASN CB C 102 37.734 37.734 37.639 0.095 25767 4253 1 5 . 1 1 102 102 ASN H H 102 8.543 8.543 7.910 0.633 25767 4254 1 5 . 1 1 103 103 GLU N N 103 121.259 121.259 120.739 0.520 25767 4255 1 5 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.900 0.086 25767 4256 1 5 . 1 1 103 103 GLU C C 103 179.968 179.968 178.679 1.289 25767 4257 1 5 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.510 0.007 25767 4258 1 5 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.519 0.031 25767 4259 1 5 . 1 1 103 103 GLU H H 103 7.872 7.872 7.709 0.163 25767 4260 1 5 . 1 1 104 104 LYS N N 104 120.268 120.268 118.574 1.694 25767 4261 1 5 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.203 -0.157 25767 4262 1 5 . 1 1 104 104 LYS C C 104 178.355 178.355 179.097 -0.742 25767 4263 1 5 . 1 1 104 104 LYS CA C 104 56.735 56.735 58.353 -1.618 25767 4264 1 5 . 1 1 104 104 LYS CB C 104 29.113 29.113 31.885 -2.772 25767 4265 1 5 . 1 1 104 104 LYS H H 104 8.384 8.384 7.493 0.891 25767 4266 1 5 . 1 1 105 105 LEU N N 105 121.622 121.622 119.306 2.316 25767 4267 1 5 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.676 0.065 25767 4268 1 5 . 1 1 105 105 LEU C C 105 180.552 180.552 178.674 1.878 25767 4269 1 5 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.262 -0.090 25767 4270 1 5 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.118 -0.088 25767 4271 1 5 . 1 1 105 105 LEU H H 105 8.400 8.400 7.650 0.750 25767 4272 1 5 . 1 1 106 106 LYS N N 106 119.498 119.498 118.273 1.225 25767 4273 1 5 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.835 0.079 25767 4274 1 5 . 1 1 106 106 LYS C C 106 178.419 178.419 179.010 -0.591 25767 4275 1 5 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.973 -0.590 25767 4276 1 5 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.967 -0.159 25767 4277 1 5 . 1 1 106 106 LYS H H 106 7.067 7.067 7.598 -0.531 25767 4278 1 5 . 1 1 107 107 GLN N N 107 121.405 121.405 119.072 2.333 25767 4279 1 5 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.968 -0.117 25767 4280 1 5 . 1 1 107 107 GLN C C 107 177.935 177.935 178.915 -0.980 25767 4281 1 5 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.792 -0.311 25767 4282 1 5 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.549 -1.751 25767 4283 1 5 . 1 1 107 107 GLN H H 107 7.460 7.460 7.756 -0.296 25767 4284 1 5 . 1 1 108 108 LEU N N 108 119.561 119.561 118.872 0.689 25767 4285 1 5 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.820 -0.019 25767 4286 1 5 . 1 1 108 108 LEU C C 108 179.195 179.195 178.061 1.134 25767 4287 1 5 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.443 0.951 25767 4288 1 5 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.769 -0.503 25767 4289 1 5 . 1 1 108 108 LEU H H 108 8.208 8.208 7.923 0.285 25767 4290 1 5 . 1 1 109 109 LYS N N 109 118.535 118.535 117.232 1.303 25767 4291 1 5 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.127 0.125 25767 4292 1 5 . 1 1 109 109 LYS C C 109 177.726 177.726 177.906 -0.180 25767 4293 1 5 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.617 0.112 25767 4294 1 5 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.982 -0.572 25767 4295 1 5 . 1 1 109 109 LYS H H 109 7.168 7.168 7.623 -0.455 25767 4296 1 5 . 1 1 110 110 ASP N N 110 117.463 117.463 117.546 -0.083 25767 4297 1 5 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.592 0.013 25767 4298 1 5 . 1 1 110 110 ASP C C 110 177.360 177.360 176.746 0.614 25767 4299 1 5 . 1 1 110 110 ASP CA C 110 55.896 55.896 55.149 0.747 25767 4300 1 5 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.730 0.847 25767 4301 1 5 . 1 1 110 110 ASP H H 110 7.861 7.861 8.479 -0.618 25767 4302 1 5 . 1 1 111 111 GLY N N 111 113.059 113.059 108.429 4.630 25767 4303 1 5 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.808 -0.756 25767 4304 1 5 . 1 1 111 111 GLY H H 111 8.479 8.479 7.803 0.676 25767 4305 1 5 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.052 0.411 25767 4306 1 5 . 1 1 112 112 PRO C C 112 175.090 175.090 175.693 -0.603 25767 4307 1 5 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.146 -0.782 25767 4308 1 5 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.739 2.111 25767 4309 1 5 . 1 1 113 113 TRP N N 113 123.164 123.164 122.061 1.103 25767 4310 1 5 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.725 -0.015 25767 4311 1 5 . 1 1 113 113 TRP C C 113 174.605 174.605 175.140 -0.535 25767 4312 1 5 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.109 0.796 25767 4313 1 5 . 1 1 113 113 TRP CB C 113 27.293 27.293 29.974 -2.681 25767 4314 1 5 . 1 1 113 113 TRP H H 113 8.687 8.687 8.493 0.194 25767 4315 1 5 . 1 1 114 114 ASP N N 114 121.356 121.356 122.187 -0.831 25767 4316 1 5 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.988 -0.127 25767 4317 1 5 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.781 -0.532 25767 4318 1 5 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.203 -1.062 25767 4319 1 5 . 1 1 114 114 ASP H H 114 6.985 6.985 8.273 -1.288 25767 4320 1 5 . 1 1 115 115 VAL N N 115 118.649 118.649 117.790 0.859 25767 4321 1 5 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.835 0.007 25767 4322 1 5 . 1 1 115 115 VAL C C 115 177.739 177.739 177.457 0.282 25767 4323 1 5 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.927 -0.358 25767 4324 1 5 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.127 -0.450 25767 4325 1 5 . 1 1 115 115 VAL H H 115 8.206 8.206 8.388 -0.182 25767 4326 1 5 . 1 1 116 116 MET N N 116 120.401 120.401 118.273 2.128 25767 4327 1 5 . 1 1 116 116 MET HA H 116 4.303 4.303 4.221 0.082 25767 4328 1 5 . 1 1 116 116 MET C C 116 179.269 179.269 178.354 0.915 25767 4329 1 5 . 1 1 116 116 MET CA C 116 57.634 57.634 58.795 -1.161 25767 4330 1 5 . 1 1 116 116 MET CB C 116 30.414 30.414 32.008 -1.594 25767 4331 1 5 . 1 1 116 116 MET H H 116 7.642 7.642 8.189 -0.547 25767 4332 1 5 . 1 1 117 117 LEU N N 117 125.503 125.503 119.514 5.989 25767 4333 1 5 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.107 0.138 25767 4334 1 5 . 1 1 117 117 LEU C C 117 178.445 178.445 179.342 -0.897 25767 4335 1 5 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.856 0.344 25767 4336 1 5 . 1 1 117 117 LEU CB C 117 40.089 40.089 40.657 -0.568 25767 4337 1 5 . 1 1 117 117 LEU H H 117 8.157 8.157 7.635 0.522 25767 4338 1 5 . 1 1 118 118 LYS N N 118 119.052 119.052 119.463 -0.411 25767 4339 1 5 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.984 -0.179 25767 4340 1 5 . 1 1 118 118 LYS C C 118 178.251 178.251 179.312 -1.061 25767 4341 1 5 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.163 0.363 25767 4342 1 5 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.166 -0.038 25767 4343 1 5 . 1 1 118 118 LYS H H 118 7.400 7.400 7.591 -0.191 25767 4344 1 5 . 1 1 119 119 ARG N N 119 117.999 117.999 119.349 -1.350 25767 4345 1 5 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.313 -0.093 25767 4346 1 5 . 1 1 119 119 ARG C C 119 180.441 180.441 179.057 1.384 25767 4347 1 5 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.529 0.288 25767 4348 1 5 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.200 -0.115 25767 4349 1 5 . 1 1 119 119 ARG H H 119 8.265 8.265 7.921 0.344 25767 4350 1 5 . 1 1 120 120 SER N N 120 118.073 118.073 116.466 1.607 25767 4351 1 5 . 1 1 120 120 SER HA H 120 4.182 4.182 4.269 -0.087 25767 4352 1 5 . 1 1 120 120 SER C C 120 176.215 176.215 176.579 -0.364 25767 4353 1 5 . 1 1 120 120 SER CA C 120 62.817 62.817 62.486 0.331 25767 4354 1 5 . 1 1 120 120 SER CB C 120 63.550 63.550 62.992 0.558 25767 4355 1 5 . 1 1 120 120 SER H H 120 8.633 8.633 7.826 0.807 25767 4356 1 5 . 1 1 121 121 LEU N N 121 125.029 125.029 122.004 3.025 25767 4357 1 5 . 1 1 121 121 LEU HA H 121 4.219 4.219 3.967 0.252 25767 4358 1 5 . 1 1 121 121 LEU C C 121 179.679 179.679 178.517 1.162 25767 4359 1 5 . 1 1 121 121 LEU CA C 121 58.849 58.849 57.870 0.979 25767 4360 1 5 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.453 -0.679 25767 4361 1 5 . 1 1 121 121 LEU H H 121 8.313 8.313 7.750 0.563 25767 4362 1 5 . 1 1 122 122 TRP N N 122 120.217 120.217 119.597 0.620 25767 4363 1 5 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.420 -0.080 25767 4364 1 5 . 1 1 122 122 TRP C C 122 177.527 177.527 178.827 -1.300 25767 4365 1 5 . 1 1 122 122 TRP CA C 122 61.758 61.758 61.056 0.702 25767 4366 1 5 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.015 0.633 25767 4367 1 5 . 1 1 122 122 TRP H H 122 7.928 7.928 7.938 -0.010 25767 4368 1 5 . 1 1 123 123 CYS N N 123 119.669 119.669 119.016 0.653 25767 4369 1 5 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.215 -0.008 25767 4370 1 5 . 1 1 123 123 CYS C C 123 177.057 177.057 177.178 -0.121 25767 4371 1 5 . 1 1 123 123 CYS CA C 123 62.600 62.600 63.051 -0.451 25767 4372 1 5 . 1 1 123 123 CYS CB C 123 25.899 25.899 26.407 -0.508 25767 4373 1 5 . 1 1 123 123 CYS H H 123 8.273 8.273 8.253 0.020 25767 4374 1 5 . 1 1 124 124 CYS N N 124 116.898 116.898 119.510 -2.612 25767 4375 1 5 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.148 -0.300 25767 4376 1 5 . 1 1 124 124 CYS C C 124 175.759 175.759 176.782 -1.023 25767 4377 1 5 . 1 1 124 124 CYS CA C 124 65.653 65.653 65.182 0.471 25767 4378 1 5 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.614 -0.097 25767 4379 1 5 . 1 1 124 124 CYS H H 124 8.122 8.122 7.876 0.246 25767 4380 1 5 . 1 1 125 125 ILE N N 125 120.498 120.498 121.135 -0.637 25767 4381 1 5 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.667 -0.079 25767 4382 1 5 . 1 1 125 125 ILE C C 125 179.337 179.337 177.503 1.834 25767 4383 1 5 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.785 1.808 25767 4384 1 5 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.408 0.271 25767 4385 1 5 . 1 1 125 125 ILE H H 125 8.092 8.092 8.308 -0.216 25767 4386 1 5 . 1 1 126 126 ASP N N 126 125.084 125.084 121.369 3.715 25767 4387 1 5 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.551 0.066 25767 4388 1 5 . 1 1 126 126 ASP C C 126 178.299 178.299 179.176 -0.877 25767 4389 1 5 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.304 1.700 25767 4390 1 5 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.198 0.098 25767 4391 1 5 . 1 1 126 126 ASP H H 126 9.049 9.049 8.318 0.731 25767 4392 1 5 . 1 1 127 127 LEU N N 127 122.591 122.591 120.138 2.453 25767 4393 1 5 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.940 -0.073 25767 4394 1 5 . 1 1 127 127 LEU C C 127 179.655 179.655 178.944 0.711 25767 4395 1 5 . 1 1 127 127 LEU CA C 127 58.661 58.661 58.085 0.576 25767 4396 1 5 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.826 0.368 25767 4397 1 5 . 1 1 127 127 LEU H H 127 8.888 8.888 7.682 1.206 25767 4398 1 5 . 1 1 128 128 PHE N N 128 117.498 117.498 119.862 -2.364 25767 4399 1 5 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.175 0.147 25767 4400 1 5 . 1 1 128 128 PHE C C 128 178.533 178.533 176.841 1.692 25767 4401 1 5 . 1 1 128 128 PHE CA C 128 60.932 60.932 61.815 -0.883 25767 4402 1 5 . 1 1 128 128 PHE CB C 128 39.053 39.053 39.646 -0.593 25767 4403 1 5 . 1 1 128 128 PHE H H 128 8.947 8.947 8.112 0.835 25767 4404 1 5 . 1 1 129 129 SER N N 129 115.398 115.398 116.219 -0.821 25767 4405 1 5 . 1 1 129 129 SER HA H 129 4.046 4.046 4.337 -0.291 25767 4406 1 5 . 1 1 129 129 SER C C 129 175.168 175.168 176.842 -1.674 25767 4407 1 5 . 1 1 129 129 SER CA C 129 63.015 63.015 61.757 1.258 25767 4408 1 5 . 1 1 129 129 SER H H 129 8.578 8.578 9.031 -0.453 25767 4409 1 5 . 1 1 130 130 CYS N N 130 125.556 125.556 121.862 3.694 25767 4410 1 5 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.335 -0.226 25767 4411 1 5 . 1 1 130 130 CYS C C 130 175.294 175.294 176.990 -1.696 25767 4412 1 5 . 1 1 130 130 CYS CA C 130 61.438 61.438 62.779 -1.341 25767 4413 1 5 . 1 1 130 130 CYS CB C 130 27.050 27.050 26.671 0.379 25767 4414 1 5 . 1 1 130 130 CYS H H 130 8.289 8.289 8.297 -0.008 25767 4415 1 5 . 1 1 131 131 ILE N N 131 120.232 120.232 121.274 -1.042 25767 4416 1 5 . 1 1 131 131 ILE HA H 131 4.033 4.033 3.947 0.086 25767 4417 1 5 . 1 1 131 131 ILE C C 131 177.297 177.297 178.614 -1.317 25767 4418 1 5 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.629 -0.977 25767 4419 1 5 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.877 1.225 25767 4420 1 5 . 1 1 131 131 ILE H H 131 7.943 7.943 7.809 0.134 25767 4421 1 5 . 1 1 132 132 LEU N N 132 116.422 116.422 120.610 -4.188 25767 4422 1 5 . 1 1 132 132 LEU HA H 132 3.845 3.845 3.884 -0.039 25767 4423 1 5 . 1 1 132 132 LEU C C 132 177.816 177.816 178.418 -0.602 25767 4424 1 5 . 1 1 132 132 LEU CA C 132 57.078 57.078 58.041 -0.963 25767 4425 1 5 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.472 0.741 25767 4426 1 5 . 1 1 132 132 LEU H H 132 7.846 7.846 8.195 -0.349 25767 4427 1 5 . 1 1 133 133 HIS N N 133 116.929 116.929 118.973 -2.044 25767 4428 1 5 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.247 -0.108 25767 4429 1 5 . 1 1 133 133 HIS C C 133 178.669 178.669 177.487 1.182 25767 4430 1 5 . 1 1 133 133 HIS CA C 133 59.736 59.736 60.045 -0.309 25767 4431 1 5 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.469 2.683 25767 4432 1 5 . 1 1 133 133 HIS H H 133 7.822 7.822 8.201 -0.379 25767 4433 1 5 . 1 1 134 134 LEU N N 134 116.898 116.898 120.054 -3.156 25767 4434 1 5 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.131 -0.398 25767 4435 1 5 . 1 1 134 134 LEU C C 134 179.402 179.402 179.027 0.375 25767 4436 1 5 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.749 -0.522 25767 4437 1 5 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.038 -2.499 25767 4438 1 5 . 1 1 134 134 LEU H H 134 8.688 8.688 7.824 0.864 25767 4439 1 5 . 1 1 135 135 TRP N N 135 115.602 115.602 118.025 -2.423 25767 4440 1 5 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.567 0.441 25767 4441 1 5 . 1 1 135 135 TRP C C 135 175.022 175.022 178.085 -3.063 25767 4442 1 5 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.326 1.100 25767 4443 1 5 . 1 1 135 135 TRP CB C 135 27.085 27.085 29.265 -2.180 25767 4444 1 5 . 1 1 135 135 TRP H H 135 7.638 7.638 8.467 -0.829 25767 4445 1 5 . 1 1 136 136 LYS N N 136 119.721 119.721 122.930 -3.209 25767 4446 1 5 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.943 -0.127 25767 4447 1 5 . 1 1 136 136 LYS C C 136 178.279 178.279 178.395 -0.116 25767 4448 1 5 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.689 0.504 25767 4449 1 5 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.830 1.227 25767 4450 1 5 . 1 1 136 136 LYS H H 136 6.538 6.538 8.439 -1.901 25767 4451 1 5 . 1 1 137 137 GLU N N 137 115.407 115.407 115.919 -0.512 25767 4452 1 5 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.151 0.016 25767 4453 1 5 . 1 1 137 137 GLU C C 137 176.700 176.700 177.383 -0.683 25767 4454 1 5 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.505 -0.655 25767 4455 1 5 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.053 0.107 25767 4456 1 5 . 1 1 137 137 GLU H H 137 8.596 8.596 8.191 0.405 25767 4457 1 5 . 1 1 138 138 ASN N N 138 116.669 116.669 116.458 0.211 25767 4458 1 5 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.819 0.087 25767 4459 1 5 . 1 1 138 138 ASN C C 138 173.481 173.481 174.933 -1.452 25767 4460 1 5 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.939 -1.125 25767 4461 1 5 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.663 1.174 25767 4462 1 5 . 1 1 138 138 ASN H H 138 8.343 8.343 8.251 0.092 25767 4463 1 5 . 1 1 139 139 ILE N N 139 120.703 120.703 120.195 0.508 25767 4464 1 5 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.258 0.086 25767 4465 1 5 . 1 1 139 139 ILE C C 139 175.241 175.241 175.683 -0.442 25767 4466 1 5 . 1 1 139 139 ILE CA C 139 60.792 60.792 58.592 2.200 25767 4467 1 5 . 1 1 139 139 ILE CB C 139 40.274 40.274 38.645 1.629 25767 4468 1 5 . 1 1 139 139 ILE H H 139 7.167 7.167 7.607 -0.440 25767 4469 1 5 . 1 1 140 140 SER N N 140 123.284 123.284 120.384 2.900 25767 4470 1 5 . 1 1 140 140 SER HA H 140 4.345 4.345 4.480 -0.135 25767 4471 1 5 . 1 1 140 140 SER CA C 140 58.095 58.095 57.049 1.046 25767 4472 1 5 . 1 1 140 140 SER CB C 140 65.370 65.370 64.578 0.792 25767 4473 1 5 . 1 1 140 140 SER H H 140 8.727 8.727 8.257 0.470 25767 4474 1 5 . 1 1 142 142 THR N N 142 113.868 113.868 115.859 -1.991 25767 4475 1 5 . 1 1 142 142 THR HA H 142 3.976 3.976 4.181 -0.205 25767 4476 1 5 . 1 1 142 142 THR C C 142 177.559 177.559 176.846 0.713 25767 4477 1 5 . 1 1 142 142 THR CA C 142 66.007 66.007 65.943 0.064 25767 4478 1 5 . 1 1 142 142 THR CB C 142 68.530 68.530 68.467 0.063 25767 4479 1 5 . 1 1 142 142 THR H H 142 8.243 8.243 8.014 0.229 25767 4480 1 5 . 1 1 143 143 SER N N 143 120.786 120.786 117.810 2.976 25767 4481 1 5 . 1 1 143 143 SER C C 143 175.844 175.844 176.605 -0.761 25767 4482 1 5 . 1 1 143 143 SER CA C 143 62.102 62.102 61.524 0.578 25767 4483 1 5 . 1 1 143 143 SER CB C 143 63.086 63.086 63.012 0.074 25767 4484 1 5 . 1 1 143 143 SER H H 143 7.915 7.915 8.611 -0.696 25767 4485 1 5 . 1 1 144 144 THR N N 144 120.946 120.946 117.693 3.253 25767 4486 1 5 . 1 1 144 144 THR HA H 144 4.299 4.299 4.018 0.281 25767 4487 1 5 . 1 1 144 144 THR C C 144 175.874 175.874 176.391 -0.517 25767 4488 1 5 . 1 1 144 144 THR CA C 144 67.487 67.487 66.567 0.920 25767 4489 1 5 . 1 1 144 144 THR CB C 144 68.485 68.485 68.657 -0.172 25767 4490 1 5 . 1 1 144 144 THR H H 144 8.746 8.746 8.523 0.223 25767 4491 1 5 . 1 1 145 145 ASN N N 145 120.069 120.069 119.532 0.537 25767 4492 1 5 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.410 -0.102 25767 4493 1 5 . 1 1 145 145 ASN C C 145 177.917 177.917 177.775 0.142 25767 4494 1 5 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.647 -0.310 25767 4495 1 5 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.587 -0.487 25767 4496 1 5 . 1 1 145 145 ASN H H 145 7.940 7.940 7.886 0.054 25767 4497 1 5 . 1 1 146 146 SER N N 146 116.905 116.905 116.348 0.557 25767 4498 1 5 . 1 1 146 146 SER HA H 146 3.936 3.936 4.134 -0.198 25767 4499 1 5 . 1 1 146 146 SER C C 146 176.963 176.963 176.697 0.266 25767 4500 1 5 . 1 1 146 146 SER CA C 146 61.997 61.997 62.376 -0.379 25767 4501 1 5 . 1 1 146 146 SER CB C 146 62.879 62.879 63.090 -0.210 25767 4502 1 5 . 1 1 146 146 SER H H 146 7.951 7.951 7.792 0.159 25767 4503 1 5 . 1 1 147 147 LEU N N 147 123.253 123.253 121.883 1.370 25767 4504 1 5 . 1 1 147 147 LEU HA H 147 3.875 3.875 3.912 -0.037 25767 4505 1 5 . 1 1 147 147 LEU C C 147 178.726 178.726 179.002 -0.276 25767 4506 1 5 . 1 1 147 147 LEU CA C 147 58.580 58.580 57.885 0.695 25767 4507 1 5 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.625 -0.765 25767 4508 1 5 . 1 1 147 147 LEU H H 147 8.168 8.168 7.645 0.523 25767 4509 1 5 . 1 1 148 148 GLN N N 148 118.212 118.212 117.878 0.334 25767 4510 1 5 . 1 1 148 148 GLN HA H 148 3.817 3.817 3.984 -0.167 25767 4511 1 5 . 1 1 148 148 GLN C C 148 179.686 179.686 178.430 1.256 25767 4512 1 5 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.459 0.784 25767 4513 1 5 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.737 -0.017 25767 4514 1 5 . 1 1 148 148 GLN H H 148 8.295 8.295 8.536 -0.241 25767 4515 1 5 . 1 1 149 149 LYS N N 149 120.770 120.770 120.595 0.175 25767 4516 1 5 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.949 -0.048 25767 4517 1 5 . 1 1 149 149 LYS C C 149 178.006 178.006 179.061 -1.055 25767 4518 1 5 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.681 -0.149 25767 4519 1 5 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.113 -0.221 25767 4520 1 5 . 1 1 149 149 LYS H H 149 7.955 7.955 7.988 -0.033 25767 4521 1 5 . 1 1 150 150 ARG N N 150 119.244 119.244 119.114 0.130 25767 4522 1 5 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.953 -0.113 25767 4523 1 5 . 1 1 150 150 ARG C C 150 178.858 178.858 179.072 -0.214 25767 4524 1 5 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.123 0.248 25767 4525 1 5 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.899 -1.095 25767 4526 1 5 . 1 1 150 150 ARG H H 150 7.020 7.020 7.532 -0.512 25767 4527 1 5 . 1 1 151 151 ILE N N 151 121.183 121.183 120.289 0.894 25767 4528 1 5 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.570 -0.210 25767 4529 1 5 . 1 1 151 151 ILE C C 151 177.327 177.327 177.736 -0.409 25767 4530 1 5 . 1 1 151 151 ILE CA C 151 67.196 67.196 64.846 2.350 25767 4531 1 5 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.578 0.694 25767 4532 1 5 . 1 1 151 151 ILE H H 151 7.574 7.574 7.664 -0.090 25767 4533 1 5 . 1 1 152 152 LYS N N 152 119.521 119.521 120.983 -1.462 25767 4534 1 5 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.871 -0.098 25767 4535 1 5 . 1 1 152 152 LYS C C 152 178.016 178.016 178.529 -0.513 25767 4536 1 5 . 1 1 152 152 LYS CA C 152 59.830 59.830 59.947 -0.117 25767 4537 1 5 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.255 -0.674 25767 4538 1 5 . 1 1 152 152 LYS H H 152 7.629 7.629 8.175 -0.546 25767 4539 1 5 . 1 1 153 153 TYR N N 153 120.178 120.178 120.428 -0.250 25767 4540 1 5 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.118 -0.046 25767 4541 1 5 . 1 1 153 153 TYR C C 153 178.195 178.195 177.815 0.380 25767 4542 1 5 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.862 -0.546 25767 4543 1 5 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.386 -1.113 25767 4544 1 5 . 1 1 153 153 TYR H H 153 8.407 8.407 8.045 0.362 25767 4545 1 5 . 1 1 154 154 CYS N N 154 117.013 117.013 118.236 -1.223 25767 4546 1 5 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.192 -0.120 25767 4547 1 5 . 1 1 154 154 CYS C C 154 176.827 176.827 176.993 -0.166 25767 4548 1 5 . 1 1 154 154 CYS CA C 154 65.780 65.780 63.386 2.394 25767 4549 1 5 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.715 0.445 25767 4550 1 5 . 1 1 154 154 CYS H H 154 8.291 8.291 7.758 0.533 25767 4551 1 5 . 1 1 155 155 LYS N N 155 118.753 118.753 120.553 -1.800 25767 4552 1 5 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.813 -0.142 25767 4553 1 5 . 1 1 155 155 LYS C C 155 179.904 179.904 178.926 0.978 25767 4554 1 5 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.465 1.019 25767 4555 1 5 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.151 -0.207 25767 4556 1 5 . 1 1 155 155 LYS H H 155 7.934 7.934 8.091 -0.157 25767 4557 1 5 . 1 1 156 156 ILE N N 156 123.873 123.873 120.960 2.913 25767 4558 1 5 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.541 0.043 25767 4559 1 5 . 1 1 156 156 ILE C C 156 179.501 179.501 177.507 1.994 25767 4560 1 5 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.516 -0.276 25767 4561 1 5 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.753 -0.111 25767 4562 1 5 . 1 1 156 156 ILE H H 156 8.314 8.314 8.477 -0.163 25767 4563 1 5 . 1 1 157 157 TYR N N 157 121.132 121.132 119.885 1.247 25767 4564 1 5 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.960 0.205 25767 4565 1 5 . 1 1 157 157 TYR C C 157 178.558 178.558 177.442 1.116 25767 4566 1 5 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.983 0.128 25767 4567 1 5 . 1 1 157 157 TYR H H 157 8.442 8.442 7.563 0.879 25767 4568 1 5 . 1 1 158 158 LEU N N 158 120.964 120.964 119.844 1.120 25767 4569 1 5 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.836 0.076 25767 4570 1 5 . 1 1 158 158 LEU C C 158 180.130 180.130 178.744 1.386 25767 4571 1 5 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.589 1.097 25767 4572 1 5 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.519 0.211 25767 4573 1 5 . 1 1 158 158 LEU H H 158 8.469 8.469 7.824 0.645 25767 4574 1 5 . 1 1 159 159 SER N N 159 116.653 116.653 114.566 2.087 25767 4575 1 5 . 1 1 159 159 SER HA H 159 4.246 4.246 4.069 0.177 25767 4576 1 5 . 1 1 159 159 SER CA C 159 61.460 61.460 61.929 -0.469 25767 4577 1 5 . 1 1 159 159 SER CB C 159 62.849 62.849 62.708 0.141 25767 4578 1 5 . 1 1 159 159 SER H H 159 7.758 7.758 8.539 -0.781 25767 4579 1 5 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.359 -1.986 25767 4580 1 5 . 1 1 160 160 LYS CB C 160 29.832 29.832 32.053 -2.221 25767 4581 1 5 . 1 1 160 160 LYS H H 160 8.425 8.425 7.566 0.859 25767 4582 1 5 . 1 1 161 161 LEU N N 161 121.686 121.686 119.030 2.656 25767 4583 1 5 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.797 0.366 25767 4584 1 5 . 1 1 161 161 LEU C C 161 180.224 180.224 178.960 1.264 25767 4585 1 5 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.759 -0.175 25767 4586 1 5 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.460 0.002 25767 4587 1 5 . 1 1 161 161 LEU H H 161 8.323 8.323 7.409 0.914 25767 4588 1 5 . 1 1 162 162 ALA N N 162 123.102 123.102 120.914 2.188 25767 4589 1 5 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.041 0.089 25767 4590 1 5 . 1 1 162 162 ALA C C 162 179.487 179.487 179.256 0.231 25767 4591 1 5 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.701 0.043 25767 4592 1 5 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.379 0.024 25767 4593 1 5 . 1 1 162 162 ALA H H 162 7.978 7.978 7.542 0.436 25767 4594 1 5 . 1 1 163 163 LYS N N 163 116.069 116.069 116.277 -0.208 25767 4595 1 5 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.268 -0.045 25767 4596 1 5 . 1 1 163 163 LYS C C 163 176.987 176.987 176.583 0.404 25767 4597 1 5 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.302 0.304 25767 4598 1 5 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.725 0.481 25767 4599 1 5 . 1 1 163 163 LYS H H 163 7.697 7.697 7.733 -0.036 25767 4600 1 5 . 1 1 164 164 GLY N N 164 108.540 108.540 106.782 1.758 25767 4601 1 5 . 1 1 164 164 GLY C C 164 174.721 174.721 174.289 0.432 25767 4602 1 5 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.962 0.829 25767 4603 1 5 . 1 1 164 164 GLY H H 164 7.772 7.772 7.519 0.253 25767 4604 1 5 . 1 1 165 165 GLU N N 165 119.886 119.886 120.256 -0.370 25767 4605 1 5 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.350 -0.300 25767 4606 1 5 . 1 1 165 165 GLU C C 165 176.027 176.027 175.070 0.957 25767 4607 1 5 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.107 1.746 25767 4608 1 5 . 1 1 165 165 GLU CB C 165 30.338 30.338 31.006 -0.668 25767 4609 1 5 . 1 1 165 165 GLU H H 165 8.065 8.065 7.917 0.148 25767 4610 1 5 . 1 1 166 166 ILE N N 166 117.926 117.926 120.954 -3.028 25767 4611 1 5 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.926 -0.024 25767 4612 1 5 . 1 1 166 166 ILE C C 166 174.138 174.138 176.523 -2.385 25767 4613 1 5 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.526 1.929 25767 4614 1 5 . 1 1 166 166 ILE CB C 166 40.202 40.202 39.401 0.801 25767 4615 1 5 . 1 1 166 166 ILE H H 166 7.282 7.282 8.123 -0.841 25767 4616 1 6 . 1 1 2 2 ALA N N 2 122.811 122.811 125.316 -2.505 25767 4617 1 6 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.013 0.010 25767 4618 1 6 . 1 1 2 2 ALA C C 2 179.915 179.915 178.749 1.166 25767 4619 1 6 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.477 -0.360 25767 4620 1 6 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.030 0.509 25767 4621 1 6 . 1 1 2 2 ALA H H 2 8.509 8.509 8.987 -0.478 25767 4622 1 6 . 1 1 3 3 SER N N 3 115.308 115.308 113.526 1.782 25767 4623 1 6 . 1 1 3 3 SER HA H 3 4.097 4.097 4.255 -0.158 25767 4624 1 6 . 1 1 3 3 SER C C 3 176.706 176.706 176.271 0.435 25767 4625 1 6 . 1 1 3 3 SER CA C 3 60.665 60.665 61.320 -0.655 25767 4626 1 6 . 1 1 3 3 SER CB C 3 62.710 62.710 62.165 0.545 25767 4627 1 6 . 1 1 3 3 SER H H 3 7.996 7.996 8.532 -0.536 25767 4628 1 6 . 1 1 4 4 ASN N N 4 122.688 122.688 120.892 1.796 25767 4629 1 6 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.440 -0.136 25767 4630 1 6 . 1 1 4 4 ASN C C 4 176.258 176.258 177.480 -1.222 25767 4631 1 6 . 1 1 4 4 ASN CA C 4 55.701 55.701 55.852 -0.151 25767 4632 1 6 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.481 0.696 25767 4633 1 6 . 1 1 4 4 ASN H H 4 8.075 8.075 8.298 -0.223 25767 4634 1 6 . 1 1 5 5 ALA N N 5 121.900 121.900 122.431 -0.531 25767 4635 1 6 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.143 -0.568 25767 4636 1 6 . 1 1 5 5 ALA C C 5 178.475 178.475 179.378 -0.903 25767 4637 1 6 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.974 0.859 25767 4638 1 6 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.168 -0.553 25767 4639 1 6 . 1 1 5 5 ALA H H 5 8.659 8.659 7.732 0.927 25767 4640 1 6 . 1 1 6 6 ALA N N 6 117.768 117.768 121.672 -3.904 25767 4641 1 6 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.964 -0.177 25767 4642 1 6 . 1 1 6 6 ALA C C 6 180.494 180.494 179.415 1.079 25767 4643 1 6 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.118 0.232 25767 4644 1 6 . 1 1 6 6 ALA CB C 6 17.902 17.902 17.959 -0.057 25767 4645 1 6 . 1 1 6 6 ALA H H 6 7.864 7.864 7.778 0.086 25767 4646 1 6 . 1 1 7 7 ARG N N 7 121.173 121.173 119.157 2.016 25767 4647 1 6 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.085 -0.182 25767 4648 1 6 . 1 1 7 7 ARG C C 7 179.189 179.189 178.610 0.579 25767 4649 1 6 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.970 0.342 25767 4650 1 6 . 1 1 7 7 ARG CB C 7 29.222 29.222 30.097 -0.875 25767 4651 1 6 . 1 1 7 7 ARG H H 7 7.514 7.514 7.968 -0.454 25767 4652 1 6 . 1 1 8 8 VAL N N 8 122.979 122.979 119.853 3.126 25767 4653 1 6 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.738 -0.485 25767 4654 1 6 . 1 1 8 8 VAL C C 8 177.821 177.821 178.341 -0.520 25767 4655 1 6 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.179 1.593 25767 4656 1 6 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.127 0.314 25767 4657 1 6 . 1 1 8 8 VAL H H 8 8.101 8.101 7.702 0.399 25767 4658 1 6 . 1 1 9 9 VAL N N 9 119.801 119.801 120.586 -0.785 25767 4659 1 6 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.527 -0.261 25767 4660 1 6 . 1 1 9 9 VAL C C 9 177.373 177.373 177.563 -0.190 25767 4661 1 6 . 1 1 9 9 VAL CA C 9 67.484 67.484 66.796 0.688 25767 4662 1 6 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.855 0.770 25767 4663 1 6 . 1 1 9 9 VAL H H 9 8.362 8.362 8.077 0.285 25767 4664 1 6 . 1 1 10 10 ALA N N 10 122.360 122.360 121.540 0.820 25767 4665 1 6 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.064 -0.128 25767 4666 1 6 . 1 1 10 10 ALA C C 10 180.762 180.762 179.808 0.954 25767 4667 1 6 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.580 -0.136 25767 4668 1 6 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.097 -0.360 25767 4669 1 6 . 1 1 10 10 ALA H H 10 7.776 7.776 7.754 0.022 25767 4670 1 6 . 1 1 11 11 THR N N 11 117.376 117.376 114.407 2.969 25767 4671 1 6 . 1 1 11 11 THR HA H 11 3.816 3.816 4.116 -0.300 25767 4672 1 6 . 1 1 11 11 THR C C 11 175.775 175.775 176.342 -0.567 25767 4673 1 6 . 1 1 11 11 THR CA C 11 66.509 66.509 65.788 0.721 25767 4674 1 6 . 1 1 11 11 THR CB C 11 68.588 68.588 68.706 -0.118 25767 4675 1 6 . 1 1 11 11 THR H H 11 8.180 8.180 7.722 0.458 25767 4676 1 6 . 1 1 12 12 ALA N N 12 125.308 125.308 124.155 1.153 25767 4677 1 6 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.639 0.358 25767 4678 1 6 . 1 1 12 12 ALA C C 12 179.399 179.399 179.316 0.083 25767 4679 1 6 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.504 0.572 25767 4680 1 6 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.123 1.121 25767 4681 1 6 . 1 1 12 12 ALA H H 12 8.671 8.671 8.492 0.179 25767 4682 1 6 . 1 1 13 13 LYS N N 13 116.977 116.977 118.093 -1.116 25767 4683 1 6 . 1 1 13 13 LYS C C 13 179.646 179.646 178.961 0.685 25767 4684 1 6 . 1 1 13 13 LYS CA C 13 58.921 58.921 58.936 -0.015 25767 4685 1 6 . 1 1 13 13 LYS CB C 13 31.443 31.443 31.797 -0.354 25767 4686 1 6 . 1 1 13 13 LYS H H 13 8.061 8.061 7.729 0.332 25767 4687 1 6 . 1 1 14 14 ASP N N 14 121.988 121.988 120.059 1.929 25767 4688 1 6 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.488 -0.135 25767 4689 1 6 . 1 1 14 14 ASP C C 14 179.446 179.446 178.824 0.622 25767 4690 1 6 . 1 1 14 14 ASP CA C 14 57.509 57.509 57.043 0.466 25767 4691 1 6 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.619 -0.618 25767 4692 1 6 . 1 1 14 14 ASP H H 14 7.669 7.669 7.681 -0.012 25767 4693 1 6 . 1 1 15 15 PHE N N 15 119.588 119.588 118.284 1.304 25767 4694 1 6 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.189 0.155 25767 4695 1 6 . 1 1 15 15 PHE C C 15 178.373 178.373 178.035 0.338 25767 4696 1 6 . 1 1 15 15 PHE CA C 15 62.237 62.237 60.917 1.320 25767 4697 1 6 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.636 -1.140 25767 4698 1 6 . 1 1 15 15 PHE H H 15 7.913 7.913 8.406 -0.493 25767 4699 1 6 . 1 1 16 16 ASP N N 16 121.705 121.705 119.913 1.792 25767 4700 1 6 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.409 -0.414 25767 4701 1 6 . 1 1 16 16 ASP C C 16 180.071 180.071 178.947 1.124 25767 4702 1 6 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.700 0.449 25767 4703 1 6 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.827 0.660 25767 4704 1 6 . 1 1 16 16 ASP H H 16 8.324 8.324 8.188 0.136 25767 4705 1 6 . 1 1 17 17 LYS N N 17 118.825 118.825 118.923 -0.098 25767 4706 1 6 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.084 -0.047 25767 4707 1 6 . 1 1 17 17 LYS C C 17 178.407 178.407 178.056 0.351 25767 4708 1 6 . 1 1 17 17 LYS CA C 17 59.061 59.061 59.028 0.033 25767 4709 1 6 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.590 -0.006 25767 4710 1 6 . 1 1 17 17 LYS H H 17 7.834 7.834 7.698 0.136 25767 4711 1 6 . 1 1 18 18 VAL N N 18 110.562 110.562 117.274 -6.712 25767 4712 1 6 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.018 0.498 25767 4713 1 6 . 1 1 18 18 VAL C C 18 176.144 176.144 176.425 -0.281 25767 4714 1 6 . 1 1 18 18 VAL CA C 18 60.874 60.874 62.989 -2.115 25767 4715 1 6 . 1 1 18 18 VAL CB C 18 31.160 31.160 32.127 -0.967 25767 4716 1 6 . 1 1 18 18 VAL H H 18 7.185 7.185 7.557 -0.372 25767 4717 1 6 . 1 1 19 19 GLY N N 19 109.272 109.272 107.585 1.687 25767 4718 1 6 . 1 1 19 19 GLY C C 19 175.043 175.043 174.905 0.138 25767 4719 1 6 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.403 0.428 25767 4720 1 6 . 1 1 19 19 GLY H H 19 7.723 7.723 7.836 -0.113 25767 4721 1 6 . 1 1 20 20 LEU N N 20 125.428 125.428 121.577 3.851 25767 4722 1 6 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.624 -0.304 25767 4723 1 6 . 1 1 20 20 LEU C C 20 177.949 177.949 177.330 0.619 25767 4724 1 6 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.377 -0.572 25767 4725 1 6 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.447 0.470 25767 4726 1 6 . 1 1 20 20 LEU H H 20 8.083 8.083 8.056 0.027 25767 4727 1 6 . 1 1 21 21 GLY N N 21 107.804 107.804 110.031 -2.227 25767 4728 1 6 . 1 1 21 21 GLY C C 21 176.278 176.278 176.208 0.070 25767 4729 1 6 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.571 -0.277 25767 4730 1 6 . 1 1 21 21 GLY H H 21 7.982 7.982 7.931 0.051 25767 4731 1 6 . 1 1 22 22 ILE N N 22 121.319 121.319 121.916 -0.597 25767 4732 1 6 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.874 0.036 25767 4733 1 6 . 1 1 22 22 ILE C C 22 176.604 176.604 178.047 -1.443 25767 4734 1 6 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.367 -1.921 25767 4735 1 6 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.980 -1.414 25767 4736 1 6 . 1 1 22 22 ILE H H 22 8.478 8.478 8.064 0.414 25767 4737 1 6 . 1 1 23 23 ILE N N 23 120.377 120.377 120.230 0.147 25767 4738 1 6 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.946 -0.233 25767 4739 1 6 . 1 1 23 23 ILE C C 23 178.581 178.581 178.193 0.388 25767 4740 1 6 . 1 1 23 23 ILE CA C 23 64.246 64.246 65.881 -1.635 25767 4741 1 6 . 1 1 23 23 ILE CB C 23 36.199 36.199 37.421 -1.222 25767 4742 1 6 . 1 1 23 23 ILE H H 23 6.869 6.869 7.821 -0.952 25767 4743 1 6 . 1 1 24 24 GLY N N 24 103.449 103.449 108.691 -5.242 25767 4744 1 6 . 1 1 24 24 GLY C C 24 175.308 175.308 175.625 -0.317 25767 4745 1 6 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.372 0.571 25767 4746 1 6 . 1 1 24 24 GLY H H 24 7.488 7.488 7.982 -0.494 25767 4747 1 6 . 1 1 25 25 TYR N N 25 124.685 124.685 123.385 1.300 25767 4748 1 6 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.427 0.239 25767 4749 1 6 . 1 1 25 25 TYR C C 25 176.208 176.208 177.236 -1.028 25767 4750 1 6 . 1 1 25 25 TYR CA C 25 61.371 61.371 61.617 -0.246 25767 4751 1 6 . 1 1 25 25 TYR CB C 25 38.267 38.267 37.986 0.281 25767 4752 1 6 . 1 1 25 25 TYR H H 25 7.931 7.931 7.967 -0.036 25767 4753 1 6 . 1 1 26 26 TYR N N 26 117.001 117.001 117.203 -0.202 25767 4754 1 6 . 1 1 26 26 TYR HA H 26 3.941 3.941 4.052 -0.111 25767 4755 1 6 . 1 1 26 26 TYR C C 26 178.753 178.753 177.987 0.766 25767 4756 1 6 . 1 1 26 26 TYR CA C 26 64.260 64.260 61.997 2.263 25767 4757 1 6 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.413 -0.892 25767 4758 1 6 . 1 1 26 26 TYR H H 26 7.693 7.693 7.717 -0.024 25767 4759 1 6 . 1 1 27 27 LEU N N 27 118.657 118.657 119.810 -1.153 25767 4760 1 6 . 1 1 27 27 LEU HA H 27 4.311 4.311 4.251 0.060 25767 4761 1 6 . 1 1 27 27 LEU CA C 27 58.297 58.297 57.759 0.538 25767 4762 1 6 . 1 1 27 27 LEU CB C 27 42.723 42.723 41.394 1.329 25767 4763 1 6 . 1 1 27 27 LEU H H 27 8.339 8.339 8.905 -0.566 25767 4764 1 6 . 1 1 28 28 GLN N N 28 118.593 118.593 118.068 0.525 25767 4765 1 6 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.914 -0.263 25767 4766 1 6 . 1 1 28 28 GLN C C 28 177.282 177.282 178.658 -1.376 25767 4767 1 6 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.721 0.108 25767 4768 1 6 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.427 1.222 25767 4769 1 6 . 1 1 28 28 GLN H H 28 7.970 7.970 8.012 -0.042 25767 4770 1 6 . 1 1 29 29 LEU N N 29 122.111 122.111 120.018 2.093 25767 4771 1 6 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.767 0.177 25767 4772 1 6 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.751 0.915 25767 4773 1 6 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.414 0.593 25767 4774 1 6 . 1 1 29 29 LEU H H 29 7.979 7.979 7.460 0.519 25767 4775 1 6 . 1 1 30 30 TYR N N 30 119.283 119.283 120.285 -1.002 25767 4776 1 6 . 1 1 30 30 TYR C C 30 175.775 175.775 177.406 -1.631 25767 4777 1 6 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.872 -1.778 25767 4778 1 6 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.406 0.667 25767 4779 1 6 . 1 1 30 30 TYR H H 30 8.093 8.093 7.782 0.311 25767 4780 1 6 . 1 1 31 31 ALA N N 31 121.327 121.327 122.204 -0.877 25767 4781 1 6 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.849 -0.481 25767 4782 1 6 . 1 1 31 31 ALA C C 31 178.955 178.955 178.805 0.150 25767 4783 1 6 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.322 0.225 25767 4784 1 6 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.211 -0.248 25767 4785 1 6 . 1 1 31 31 ALA H H 31 8.394 8.394 7.950 0.444 25767 4786 1 6 . 1 1 32 32 VAL N N 32 116.757 116.757 119.018 -2.261 25767 4787 1 6 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.489 -0.229 25767 4788 1 6 . 1 1 32 32 VAL CA C 32 67.662 67.662 66.234 1.428 25767 4789 1 6 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.629 -0.658 25767 4790 1 6 . 1 1 32 32 VAL H H 32 8.020 8.020 7.614 0.406 25767 4791 1 6 . 1 1 33 33 GLU N N 33 118.775 118.775 119.798 -1.023 25767 4792 1 6 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.848 0.141 25767 4793 1 6 . 1 1 33 33 GLU C C 33 179.746 179.746 178.700 1.046 25767 4794 1 6 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.298 0.705 25767 4795 1 6 . 1 1 33 33 GLU H H 33 7.358 7.358 7.566 -0.208 25767 4796 1 6 . 1 1 34 34 LEU N N 34 120.632 120.632 120.811 -0.179 25767 4797 1 6 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.807 -0.158 25767 4798 1 6 . 1 1 34 34 LEU C C 34 180.336 180.336 178.561 1.775 25767 4799 1 6 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.612 0.063 25767 4800 1 6 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.732 -0.144 25767 4801 1 6 . 1 1 34 34 LEU H H 34 8.390 8.390 7.692 0.698 25767 4802 1 6 . 1 1 35 35 ILE N N 35 121.240 121.240 118.817 2.423 25767 4803 1 6 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.573 -0.031 25767 4804 1 6 . 1 1 35 35 ILE C C 35 178.604 178.604 178.566 0.038 25767 4805 1 6 . 1 1 35 35 ILE CA C 35 65.547 65.547 65.260 0.287 25767 4806 1 6 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.672 1.060 25767 4807 1 6 . 1 1 35 35 ILE H H 35 8.129 8.129 7.697 0.432 25767 4808 1 6 . 1 1 36 36 LEU N N 36 115.637 115.637 118.724 -3.087 25767 4809 1 6 . 1 1 36 36 LEU HA H 36 4.008 4.008 3.990 0.018 25767 4810 1 6 . 1 1 36 36 LEU C C 36 178.001 178.001 177.757 0.244 25767 4811 1 6 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.263 -1.187 25767 4812 1 6 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.290 -1.356 25767 4813 1 6 . 1 1 36 36 LEU H H 36 8.416 8.416 7.911 0.505 25767 4814 1 6 . 1 1 37 37 SER N N 37 114.106 114.106 111.054 3.052 25767 4815 1 6 . 1 1 37 37 SER HA H 37 3.991 3.991 4.214 -0.223 25767 4816 1 6 . 1 1 37 37 SER C C 37 173.997 173.997 175.295 -1.298 25767 4817 1 6 . 1 1 37 37 SER CA C 37 60.311 60.311 58.958 1.353 25767 4818 1 6 . 1 1 37 37 SER CB C 37 63.746 63.746 63.535 0.210 25767 4819 1 6 . 1 1 37 37 SER H H 37 7.517 7.517 7.457 0.060 25767 4820 1 6 . 1 1 38 38 GLU N N 38 123.003 123.003 122.135 0.868 25767 4821 1 6 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.231 0.138 25767 4822 1 6 . 1 1 38 38 GLU C C 38 175.780 175.780 176.224 -0.444 25767 4823 1 6 . 1 1 38 38 GLU CA C 38 55.365 55.365 56.239 -0.874 25767 4824 1 6 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.282 0.011 25767 4825 1 6 . 1 1 38 38 GLU H H 38 7.151 7.151 7.551 -0.400 25767 4826 1 6 . 1 1 39 39 GLU N N 39 126.166 126.166 122.133 4.033 25767 4827 1 6 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.105 -0.096 25767 4828 1 6 . 1 1 39 39 GLU C C 39 176.652 176.652 176.308 0.344 25767 4829 1 6 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.800 1.399 25767 4830 1 6 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.139 -0.104 25767 4831 1 6 . 1 1 39 39 GLU H H 39 8.587 8.587 8.460 0.127 25767 4832 1 6 . 1 1 40 40 ASP N N 40 120.047 120.047 121.092 -1.045 25767 4833 1 6 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.483 0.067 25767 4834 1 6 . 1 1 40 40 ASP C C 40 175.035 175.035 175.828 -0.793 25767 4835 1 6 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.263 -1.895 25767 4836 1 6 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.793 -0.770 25767 4837 1 6 . 1 1 40 40 ASP H H 40 8.504 8.504 8.588 -0.084 25767 4838 1 6 . 1 1 41 41 ARG N N 41 120.671 120.671 123.665 -2.994 25767 4839 1 6 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.597 -0.208 25767 4840 1 6 . 1 1 41 41 ARG C C 41 175.755 175.755 176.052 -0.297 25767 4841 1 6 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.748 0.260 25767 4842 1 6 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.356 -0.807 25767 4843 1 6 . 1 1 41 41 ARG H H 41 7.672 7.672 8.308 -0.636 25767 4844 1 6 . 1 1 42 42 SER N N 42 120.330 120.330 116.931 3.399 25767 4845 1 6 . 1 1 42 42 SER HA H 42 3.837 3.837 4.360 -0.523 25767 4846 1 6 . 1 1 42 42 SER CA C 42 57.326 57.326 58.606 -1.280 25767 4847 1 6 . 1 1 42 42 SER CB C 42 65.762 65.762 63.813 1.949 25767 4848 1 6 . 1 1 42 42 SER H H 42 8.544 8.544 8.371 0.173 25767 4849 1 6 . 1 1 43 43 GLN HA H 43 3.989 3.989 4.008 -0.019 25767 4850 1 6 . 1 1 43 43 GLN C C 43 178.907 178.907 178.062 0.845 25767 4851 1 6 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.965 0.405 25767 4852 1 6 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.686 -0.723 25767 4853 1 6 . 1 1 44 44 GLU N N 44 120.328 120.328 120.082 0.246 25767 4854 1 6 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.975 0.038 25767 4855 1 6 . 1 1 44 44 GLU C C 44 179.824 179.824 178.812 1.012 25767 4856 1 6 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.126 0.919 25767 4857 1 6 . 1 1 44 44 GLU CB C 44 28.648 28.648 28.995 -0.347 25767 4858 1 6 . 1 1 44 44 GLU H H 44 8.938 8.938 8.719 0.219 25767 4859 1 6 . 1 1 45 45 MET N N 45 121.030 121.030 118.813 2.217 25767 4860 1 6 . 1 1 45 45 MET HA H 45 4.412 4.412 4.252 0.160 25767 4861 1 6 . 1 1 45 45 MET C C 45 180.357 180.357 178.217 2.140 25767 4862 1 6 . 1 1 45 45 MET CA C 45 57.209 57.209 57.671 -0.462 25767 4863 1 6 . 1 1 45 45 MET CB C 45 32.436 32.436 32.090 0.346 25767 4864 1 6 . 1 1 45 45 MET H H 45 7.756 7.756 7.864 -0.108 25767 4865 1 6 . 1 1 46 46 THR N N 46 120.008 120.008 116.098 3.910 25767 4866 1 6 . 1 1 46 46 THR HA H 46 4.071 4.071 3.870 0.201 25767 4867 1 6 . 1 1 46 46 THR CA C 46 67.096 67.096 67.416 -0.320 25767 4868 1 6 . 1 1 46 46 THR CB C 46 68.954 68.954 68.482 0.472 25767 4869 1 6 . 1 1 46 46 THR H H 46 8.187 8.187 7.480 0.707 25767 4870 1 6 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.088 0.021 25767 4871 1 6 . 1 1 47 47 ALA C C 47 180.118 180.118 179.181 0.937 25767 4872 1 6 . 1 1 47 47 ALA CA C 47 55.339 55.339 55.059 0.280 25767 4873 1 6 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.303 -0.471 25767 4874 1 6 . 1 1 47 47 ALA H H 47 8.238 8.238 8.003 0.235 25767 4875 1 6 . 1 1 48 48 LEU N N 48 122.093 122.093 119.262 2.831 25767 4876 1 6 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.028 0.235 25767 4877 1 6 . 1 1 48 48 LEU C C 48 179.103 179.103 179.331 -0.228 25767 4878 1 6 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.444 0.296 25767 4879 1 6 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.512 -0.716 25767 4880 1 6 . 1 1 48 48 LEU H H 48 7.778 7.778 7.660 0.118 25767 4881 1 6 . 1 1 49 49 ALA N N 49 120.130 120.130 121.838 -1.708 25767 4882 1 6 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.945 -0.224 25767 4883 1 6 . 1 1 49 49 ALA C C 49 178.676 178.676 179.514 -0.838 25767 4884 1 6 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.369 0.352 25767 4885 1 6 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.050 -0.223 25767 4886 1 6 . 1 1 49 49 ALA H H 49 8.432 8.432 8.344 0.088 25767 4887 1 6 . 1 1 50 50 THR N N 50 113.333 113.333 115.215 -1.882 25767 4888 1 6 . 1 1 50 50 THR HA H 50 3.895 3.895 3.857 0.038 25767 4889 1 6 . 1 1 50 50 THR C C 50 174.948 174.948 176.546 -1.598 25767 4890 1 6 . 1 1 50 50 THR CA C 50 67.334 67.334 67.570 -0.236 25767 4891 1 6 . 1 1 50 50 THR CB C 50 68.864 68.864 68.634 0.230 25767 4892 1 6 . 1 1 50 50 THR H H 50 7.857 7.857 7.843 0.014 25767 4893 1 6 . 1 1 51 51 GLU N N 51 122.698 122.698 122.345 0.353 25767 4894 1 6 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.043 0.025 25767 4895 1 6 . 1 1 51 51 GLU C C 51 179.997 179.997 178.765 1.232 25767 4896 1 6 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.280 0.153 25767 4897 1 6 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.630 -0.113 25767 4898 1 6 . 1 1 51 51 GLU H H 51 7.817 7.817 7.623 0.194 25767 4899 1 6 . 1 1 52 52 LEU N N 52 121.100 121.100 121.314 -0.214 25767 4900 1 6 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.048 0.081 25767 4901 1 6 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.791 0.098 25767 4902 1 6 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.759 0.188 25767 4903 1 6 . 1 1 52 52 LEU H H 52 8.628 8.628 7.952 0.676 25767 4904 1 6 . 1 1 53 53 LEU N N 53 119.935 119.935 119.754 0.181 25767 4905 1 6 . 1 1 53 53 LEU C C 53 179.671 179.671 178.355 1.316 25767 4906 1 6 . 1 1 53 53 LEU H H 53 8.303 8.303 7.899 0.404 25767 4907 1 6 . 1 1 54 54 ASP N N 54 120.339 120.339 118.712 1.627 25767 4908 1 6 . 1 1 54 54 ASP C C 54 179.106 179.106 178.399 0.707 25767 4909 1 6 . 1 1 54 54 ASP H H 54 7.901 7.901 7.910 -0.009 25767 4910 1 6 . 1 1 55 55 THR N N 55 120.237 120.237 116.756 3.481 25767 4911 1 6 . 1 1 55 55 THR HA H 55 3.696 3.696 4.017 -0.321 25767 4912 1 6 . 1 1 55 55 THR CA C 55 67.340 67.340 67.015 0.325 25767 4913 1 6 . 1 1 55 55 THR CB C 55 68.151 68.151 68.582 -0.431 25767 4914 1 6 . 1 1 55 55 THR H H 55 8.262 8.262 7.720 0.542 25767 4915 1 6 . 1 1 56 56 ILE N N 56 123.953 123.953 122.002 1.951 25767 4916 1 6 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.606 0.237 25767 4917 1 6 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.883 0.011 25767 4918 1 6 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.511 0.622 25767 4919 1 6 . 1 1 56 56 ILE H H 56 8.930 8.930 7.647 1.283 25767 4920 1 6 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.430 0.151 25767 4921 1 6 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.162 -0.131 25767 4922 1 6 . 1 1 58 58 ALA C C 58 179.875 179.875 179.371 0.504 25767 4923 1 6 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.736 0.530 25767 4924 1 6 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.368 -0.383 25767 4925 1 6 . 1 1 58 58 ALA H H 58 7.764 7.764 8.495 -0.731 25767 4926 1 6 . 1 1 59 59 PHE N N 59 121.988 121.988 120.165 1.823 25767 4927 1 6 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.148 0.078 25767 4928 1 6 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.376 0.063 25767 4929 1 6 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.332 0.031 25767 4930 1 6 . 1 1 59 59 PHE H H 59 8.159 8.159 8.642 -0.483 25767 4931 1 6 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.878 -0.337 25767 4932 1 6 . 1 1 60 60 LYS C C 60 179.438 179.438 178.785 0.653 25767 4933 1 6 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.575 0.561 25767 4934 1 6 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.439 -0.381 25767 4935 1 6 . 1 1 61 61 LYS N N 61 119.262 119.262 118.044 1.218 25767 4936 1 6 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.183 -0.238 25767 4937 1 6 . 1 1 61 61 LYS C C 61 178.730 178.730 178.232 0.498 25767 4938 1 6 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.500 1.542 25767 4939 1 6 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.060 0.582 25767 4940 1 6 . 1 1 61 61 LYS H H 61 7.832 7.832 7.862 -0.030 25767 4941 1 6 . 1 1 62 62 GLU N N 62 120.790 120.790 120.273 0.517 25767 4942 1 6 . 1 1 62 62 GLU HA H 62 3.935 3.935 3.984 -0.049 25767 4943 1 6 . 1 1 62 62 GLU C C 62 178.424 178.424 178.056 0.368 25767 4944 1 6 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.946 -0.232 25767 4945 1 6 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.262 -0.032 25767 4946 1 6 . 1 1 62 62 GLU H H 62 7.982 7.982 8.097 -0.115 25767 4947 1 6 . 1 1 63 63 ILE N N 63 118.463 118.463 116.668 1.795 25767 4948 1 6 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.797 -0.108 25767 4949 1 6 . 1 1 63 63 ILE C C 63 177.555 177.555 177.272 0.283 25767 4950 1 6 . 1 1 63 63 ILE CA C 63 61.499 61.499 63.093 -1.593 25767 4951 1 6 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.596 -2.072 25767 4952 1 6 . 1 1 63 63 ILE H H 63 7.732 7.732 7.384 0.348 25767 4953 1 6 . 1 1 64 64 GLY N N 64 107.973 107.973 106.872 1.101 25767 4954 1 6 . 1 1 64 64 GLY C C 64 175.271 175.271 175.090 0.181 25767 4955 1 6 . 1 1 64 64 GLY CA C 64 45.902 45.902 45.793 0.109 25767 4956 1 6 . 1 1 64 64 GLY H H 64 7.661 7.661 7.659 0.002 25767 4957 1 6 . 1 1 65 65 GLY N N 65 108.464 108.464 107.454 1.010 25767 4958 1 6 . 1 1 65 65 GLY C C 65 174.800 174.800 175.424 -0.624 25767 4959 1 6 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.292 0.354 25767 4960 1 6 . 1 1 65 65 GLY H H 65 7.808 7.808 8.084 -0.276 25767 4961 1 6 . 1 1 66 66 GLU N N 66 121.162 121.162 121.152 0.010 25767 4962 1 6 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.057 0.048 25767 4963 1 6 . 1 1 66 66 GLU C C 66 177.230 177.230 178.518 -1.288 25767 4964 1 6 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.068 -1.844 25767 4965 1 6 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.585 0.407 25767 4966 1 6 . 1 1 66 66 GLU H H 66 8.203 8.203 7.733 0.470 25767 4967 1 6 . 1 1 67 67 SER N N 67 116.468 116.468 115.913 0.555 25767 4968 1 6 . 1 1 67 67 SER HA H 67 4.249 4.249 4.246 0.003 25767 4969 1 6 . 1 1 67 67 SER C C 67 174.640 174.640 176.530 -1.890 25767 4970 1 6 . 1 1 67 67 SER CA C 67 58.930 58.930 61.080 -2.150 25767 4971 1 6 . 1 1 67 67 SER CB C 67 63.912 63.912 62.939 0.973 25767 4972 1 6 . 1 1 67 67 SER H H 67 8.206 8.206 8.461 -0.255 25767 4973 1 6 . 1 1 68 68 GLU N N 68 122.400 122.400 120.881 1.519 25767 4974 1 6 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.000 0.153 25767 4975 1 6 . 1 1 68 68 GLU C C 68 176.349 176.349 177.275 -0.926 25767 4976 1 6 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.459 -1.637 25767 4977 1 6 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.357 0.625 25767 4978 1 6 . 1 1 68 68 GLU H H 68 8.168 8.168 8.478 -0.310 25767 4979 1 6 . 1 1 69 69 ALA N N 69 124.342 124.342 120.116 4.226 25767 4980 1 6 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.009 0.179 25767 4981 1 6 . 1 1 69 69 ALA C C 69 178.027 178.027 178.186 -0.159 25767 4982 1 6 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.850 -1.292 25767 4983 1 6 . 1 1 69 69 ALA CB C 69 19.492 19.492 18.861 0.631 25767 4984 1 6 . 1 1 69 69 ALA H H 69 7.939 7.939 7.358 0.581 25767 4985 1 6 . 1 1 70 70 GLU N N 70 121.059 121.059 117.947 3.112 25767 4986 1 6 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.431 -0.317 25767 4987 1 6 . 1 1 70 70 GLU C C 70 176.519 176.519 175.331 1.188 25767 4988 1 6 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.255 2.049 25767 4989 1 6 . 1 1 70 70 GLU CB C 70 29.827 29.827 30.560 -0.733 25767 4990 1 6 . 1 1 70 70 GLU H H 70 8.430 8.430 7.566 0.864 25767 4991 1 6 . 1 1 71 71 ASP N N 71 120.274 120.274 123.456 -3.182 25767 4992 1 6 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.298 0.234 25767 4993 1 6 . 1 1 71 71 ASP C C 71 176.369 176.369 176.860 -0.491 25767 4994 1 6 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.273 -1.022 25767 4995 1 6 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.883 0.958 25767 4996 1 6 . 1 1 71 71 ASP H H 71 8.305 8.305 9.075 -0.770 25767 4997 1 6 . 1 1 72 72 SER N N 72 116.165 116.165 113.954 2.211 25767 4998 1 6 . 1 1 72 72 SER HA H 72 4.241 4.241 3.971 0.270 25767 4999 1 6 . 1 1 72 72 SER C C 72 174.567 174.567 175.529 -0.962 25767 5000 1 6 . 1 1 72 72 SER CA C 72 59.031 59.031 61.821 -2.790 25767 5001 1 6 . 1 1 72 72 SER CB C 72 64.040 64.040 63.197 0.843 25767 5002 1 6 . 1 1 72 72 SER H H 72 7.964 7.964 8.221 -0.257 25767 5003 1 6 . 1 1 73 73 ASP N N 73 122.440 122.440 120.389 2.051 25767 5004 1 6 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.046 0.488 25767 5005 1 6 . 1 1 73 73 ASP C C 73 176.882 176.882 177.990 -1.108 25767 5006 1 6 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.269 -2.826 25767 5007 1 6 . 1 1 73 73 ASP CB C 73 41.336 41.336 39.804 1.532 25767 5008 1 6 . 1 1 73 73 ASP H H 73 8.392 8.392 8.666 -0.274 25767 5009 1 6 . 1 1 74 74 LYS N N 74 123.270 123.270 119.021 4.249 25767 5010 1 6 . 1 1 74 74 LYS HA H 74 4.093 4.093 3.996 0.097 25767 5011 1 6 . 1 1 74 74 LYS C C 74 177.608 177.608 179.054 -1.446 25767 5012 1 6 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.396 -1.931 25767 5013 1 6 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.507 -0.361 25767 5014 1 6 . 1 1 74 74 LYS H H 74 8.317 8.317 7.426 0.891 25767 5015 1 6 . 1 1 75 75 SER N N 75 116.557 116.557 116.075 0.482 25767 5016 1 6 . 1 1 75 75 SER HA H 75 4.197 4.197 4.183 0.014 25767 5017 1 6 . 1 1 75 75 SER C C 75 175.988 175.988 176.486 -0.498 25767 5018 1 6 . 1 1 75 75 SER CA C 75 60.434 60.434 61.408 -0.974 25767 5019 1 6 . 1 1 75 75 SER CB C 75 63.172 63.172 62.454 0.718 25767 5020 1 6 . 1 1 75 75 SER H H 75 8.387 8.387 7.840 0.547 25767 5021 1 6 . 1 1 76 76 LEU N N 76 123.910 123.910 122.912 0.998 25767 5022 1 6 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.979 0.191 25767 5023 1 6 . 1 1 76 76 LEU C C 76 178.083 178.083 179.031 -0.948 25767 5024 1 6 . 1 1 76 76 LEU CA C 76 56.492 56.492 58.003 -1.511 25767 5025 1 6 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.465 0.232 25767 5026 1 6 . 1 1 76 76 LEU H H 76 8.059 8.059 8.092 -0.033 25767 5027 1 6 . 1 1 77 77 HIS N N 77 120.620 120.620 118.822 1.798 25767 5028 1 6 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.237 0.051 25767 5029 1 6 . 1 1 77 77 HIS C C 77 177.667 177.667 178.291 -0.624 25767 5030 1 6 . 1 1 77 77 HIS CA C 77 58.422 58.422 58.988 -0.566 25767 5031 1 6 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.903 0.361 25767 5032 1 6 . 1 1 77 77 HIS H H 77 7.936 7.936 8.087 -0.151 25767 5033 1 6 . 1 1 78 78 VAL N N 78 121.774 121.774 119.562 2.212 25767 5034 1 6 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.666 0.011 25767 5035 1 6 . 1 1 78 78 VAL CA C 78 65.606 65.606 67.070 -1.464 25767 5036 1 6 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.590 0.274 25767 5037 1 6 . 1 1 78 78 VAL H H 78 7.916 7.916 7.910 0.006 25767 5038 1 6 . 1 1 79 79 MET N N 79 119.660 119.660 118.689 0.971 25767 5039 1 6 . 1 1 79 79 MET HA H 79 3.925 3.925 4.013 -0.088 25767 5040 1 6 . 1 1 79 79 MET C C 79 177.077 177.077 178.592 -1.515 25767 5041 1 6 . 1 1 79 79 MET CA C 79 58.862 58.862 59.910 -1.048 25767 5042 1 6 . 1 1 79 79 MET CB C 79 32.852 32.852 32.337 0.515 25767 5043 1 6 . 1 1 79 79 MET H H 79 8.149 8.149 8.005 0.144 25767 5044 1 6 . 1 1 80 80 ASN N N 80 117.337 117.337 118.786 -1.449 25767 5045 1 6 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.853 -0.715 25767 5046 1 6 . 1 1 80 80 ASN C C 80 178.133 178.133 178.431 -0.298 25767 5047 1 6 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.243 0.796 25767 5048 1 6 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.642 0.354 25767 5049 1 6 . 1 1 80 80 ASN H H 80 8.202 8.202 8.840 -0.638 25767 5050 1 6 . 1 1 81 81 THR N N 81 115.517 115.517 118.522 -3.005 25767 5051 1 6 . 1 1 81 81 THR HA H 81 3.896 3.896 4.173 -0.277 25767 5052 1 6 . 1 1 81 81 THR C C 81 175.186 175.186 175.892 -0.706 25767 5053 1 6 . 1 1 81 81 THR CA C 81 66.221 66.221 66.711 -0.490 25767 5054 1 6 . 1 1 81 81 THR CB C 81 69.087 69.087 68.637 0.450 25767 5055 1 6 . 1 1 81 81 THR H H 81 7.944 7.944 8.234 -0.290 25767 5056 1 6 . 1 1 82 82 LEU N N 82 119.074 119.074 120.170 -1.096 25767 5057 1 6 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.195 -0.214 25767 5058 1 6 . 1 1 82 82 LEU C C 82 177.583 177.583 178.133 -0.550 25767 5059 1 6 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.321 -0.781 25767 5060 1 6 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.886 -0.093 25767 5061 1 6 . 1 1 82 82 LEU H H 82 7.547 7.547 7.758 -0.211 25767 5062 1 6 . 1 1 83 83 ILE N N 83 118.085 118.085 115.953 2.132 25767 5063 1 6 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.691 0.152 25767 5064 1 6 . 1 1 83 83 ILE C C 83 176.413 176.413 178.789 -2.376 25767 5065 1 6 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.954 -1.227 25767 5066 1 6 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.011 -0.313 25767 5067 1 6 . 1 1 83 83 ILE H H 83 7.409 7.409 7.719 -0.310 25767 5068 1 6 . 1 1 84 84 HIS N N 84 116.152 116.152 116.480 -0.328 25767 5069 1 6 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.532 0.063 25767 5070 1 6 . 1 1 84 84 HIS C C 84 175.707 175.707 175.052 0.655 25767 5071 1 6 . 1 1 84 84 HIS CA C 84 58.628 58.628 58.256 0.372 25767 5072 1 6 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.818 0.585 25767 5073 1 6 . 1 1 84 84 HIS H H 84 7.194 7.194 7.915 -0.721 25767 5074 1 6 . 1 1 85 85 ASP N N 85 122.322 122.322 120.140 2.182 25767 5075 1 6 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.789 -0.255 25767 5076 1 6 . 1 1 85 85 ASP C C 85 175.580 175.580 176.522 -0.942 25767 5077 1 6 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.215 0.130 25767 5078 1 6 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.440 -0.322 25767 5079 1 6 . 1 1 85 85 ASP H H 85 8.505 8.505 7.995 0.510 25767 5080 1 6 . 1 1 86 86 GLN N N 86 122.783 122.783 127.085 -4.302 25767 5081 1 6 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.095 -0.132 25767 5082 1 6 . 1 1 86 86 GLN C C 86 178.581 178.581 177.902 0.679 25767 5083 1 6 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.405 -1.451 25767 5084 1 6 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.216 -0.322 25767 5085 1 6 . 1 1 86 86 GLN H H 86 8.803 8.803 8.796 0.007 25767 5086 1 6 . 1 1 87 87 GLU N N 87 121.794 121.794 118.919 2.875 25767 5087 1 6 . 1 1 87 87 GLU HA H 87 4.013 4.013 4.042 -0.029 25767 5088 1 6 . 1 1 87 87 GLU C C 87 178.290 178.290 178.797 -0.507 25767 5089 1 6 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.440 -0.402 25767 5090 1 6 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.441 -0.461 25767 5091 1 6 . 1 1 87 87 GLU H H 87 8.072 8.072 8.434 -0.362 25767 5092 1 6 . 1 1 88 88 LYS N N 88 119.345 119.345 119.510 -0.165 25767 5093 1 6 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.062 -0.307 25767 5094 1 6 . 1 1 88 88 LYS C C 88 180.040 180.040 178.868 1.172 25767 5095 1 6 . 1 1 88 88 LYS CA C 88 59.411 59.411 59.042 0.369 25767 5096 1 6 . 1 1 88 88 LYS CB C 88 32.007 32.007 32.336 -0.329 25767 5097 1 6 . 1 1 88 88 LYS H H 88 7.588 7.588 7.827 -0.239 25767 5098 1 6 . 1 1 89 89 ALA N N 89 123.933 123.933 122.330 1.603 25767 5099 1 6 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.107 -0.368 25767 5100 1 6 . 1 1 89 89 ALA C C 89 177.457 177.457 179.113 -1.656 25767 5101 1 6 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.178 0.792 25767 5102 1 6 . 1 1 89 89 ALA CB C 89 18.656 18.656 17.796 0.860 25767 5103 1 6 . 1 1 89 89 ALA H H 89 8.500 8.500 7.863 0.637 25767 5104 1 6 . 1 1 90 90 LYS N N 90 119.244 119.244 119.524 -0.280 25767 5105 1 6 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.377 0.667 25767 5106 1 6 . 1 1 90 90 LYS C C 90 177.774 177.774 178.099 -0.325 25767 5107 1 6 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.051 0.027 25767 5108 1 6 . 1 1 90 90 LYS CB C 90 30.241 30.241 31.843 -1.602 25767 5109 1 6 . 1 1 90 90 LYS H H 90 6.845 6.845 7.654 -0.809 25767 5110 1 6 . 1 1 91 91 ILE N N 91 117.718 117.718 120.016 -2.298 25767 5111 1 6 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.637 -0.239 25767 5112 1 6 . 1 1 91 91 ILE C C 91 177.670 177.670 177.019 0.651 25767 5113 1 6 . 1 1 91 91 ILE CA C 91 63.998 63.998 63.906 0.092 25767 5114 1 6 . 1 1 91 91 ILE CB C 91 37.801 37.801 36.933 0.868 25767 5115 1 6 . 1 1 91 91 ILE H H 91 7.293 7.293 7.644 -0.351 25767 5116 1 6 . 1 1 92 92 TYR N N 92 121.868 121.868 121.971 -0.103 25767 5117 1 6 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.074 0.049 25767 5118 1 6 . 1 1 92 92 TYR C C 92 178.781 178.781 177.814 0.967 25767 5119 1 6 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.598 -0.956 25767 5120 1 6 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.610 0.611 25767 5121 1 6 . 1 1 92 92 TYR H H 92 8.016 8.016 7.924 0.092 25767 5122 1 6 . 1 1 93 93 MET N N 93 118.984 118.984 118.569 0.415 25767 5123 1 6 . 1 1 93 93 MET HA H 93 3.952 3.952 4.142 -0.190 25767 5124 1 6 . 1 1 93 93 MET C C 93 179.925 179.925 178.302 1.623 25767 5125 1 6 . 1 1 93 93 MET CA C 93 57.589 57.589 59.422 -1.833 25767 5126 1 6 . 1 1 93 93 MET CB C 93 30.752 30.752 32.770 -2.018 25767 5127 1 6 . 1 1 93 93 MET H H 93 8.464 8.464 8.360 0.104 25767 5128 1 6 . 1 1 94 94 LEU N N 94 125.441 125.441 121.744 3.697 25767 5129 1 6 . 1 1 94 94 LEU HA H 94 3.870 3.870 3.998 -0.128 25767 5130 1 6 . 1 1 94 94 LEU C C 94 177.937 177.937 178.901 -0.964 25767 5131 1 6 . 1 1 94 94 LEU CA C 94 58.761 58.761 57.331 1.430 25767 5132 1 6 . 1 1 94 94 LEU CB C 94 41.762 41.762 40.756 1.006 25767 5133 1 6 . 1 1 94 94 LEU H H 94 8.927 8.927 8.771 0.156 25767 5134 1 6 . 1 1 95 95 ASN N N 95 119.066 119.066 118.111 0.955 25767 5135 1 6 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.352 -0.090 25767 5136 1 6 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.087 0.187 25767 5137 1 6 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.015 -0.410 25767 5138 1 6 . 1 1 95 95 ASN H H 95 8.691 8.691 8.401 0.290 25767 5139 1 6 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.262 0.403 25767 5140 1 6 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.508 0.563 25767 5141 1 6 . 1 1 96 96 PHE H H 96 8.317 8.317 7.833 0.484 25767 5142 1 6 . 1 1 97 97 THR N N 97 118.178 118.178 114.792 3.386 25767 5143 1 6 . 1 1 97 97 THR HA H 97 3.338 3.338 3.806 -0.468 25767 5144 1 6 . 1 1 97 97 THR C C 97 176.074 176.074 176.598 -0.524 25767 5145 1 6 . 1 1 97 97 THR CA C 97 67.986 67.986 66.452 1.534 25767 5146 1 6 . 1 1 97 97 THR H H 97 8.214 8.214 8.489 -0.275 25767 5147 1 6 . 1 1 98 98 MET N N 98 120.097 120.097 121.233 -1.136 25767 5148 1 6 . 1 1 98 98 MET HA H 98 4.403 4.403 4.152 0.251 25767 5149 1 6 . 1 1 98 98 MET C C 98 178.696 178.696 177.754 0.942 25767 5150 1 6 . 1 1 98 98 MET CA C 98 57.029 57.029 58.995 -1.966 25767 5151 1 6 . 1 1 98 98 MET CB C 98 29.898 29.898 32.700 -2.802 25767 5152 1 6 . 1 1 98 98 MET H H 98 8.885 8.885 8.347 0.538 25767 5153 1 6 . 1 1 99 99 SER N N 99 114.959 114.959 116.114 -1.155 25767 5154 1 6 . 1 1 99 99 SER HA H 99 4.199 4.199 4.129 0.070 25767 5155 1 6 . 1 1 99 99 SER C C 99 176.565 176.565 176.574 -0.009 25767 5156 1 6 . 1 1 99 99 SER CA C 99 61.965 61.965 61.655 0.310 25767 5157 1 6 . 1 1 99 99 SER CB C 99 62.565 62.565 62.640 -0.075 25767 5158 1 6 . 1 1 99 99 SER H H 99 7.515 7.515 7.728 -0.213 25767 5159 1 6 . 1 1 100 100 LEU N N 100 125.380 125.380 122.607 2.773 25767 5160 1 6 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.869 -0.093 25767 5161 1 6 . 1 1 100 100 LEU C C 100 177.689 177.689 178.769 -1.080 25767 5162 1 6 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.739 0.318 25767 5163 1 6 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.368 0.182 25767 5164 1 6 . 1 1 100 100 LEU H H 100 7.400 7.400 7.403 -0.003 25767 5165 1 6 . 1 1 101 101 TYR N N 101 120.597 120.597 120.323 0.274 25767 5166 1 6 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.981 0.135 25767 5167 1 6 . 1 1 101 101 TYR C C 101 176.825 176.825 177.705 -0.880 25767 5168 1 6 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.239 -0.351 25767 5169 1 6 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.526 0.467 25767 5170 1 6 . 1 1 101 101 TYR H H 101 8.880 8.880 8.426 0.454 25767 5171 1 6 . 1 1 102 102 ASN N N 102 116.869 116.869 116.593 0.276 25767 5172 1 6 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.306 -0.140 25767 5173 1 6 . 1 1 102 102 ASN C C 102 179.089 179.089 177.596 1.493 25767 5174 1 6 . 1 1 102 102 ASN CA C 102 56.212 56.212 55.966 0.246 25767 5175 1 6 . 1 1 102 102 ASN CB C 102 37.734 37.734 38.147 -0.413 25767 5176 1 6 . 1 1 102 102 ASN H H 102 8.543 8.543 7.929 0.614 25767 5177 1 6 . 1 1 103 103 GLU N N 103 121.259 121.259 120.396 0.863 25767 5178 1 6 . 1 1 103 103 GLU HA H 103 3.986 3.986 4.015 -0.029 25767 5179 1 6 . 1 1 103 103 GLU C C 103 179.968 179.968 179.072 0.896 25767 5180 1 6 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.413 0.104 25767 5181 1 6 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.455 0.095 25767 5182 1 6 . 1 1 103 103 GLU H H 103 7.872 7.872 8.425 -0.553 25767 5183 1 6 . 1 1 104 104 LYS N N 104 120.268 120.268 118.933 1.335 25767 5184 1 6 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.224 -0.178 25767 5185 1 6 . 1 1 104 104 LYS C C 104 178.355 178.355 179.047 -0.692 25767 5186 1 6 . 1 1 104 104 LYS CA C 104 56.735 56.735 58.054 -1.319 25767 5187 1 6 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.004 -2.891 25767 5188 1 6 . 1 1 104 104 LYS H H 104 8.384 8.384 8.167 0.217 25767 5189 1 6 . 1 1 105 105 LEU N N 105 121.622 121.622 121.139 0.483 25767 5190 1 6 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.699 0.042 25767 5191 1 6 . 1 1 105 105 LEU C C 105 180.552 180.552 178.161 2.391 25767 5192 1 6 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.154 0.018 25767 5193 1 6 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.547 -0.517 25767 5194 1 6 . 1 1 105 105 LEU H H 105 8.400 8.400 7.964 0.436 25767 5195 1 6 . 1 1 106 106 LYS N N 106 119.498 119.498 117.877 1.621 25767 5196 1 6 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.829 0.085 25767 5197 1 6 . 1 1 106 106 LYS C C 106 178.419 178.419 178.940 -0.521 25767 5198 1 6 . 1 1 106 106 LYS CA C 106 59.383 59.383 60.055 -0.672 25767 5199 1 6 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.987 -0.179 25767 5200 1 6 . 1 1 106 106 LYS H H 106 7.067 7.067 7.594 -0.527 25767 5201 1 6 . 1 1 107 107 GLN N N 107 121.405 121.405 118.739 2.666 25767 5202 1 6 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.891 -0.040 25767 5203 1 6 . 1 1 107 107 GLN C C 107 177.935 177.935 178.651 -0.716 25767 5204 1 6 . 1 1 107 107 GLN CA C 107 58.481 58.481 59.041 -0.560 25767 5205 1 6 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.563 -1.765 25767 5206 1 6 . 1 1 107 107 GLN H H 107 7.460 7.460 7.636 -0.176 25767 5207 1 6 . 1 1 108 108 LEU N N 108 119.561 119.561 118.668 0.893 25767 5208 1 6 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.679 0.122 25767 5209 1 6 . 1 1 108 108 LEU C C 108 179.195 179.195 178.069 1.126 25767 5210 1 6 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.311 1.082 25767 5211 1 6 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.783 -0.517 25767 5212 1 6 . 1 1 108 108 LEU H H 108 8.208 8.208 7.965 0.243 25767 5213 1 6 . 1 1 109 109 LYS N N 109 118.535 118.535 116.956 1.579 25767 5214 1 6 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.221 0.031 25767 5215 1 6 . 1 1 109 109 LYS C C 109 177.726 177.726 178.078 -0.352 25767 5216 1 6 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.730 -0.000 25767 5217 1 6 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.845 -0.435 25767 5218 1 6 . 1 1 109 109 LYS H H 109 7.168 7.168 7.496 -0.328 25767 5219 1 6 . 1 1 110 110 ASP N N 110 117.463 117.463 116.776 0.687 25767 5220 1 6 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.643 -0.038 25767 5221 1 6 . 1 1 110 110 ASP C C 110 177.360 177.360 176.728 0.632 25767 5222 1 6 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.889 1.007 25767 5223 1 6 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.687 0.890 25767 5224 1 6 . 1 1 110 110 ASP H H 110 7.861 7.861 8.368 -0.507 25767 5225 1 6 . 1 1 111 111 GLY N N 111 113.059 113.059 108.523 4.536 25767 5226 1 6 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.802 -0.750 25767 5227 1 6 . 1 1 111 111 GLY H H 111 8.479 8.479 7.796 0.683 25767 5228 1 6 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.120 0.343 25767 5229 1 6 . 1 1 112 112 PRO C C 112 175.090 175.090 175.591 -0.501 25767 5230 1 6 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.215 -0.851 25767 5231 1 6 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.786 2.064 25767 5232 1 6 . 1 1 113 113 TRP N N 113 123.164 123.164 121.623 1.541 25767 5233 1 6 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.718 -0.008 25767 5234 1 6 . 1 1 113 113 TRP C C 113 174.605 174.605 175.124 -0.519 25767 5235 1 6 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.207 0.698 25767 5236 1 6 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.624 -3.331 25767 5237 1 6 . 1 1 113 113 TRP H H 113 8.687 8.687 8.566 0.121 25767 5238 1 6 . 1 1 114 114 ASP N N 114 121.356 121.356 122.409 -1.053 25767 5239 1 6 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.956 -0.095 25767 5240 1 6 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.697 -0.448 25767 5241 1 6 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.170 -1.029 25767 5242 1 6 . 1 1 114 114 ASP H H 114 6.985 6.985 8.450 -1.465 25767 5243 1 6 . 1 1 115 115 VAL N N 115 118.649 118.649 119.499 -0.850 25767 5244 1 6 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.897 -0.055 25767 5245 1 6 . 1 1 115 115 VAL C C 115 177.739 177.739 177.481 0.258 25767 5246 1 6 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.976 -0.407 25767 5247 1 6 . 1 1 115 115 VAL CB C 115 31.677 31.677 31.956 -0.279 25767 5248 1 6 . 1 1 115 115 VAL H H 115 8.206 8.206 8.498 -0.292 25767 5249 1 6 . 1 1 116 116 MET N N 116 120.401 120.401 118.801 1.600 25767 5250 1 6 . 1 1 116 116 MET HA H 116 4.303 4.303 4.202 0.101 25767 5251 1 6 . 1 1 116 116 MET C C 116 179.269 179.269 178.497 0.772 25767 5252 1 6 . 1 1 116 116 MET CA C 116 57.634 57.634 59.142 -1.508 25767 5253 1 6 . 1 1 116 116 MET CB C 116 30.414 30.414 31.821 -1.407 25767 5254 1 6 . 1 1 116 116 MET H H 116 7.642 7.642 8.078 -0.436 25767 5255 1 6 . 1 1 117 117 LEU N N 117 125.503 125.503 118.957 6.546 25767 5256 1 6 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.037 0.208 25767 5257 1 6 . 1 1 117 117 LEU C C 117 178.445 178.445 179.304 -0.859 25767 5258 1 6 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.484 0.716 25767 5259 1 6 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.201 -1.112 25767 5260 1 6 . 1 1 117 117 LEU H H 117 8.157 8.157 7.514 0.643 25767 5261 1 6 . 1 1 118 118 LYS N N 118 119.052 119.052 119.625 -0.573 25767 5262 1 6 . 1 1 118 118 LYS HA H 118 3.805 3.805 4.029 -0.224 25767 5263 1 6 . 1 1 118 118 LYS C C 118 178.251 178.251 179.383 -1.132 25767 5264 1 6 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.146 0.380 25767 5265 1 6 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.165 -0.037 25767 5266 1 6 . 1 1 118 118 LYS H H 118 7.400 7.400 7.786 -0.386 25767 5267 1 6 . 1 1 119 119 ARG N N 119 117.999 117.999 119.208 -1.209 25767 5268 1 6 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.252 -0.032 25767 5269 1 6 . 1 1 119 119 ARG C C 119 180.441 180.441 179.066 1.375 25767 5270 1 6 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.469 0.348 25767 5271 1 6 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.161 -0.076 25767 5272 1 6 . 1 1 119 119 ARG H H 119 8.265 8.265 8.000 0.265 25767 5273 1 6 . 1 1 120 120 SER N N 120 118.073 118.073 116.281 1.792 25767 5274 1 6 . 1 1 120 120 SER HA H 120 4.182 4.182 4.305 -0.123 25767 5275 1 6 . 1 1 120 120 SER C C 120 176.215 176.215 176.740 -0.525 25767 5276 1 6 . 1 1 120 120 SER CA C 120 62.817 62.817 62.458 0.359 25767 5277 1 6 . 1 1 120 120 SER CB C 120 63.550 63.550 63.107 0.443 25767 5278 1 6 . 1 1 120 120 SER H H 120 8.633 8.633 7.787 0.846 25767 5279 1 6 . 1 1 121 121 LEU N N 121 125.029 125.029 121.853 3.176 25767 5280 1 6 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.064 0.155 25767 5281 1 6 . 1 1 121 121 LEU C C 121 179.679 179.679 178.731 0.948 25767 5282 1 6 . 1 1 121 121 LEU CA C 121 58.849 58.849 58.005 0.844 25767 5283 1 6 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.446 -0.672 25767 5284 1 6 . 1 1 121 121 LEU H H 121 8.313 8.313 7.971 0.342 25767 5285 1 6 . 1 1 122 122 TRP N N 122 120.217 120.217 119.849 0.368 25767 5286 1 6 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.388 -0.048 25767 5287 1 6 . 1 1 122 122 TRP C C 122 177.527 177.527 178.751 -1.224 25767 5288 1 6 . 1 1 122 122 TRP CA C 122 61.758 61.758 61.711 0.047 25767 5289 1 6 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.057 0.591 25767 5290 1 6 . 1 1 122 122 TRP H H 122 7.928 7.928 8.014 -0.086 25767 5291 1 6 . 1 1 123 123 CYS N N 123 119.669 119.669 118.982 0.687 25767 5292 1 6 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.420 -0.213 25767 5293 1 6 . 1 1 123 123 CYS C C 123 177.057 177.057 177.273 -0.216 25767 5294 1 6 . 1 1 123 123 CYS CA C 123 62.600 62.600 62.981 -0.381 25767 5295 1 6 . 1 1 123 123 CYS CB C 123 25.899 25.899 26.426 -0.527 25767 5296 1 6 . 1 1 123 123 CYS H H 123 8.273 8.273 8.217 0.056 25767 5297 1 6 . 1 1 124 124 CYS N N 124 116.898 116.898 119.611 -2.713 25767 5298 1 6 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.136 -0.288 25767 5299 1 6 . 1 1 124 124 CYS C C 124 175.759 175.759 177.022 -1.263 25767 5300 1 6 . 1 1 124 124 CYS CA C 124 65.653 65.653 65.076 0.577 25767 5301 1 6 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.724 -0.207 25767 5302 1 6 . 1 1 124 124 CYS H H 124 8.122 8.122 7.807 0.315 25767 5303 1 6 . 1 1 125 125 ILE N N 125 120.498 120.498 120.991 -0.493 25767 5304 1 6 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.731 -0.143 25767 5305 1 6 . 1 1 125 125 ILE C C 125 179.337 179.337 177.543 1.794 25767 5306 1 6 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.720 1.874 25767 5307 1 6 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.336 0.344 25767 5308 1 6 . 1 1 125 125 ILE H H 125 8.092 8.092 8.173 -0.081 25767 5309 1 6 . 1 1 126 126 ASP N N 126 125.084 125.084 121.382 3.702 25767 5310 1 6 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.521 0.096 25767 5311 1 6 . 1 1 126 126 ASP C C 126 178.299 178.299 178.980 -0.681 25767 5312 1 6 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.431 1.573 25767 5313 1 6 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.214 0.083 25767 5314 1 6 . 1 1 126 126 ASP H H 126 9.049 9.049 8.242 0.807 25767 5315 1 6 . 1 1 127 127 LEU N N 127 122.591 122.591 120.524 2.067 25767 5316 1 6 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.848 0.019 25767 5317 1 6 . 1 1 127 127 LEU C C 127 179.655 179.655 178.589 1.066 25767 5318 1 6 . 1 1 127 127 LEU CA C 127 58.661 58.661 58.343 0.318 25767 5319 1 6 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.639 0.555 25767 5320 1 6 . 1 1 127 127 LEU H H 127 8.888 8.888 7.709 1.179 25767 5321 1 6 . 1 1 128 128 PHE N N 128 117.498 117.498 118.797 -1.299 25767 5322 1 6 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.067 0.255 25767 5323 1 6 . 1 1 128 128 PHE C C 128 178.533 178.533 177.860 0.673 25767 5324 1 6 . 1 1 128 128 PHE CA C 128 60.932 60.932 62.549 -1.617 25767 5325 1 6 . 1 1 128 128 PHE CB C 128 39.053 39.053 38.633 0.420 25767 5326 1 6 . 1 1 128 128 PHE H H 128 8.947 8.947 8.118 0.829 25767 5327 1 6 . 1 1 129 129 SER N N 129 115.398 115.398 115.756 -0.358 25767 5328 1 6 . 1 1 129 129 SER HA H 129 4.046 4.046 4.254 -0.208 25767 5329 1 6 . 1 1 129 129 SER C C 129 175.168 175.168 176.796 -1.628 25767 5330 1 6 . 1 1 129 129 SER CA C 129 63.015 63.015 61.539 1.476 25767 5331 1 6 . 1 1 129 129 SER H H 129 8.578 8.578 8.964 -0.386 25767 5332 1 6 . 1 1 130 130 CYS N N 130 125.556 125.556 121.333 4.223 25767 5333 1 6 . 1 1 130 130 CYS HA H 130 4.109 4.109 3.740 0.369 25767 5334 1 6 . 1 1 130 130 CYS C C 130 175.294 175.294 176.566 -1.272 25767 5335 1 6 . 1 1 130 130 CYS CA C 130 61.438 61.438 62.100 -0.662 25767 5336 1 6 . 1 1 130 130 CYS CB C 130 27.050 27.050 26.870 0.180 25767 5337 1 6 . 1 1 130 130 CYS H H 130 8.289 8.289 7.826 0.463 25767 5338 1 6 . 1 1 131 131 ILE N N 131 120.232 120.232 121.611 -1.379 25767 5339 1 6 . 1 1 131 131 ILE HA H 131 4.033 4.033 4.085 -0.052 25767 5340 1 6 . 1 1 131 131 ILE C C 131 177.297 177.297 178.317 -1.020 25767 5341 1 6 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.557 -0.905 25767 5342 1 6 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.793 1.309 25767 5343 1 6 . 1 1 131 131 ILE H H 131 7.943 7.943 8.152 -0.209 25767 5344 1 6 . 1 1 132 132 LEU N N 132 116.422 116.422 120.774 -4.352 25767 5345 1 6 . 1 1 132 132 LEU HA H 132 3.845 3.845 4.015 -0.170 25767 5346 1 6 . 1 1 132 132 LEU C C 132 177.816 177.816 178.264 -0.448 25767 5347 1 6 . 1 1 132 132 LEU CA C 132 57.078 57.078 58.377 -1.299 25767 5348 1 6 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.793 0.420 25767 5349 1 6 . 1 1 132 132 LEU H H 132 7.846 7.846 8.474 -0.628 25767 5350 1 6 . 1 1 133 133 HIS N N 133 116.929 116.929 117.649 -0.720 25767 5351 1 6 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.404 -0.265 25767 5352 1 6 . 1 1 133 133 HIS C C 133 178.669 178.669 178.257 0.412 25767 5353 1 6 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.604 0.132 25767 5354 1 6 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.477 2.675 25767 5355 1 6 . 1 1 133 133 HIS H H 133 7.822 7.822 8.060 -0.238 25767 5356 1 6 . 1 1 134 134 LEU N N 134 116.898 116.898 122.273 -5.375 25767 5357 1 6 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.184 -0.451 25767 5358 1 6 . 1 1 134 134 LEU C C 134 179.402 179.402 178.559 0.843 25767 5359 1 6 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.838 -0.611 25767 5360 1 6 . 1 1 134 134 LEU CB C 134 39.539 39.539 41.952 -2.413 25767 5361 1 6 . 1 1 134 134 LEU H H 134 8.688 8.688 8.086 0.602 25767 5362 1 6 . 1 1 135 135 TRP N N 135 115.602 115.602 116.545 -0.943 25767 5363 1 6 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.675 0.333 25767 5364 1 6 . 1 1 135 135 TRP C C 135 175.022 175.022 177.545 -2.523 25767 5365 1 6 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.056 1.369 25767 5366 1 6 . 1 1 135 135 TRP CB C 135 27.085 27.085 28.989 -1.904 25767 5367 1 6 . 1 1 135 135 TRP H H 135 7.638 7.638 8.482 -0.844 25767 5368 1 6 . 1 1 136 136 LYS N N 136 119.721 119.721 122.287 -2.566 25767 5369 1 6 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.982 -0.166 25767 5370 1 6 . 1 1 136 136 LYS C C 136 178.279 178.279 178.471 -0.192 25767 5371 1 6 . 1 1 136 136 LYS CA C 136 60.193 60.193 60.201 -0.008 25767 5372 1 6 . 1 1 136 136 LYS CB C 136 33.057 33.057 32.089 0.968 25767 5373 1 6 . 1 1 136 136 LYS H H 136 6.538 6.538 7.536 -0.998 25767 5374 1 6 . 1 1 137 137 GLU N N 137 115.407 115.407 115.128 0.279 25767 5375 1 6 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.187 -0.020 25767 5376 1 6 . 1 1 137 137 GLU C C 137 176.700 176.700 177.251 -0.551 25767 5377 1 6 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.366 -0.516 25767 5378 1 6 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.079 0.081 25767 5379 1 6 . 1 1 137 137 GLU H H 137 8.596 8.596 8.399 0.197 25767 5380 1 6 . 1 1 138 138 ASN N N 138 116.669 116.669 116.986 -0.317 25767 5381 1 6 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.797 0.109 25767 5382 1 6 . 1 1 138 138 ASN C C 138 173.481 173.481 174.970 -1.489 25767 5383 1 6 . 1 1 138 138 ASN CA C 138 52.814 52.814 54.114 -1.300 25767 5384 1 6 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.761 1.076 25767 5385 1 6 . 1 1 138 138 ASN H H 138 8.343 8.343 8.185 0.158 25767 5386 1 6 . 1 1 139 139 ILE N N 139 120.703 120.703 120.480 0.223 25767 5387 1 6 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.264 0.080 25767 5388 1 6 . 1 1 139 139 ILE C C 139 175.241 175.241 174.691 0.550 25767 5389 1 6 . 1 1 139 139 ILE CA C 139 60.792 60.792 60.396 0.396 25767 5390 1 6 . 1 1 139 139 ILE CB C 139 40.274 40.274 40.791 -0.517 25767 5391 1 6 . 1 1 139 139 ILE H H 139 7.167 7.167 7.449 -0.282 25767 5392 1 6 . 1 1 140 140 SER N N 140 123.284 123.284 121.012 2.272 25767 5393 1 6 . 1 1 140 140 SER HA H 140 4.345 4.345 4.577 -0.232 25767 5394 1 6 . 1 1 140 140 SER CA C 140 58.095 58.095 57.710 0.385 25767 5395 1 6 . 1 1 140 140 SER CB C 140 65.370 65.370 64.665 0.705 25767 5396 1 6 . 1 1 140 140 SER H H 140 8.727 8.727 8.575 0.152 25767 5397 1 6 . 1 1 142 142 THR N N 142 113.868 113.868 115.012 -1.144 25767 5398 1 6 . 1 1 142 142 THR HA H 142 3.976 3.976 4.152 -0.176 25767 5399 1 6 . 1 1 142 142 THR C C 142 177.559 177.559 176.530 1.029 25767 5400 1 6 . 1 1 142 142 THR CA C 142 66.007 66.007 66.103 -0.096 25767 5401 1 6 . 1 1 142 142 THR CB C 142 68.530 68.530 68.255 0.275 25767 5402 1 6 . 1 1 142 142 THR H H 142 8.243 8.243 8.098 0.145 25767 5403 1 6 . 1 1 143 143 SER N N 143 120.786 120.786 117.565 3.221 25767 5404 1 6 . 1 1 143 143 SER C C 143 175.844 175.844 176.713 -0.869 25767 5405 1 6 . 1 1 143 143 SER CA C 143 62.102 62.102 61.855 0.247 25767 5406 1 6 . 1 1 143 143 SER CB C 143 63.086 63.086 62.166 0.920 25767 5407 1 6 . 1 1 143 143 SER H H 143 7.915 7.915 8.541 -0.626 25767 5408 1 6 . 1 1 144 144 THR N N 144 120.946 120.946 119.231 1.715 25767 5409 1 6 . 1 1 144 144 THR HA H 144 4.299 4.299 3.993 0.306 25767 5410 1 6 . 1 1 144 144 THR C C 144 175.874 175.874 175.956 -0.082 25767 5411 1 6 . 1 1 144 144 THR CA C 144 67.487 67.487 67.210 0.277 25767 5412 1 6 . 1 1 144 144 THR CB C 144 68.485 68.485 68.282 0.203 25767 5413 1 6 . 1 1 144 144 THR H H 144 8.746 8.746 8.394 0.352 25767 5414 1 6 . 1 1 145 145 ASN N N 145 120.069 120.069 119.659 0.410 25767 5415 1 6 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.411 -0.103 25767 5416 1 6 . 1 1 145 145 ASN C C 145 177.917 177.917 177.488 0.429 25767 5417 1 6 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.624 -0.287 25767 5418 1 6 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.480 -0.380 25767 5419 1 6 . 1 1 145 145 ASN H H 145 7.940 7.940 7.815 0.125 25767 5420 1 6 . 1 1 146 146 SER N N 146 116.905 116.905 116.710 0.195 25767 5421 1 6 . 1 1 146 146 SER HA H 146 3.936 3.936 4.187 -0.251 25767 5422 1 6 . 1 1 146 146 SER C C 146 176.963 176.963 176.800 0.163 25767 5423 1 6 . 1 1 146 146 SER CA C 146 61.997 61.997 61.955 0.042 25767 5424 1 6 . 1 1 146 146 SER CB C 146 62.879 62.879 62.986 -0.107 25767 5425 1 6 . 1 1 146 146 SER H H 146 7.951 7.951 7.623 0.328 25767 5426 1 6 . 1 1 147 147 LEU N N 147 123.253 123.253 121.782 1.471 25767 5427 1 6 . 1 1 147 147 LEU HA H 147 3.875 3.875 3.909 -0.034 25767 5428 1 6 . 1 1 147 147 LEU C C 147 178.726 178.726 179.184 -0.458 25767 5429 1 6 . 1 1 147 147 LEU CA C 147 58.580 58.580 57.808 0.772 25767 5430 1 6 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.711 -0.851 25767 5431 1 6 . 1 1 147 147 LEU H H 147 8.168 8.168 7.807 0.361 25767 5432 1 6 . 1 1 148 148 GLN N N 148 118.212 118.212 118.070 0.142 25767 5433 1 6 . 1 1 148 148 GLN HA H 148 3.817 3.817 4.039 -0.222 25767 5434 1 6 . 1 1 148 148 GLN C C 148 179.686 179.686 178.167 1.519 25767 5435 1 6 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.546 0.697 25767 5436 1 6 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.886 -0.166 25767 5437 1 6 . 1 1 148 148 GLN H H 148 8.295 8.295 8.816 -0.521 25767 5438 1 6 . 1 1 149 149 LYS N N 149 120.770 120.770 120.695 0.075 25767 5439 1 6 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.914 -0.013 25767 5440 1 6 . 1 1 149 149 LYS C C 149 178.006 178.006 178.859 -0.853 25767 5441 1 6 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.595 -0.063 25767 5442 1 6 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.350 -0.458 25767 5443 1 6 . 1 1 149 149 LYS H H 149 7.955 7.955 8.341 -0.386 25767 5444 1 6 . 1 1 150 150 ARG N N 150 119.244 119.244 117.830 1.414 25767 5445 1 6 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.943 -0.103 25767 5446 1 6 . 1 1 150 150 ARG C C 150 178.858 178.858 178.887 -0.029 25767 5447 1 6 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.288 0.083 25767 5448 1 6 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.892 -1.087 25767 5449 1 6 . 1 1 150 150 ARG H H 150 7.020 7.020 7.552 -0.532 25767 5450 1 6 . 1 1 151 151 ILE N N 151 121.183 121.183 120.167 1.016 25767 5451 1 6 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.531 -0.172 25767 5452 1 6 . 1 1 151 151 ILE C C 151 177.327 177.327 177.485 -0.158 25767 5453 1 6 . 1 1 151 151 ILE CA C 151 67.196 67.196 65.162 2.034 25767 5454 1 6 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.481 0.791 25767 5455 1 6 . 1 1 151 151 ILE H H 151 7.574 7.574 7.685 -0.111 25767 5456 1 6 . 1 1 152 152 LYS N N 152 119.521 119.521 120.828 -1.307 25767 5457 1 6 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.868 -0.095 25767 5458 1 6 . 1 1 152 152 LYS C C 152 178.016 178.016 178.541 -0.525 25767 5459 1 6 . 1 1 152 152 LYS CA C 152 59.830 59.830 59.949 -0.119 25767 5460 1 6 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.224 -0.643 25767 5461 1 6 . 1 1 152 152 LYS H H 152 7.629 7.629 8.158 -0.529 25767 5462 1 6 . 1 1 153 153 TYR N N 153 120.178 120.178 120.384 -0.206 25767 5463 1 6 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.175 -0.103 25767 5464 1 6 . 1 1 153 153 TYR C C 153 178.195 178.195 177.998 0.197 25767 5465 1 6 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.798 -0.482 25767 5466 1 6 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.429 -1.156 25767 5467 1 6 . 1 1 153 153 TYR H H 153 8.407 8.407 7.799 0.608 25767 5468 1 6 . 1 1 154 154 CYS N N 154 117.013 117.013 117.821 -0.808 25767 5469 1 6 . 1 1 154 154 CYS HA H 154 4.072 4.072 3.847 0.225 25767 5470 1 6 . 1 1 154 154 CYS C C 154 176.827 176.827 176.661 0.166 25767 5471 1 6 . 1 1 154 154 CYS CA C 154 65.780 65.780 64.520 1.260 25767 5472 1 6 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.786 0.374 25767 5473 1 6 . 1 1 154 154 CYS H H 154 8.291 8.291 7.826 0.465 25767 5474 1 6 . 1 1 155 155 LYS N N 155 118.753 118.753 120.349 -1.596 25767 5475 1 6 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.764 -0.093 25767 5476 1 6 . 1 1 155 155 LYS C C 155 179.904 179.904 178.831 1.073 25767 5477 1 6 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.549 0.935 25767 5478 1 6 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.209 -0.266 25767 5479 1 6 . 1 1 155 155 LYS H H 155 7.934 7.934 8.130 -0.196 25767 5480 1 6 . 1 1 156 156 ILE N N 156 123.873 123.873 120.701 3.172 25767 5481 1 6 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.607 -0.023 25767 5482 1 6 . 1 1 156 156 ILE C C 156 179.501 179.501 177.903 1.598 25767 5483 1 6 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.588 -0.349 25767 5484 1 6 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.857 -0.215 25767 5485 1 6 . 1 1 156 156 ILE H H 156 8.314 8.314 8.531 -0.217 25767 5486 1 6 . 1 1 157 157 TYR N N 157 121.132 121.132 118.939 2.193 25767 5487 1 6 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.958 0.207 25767 5488 1 6 . 1 1 157 157 TYR C C 157 178.558 178.558 177.968 0.590 25767 5489 1 6 . 1 1 157 157 TYR CA C 157 62.110 62.110 62.541 -0.431 25767 5490 1 6 . 1 1 157 157 TYR H H 157 8.442 8.442 7.547 0.895 25767 5491 1 6 . 1 1 158 158 LEU N N 158 120.964 120.964 118.844 2.120 25767 5492 1 6 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.792 0.120 25767 5493 1 6 . 1 1 158 158 LEU C C 158 180.130 180.130 179.026 1.104 25767 5494 1 6 . 1 1 158 158 LEU CA C 158 58.686 58.686 58.097 0.589 25767 5495 1 6 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.278 0.452 25767 5496 1 6 . 1 1 158 158 LEU H H 158 8.469 8.469 7.784 0.685 25767 5497 1 6 . 1 1 159 159 SER N N 159 116.653 116.653 115.677 0.976 25767 5498 1 6 . 1 1 159 159 SER HA H 159 4.246 4.246 4.093 0.153 25767 5499 1 6 . 1 1 159 159 SER CA C 159 61.460 61.460 62.071 -0.611 25767 5500 1 6 . 1 1 159 159 SER CB C 159 62.849 62.849 62.852 -0.003 25767 5501 1 6 . 1 1 159 159 SER H H 159 7.758 7.758 8.135 -0.377 25767 5502 1 6 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.416 -2.043 25767 5503 1 6 . 1 1 160 160 LYS CB C 160 29.832 29.832 32.169 -2.337 25767 5504 1 6 . 1 1 160 160 LYS H H 160 8.425 8.425 7.535 0.890 25767 5505 1 6 . 1 1 161 161 LEU N N 161 121.686 121.686 119.063 2.623 25767 5506 1 6 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.957 0.206 25767 5507 1 6 . 1 1 161 161 LEU C C 161 180.224 180.224 179.225 0.999 25767 5508 1 6 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.466 0.118 25767 5509 1 6 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.705 -0.243 25767 5510 1 6 . 1 1 161 161 LEU H H 161 8.323 8.323 7.883 0.440 25767 5511 1 6 . 1 1 162 162 ALA N N 162 123.102 123.102 121.031 2.071 25767 5512 1 6 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.106 0.024 25767 5513 1 6 . 1 1 162 162 ALA C C 162 179.487 179.487 179.117 0.370 25767 5514 1 6 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.686 0.058 25767 5515 1 6 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.539 -0.136 25767 5516 1 6 . 1 1 162 162 ALA H H 162 7.978 7.978 7.685 0.293 25767 5517 1 6 . 1 1 163 163 LYS N N 163 116.069 116.069 116.436 -0.367 25767 5518 1 6 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.290 -0.067 25767 5519 1 6 . 1 1 163 163 LYS C C 163 176.987 176.987 176.512 0.475 25767 5520 1 6 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.192 0.414 25767 5521 1 6 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.687 0.519 25767 5522 1 6 . 1 1 163 163 LYS H H 163 7.697 7.697 7.759 -0.062 25767 5523 1 6 . 1 1 164 164 GLY N N 164 108.540 108.540 106.973 1.567 25767 5524 1 6 . 1 1 164 164 GLY C C 164 174.721 174.721 174.315 0.406 25767 5525 1 6 . 1 1 164 164 GLY CA C 164 45.791 45.791 45.022 0.769 25767 5526 1 6 . 1 1 164 164 GLY H H 164 7.772 7.772 7.520 0.252 25767 5527 1 6 . 1 1 165 165 GLU N N 165 119.886 119.886 120.109 -0.223 25767 5528 1 6 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.414 -0.364 25767 5529 1 6 . 1 1 165 165 GLU C C 165 176.027 176.027 175.011 1.016 25767 5530 1 6 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.038 1.815 25767 5531 1 6 . 1 1 165 165 GLU CB C 165 30.338 30.338 31.126 -0.788 25767 5532 1 6 . 1 1 165 165 GLU H H 165 8.065 8.065 8.238 -0.173 25767 5533 1 6 . 1 1 166 166 ILE N N 166 117.926 117.926 120.428 -2.502 25767 5534 1 6 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.897 0.005 25767 5535 1 6 . 1 1 166 166 ILE C C 166 174.138 174.138 176.759 -2.621 25767 5536 1 6 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.394 2.061 25767 5537 1 6 . 1 1 166 166 ILE CB C 166 40.202 40.202 38.608 1.594 25767 5538 1 6 . 1 1 166 166 ILE H H 166 7.282 7.282 8.132 -0.850 25767 5539 1 7 . 1 1 2 2 ALA N N 2 122.811 122.811 123.802 -0.991 25767 5540 1 7 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.013 0.010 25767 5541 1 7 . 1 1 2 2 ALA C C 2 179.915 179.915 178.809 1.106 25767 5542 1 7 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.486 -0.369 25767 5543 1 7 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.119 0.420 25767 5544 1 7 . 1 1 2 2 ALA H H 2 8.509 8.509 8.906 -0.397 25767 5545 1 7 . 1 1 3 3 SER N N 3 115.308 115.308 113.924 1.384 25767 5546 1 7 . 1 1 3 3 SER HA H 3 4.097 4.097 4.209 -0.112 25767 5547 1 7 . 1 1 3 3 SER C C 3 176.706 176.706 176.412 0.294 25767 5548 1 7 . 1 1 3 3 SER CA C 3 60.665 60.665 61.197 -0.532 25767 5549 1 7 . 1 1 3 3 SER CB C 3 62.710 62.710 62.094 0.616 25767 5550 1 7 . 1 1 3 3 SER H H 3 7.996 7.996 8.552 -0.556 25767 5551 1 7 . 1 1 4 4 ASN N N 4 122.688 122.688 120.534 2.154 25767 5552 1 7 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.449 -0.145 25767 5553 1 7 . 1 1 4 4 ASN C C 4 176.258 176.258 177.359 -1.101 25767 5554 1 7 . 1 1 4 4 ASN CA C 4 55.701 55.701 55.877 -0.176 25767 5555 1 7 . 1 1 4 4 ASN CB C 4 38.177 38.177 38.078 0.099 25767 5556 1 7 . 1 1 4 4 ASN H H 4 8.075 8.075 8.306 -0.231 25767 5557 1 7 . 1 1 5 5 ALA N N 5 121.900 121.900 122.842 -0.942 25767 5558 1 7 . 1 1 5 5 ALA HA H 5 3.575 3.575 3.992 -0.417 25767 5559 1 7 . 1 1 5 5 ALA C C 5 178.475 178.475 178.900 -0.425 25767 5560 1 7 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.993 0.840 25767 5561 1 7 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.370 -0.755 25767 5562 1 7 . 1 1 5 5 ALA H H 5 8.659 8.659 7.670 0.989 25767 5563 1 7 . 1 1 6 6 ALA N N 6 117.768 117.768 121.678 -3.910 25767 5564 1 7 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.969 -0.182 25767 5565 1 7 . 1 1 6 6 ALA C C 6 180.494 180.494 179.397 1.097 25767 5566 1 7 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.122 0.228 25767 5567 1 7 . 1 1 6 6 ALA CB C 6 17.902 17.902 17.974 -0.072 25767 5568 1 7 . 1 1 6 6 ALA H H 6 7.864 7.864 7.710 0.154 25767 5569 1 7 . 1 1 7 7 ARG N N 7 121.173 121.173 119.270 1.903 25767 5570 1 7 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.097 -0.194 25767 5571 1 7 . 1 1 7 7 ARG C C 7 179.189 179.189 178.663 0.526 25767 5572 1 7 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.856 0.456 25767 5573 1 7 . 1 1 7 7 ARG CB C 7 29.222 29.222 30.000 -0.778 25767 5574 1 7 . 1 1 7 7 ARG H H 7 7.514 7.514 7.995 -0.481 25767 5575 1 7 . 1 1 8 8 VAL N N 8 122.979 122.979 119.935 3.044 25767 5576 1 7 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.728 -0.475 25767 5577 1 7 . 1 1 8 8 VAL C C 8 177.821 177.821 178.278 -0.457 25767 5578 1 7 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.585 1.187 25767 5579 1 7 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.203 0.238 25767 5580 1 7 . 1 1 8 8 VAL H H 8 8.101 8.101 7.710 0.391 25767 5581 1 7 . 1 1 9 9 VAL N N 9 119.801 119.801 120.740 -0.939 25767 5582 1 7 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.657 -0.391 25767 5583 1 7 . 1 1 9 9 VAL C C 9 177.373 177.373 177.826 -0.453 25767 5584 1 7 . 1 1 9 9 VAL CA C 9 67.484 67.484 66.412 1.072 25767 5585 1 7 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.770 0.855 25767 5586 1 7 . 1 1 9 9 VAL H H 9 8.362 8.362 8.030 0.332 25767 5587 1 7 . 1 1 10 10 ALA N N 10 122.360 122.360 121.324 1.036 25767 5588 1 7 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.072 -0.136 25767 5589 1 7 . 1 1 10 10 ALA C C 10 180.762 180.762 179.834 0.928 25767 5590 1 7 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.552 -0.108 25767 5591 1 7 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.116 -0.379 25767 5592 1 7 . 1 1 10 10 ALA H H 10 7.776 7.776 7.772 0.004 25767 5593 1 7 . 1 1 11 11 THR N N 11 117.376 117.376 114.514 2.862 25767 5594 1 7 . 1 1 11 11 THR HA H 11 3.816 3.816 4.176 -0.360 25767 5595 1 7 . 1 1 11 11 THR C C 11 175.775 175.775 176.306 -0.531 25767 5596 1 7 . 1 1 11 11 THR CA C 11 66.509 66.509 65.752 0.757 25767 5597 1 7 . 1 1 11 11 THR CB C 11 68.588 68.588 68.722 -0.134 25767 5598 1 7 . 1 1 11 11 THR H H 11 8.180 8.180 7.696 0.484 25767 5599 1 7 . 1 1 12 12 ALA N N 12 125.308 125.308 124.563 0.745 25767 5600 1 7 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.733 0.264 25767 5601 1 7 . 1 1 12 12 ALA C C 12 179.399 179.399 179.349 0.050 25767 5602 1 7 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.596 0.480 25767 5603 1 7 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.125 1.119 25767 5604 1 7 . 1 1 12 12 ALA H H 12 8.671 8.671 8.590 0.081 25767 5605 1 7 . 1 1 13 13 LYS N N 13 116.977 116.977 117.916 -0.939 25767 5606 1 7 . 1 1 13 13 LYS C C 13 179.646 179.646 178.744 0.902 25767 5607 1 7 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.804 -0.883 25767 5608 1 7 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.218 -0.775 25767 5609 1 7 . 1 1 13 13 LYS H H 13 8.061 8.061 7.754 0.307 25767 5610 1 7 . 1 1 14 14 ASP N N 14 121.988 121.988 120.284 1.704 25767 5611 1 7 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.478 -0.125 25767 5612 1 7 . 1 1 14 14 ASP C C 14 179.446 179.446 178.729 0.717 25767 5613 1 7 . 1 1 14 14 ASP CA C 14 57.509 57.509 57.053 0.456 25767 5614 1 7 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.659 -0.658 25767 5615 1 7 . 1 1 14 14 ASP H H 14 7.669 7.669 7.696 -0.027 25767 5616 1 7 . 1 1 15 15 PHE N N 15 119.588 119.588 118.285 1.303 25767 5617 1 7 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.217 0.127 25767 5618 1 7 . 1 1 15 15 PHE C C 15 178.373 178.373 178.006 0.367 25767 5619 1 7 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.380 0.856 25767 5620 1 7 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.692 -1.196 25767 5621 1 7 . 1 1 15 15 PHE H H 15 7.913 7.913 8.731 -0.818 25767 5622 1 7 . 1 1 16 16 ASP N N 16 121.705 121.705 119.665 2.040 25767 5623 1 7 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.600 -0.605 25767 5624 1 7 . 1 1 16 16 ASP C C 16 180.071 180.071 179.483 0.588 25767 5625 1 7 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.303 0.846 25767 5626 1 7 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.741 0.746 25767 5627 1 7 . 1 1 16 16 ASP H H 16 8.324 8.324 8.094 0.230 25767 5628 1 7 . 1 1 17 17 LYS N N 17 118.825 118.825 119.570 -0.745 25767 5629 1 7 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.138 -0.101 25767 5630 1 7 . 1 1 17 17 LYS C C 17 178.407 178.407 178.029 0.378 25767 5631 1 7 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.774 0.287 25767 5632 1 7 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.590 -0.006 25767 5633 1 7 . 1 1 17 17 LYS H H 17 7.834 7.834 7.763 0.071 25767 5634 1 7 . 1 1 18 18 VAL N N 18 110.562 110.562 117.569 -7.007 25767 5635 1 7 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.035 0.481 25767 5636 1 7 . 1 1 18 18 VAL C C 18 176.144 176.144 176.585 -0.441 25767 5637 1 7 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.122 -2.248 25767 5638 1 7 . 1 1 18 18 VAL CB C 18 31.160 31.160 31.741 -0.581 25767 5639 1 7 . 1 1 18 18 VAL H H 18 7.185 7.185 7.569 -0.384 25767 5640 1 7 . 1 1 19 19 GLY N N 19 109.272 109.272 107.821 1.451 25767 5641 1 7 . 1 1 19 19 GLY C C 19 175.043 175.043 174.915 0.128 25767 5642 1 7 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.755 0.076 25767 5643 1 7 . 1 1 19 19 GLY H H 19 7.723 7.723 7.974 -0.251 25767 5644 1 7 . 1 1 20 20 LEU N N 20 125.428 125.428 120.909 4.519 25767 5645 1 7 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.697 -0.377 25767 5646 1 7 . 1 1 20 20 LEU C C 20 177.949 177.949 177.774 0.175 25767 5647 1 7 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.602 -0.798 25767 5648 1 7 . 1 1 20 20 LEU CB C 20 39.917 39.917 40.362 -0.445 25767 5649 1 7 . 1 1 20 20 LEU H H 20 8.083 8.083 8.041 0.042 25767 5650 1 7 . 1 1 21 21 GLY N N 21 107.804 107.804 110.324 -2.520 25767 5651 1 7 . 1 1 21 21 GLY C C 21 176.278 176.278 176.220 0.058 25767 5652 1 7 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.712 -0.418 25767 5653 1 7 . 1 1 21 21 GLY H H 21 7.982 7.982 8.849 -0.867 25767 5654 1 7 . 1 1 22 22 ILE N N 22 121.319 121.319 121.724 -0.405 25767 5655 1 7 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.856 0.054 25767 5656 1 7 . 1 1 22 22 ILE C C 22 176.604 176.604 177.759 -1.155 25767 5657 1 7 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.143 -1.697 25767 5658 1 7 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.689 -1.123 25767 5659 1 7 . 1 1 22 22 ILE H H 22 8.478 8.478 7.911 0.567 25767 5660 1 7 . 1 1 23 23 ILE N N 23 120.377 120.377 120.029 0.348 25767 5661 1 7 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.810 -0.097 25767 5662 1 7 . 1 1 23 23 ILE C C 23 178.581 178.581 178.325 0.256 25767 5663 1 7 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.313 0.933 25767 5664 1 7 . 1 1 23 23 ILE CB C 23 36.199 36.199 36.183 0.016 25767 5665 1 7 . 1 1 23 23 ILE H H 23 6.869 6.869 7.946 -1.077 25767 5666 1 7 . 1 1 24 24 GLY N N 24 103.449 103.449 108.048 -4.599 25767 5667 1 7 . 1 1 24 24 GLY C C 24 175.308 175.308 175.761 -0.453 25767 5668 1 7 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.108 0.835 25767 5669 1 7 . 1 1 24 24 GLY H H 24 7.488 7.488 8.108 -0.621 25767 5670 1 7 . 1 1 25 25 TYR N N 25 124.685 124.685 123.610 1.075 25767 5671 1 7 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.712 -0.046 25767 5672 1 7 . 1 1 25 25 TYR C C 25 176.208 176.208 176.741 -0.533 25767 5673 1 7 . 1 1 25 25 TYR CA C 25 61.371 61.371 61.599 -0.229 25767 5674 1 7 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.571 -0.304 25767 5675 1 7 . 1 1 25 25 TYR H H 25 7.931 7.931 8.065 -0.134 25767 5676 1 7 . 1 1 26 26 TYR N N 26 117.001 117.001 120.045 -3.044 25767 5677 1 7 . 1 1 26 26 TYR HA H 26 3.941 3.941 3.995 -0.054 25767 5678 1 7 . 1 1 26 26 TYR C C 26 178.753 178.753 177.460 1.293 25767 5679 1 7 . 1 1 26 26 TYR CA C 26 64.260 64.260 62.035 2.225 25767 5680 1 7 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.788 -1.267 25767 5681 1 7 . 1 1 26 26 TYR H H 26 7.693 7.693 7.964 -0.271 25767 5682 1 7 . 1 1 27 27 LEU N N 27 118.657 118.657 117.164 1.493 25767 5683 1 7 . 1 1 27 27 LEU HA H 27 4.311 4.311 3.937 0.374 25767 5684 1 7 . 1 1 27 27 LEU CA C 27 58.297 58.297 57.861 0.436 25767 5685 1 7 . 1 1 27 27 LEU CB C 27 42.723 42.723 40.758 1.965 25767 5686 1 7 . 1 1 27 27 LEU H H 27 8.339 8.339 7.827 0.512 25767 5687 1 7 . 1 1 28 28 GLN N N 28 118.593 118.593 119.173 -0.580 25767 5688 1 7 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.837 -0.186 25767 5689 1 7 . 1 1 28 28 GLN C C 28 177.282 177.282 178.146 -0.864 25767 5690 1 7 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.746 0.083 25767 5691 1 7 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.195 1.453 25767 5692 1 7 . 1 1 28 28 GLN H H 28 7.970 7.970 7.688 0.282 25767 5693 1 7 . 1 1 29 29 LEU N N 29 122.111 122.111 119.420 2.691 25767 5694 1 7 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.705 0.239 25767 5695 1 7 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.550 1.116 25767 5696 1 7 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.212 0.796 25767 5697 1 7 . 1 1 29 29 LEU H H 29 7.979 7.979 7.301 0.678 25767 5698 1 7 . 1 1 30 30 TYR N N 30 119.283 119.283 120.090 -0.807 25767 5699 1 7 . 1 1 30 30 TYR C C 30 175.775 175.775 177.207 -1.432 25767 5700 1 7 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.808 -1.714 25767 5701 1 7 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.259 0.814 25767 5702 1 7 . 1 1 30 30 TYR H H 30 8.093 8.093 7.487 0.606 25767 5703 1 7 . 1 1 31 31 ALA N N 31 121.327 121.327 121.980 -0.653 25767 5704 1 7 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.833 -0.465 25767 5705 1 7 . 1 1 31 31 ALA C C 31 178.955 178.955 178.766 0.189 25767 5706 1 7 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.337 0.210 25767 5707 1 7 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.105 -0.142 25767 5708 1 7 . 1 1 31 31 ALA H H 31 8.394 8.394 8.116 0.278 25767 5709 1 7 . 1 1 32 32 VAL N N 32 116.757 116.757 118.534 -1.777 25767 5710 1 7 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.511 -0.251 25767 5711 1 7 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.637 2.025 25767 5712 1 7 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.201 -0.230 25767 5713 1 7 . 1 1 32 32 VAL H H 32 8.020 8.020 7.548 0.471 25767 5714 1 7 . 1 1 33 33 GLU N N 33 118.775 118.775 119.950 -1.175 25767 5715 1 7 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.842 0.147 25767 5716 1 7 . 1 1 33 33 GLU C C 33 179.746 179.746 179.017 0.729 25767 5717 1 7 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.462 0.541 25767 5718 1 7 . 1 1 33 33 GLU H H 33 7.358 7.358 7.636 -0.278 25767 5719 1 7 . 1 1 34 34 LEU N N 34 120.632 120.632 120.743 -0.111 25767 5720 1 7 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.831 -0.182 25767 5721 1 7 . 1 1 34 34 LEU C C 34 180.336 180.336 178.006 2.330 25767 5722 1 7 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.665 0.010 25767 5723 1 7 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.742 -0.154 25767 5724 1 7 . 1 1 34 34 LEU H H 34 8.390 8.390 7.667 0.723 25767 5725 1 7 . 1 1 35 35 ILE N N 35 121.240 121.240 118.339 2.901 25767 5726 1 7 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.524 0.018 25767 5727 1 7 . 1 1 35 35 ILE C C 35 178.604 178.604 178.557 0.047 25767 5728 1 7 . 1 1 35 35 ILE CA C 35 65.547 65.547 65.195 0.352 25767 5729 1 7 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.738 0.993 25767 5730 1 7 . 1 1 35 35 ILE H H 35 8.129 8.129 7.465 0.663 25767 5731 1 7 . 1 1 36 36 LEU N N 36 115.637 115.637 119.200 -3.563 25767 5732 1 7 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.043 -0.035 25767 5733 1 7 . 1 1 36 36 LEU C C 36 178.001 178.001 178.050 -0.049 25767 5734 1 7 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.166 -1.090 25767 5735 1 7 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.469 -1.535 25767 5736 1 7 . 1 1 36 36 LEU H H 36 8.416 8.416 7.853 0.563 25767 5737 1 7 . 1 1 37 37 SER N N 37 114.106 114.106 110.617 3.489 25767 5738 1 7 . 1 1 37 37 SER HA H 37 3.991 3.991 4.341 -0.350 25767 5739 1 7 . 1 1 37 37 SER C C 37 173.997 173.997 173.867 0.130 25767 5740 1 7 . 1 1 37 37 SER CA C 37 60.311 60.311 59.142 1.169 25767 5741 1 7 . 1 1 37 37 SER CB C 37 63.746 63.746 63.462 0.284 25767 5742 1 7 . 1 1 37 37 SER H H 37 7.517 7.517 7.719 -0.202 25767 5743 1 7 . 1 1 38 38 GLU N N 38 123.003 123.003 121.354 1.649 25767 5744 1 7 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.343 0.026 25767 5745 1 7 . 1 1 38 38 GLU C C 38 175.780 175.780 175.882 -0.102 25767 5746 1 7 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.469 -0.104 25767 5747 1 7 . 1 1 38 38 GLU CB C 38 30.293 30.293 31.023 -0.730 25767 5748 1 7 . 1 1 38 38 GLU H H 38 7.151 7.151 7.414 -0.263 25767 5749 1 7 . 1 1 39 39 GLU N N 39 126.166 126.166 122.915 3.251 25767 5750 1 7 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.149 -0.140 25767 5751 1 7 . 1 1 39 39 GLU C C 39 176.652 176.652 175.774 0.878 25767 5752 1 7 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.497 1.701 25767 5753 1 7 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.300 -0.265 25767 5754 1 7 . 1 1 39 39 GLU H H 39 8.587 8.587 8.424 0.163 25767 5755 1 7 . 1 1 40 40 ASP N N 40 120.047 120.047 121.284 -1.237 25767 5756 1 7 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.479 0.071 25767 5757 1 7 . 1 1 40 40 ASP C C 40 175.035 175.035 175.991 -0.956 25767 5758 1 7 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.112 -1.744 25767 5759 1 7 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.702 -0.679 25767 5760 1 7 . 1 1 40 40 ASP H H 40 8.504 8.504 8.537 -0.033 25767 5761 1 7 . 1 1 41 41 ARG N N 41 120.671 120.671 123.255 -2.584 25767 5762 1 7 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.573 -0.184 25767 5763 1 7 . 1 1 41 41 ARG C C 41 175.755 175.755 175.745 0.010 25767 5764 1 7 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.733 0.274 25767 5765 1 7 . 1 1 41 41 ARG CB C 41 31.549 31.549 31.927 -0.378 25767 5766 1 7 . 1 1 41 41 ARG H H 41 7.672 7.672 8.158 -0.486 25767 5767 1 7 . 1 1 42 42 SER N N 42 120.330 120.330 115.546 4.784 25767 5768 1 7 . 1 1 42 42 SER HA H 42 3.837 3.837 4.372 -0.535 25767 5769 1 7 . 1 1 42 42 SER CA C 42 57.326 57.326 58.159 -0.833 25767 5770 1 7 . 1 1 42 42 SER CB C 42 65.762 65.762 64.156 1.606 25767 5771 1 7 . 1 1 42 42 SER H H 42 8.544 8.544 8.253 0.291 25767 5772 1 7 . 1 1 43 43 GLN HA H 43 3.989 3.989 3.974 0.015 25767 5773 1 7 . 1 1 43 43 GLN C C 43 178.907 178.907 177.655 1.252 25767 5774 1 7 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.578 0.792 25767 5775 1 7 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.683 -0.720 25767 5776 1 7 . 1 1 44 44 GLU N N 44 120.328 120.328 119.850 0.478 25767 5777 1 7 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.933 0.080 25767 5778 1 7 . 1 1 44 44 GLU C C 44 179.824 179.824 178.337 1.487 25767 5779 1 7 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.333 0.712 25767 5780 1 7 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.419 -0.771 25767 5781 1 7 . 1 1 44 44 GLU H H 44 8.938 8.938 7.860 1.078 25767 5782 1 7 . 1 1 45 45 MET N N 45 121.030 121.030 117.286 3.744 25767 5783 1 7 . 1 1 45 45 MET HA H 45 4.412 4.412 4.259 0.153 25767 5784 1 7 . 1 1 45 45 MET C C 45 180.357 180.357 178.089 2.268 25767 5785 1 7 . 1 1 45 45 MET CA C 45 57.209 57.209 57.906 -0.697 25767 5786 1 7 . 1 1 45 45 MET CB C 45 32.436 32.436 31.854 0.582 25767 5787 1 7 . 1 1 45 45 MET H H 45 7.756 7.756 7.887 -0.131 25767 5788 1 7 . 1 1 46 46 THR N N 46 120.008 120.008 114.033 5.975 25767 5789 1 7 . 1 1 46 46 THR HA H 46 4.071 4.071 3.988 0.083 25767 5790 1 7 . 1 1 46 46 THR CA C 46 67.096 67.096 65.953 1.143 25767 5791 1 7 . 1 1 46 46 THR CB C 46 68.954 68.954 68.014 0.940 25767 5792 1 7 . 1 1 46 46 THR H H 46 8.187 8.187 7.683 0.504 25767 5793 1 7 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.120 -0.011 25767 5794 1 7 . 1 1 47 47 ALA C C 47 180.118 180.118 179.386 0.732 25767 5795 1 7 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.838 0.501 25767 5796 1 7 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.254 -0.422 25767 5797 1 7 . 1 1 47 47 ALA H H 47 8.238 8.238 7.615 0.623 25767 5798 1 7 . 1 1 48 48 LEU N N 48 122.093 122.093 119.315 2.778 25767 5799 1 7 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.037 0.226 25767 5800 1 7 . 1 1 48 48 LEU C C 48 179.103 179.103 179.357 -0.254 25767 5801 1 7 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.409 0.331 25767 5802 1 7 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.476 -0.680 25767 5803 1 7 . 1 1 48 48 LEU H H 48 7.778 7.778 7.698 0.080 25767 5804 1 7 . 1 1 49 49 ALA N N 49 120.130 120.130 121.927 -1.797 25767 5805 1 7 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.931 -0.210 25767 5806 1 7 . 1 1 49 49 ALA C C 49 178.676 178.676 179.416 -0.740 25767 5807 1 7 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.411 0.310 25767 5808 1 7 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.012 -0.185 25767 5809 1 7 . 1 1 49 49 ALA H H 49 8.432 8.432 8.366 0.066 25767 5810 1 7 . 1 1 50 50 THR N N 50 113.333 113.333 115.375 -2.042 25767 5811 1 7 . 1 1 50 50 THR HA H 50 3.895 3.895 3.826 0.069 25767 5812 1 7 . 1 1 50 50 THR C C 50 174.948 174.948 176.535 -1.587 25767 5813 1 7 . 1 1 50 50 THR CA C 50 67.334 67.334 67.397 -0.062 25767 5814 1 7 . 1 1 50 50 THR CB C 50 68.864 68.864 68.632 0.232 25767 5815 1 7 . 1 1 50 50 THR H H 50 7.857 7.857 7.799 0.058 25767 5816 1 7 . 1 1 51 51 GLU N N 51 122.698 122.698 122.262 0.436 25767 5817 1 7 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.024 0.044 25767 5818 1 7 . 1 1 51 51 GLU C C 51 179.997 179.997 178.658 1.339 25767 5819 1 7 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.240 0.193 25767 5820 1 7 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.728 -0.211 25767 5821 1 7 . 1 1 51 51 GLU H H 51 7.817 7.817 7.597 0.220 25767 5822 1 7 . 1 1 52 52 LEU N N 52 121.100 121.100 121.381 -0.281 25767 5823 1 7 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.044 0.085 25767 5824 1 7 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.865 0.024 25767 5825 1 7 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.729 0.218 25767 5826 1 7 . 1 1 52 52 LEU H H 52 8.628 8.628 8.051 0.577 25767 5827 1 7 . 1 1 53 53 LEU N N 53 119.935 119.935 119.786 0.149 25767 5828 1 7 . 1 1 53 53 LEU C C 53 179.671 179.671 178.342 1.329 25767 5829 1 7 . 1 1 53 53 LEU H H 53 8.303 8.303 7.718 0.585 25767 5830 1 7 . 1 1 54 54 ASP N N 54 120.339 120.339 118.518 1.821 25767 5831 1 7 . 1 1 54 54 ASP C C 54 179.106 179.106 178.326 0.780 25767 5832 1 7 . 1 1 54 54 ASP H H 54 7.901 7.901 7.897 0.004 25767 5833 1 7 . 1 1 55 55 THR N N 55 120.237 120.237 116.953 3.284 25767 5834 1 7 . 1 1 55 55 THR HA H 55 3.696 3.696 4.068 -0.372 25767 5835 1 7 . 1 1 55 55 THR CA C 55 67.340 67.340 66.615 0.725 25767 5836 1 7 . 1 1 55 55 THR CB C 55 68.151 68.151 68.407 -0.256 25767 5837 1 7 . 1 1 55 55 THR H H 55 8.262 8.262 8.001 0.261 25767 5838 1 7 . 1 1 56 56 ILE N N 56 123.953 123.953 122.010 1.943 25767 5839 1 7 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.706 0.137 25767 5840 1 7 . 1 1 56 56 ILE CA C 56 65.894 65.894 66.024 -0.130 25767 5841 1 7 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.596 0.537 25767 5842 1 7 . 1 1 56 56 ILE H H 56 8.930 8.930 7.763 1.167 25767 5843 1 7 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.506 0.075 25767 5844 1 7 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.173 -0.142 25767 5845 1 7 . 1 1 58 58 ALA C C 58 179.875 179.875 179.410 0.465 25767 5846 1 7 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.745 0.521 25767 5847 1 7 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.441 -0.456 25767 5848 1 7 . 1 1 58 58 ALA H H 58 7.764 7.764 8.708 -0.944 25767 5849 1 7 . 1 1 59 59 PHE N N 59 121.988 121.988 120.161 1.827 25767 5850 1 7 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.215 0.011 25767 5851 1 7 . 1 1 59 59 PHE CA C 59 61.439 61.439 60.288 1.151 25767 5852 1 7 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.060 0.303 25767 5853 1 7 . 1 1 59 59 PHE H H 59 8.159 8.159 8.549 -0.390 25767 5854 1 7 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.211 0.330 25767 5855 1 7 . 1 1 60 60 LYS C C 60 179.438 179.438 178.731 0.707 25767 5856 1 7 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.296 0.840 25767 5857 1 7 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.162 -0.104 25767 5858 1 7 . 1 1 61 61 LYS N N 61 119.262 119.262 117.249 2.013 25767 5859 1 7 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.175 -0.230 25767 5860 1 7 . 1 1 61 61 LYS C C 61 178.730 178.730 177.946 0.784 25767 5861 1 7 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.462 1.580 25767 5862 1 7 . 1 1 61 61 LYS CB C 61 32.642 32.642 31.969 0.673 25767 5863 1 7 . 1 1 61 61 LYS H H 61 7.832 7.832 7.647 0.185 25767 5864 1 7 . 1 1 62 62 GLU N N 62 120.790 120.790 120.117 0.673 25767 5865 1 7 . 1 1 62 62 GLU HA H 62 3.935 3.935 4.031 -0.096 25767 5866 1 7 . 1 1 62 62 GLU C C 62 178.424 178.424 178.077 0.347 25767 5867 1 7 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.968 -0.254 25767 5868 1 7 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.453 -0.223 25767 5869 1 7 . 1 1 62 62 GLU H H 62 7.982 7.982 8.070 -0.088 25767 5870 1 7 . 1 1 63 63 ILE N N 63 118.463 118.463 117.011 1.452 25767 5871 1 7 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.902 -0.213 25767 5872 1 7 . 1 1 63 63 ILE C C 63 177.555 177.555 177.267 0.288 25767 5873 1 7 . 1 1 63 63 ILE CA C 63 61.499 61.499 62.898 -1.399 25767 5874 1 7 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.501 -1.977 25767 5875 1 7 . 1 1 63 63 ILE H H 63 7.732 7.732 7.400 0.332 25767 5876 1 7 . 1 1 64 64 GLY N N 64 107.973 107.973 107.259 0.714 25767 5877 1 7 . 1 1 64 64 GLY C C 64 175.271 175.271 175.144 0.127 25767 5878 1 7 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.077 -0.175 25767 5879 1 7 . 1 1 64 64 GLY H H 64 7.661 7.661 7.570 0.091 25767 5880 1 7 . 1 1 65 65 GLY N N 65 108.464 108.464 107.671 0.793 25767 5881 1 7 . 1 1 65 65 GLY C C 65 174.800 174.800 176.059 -1.259 25767 5882 1 7 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.530 0.116 25767 5883 1 7 . 1 1 65 65 GLY H H 65 7.808 7.808 8.172 -0.364 25767 5884 1 7 . 1 1 66 66 GLU N N 66 121.162 121.162 121.537 -0.375 25767 5885 1 7 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.076 0.029 25767 5886 1 7 . 1 1 66 66 GLU C C 66 177.230 177.230 177.287 -0.057 25767 5887 1 7 . 1 1 66 66 GLU CA C 66 57.224 57.224 58.934 -1.710 25767 5888 1 7 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.235 0.757 25767 5889 1 7 . 1 1 66 66 GLU H H 66 8.203 8.203 7.760 0.443 25767 5890 1 7 . 1 1 67 67 SER N N 67 116.468 116.468 114.422 2.046 25767 5891 1 7 . 1 1 67 67 SER HA H 67 4.249 4.249 4.248 0.001 25767 5892 1 7 . 1 1 67 67 SER C C 67 174.640 174.640 176.163 -1.523 25767 5893 1 7 . 1 1 67 67 SER CA C 67 58.930 58.930 60.555 -1.625 25767 5894 1 7 . 1 1 67 67 SER CB C 67 63.912 63.912 63.246 0.666 25767 5895 1 7 . 1 1 67 67 SER H H 67 8.206 8.206 8.076 0.130 25767 5896 1 7 . 1 1 68 68 GLU N N 68 122.400 122.400 120.164 2.236 25767 5897 1 7 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.087 0.066 25767 5898 1 7 . 1 1 68 68 GLU C C 68 176.349 176.349 177.392 -1.043 25767 5899 1 7 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.149 -1.326 25767 5900 1 7 . 1 1 68 68 GLU CB C 68 29.981 29.981 28.958 1.023 25767 5901 1 7 . 1 1 68 68 GLU H H 68 8.168 8.168 8.219 -0.051 25767 5902 1 7 . 1 1 69 69 ALA N N 69 124.342 124.342 121.050 3.292 25767 5903 1 7 . 1 1 69 69 ALA HA H 69 4.188 4.188 3.859 0.329 25767 5904 1 7 . 1 1 69 69 ALA C C 69 178.027 178.027 177.791 0.236 25767 5905 1 7 . 1 1 69 69 ALA CA C 69 52.558 52.558 54.698 -2.140 25767 5906 1 7 . 1 1 69 69 ALA CB C 69 19.492 19.492 17.893 1.599 25767 5907 1 7 . 1 1 69 69 ALA H H 69 7.939 7.939 7.839 0.100 25767 5908 1 7 . 1 1 70 70 GLU N N 70 121.059 121.059 118.686 2.373 25767 5909 1 7 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.104 0.010 25767 5910 1 7 . 1 1 70 70 GLU C C 70 176.519 176.519 175.521 0.998 25767 5911 1 7 . 1 1 70 70 GLU CA C 70 57.304 57.304 56.620 0.684 25767 5912 1 7 . 1 1 70 70 GLU CB C 70 29.827 29.827 29.464 0.363 25767 5913 1 7 . 1 1 70 70 GLU H H 70 8.430 8.430 8.483 -0.053 25767 5914 1 7 . 1 1 71 71 ASP N N 71 120.274 120.274 121.939 -1.665 25767 5915 1 7 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.303 0.229 25767 5916 1 7 . 1 1 71 71 ASP C C 71 176.369 176.369 177.122 -0.753 25767 5917 1 7 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.212 -0.961 25767 5918 1 7 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.233 1.607 25767 5919 1 7 . 1 1 71 71 ASP H H 71 8.305 8.305 8.873 -0.568 25767 5920 1 7 . 1 1 72 72 SER N N 72 116.165 116.165 114.714 1.451 25767 5921 1 7 . 1 1 72 72 SER HA H 72 4.241 4.241 4.044 0.197 25767 5922 1 7 . 1 1 72 72 SER C C 72 174.567 174.567 175.477 -0.910 25767 5923 1 7 . 1 1 72 72 SER CA C 72 59.031 59.031 61.477 -2.446 25767 5924 1 7 . 1 1 72 72 SER CB C 72 64.040 64.040 63.166 0.874 25767 5925 1 7 . 1 1 72 72 SER H H 72 7.964 7.964 7.853 0.111 25767 5926 1 7 . 1 1 73 73 ASP N N 73 122.440 122.440 120.522 1.918 25767 5927 1 7 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.381 0.153 25767 5928 1 7 . 1 1 73 73 ASP C C 73 176.882 176.882 178.685 -1.803 25767 5929 1 7 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.799 -3.356 25767 5930 1 7 . 1 1 73 73 ASP CB C 73 41.336 41.336 40.158 1.178 25767 5931 1 7 . 1 1 73 73 ASP H H 73 8.392 8.392 8.699 -0.307 25767 5932 1 7 . 1 1 74 74 LYS N N 74 123.270 123.270 120.399 2.871 25767 5933 1 7 . 1 1 74 74 LYS HA H 74 4.093 4.093 3.963 0.130 25767 5934 1 7 . 1 1 74 74 LYS C C 74 177.608 177.608 178.771 -1.163 25767 5935 1 7 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.678 -2.213 25767 5936 1 7 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.329 -0.183 25767 5937 1 7 . 1 1 74 74 LYS H H 74 8.317 8.317 7.777 0.540 25767 5938 1 7 . 1 1 75 75 SER N N 75 116.557 116.557 116.385 0.172 25767 5939 1 7 . 1 1 75 75 SER HA H 75 4.197 4.197 4.185 0.012 25767 5940 1 7 . 1 1 75 75 SER C C 75 175.988 175.988 176.568 -0.580 25767 5941 1 7 . 1 1 75 75 SER CA C 75 60.434 60.434 62.523 -2.089 25767 5942 1 7 . 1 1 75 75 SER CB C 75 63.172 63.172 62.976 0.196 25767 5943 1 7 . 1 1 75 75 SER H H 75 8.387 8.387 7.794 0.593 25767 5944 1 7 . 1 1 76 76 LEU N N 76 123.910 123.910 122.494 1.416 25767 5945 1 7 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.929 0.241 25767 5946 1 7 . 1 1 76 76 LEU C C 76 178.083 178.083 178.233 -0.150 25767 5947 1 7 . 1 1 76 76 LEU CA C 76 56.492 56.492 58.265 -1.773 25767 5948 1 7 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.341 0.356 25767 5949 1 7 . 1 1 76 76 LEU H H 76 8.059 8.059 8.027 0.032 25767 5950 1 7 . 1 1 77 77 HIS N N 77 120.620 120.620 119.874 0.746 25767 5951 1 7 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.254 0.034 25767 5952 1 7 . 1 1 77 77 HIS C C 77 177.667 177.667 178.035 -0.368 25767 5953 1 7 . 1 1 77 77 HIS CA C 77 58.422 58.422 60.475 -2.053 25767 5954 1 7 . 1 1 77 77 HIS CB C 77 30.264 30.264 30.260 0.004 25767 5955 1 7 . 1 1 77 77 HIS H H 77 7.936 7.936 7.801 0.135 25767 5956 1 7 . 1 1 78 78 VAL N N 78 121.774 121.774 120.106 1.668 25767 5957 1 7 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.535 0.142 25767 5958 1 7 . 1 1 78 78 VAL CA C 78 65.606 65.606 67.067 -1.461 25767 5959 1 7 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.946 -0.082 25767 5960 1 7 . 1 1 78 78 VAL H H 78 7.916 7.916 7.953 -0.037 25767 5961 1 7 . 1 1 79 79 MET N N 79 119.660 119.660 118.389 1.271 25767 5962 1 7 . 1 1 79 79 MET HA H 79 3.925 3.925 3.918 0.007 25767 5963 1 7 . 1 1 79 79 MET C C 79 177.077 177.077 178.583 -1.506 25767 5964 1 7 . 1 1 79 79 MET CA C 79 58.862 58.862 59.550 -0.688 25767 5965 1 7 . 1 1 79 79 MET CB C 79 32.852 32.852 32.254 0.598 25767 5966 1 7 . 1 1 79 79 MET H H 79 8.149 8.149 8.057 0.092 25767 5967 1 7 . 1 1 80 80 ASN N N 80 117.337 117.337 118.082 -0.745 25767 5968 1 7 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.538 -0.400 25767 5969 1 7 . 1 1 80 80 ASN C C 80 178.133 178.133 178.753 -0.620 25767 5970 1 7 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.031 1.008 25767 5971 1 7 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.269 0.727 25767 5972 1 7 . 1 1 80 80 ASN H H 80 8.202 8.202 8.713 -0.511 25767 5973 1 7 . 1 1 81 81 THR N N 81 115.517 115.517 119.018 -3.501 25767 5974 1 7 . 1 1 81 81 THR HA H 81 3.896 3.896 3.954 -0.058 25767 5975 1 7 . 1 1 81 81 THR C C 81 175.186 175.186 175.923 -0.737 25767 5976 1 7 . 1 1 81 81 THR CA C 81 66.221 66.221 66.706 -0.485 25767 5977 1 7 . 1 1 81 81 THR CB C 81 69.087 69.087 68.497 0.590 25767 5978 1 7 . 1 1 81 81 THR H H 81 7.944 7.944 8.445 -0.501 25767 5979 1 7 . 1 1 82 82 LEU N N 82 119.074 119.074 120.073 -0.999 25767 5980 1 7 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.032 -0.051 25767 5981 1 7 . 1 1 82 82 LEU C C 82 177.583 177.583 178.047 -0.464 25767 5982 1 7 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.162 -0.622 25767 5983 1 7 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.711 0.082 25767 5984 1 7 . 1 1 82 82 LEU H H 82 7.547 7.547 7.703 -0.156 25767 5985 1 7 . 1 1 83 83 ILE N N 83 118.085 118.085 115.964 2.121 25767 5986 1 7 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.478 0.365 25767 5987 1 7 . 1 1 83 83 ILE C C 83 176.413 176.413 177.228 -0.815 25767 5988 1 7 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.410 -0.683 25767 5989 1 7 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.148 -0.450 25767 5990 1 7 . 1 1 83 83 ILE H H 83 7.409 7.409 7.348 0.061 25767 5991 1 7 . 1 1 84 84 HIS N N 84 116.152 116.152 116.031 0.121 25767 5992 1 7 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.269 0.326 25767 5993 1 7 . 1 1 84 84 HIS C C 84 175.707 175.707 175.641 0.066 25767 5994 1 7 . 1 1 84 84 HIS CA C 84 58.628 58.628 58.491 0.137 25767 5995 1 7 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.436 0.967 25767 5996 1 7 . 1 1 84 84 HIS H H 84 7.194 7.194 7.763 -0.569 25767 5997 1 7 . 1 1 85 85 ASP N N 85 122.322 122.322 119.271 3.051 25767 5998 1 7 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.691 -0.157 25767 5999 1 7 . 1 1 85 85 ASP C C 85 175.580 175.580 176.676 -1.096 25767 6000 1 7 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.081 0.265 25767 6001 1 7 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.210 -0.092 25767 6002 1 7 . 1 1 85 85 ASP H H 85 8.505 8.505 7.613 0.892 25767 6003 1 7 . 1 1 86 86 GLN N N 86 122.783 122.783 126.130 -3.347 25767 6004 1 7 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.089 -0.126 25767 6005 1 7 . 1 1 86 86 GLN C C 86 178.581 178.581 177.576 1.005 25767 6006 1 7 . 1 1 86 86 GLN CA C 86 57.954 57.954 58.793 -0.839 25767 6007 1 7 . 1 1 86 86 GLN CB C 86 28.894 28.894 28.765 0.129 25767 6008 1 7 . 1 1 86 86 GLN H H 86 8.803 8.803 8.607 0.196 25767 6009 1 7 . 1 1 87 87 GLU N N 87 121.794 121.794 120.301 1.493 25767 6010 1 7 . 1 1 87 87 GLU HA H 87 4.013 4.013 3.796 0.217 25767 6011 1 7 . 1 1 87 87 GLU C C 87 178.290 178.290 178.890 -0.600 25767 6012 1 7 . 1 1 87 87 GLU CA C 87 59.038 59.038 58.980 0.058 25767 6013 1 7 . 1 1 87 87 GLU CB C 87 28.980 28.980 28.415 0.565 25767 6014 1 7 . 1 1 87 87 GLU H H 87 8.072 8.072 8.012 0.060 25767 6015 1 7 . 1 1 88 88 LYS N N 88 119.345 119.345 119.638 -0.293 25767 6016 1 7 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.096 -0.341 25767 6017 1 7 . 1 1 88 88 LYS C C 88 180.040 180.040 178.470 1.570 25767 6018 1 7 . 1 1 88 88 LYS CA C 88 59.411 59.411 58.979 0.432 25767 6019 1 7 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.812 0.195 25767 6020 1 7 . 1 1 88 88 LYS H H 88 7.588 7.588 8.497 -0.909 25767 6021 1 7 . 1 1 89 89 ALA N N 89 123.933 123.933 121.702 2.231 25767 6022 1 7 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.179 -0.440 25767 6023 1 7 . 1 1 89 89 ALA C C 89 177.457 177.457 179.345 -1.888 25767 6024 1 7 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.311 0.659 25767 6025 1 7 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.286 0.370 25767 6026 1 7 . 1 1 89 89 ALA H H 89 8.500 8.500 7.633 0.867 25767 6027 1 7 . 1 1 90 90 LYS N N 90 119.244 119.244 120.126 -0.882 25767 6028 1 7 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.997 0.047 25767 6029 1 7 . 1 1 90 90 LYS C C 90 177.774 177.774 178.772 -0.998 25767 6030 1 7 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.672 -0.594 25767 6031 1 7 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.566 -2.325 25767 6032 1 7 . 1 1 90 90 LYS H H 90 6.845 6.845 7.681 -0.836 25767 6033 1 7 . 1 1 91 91 ILE N N 91 117.718 117.718 117.329 0.389 25767 6034 1 7 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.735 -0.337 25767 6035 1 7 . 1 1 91 91 ILE C C 91 177.670 177.670 177.701 -0.031 25767 6036 1 7 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.777 -0.779 25767 6037 1 7 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.090 0.711 25767 6038 1 7 . 1 1 91 91 ILE H H 91 7.293 7.293 8.037 -0.744 25767 6039 1 7 . 1 1 92 92 TYR N N 92 121.868 121.868 121.517 0.351 25767 6040 1 7 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.130 -0.007 25767 6041 1 7 . 1 1 92 92 TYR C C 92 178.781 178.781 177.584 1.197 25767 6042 1 7 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.341 -0.699 25767 6043 1 7 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.952 0.269 25767 6044 1 7 . 1 1 92 92 TYR H H 92 8.016 8.016 7.943 0.073 25767 6045 1 7 . 1 1 93 93 MET N N 93 118.984 118.984 118.421 0.563 25767 6046 1 7 . 1 1 93 93 MET HA H 93 3.952 3.952 4.116 -0.164 25767 6047 1 7 . 1 1 93 93 MET C C 93 179.925 179.925 178.349 1.576 25767 6048 1 7 . 1 1 93 93 MET CA C 93 57.589 57.589 59.380 -1.791 25767 6049 1 7 . 1 1 93 93 MET CB C 93 30.752 30.752 32.783 -2.031 25767 6050 1 7 . 1 1 93 93 MET H H 93 8.464 8.464 8.895 -0.431 25767 6051 1 7 . 1 1 94 94 LEU N N 94 125.441 125.441 121.810 3.631 25767 6052 1 7 . 1 1 94 94 LEU HA H 94 3.870 3.870 4.117 -0.247 25767 6053 1 7 . 1 1 94 94 LEU C C 94 177.937 177.937 178.531 -0.594 25767 6054 1 7 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.270 0.491 25767 6055 1 7 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.673 0.089 25767 6056 1 7 . 1 1 94 94 LEU H H 94 8.927 8.927 8.974 -0.047 25767 6057 1 7 . 1 1 95 95 ASN N N 95 119.066 119.066 118.025 1.041 25767 6058 1 7 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.372 -0.110 25767 6059 1 7 . 1 1 95 95 ASN CA C 95 56.273 56.273 55.932 0.341 25767 6060 1 7 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.161 -0.556 25767 6061 1 7 . 1 1 95 95 ASN H H 95 8.691 8.691 8.039 0.652 25767 6062 1 7 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.243 0.422 25767 6063 1 7 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.891 0.180 25767 6064 1 7 . 1 1 96 96 PHE H H 96 8.317 8.317 8.086 0.231 25767 6065 1 7 . 1 1 97 97 THR N N 97 118.178 118.178 115.868 2.310 25767 6066 1 7 . 1 1 97 97 THR HA H 97 3.338 3.338 4.072 -0.734 25767 6067 1 7 . 1 1 97 97 THR C C 97 176.074 176.074 176.742 -0.668 25767 6068 1 7 . 1 1 97 97 THR CA C 97 67.986 67.986 65.526 2.460 25767 6069 1 7 . 1 1 97 97 THR H H 97 8.214 8.214 8.916 -0.702 25767 6070 1 7 . 1 1 98 98 MET N N 98 120.097 120.097 121.049 -0.952 25767 6071 1 7 . 1 1 98 98 MET HA H 98 4.403 4.403 4.199 0.204 25767 6072 1 7 . 1 1 98 98 MET C C 98 178.696 178.696 178.624 0.072 25767 6073 1 7 . 1 1 98 98 MET CA C 98 57.029 57.029 57.136 -0.107 25767 6074 1 7 . 1 1 98 98 MET CB C 98 29.898 29.898 30.667 -0.769 25767 6075 1 7 . 1 1 98 98 MET H H 98 8.885 8.885 8.365 0.520 25767 6076 1 7 . 1 1 99 99 SER N N 99 114.959 114.959 115.553 -0.594 25767 6077 1 7 . 1 1 99 99 SER HA H 99 4.199 4.199 4.173 0.026 25767 6078 1 7 . 1 1 99 99 SER C C 99 176.565 176.565 176.703 -0.138 25767 6079 1 7 . 1 1 99 99 SER CA C 99 61.965 61.965 61.621 0.344 25767 6080 1 7 . 1 1 99 99 SER CB C 99 62.565 62.565 63.112 -0.547 25767 6081 1 7 . 1 1 99 99 SER H H 99 7.515 7.515 8.067 -0.552 25767 6082 1 7 . 1 1 100 100 LEU N N 100 125.380 125.380 123.214 2.166 25767 6083 1 7 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.823 -0.047 25767 6084 1 7 . 1 1 100 100 LEU C C 100 177.689 177.689 177.801 -0.112 25767 6085 1 7 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.311 0.746 25767 6086 1 7 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.458 0.092 25767 6087 1 7 . 1 1 100 100 LEU H H 100 7.400 7.400 8.344 -0.944 25767 6088 1 7 . 1 1 101 101 TYR N N 101 120.597 120.597 119.758 0.839 25767 6089 1 7 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.962 0.154 25767 6090 1 7 . 1 1 101 101 TYR C C 101 176.825 176.825 177.227 -0.402 25767 6091 1 7 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.287 -0.399 25767 6092 1 7 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.325 0.667 25767 6093 1 7 . 1 1 101 101 TYR H H 101 8.880 8.880 8.687 0.193 25767 6094 1 7 . 1 1 102 102 ASN N N 102 116.869 116.869 116.662 0.207 25767 6095 1 7 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.272 -0.106 25767 6096 1 7 . 1 1 102 102 ASN C C 102 179.089 179.089 177.862 1.227 25767 6097 1 7 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.116 0.096 25767 6098 1 7 . 1 1 102 102 ASN CB C 102 37.734 37.734 37.669 0.065 25767 6099 1 7 . 1 1 102 102 ASN H H 102 8.543 8.543 7.985 0.558 25767 6100 1 7 . 1 1 103 103 GLU N N 103 121.259 121.259 120.371 0.888 25767 6101 1 7 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.899 0.087 25767 6102 1 7 . 1 1 103 103 GLU C C 103 179.968 179.968 178.832 1.136 25767 6103 1 7 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.418 0.099 25767 6104 1 7 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.347 0.203 25767 6105 1 7 . 1 1 103 103 GLU H H 103 7.872 7.872 7.859 0.013 25767 6106 1 7 . 1 1 104 104 LYS N N 104 120.268 120.268 119.891 0.377 25767 6107 1 7 . 1 1 104 104 LYS HA H 104 4.046 4.046 3.916 0.130 25767 6108 1 7 . 1 1 104 104 LYS C C 104 178.355 178.355 178.934 -0.579 25767 6109 1 7 . 1 1 104 104 LYS CA C 104 56.735 56.735 59.305 -2.570 25767 6110 1 7 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.152 -3.039 25767 6111 1 7 . 1 1 104 104 LYS H H 104 8.384 8.384 7.485 0.899 25767 6112 1 7 . 1 1 105 105 LEU N N 105 121.622 121.622 119.297 2.325 25767 6113 1 7 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.635 0.106 25767 6114 1 7 . 1 1 105 105 LEU C C 105 180.552 180.552 178.577 1.975 25767 6115 1 7 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.219 -0.047 25767 6116 1 7 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.253 -0.223 25767 6117 1 7 . 1 1 105 105 LEU H H 105 8.400 8.400 7.701 0.699 25767 6118 1 7 . 1 1 106 106 LYS N N 106 119.498 119.498 118.300 1.198 25767 6119 1 7 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.786 0.128 25767 6120 1 7 . 1 1 106 106 LYS C C 106 178.419 178.419 178.889 -0.470 25767 6121 1 7 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.706 -0.324 25767 6122 1 7 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.931 -0.123 25767 6123 1 7 . 1 1 106 106 LYS H H 106 7.067 7.067 7.585 -0.518 25767 6124 1 7 . 1 1 107 107 GLN N N 107 121.405 121.405 119.708 1.697 25767 6125 1 7 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.997 -0.146 25767 6126 1 7 . 1 1 107 107 GLN C C 107 177.935 177.935 178.702 -0.767 25767 6127 1 7 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.440 0.041 25767 6128 1 7 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.079 -1.281 25767 6129 1 7 . 1 1 107 107 GLN H H 107 7.460 7.460 7.658 -0.198 25767 6130 1 7 . 1 1 108 108 LEU N N 108 119.561 119.561 118.231 1.330 25767 6131 1 7 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.750 0.051 25767 6132 1 7 . 1 1 108 108 LEU C C 108 179.195 179.195 178.457 0.738 25767 6133 1 7 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.382 1.011 25767 6134 1 7 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.790 -0.524 25767 6135 1 7 . 1 1 108 108 LEU H H 108 8.208 8.208 7.972 0.236 25767 6136 1 7 . 1 1 109 109 LYS N N 109 118.535 118.535 116.784 1.751 25767 6137 1 7 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.198 0.054 25767 6138 1 7 . 1 1 109 109 LYS C C 109 177.726 177.726 177.951 -0.225 25767 6139 1 7 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.615 0.115 25767 6140 1 7 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.940 -0.530 25767 6141 1 7 . 1 1 109 109 LYS H H 109 7.168 7.168 7.578 -0.410 25767 6142 1 7 . 1 1 110 110 ASP N N 110 117.463 117.463 116.451 1.012 25767 6143 1 7 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.678 -0.073 25767 6144 1 7 . 1 1 110 110 ASP C C 110 177.360 177.360 176.554 0.806 25767 6145 1 7 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.573 1.323 25767 6146 1 7 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.999 0.577 25767 6147 1 7 . 1 1 110 110 ASP H H 110 7.861 7.861 8.299 -0.438 25767 6148 1 7 . 1 1 111 111 GLY N N 111 113.059 113.059 108.781 4.278 25767 6149 1 7 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.881 -0.829 25767 6150 1 7 . 1 1 111 111 GLY H H 111 8.479 8.479 7.745 0.734 25767 6151 1 7 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.075 0.388 25767 6152 1 7 . 1 1 112 112 PRO C C 112 175.090 175.090 175.621 -0.531 25767 6153 1 7 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.126 -0.762 25767 6154 1 7 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.817 2.033 25767 6155 1 7 . 1 1 113 113 TRP N N 113 123.164 123.164 121.701 1.463 25767 6156 1 7 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.704 0.006 25767 6157 1 7 . 1 1 113 113 TRP C C 113 174.605 174.605 175.192 -0.587 25767 6158 1 7 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.230 0.675 25767 6159 1 7 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.391 -3.098 25767 6160 1 7 . 1 1 113 113 TRP H H 113 8.687 8.687 8.520 0.168 25767 6161 1 7 . 1 1 114 114 ASP N N 114 121.356 121.356 122.269 -0.913 25767 6162 1 7 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.988 -0.127 25767 6163 1 7 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.786 -0.537 25767 6164 1 7 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.358 -1.217 25767 6165 1 7 . 1 1 114 114 ASP H H 114 6.985 6.985 8.368 -1.383 25767 6166 1 7 . 1 1 115 115 VAL N N 115 118.649 118.649 118.099 0.550 25767 6167 1 7 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.854 -0.012 25767 6168 1 7 . 1 1 115 115 VAL C C 115 177.739 177.739 177.371 0.368 25767 6169 1 7 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.842 -0.273 25767 6170 1 7 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.131 -0.454 25767 6171 1 7 . 1 1 115 115 VAL H H 115 8.206 8.206 8.437 -0.231 25767 6172 1 7 . 1 1 116 116 MET N N 116 120.401 120.401 118.578 1.823 25767 6173 1 7 . 1 1 116 116 MET HA H 116 4.303 4.303 4.200 0.103 25767 6174 1 7 . 1 1 116 116 MET C C 116 179.269 179.269 178.341 0.928 25767 6175 1 7 . 1 1 116 116 MET CA C 116 57.634 57.634 58.893 -1.259 25767 6176 1 7 . 1 1 116 116 MET CB C 116 30.414 30.414 31.987 -1.573 25767 6177 1 7 . 1 1 116 116 MET H H 116 7.642 7.642 8.163 -0.521 25767 6178 1 7 . 1 1 117 117 LEU N N 117 125.503 125.503 119.348 6.155 25767 6179 1 7 . 1 1 117 117 LEU HA H 117 4.245 4.245 3.961 0.284 25767 6180 1 7 . 1 1 117 117 LEU C C 117 178.445 178.445 178.882 -0.437 25767 6181 1 7 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.574 0.626 25767 6182 1 7 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.150 -1.061 25767 6183 1 7 . 1 1 117 117 LEU H H 117 8.157 8.157 7.551 0.606 25767 6184 1 7 . 1 1 118 118 LYS N N 118 119.052 119.052 119.480 -0.428 25767 6185 1 7 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.960 -0.155 25767 6186 1 7 . 1 1 118 118 LYS C C 118 178.251 178.251 179.312 -1.061 25767 6187 1 7 . 1 1 118 118 LYS CA C 118 60.526 60.526 59.996 0.530 25767 6188 1 7 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.138 -0.010 25767 6189 1 7 . 1 1 118 118 LYS H H 118 7.400 7.400 7.524 -0.124 25767 6190 1 7 . 1 1 119 119 ARG N N 119 117.999 117.999 119.234 -1.235 25767 6191 1 7 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.306 -0.086 25767 6192 1 7 . 1 1 119 119 ARG C C 119 180.441 180.441 178.985 1.456 25767 6193 1 7 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.595 0.222 25767 6194 1 7 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.164 -0.079 25767 6195 1 7 . 1 1 119 119 ARG H H 119 8.265 8.265 7.998 0.267 25767 6196 1 7 . 1 1 120 120 SER N N 120 118.073 118.073 115.197 2.876 25767 6197 1 7 . 1 1 120 120 SER HA H 120 4.182 4.182 4.347 -0.165 25767 6198 1 7 . 1 1 120 120 SER C C 120 176.215 176.215 176.532 -0.317 25767 6199 1 7 . 1 1 120 120 SER CA C 120 62.817 62.817 61.583 1.234 25767 6200 1 7 . 1 1 120 120 SER CB C 120 63.550 63.550 62.993 0.557 25767 6201 1 7 . 1 1 120 120 SER H H 120 8.633 8.633 7.910 0.723 25767 6202 1 7 . 1 1 121 121 LEU N N 121 125.029 125.029 123.202 1.827 25767 6203 1 7 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.057 0.162 25767 6204 1 7 . 1 1 121 121 LEU C C 121 179.679 179.679 178.168 1.511 25767 6205 1 7 . 1 1 121 121 LEU CA C 121 58.849 58.849 57.401 1.448 25767 6206 1 7 . 1 1 121 121 LEU CB C 121 40.774 40.774 40.793 -0.019 25767 6207 1 7 . 1 1 121 121 LEU H H 121 8.313 8.313 8.050 0.263 25767 6208 1 7 . 1 1 122 122 TRP N N 122 120.217 120.217 118.911 1.306 25767 6209 1 7 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.363 -0.023 25767 6210 1 7 . 1 1 122 122 TRP C C 122 177.527 177.527 178.992 -1.465 25767 6211 1 7 . 1 1 122 122 TRP CA C 122 61.758 61.758 60.639 1.119 25767 6212 1 7 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.080 0.568 25767 6213 1 7 . 1 1 122 122 TRP H H 122 7.928 7.928 7.989 -0.062 25767 6214 1 7 . 1 1 123 123 CYS N N 123 119.669 119.669 119.875 -0.206 25767 6215 1 7 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.199 0.008 25767 6216 1 7 . 1 1 123 123 CYS C C 123 177.057 177.057 177.133 -0.076 25767 6217 1 7 . 1 1 123 123 CYS CA C 123 62.600 62.600 61.278 1.322 25767 6218 1 7 . 1 1 123 123 CYS CB C 123 25.899 25.899 26.533 -0.634 25767 6219 1 7 . 1 1 123 123 CYS H H 123 8.273 8.273 8.297 -0.024 25767 6220 1 7 . 1 1 124 124 CYS N N 124 116.898 116.898 121.557 -4.659 25767 6221 1 7 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.171 -0.323 25767 6222 1 7 . 1 1 124 124 CYS C C 124 175.759 175.759 177.259 -1.500 25767 6223 1 7 . 1 1 124 124 CYS CA C 124 65.653 65.653 63.560 2.093 25767 6224 1 7 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.152 0.365 25767 6225 1 7 . 1 1 124 124 CYS H H 124 8.122 8.122 8.389 -0.267 25767 6226 1 7 . 1 1 125 125 ILE N N 125 120.498 120.498 120.679 -0.181 25767 6227 1 7 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.632 -0.044 25767 6228 1 7 . 1 1 125 125 ILE C C 125 179.337 179.337 177.452 1.885 25767 6229 1 7 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.920 1.674 25767 6230 1 7 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.475 0.204 25767 6231 1 7 . 1 1 125 125 ILE H H 125 8.092 8.092 8.181 -0.089 25767 6232 1 7 . 1 1 126 126 ASP N N 126 125.084 125.084 120.398 4.686 25767 6233 1 7 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.387 0.230 25767 6234 1 7 . 1 1 126 126 ASP C C 126 178.299 178.299 178.868 -0.569 25767 6235 1 7 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.425 1.579 25767 6236 1 7 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.086 0.210 25767 6237 1 7 . 1 1 126 126 ASP H H 126 9.049 9.049 8.275 0.774 25767 6238 1 7 . 1 1 127 127 LEU N N 127 122.591 122.591 121.316 1.275 25767 6239 1 7 . 1 1 127 127 LEU HA H 127 3.867 3.867 4.039 -0.172 25767 6240 1 7 . 1 1 127 127 LEU C C 127 179.655 179.655 177.756 1.899 25767 6241 1 7 . 1 1 127 127 LEU CA C 127 58.661 58.661 57.995 0.666 25767 6242 1 7 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.831 0.363 25767 6243 1 7 . 1 1 127 127 LEU H H 127 8.888 8.888 7.840 1.048 25767 6244 1 7 . 1 1 128 128 PHE N N 128 117.498 117.498 119.164 -1.666 25767 6245 1 7 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.080 0.242 25767 6246 1 7 . 1 1 128 128 PHE C C 128 178.533 178.533 177.023 1.510 25767 6247 1 7 . 1 1 128 128 PHE CA C 128 60.932 60.932 61.857 -0.925 25767 6248 1 7 . 1 1 128 128 PHE CB C 128 39.053 39.053 39.263 -0.210 25767 6249 1 7 . 1 1 128 128 PHE H H 128 8.947 8.947 8.102 0.845 25767 6250 1 7 . 1 1 129 129 SER N N 129 115.398 115.398 115.821 -0.423 25767 6251 1 7 . 1 1 129 129 SER HA H 129 4.046 4.046 4.063 -0.017 25767 6252 1 7 . 1 1 129 129 SER C C 129 175.168 175.168 175.933 -0.765 25767 6253 1 7 . 1 1 129 129 SER CA C 129 63.015 63.015 61.060 1.955 25767 6254 1 7 . 1 1 129 129 SER H H 129 8.578 8.578 9.015 -0.437 25767 6255 1 7 . 1 1 130 130 CYS N N 130 125.556 125.556 120.788 4.768 25767 6256 1 7 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.220 -0.111 25767 6257 1 7 . 1 1 130 130 CYS C C 130 175.294 175.294 176.962 -1.668 25767 6258 1 7 . 1 1 130 130 CYS CA C 130 61.438 61.438 62.501 -1.063 25767 6259 1 7 . 1 1 130 130 CYS CB C 130 27.050 27.050 26.949 0.101 25767 6260 1 7 . 1 1 130 130 CYS H H 130 8.289 8.289 8.372 -0.083 25767 6261 1 7 . 1 1 131 131 ILE N N 131 120.232 120.232 120.898 -0.666 25767 6262 1 7 . 1 1 131 131 ILE HA H 131 4.033 4.033 3.747 0.286 25767 6263 1 7 . 1 1 131 131 ILE C C 131 177.297 177.297 178.324 -1.027 25767 6264 1 7 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.491 -0.839 25767 6265 1 7 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.757 1.345 25767 6266 1 7 . 1 1 131 131 ILE H H 131 7.943 7.943 7.571 0.372 25767 6267 1 7 . 1 1 132 132 LEU N N 132 116.422 116.422 120.560 -4.138 25767 6268 1 7 . 1 1 132 132 LEU HA H 132 3.845 3.845 3.812 0.033 25767 6269 1 7 . 1 1 132 132 LEU C C 132 177.816 177.816 178.347 -0.531 25767 6270 1 7 . 1 1 132 132 LEU CA C 132 57.078 57.078 57.909 -0.831 25767 6271 1 7 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.597 0.616 25767 6272 1 7 . 1 1 132 132 LEU H H 132 7.846 7.846 7.764 0.082 25767 6273 1 7 . 1 1 133 133 HIS N N 133 116.929 116.929 117.650 -0.721 25767 6274 1 7 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.030 0.109 25767 6275 1 7 . 1 1 133 133 HIS C C 133 178.669 178.669 177.530 1.139 25767 6276 1 7 . 1 1 133 133 HIS CA C 133 59.736 59.736 58.827 0.909 25767 6277 1 7 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.017 3.135 25767 6278 1 7 . 1 1 133 133 HIS H H 133 7.822 7.822 7.598 0.224 25767 6279 1 7 . 1 1 134 134 LEU N N 134 116.898 116.898 118.562 -1.664 25767 6280 1 7 . 1 1 134 134 LEU HA H 134 3.733 3.733 3.795 -0.062 25767 6281 1 7 . 1 1 134 134 LEU C C 134 179.402 179.402 178.912 0.490 25767 6282 1 7 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.236 -0.009 25767 6283 1 7 . 1 1 134 134 LEU CB C 134 39.539 39.539 41.355 -1.817 25767 6284 1 7 . 1 1 134 134 LEU H H 134 8.688 8.688 7.489 1.199 25767 6285 1 7 . 1 1 135 135 TRP N N 135 115.602 115.602 116.341 -0.739 25767 6286 1 7 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.703 0.305 25767 6287 1 7 . 1 1 135 135 TRP C C 135 175.022 175.022 178.089 -3.067 25767 6288 1 7 . 1 1 135 135 TRP CA C 135 59.426 59.426 56.765 2.661 25767 6289 1 7 . 1 1 135 135 TRP CB C 135 27.085 27.085 28.558 -1.473 25767 6290 1 7 . 1 1 135 135 TRP H H 135 7.638 7.638 7.552 0.086 25767 6291 1 7 . 1 1 136 136 LYS N N 136 119.721 119.721 123.251 -3.530 25767 6292 1 7 . 1 1 136 136 LYS HA H 136 3.816 3.816 4.052 -0.236 25767 6293 1 7 . 1 1 136 136 LYS C C 136 178.279 178.279 178.397 -0.118 25767 6294 1 7 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.298 0.895 25767 6295 1 7 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.808 1.248 25767 6296 1 7 . 1 1 136 136 LYS H H 136 6.538 6.538 8.358 -1.820 25767 6297 1 7 . 1 1 137 137 GLU N N 137 115.407 115.407 116.480 -1.073 25767 6298 1 7 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.165 0.002 25767 6299 1 7 . 1 1 137 137 GLU C C 137 176.700 176.700 177.305 -0.605 25767 6300 1 7 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.706 -0.856 25767 6301 1 7 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.120 0.040 25767 6302 1 7 . 1 1 137 137 GLU H H 137 8.596 8.596 8.250 0.346 25767 6303 1 7 . 1 1 138 138 ASN N N 138 116.669 116.669 116.497 0.172 25767 6304 1 7 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.810 0.096 25767 6305 1 7 . 1 1 138 138 ASN C C 138 173.481 173.481 174.883 -1.402 25767 6306 1 7 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.792 -0.978 25767 6307 1 7 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.431 1.406 25767 6308 1 7 . 1 1 138 138 ASN H H 138 8.343 8.343 8.250 0.093 25767 6309 1 7 . 1 1 139 139 ILE N N 139 120.703 120.703 120.515 0.188 25767 6310 1 7 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.290 0.054 25767 6311 1 7 . 1 1 139 139 ILE C C 139 175.241 175.241 175.578 -0.337 25767 6312 1 7 . 1 1 139 139 ILE CA C 139 60.792 60.792 58.702 2.090 25767 6313 1 7 . 1 1 139 139 ILE CB C 139 40.274 40.274 38.546 1.728 25767 6314 1 7 . 1 1 139 139 ILE H H 139 7.167 7.167 7.616 -0.449 25767 6315 1 7 . 1 1 140 140 SER N N 140 123.284 123.284 120.625 2.659 25767 6316 1 7 . 1 1 140 140 SER HA H 140 4.345 4.345 4.557 -0.212 25767 6317 1 7 . 1 1 140 140 SER CA C 140 58.095 58.095 57.548 0.547 25767 6318 1 7 . 1 1 140 140 SER CB C 140 65.370 65.370 65.163 0.207 25767 6319 1 7 . 1 1 140 140 SER H H 140 8.727 8.727 8.494 0.233 25767 6320 1 7 . 1 1 142 142 THR N N 142 113.868 113.868 115.128 -1.260 25767 6321 1 7 . 1 1 142 142 THR HA H 142 3.976 3.976 4.124 -0.148 25767 6322 1 7 . 1 1 142 142 THR C C 142 177.559 177.559 176.749 0.810 25767 6323 1 7 . 1 1 142 142 THR CA C 142 66.007 66.007 65.950 0.057 25767 6324 1 7 . 1 1 142 142 THR CB C 142 68.530 68.530 68.352 0.178 25767 6325 1 7 . 1 1 142 142 THR H H 142 8.243 8.243 8.081 0.162 25767 6326 1 7 . 1 1 143 143 SER N N 143 120.786 120.786 119.114 1.672 25767 6327 1 7 . 1 1 143 143 SER C C 143 175.844 175.844 176.510 -0.666 25767 6328 1 7 . 1 1 143 143 SER CA C 143 62.102 62.102 62.003 0.099 25767 6329 1 7 . 1 1 143 143 SER CB C 143 63.086 63.086 62.963 0.123 25767 6330 1 7 . 1 1 143 143 SER H H 143 7.915 7.915 8.464 -0.549 25767 6331 1 7 . 1 1 144 144 THR N N 144 120.946 120.946 117.886 3.060 25767 6332 1 7 . 1 1 144 144 THR HA H 144 4.299 4.299 4.023 0.276 25767 6333 1 7 . 1 1 144 144 THR C C 144 175.874 175.874 176.080 -0.206 25767 6334 1 7 . 1 1 144 144 THR CA C 144 67.487 67.487 66.910 0.577 25767 6335 1 7 . 1 1 144 144 THR CB C 144 68.485 68.485 68.669 -0.184 25767 6336 1 7 . 1 1 144 144 THR H H 144 8.746 8.746 8.623 0.123 25767 6337 1 7 . 1 1 145 145 ASN N N 145 120.069 120.069 119.768 0.301 25767 6338 1 7 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.445 -0.137 25767 6339 1 7 . 1 1 145 145 ASN C C 145 177.917 177.917 177.713 0.204 25767 6340 1 7 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.773 -0.436 25767 6341 1 7 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.589 -0.489 25767 6342 1 7 . 1 1 145 145 ASN H H 145 7.940 7.940 7.838 0.102 25767 6343 1 7 . 1 1 146 146 SER N N 146 116.905 116.905 117.100 -0.195 25767 6344 1 7 . 1 1 146 146 SER HA H 146 3.936 3.936 4.154 -0.218 25767 6345 1 7 . 1 1 146 146 SER C C 146 176.963 176.963 176.741 0.222 25767 6346 1 7 . 1 1 146 146 SER CA C 146 61.997 61.997 62.078 -0.080 25767 6347 1 7 . 1 1 146 146 SER CB C 146 62.879 62.879 63.212 -0.333 25767 6348 1 7 . 1 1 146 146 SER H H 146 7.951 7.951 7.753 0.198 25767 6349 1 7 . 1 1 147 147 LEU N N 147 123.253 123.253 122.052 1.201 25767 6350 1 7 . 1 1 147 147 LEU HA H 147 3.875 3.875 4.033 -0.158 25767 6351 1 7 . 1 1 147 147 LEU C C 147 178.726 178.726 178.850 -0.124 25767 6352 1 7 . 1 1 147 147 LEU CA C 147 58.580 58.580 58.169 0.411 25767 6353 1 7 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.663 -0.803 25767 6354 1 7 . 1 1 147 147 LEU H H 147 8.168 8.168 7.817 0.351 25767 6355 1 7 . 1 1 148 148 GLN N N 148 118.212 118.212 118.146 0.066 25767 6356 1 7 . 1 1 148 148 GLN HA H 148 3.817 3.817 4.046 -0.229 25767 6357 1 7 . 1 1 148 148 GLN C C 148 179.686 179.686 178.399 1.287 25767 6358 1 7 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.447 0.796 25767 6359 1 7 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.975 -0.255 25767 6360 1 7 . 1 1 148 148 GLN H H 148 8.295 8.295 8.879 -0.584 25767 6361 1 7 . 1 1 149 149 LYS N N 149 120.770 120.770 120.547 0.223 25767 6362 1 7 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.926 -0.025 25767 6363 1 7 . 1 1 149 149 LYS C C 149 178.006 178.006 178.858 -0.852 25767 6364 1 7 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.519 0.013 25767 6365 1 7 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.356 -0.464 25767 6366 1 7 . 1 1 149 149 LYS H H 149 7.955 7.955 8.369 -0.414 25767 6367 1 7 . 1 1 150 150 ARG N N 150 119.244 119.244 118.743 0.501 25767 6368 1 7 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.949 -0.109 25767 6369 1 7 . 1 1 150 150 ARG C C 150 178.858 178.858 178.878 -0.020 25767 6370 1 7 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.182 0.189 25767 6371 1 7 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.848 -1.044 25767 6372 1 7 . 1 1 150 150 ARG H H 150 7.020 7.020 7.553 -0.533 25767 6373 1 7 . 1 1 151 151 ILE N N 151 121.183 121.183 119.918 1.265 25767 6374 1 7 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.693 -0.334 25767 6375 1 7 . 1 1 151 151 ILE C C 151 177.327 177.327 177.927 -0.600 25767 6376 1 7 . 1 1 151 151 ILE CA C 151 67.196 67.196 62.817 4.379 25767 6377 1 7 . 1 1 151 151 ILE CB C 151 38.272 38.272 36.505 1.767 25767 6378 1 7 . 1 1 151 151 ILE H H 151 7.574 7.574 7.629 -0.055 25767 6379 1 7 . 1 1 152 152 LYS N N 152 119.521 119.521 119.818 -0.297 25767 6380 1 7 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.863 -0.090 25767 6381 1 7 . 1 1 152 152 LYS C C 152 178.016 178.016 178.974 -0.958 25767 6382 1 7 . 1 1 152 152 LYS CA C 152 59.830 59.830 60.164 -0.334 25767 6383 1 7 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.230 -0.649 25767 6384 1 7 . 1 1 152 152 LYS H H 152 7.629 7.629 8.100 -0.471 25767 6385 1 7 . 1 1 153 153 TYR N N 153 120.178 120.178 120.988 -0.810 25767 6386 1 7 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.156 -0.084 25767 6387 1 7 . 1 1 153 153 TYR C C 153 178.195 178.195 177.791 0.404 25767 6388 1 7 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.899 -0.583 25767 6389 1 7 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.378 -1.105 25767 6390 1 7 . 1 1 153 153 TYR H H 153 8.407 8.407 7.766 0.641 25767 6391 1 7 . 1 1 154 154 CYS N N 154 117.013 117.013 118.409 -1.396 25767 6392 1 7 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.186 -0.114 25767 6393 1 7 . 1 1 154 154 CYS C C 154 176.827 176.827 177.168 -0.341 25767 6394 1 7 . 1 1 154 154 CYS CA C 154 65.780 65.780 62.945 2.835 25767 6395 1 7 . 1 1 154 154 CYS CB C 154 28.160 28.160 28.057 0.103 25767 6396 1 7 . 1 1 154 154 CYS H H 154 8.291 8.291 7.842 0.449 25767 6397 1 7 . 1 1 155 155 LYS N N 155 118.753 118.753 120.543 -1.790 25767 6398 1 7 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.850 -0.179 25767 6399 1 7 . 1 1 155 155 LYS C C 155 179.904 179.904 178.749 1.155 25767 6400 1 7 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.534 0.950 25767 6401 1 7 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.268 -0.325 25767 6402 1 7 . 1 1 155 155 LYS H H 155 7.934 7.934 8.273 -0.339 25767 6403 1 7 . 1 1 156 156 ILE N N 156 123.873 123.873 120.871 3.002 25767 6404 1 7 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.613 -0.029 25767 6405 1 7 . 1 1 156 156 ILE C C 156 179.501 179.501 177.650 1.851 25767 6406 1 7 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.676 -0.436 25767 6407 1 7 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.997 -0.355 25767 6408 1 7 . 1 1 156 156 ILE H H 156 8.314 8.314 8.617 -0.303 25767 6409 1 7 . 1 1 157 157 TYR N N 157 121.132 121.132 119.901 1.231 25767 6410 1 7 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.975 0.190 25767 6411 1 7 . 1 1 157 157 TYR C C 157 178.558 178.558 177.439 1.119 25767 6412 1 7 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.956 0.154 25767 6413 1 7 . 1 1 157 157 TYR H H 157 8.442 8.442 7.574 0.868 25767 6414 1 7 . 1 1 158 158 LEU N N 158 120.964 120.964 119.723 1.241 25767 6415 1 7 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.811 0.101 25767 6416 1 7 . 1 1 158 158 LEU C C 158 180.130 180.130 178.577 1.553 25767 6417 1 7 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.768 0.918 25767 6418 1 7 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.605 0.125 25767 6419 1 7 . 1 1 158 158 LEU H H 158 8.469 8.469 7.917 0.552 25767 6420 1 7 . 1 1 159 159 SER N N 159 116.653 116.653 115.112 1.541 25767 6421 1 7 . 1 1 159 159 SER HA H 159 4.246 4.246 4.012 0.234 25767 6422 1 7 . 1 1 159 159 SER CA C 159 61.460 61.460 62.363 -0.903 25767 6423 1 7 . 1 1 159 159 SER CB C 159 62.849 62.849 62.825 0.024 25767 6424 1 7 . 1 1 159 159 SER H H 159 7.758 7.758 8.301 -0.543 25767 6425 1 7 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.290 -1.917 25767 6426 1 7 . 1 1 160 160 LYS CB C 160 29.832 29.832 32.064 -2.232 25767 6427 1 7 . 1 1 160 160 LYS H H 160 8.425 8.425 7.360 1.065 25767 6428 1 7 . 1 1 161 161 LEU N N 161 121.686 121.686 118.758 2.928 25767 6429 1 7 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.744 0.419 25767 6430 1 7 . 1 1 161 161 LEU C C 161 180.224 180.224 179.106 1.118 25767 6431 1 7 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.262 0.322 25767 6432 1 7 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.466 -0.004 25767 6433 1 7 . 1 1 161 161 LEU H H 161 8.323 8.323 7.532 0.791 25767 6434 1 7 . 1 1 162 162 ALA N N 162 123.102 123.102 120.947 2.155 25767 6435 1 7 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.068 0.062 25767 6436 1 7 . 1 1 162 162 ALA C C 162 179.487 179.487 179.113 0.374 25767 6437 1 7 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.678 0.066 25767 6438 1 7 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.473 -0.070 25767 6439 1 7 . 1 1 162 162 ALA H H 162 7.978 7.978 7.585 0.393 25767 6440 1 7 . 1 1 163 163 LYS N N 163 116.069 116.069 116.347 -0.278 25767 6441 1 7 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.254 -0.031 25767 6442 1 7 . 1 1 163 163 LYS C C 163 176.987 176.987 176.589 0.398 25767 6443 1 7 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.314 0.292 25767 6444 1 7 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.713 0.493 25767 6445 1 7 . 1 1 163 163 LYS H H 163 7.697 7.697 7.702 -0.005 25767 6446 1 7 . 1 1 164 164 GLY N N 164 108.540 108.540 107.012 1.528 25767 6447 1 7 . 1 1 164 164 GLY C C 164 174.721 174.721 173.859 0.862 25767 6448 1 7 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.820 0.971 25767 6449 1 7 . 1 1 164 164 GLY H H 164 7.772 7.772 7.427 0.345 25767 6450 1 7 . 1 1 165 165 GLU N N 165 119.886 119.886 120.592 -0.706 25767 6451 1 7 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.340 -0.290 25767 6452 1 7 . 1 1 165 165 GLU C C 165 176.027 176.027 175.024 1.003 25767 6453 1 7 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.070 1.783 25767 6454 1 7 . 1 1 165 165 GLU CB C 165 30.338 30.338 30.954 -0.617 25767 6455 1 7 . 1 1 165 165 GLU H H 165 8.065 8.065 7.794 0.271 25767 6456 1 7 . 1 1 166 166 ILE N N 166 117.926 117.926 122.635 -4.709 25767 6457 1 7 . 1 1 166 166 ILE HA H 166 3.902 3.902 4.004 -0.102 25767 6458 1 7 . 1 1 166 166 ILE C C 166 174.138 174.138 176.666 -2.528 25767 6459 1 7 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.611 1.844 25767 6460 1 7 . 1 1 166 166 ILE CB C 166 40.202 40.202 38.770 1.433 25767 6461 1 7 . 1 1 166 166 ILE H H 166 7.282 7.282 8.160 -0.878 25767 6462 1 8 . 1 1 2 2 ALA N N 2 122.811 122.811 123.730 -0.919 25767 6463 1 8 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.133 -0.110 25767 6464 1 8 . 1 1 2 2 ALA C C 2 179.915 179.915 179.651 0.264 25767 6465 1 8 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.390 -0.273 25767 6466 1 8 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.425 0.114 25767 6467 1 8 . 1 1 2 2 ALA H H 2 8.509 8.509 8.482 0.027 25767 6468 1 8 . 1 1 3 3 SER N N 3 115.308 115.308 114.629 0.679 25767 6469 1 8 . 1 1 3 3 SER HA H 3 4.097 4.097 4.115 -0.018 25767 6470 1 8 . 1 1 3 3 SER C C 3 176.706 176.706 176.524 0.182 25767 6471 1 8 . 1 1 3 3 SER CA C 3 60.665 60.665 61.800 -1.135 25767 6472 1 8 . 1 1 3 3 SER CB C 3 62.710 62.710 62.438 0.272 25767 6473 1 8 . 1 1 3 3 SER H H 3 7.996 7.996 8.818 -0.822 25767 6474 1 8 . 1 1 4 4 ASN N N 4 122.688 122.688 120.822 1.866 25767 6475 1 8 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.440 -0.136 25767 6476 1 8 . 1 1 4 4 ASN C C 4 176.258 176.258 177.122 -0.864 25767 6477 1 8 . 1 1 4 4 ASN CA C 4 55.701 55.701 56.461 -0.760 25767 6478 1 8 . 1 1 4 4 ASN CB C 4 38.177 38.177 38.081 0.096 25767 6479 1 8 . 1 1 4 4 ASN H H 4 8.075 8.075 8.119 -0.044 25767 6480 1 8 . 1 1 5 5 ALA N N 5 121.900 121.900 122.330 -0.430 25767 6481 1 8 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.147 -0.572 25767 6482 1 8 . 1 1 5 5 ALA C C 5 178.475 178.475 179.191 -0.716 25767 6483 1 8 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.907 0.925 25767 6484 1 8 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.166 -0.551 25767 6485 1 8 . 1 1 5 5 ALA H H 5 8.659 8.659 7.732 0.927 25767 6486 1 8 . 1 1 6 6 ALA N N 6 117.768 117.768 121.751 -3.983 25767 6487 1 8 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.984 -0.197 25767 6488 1 8 . 1 1 6 6 ALA C C 6 180.494 180.494 179.457 1.037 25767 6489 1 8 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.081 0.269 25767 6490 1 8 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.220 -0.318 25767 6491 1 8 . 1 1 6 6 ALA H H 6 7.864 7.864 7.780 0.084 25767 6492 1 8 . 1 1 7 7 ARG N N 7 121.173 121.173 119.130 2.043 25767 6493 1 8 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.109 -0.206 25767 6494 1 8 . 1 1 7 7 ARG C C 7 179.189 179.189 178.571 0.618 25767 6495 1 8 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.422 0.890 25767 6496 1 8 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.700 -0.478 25767 6497 1 8 . 1 1 7 7 ARG H H 7 7.514 7.514 8.006 -0.492 25767 6498 1 8 . 1 1 8 8 VAL N N 8 122.979 122.979 120.163 2.816 25767 6499 1 8 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.737 -0.484 25767 6500 1 8 . 1 1 8 8 VAL C C 8 177.821 177.821 177.984 -0.163 25767 6501 1 8 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.925 0.847 25767 6502 1 8 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.248 0.193 25767 6503 1 8 . 1 1 8 8 VAL H H 8 8.101 8.101 7.781 0.320 25767 6504 1 8 . 1 1 9 9 VAL N N 9 119.801 119.801 120.355 -0.554 25767 6505 1 8 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.590 -0.324 25767 6506 1 8 . 1 1 9 9 VAL C C 9 177.373 177.373 177.908 -0.535 25767 6507 1 8 . 1 1 9 9 VAL CA C 9 67.484 67.484 67.140 0.344 25767 6508 1 8 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.861 0.764 25767 6509 1 8 . 1 1 9 9 VAL H H 9 8.362 8.362 8.069 0.293 25767 6510 1 8 . 1 1 10 10 ALA N N 10 122.360 122.360 122.027 0.333 25767 6511 1 8 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.073 -0.137 25767 6512 1 8 . 1 1 10 10 ALA C C 10 180.762 180.762 179.660 1.102 25767 6513 1 8 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.469 -0.025 25767 6514 1 8 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.243 -0.506 25767 6515 1 8 . 1 1 10 10 ALA H H 10 7.776 7.776 7.859 -0.083 25767 6516 1 8 . 1 1 11 11 THR N N 11 117.376 117.376 114.753 2.623 25767 6517 1 8 . 1 1 11 11 THR HA H 11 3.816 3.816 4.089 -0.273 25767 6518 1 8 . 1 1 11 11 THR C C 11 175.775 175.775 176.410 -0.635 25767 6519 1 8 . 1 1 11 11 THR CA C 11 66.509 66.509 66.508 0.001 25767 6520 1 8 . 1 1 11 11 THR CB C 11 68.588 68.588 68.834 -0.246 25767 6521 1 8 . 1 1 11 11 THR H H 11 8.180 8.180 8.310 -0.130 25767 6522 1 8 . 1 1 12 12 ALA N N 12 125.308 125.308 124.114 1.194 25767 6523 1 8 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.781 0.216 25767 6524 1 8 . 1 1 12 12 ALA C C 12 179.399 179.399 179.328 0.071 25767 6525 1 8 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.481 0.595 25767 6526 1 8 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.235 1.009 25767 6527 1 8 . 1 1 12 12 ALA H H 12 8.671 8.671 8.567 0.104 25767 6528 1 8 . 1 1 13 13 LYS N N 13 116.977 116.977 118.475 -1.498 25767 6529 1 8 . 1 1 13 13 LYS C C 13 179.646 179.646 178.698 0.948 25767 6530 1 8 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.776 -0.855 25767 6531 1 8 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.151 -0.708 25767 6532 1 8 . 1 1 13 13 LYS H H 13 8.061 8.061 7.674 0.387 25767 6533 1 8 . 1 1 14 14 ASP N N 14 121.988 121.988 120.078 1.910 25767 6534 1 8 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.451 -0.098 25767 6535 1 8 . 1 1 14 14 ASP C C 14 179.446 179.446 178.628 0.818 25767 6536 1 8 . 1 1 14 14 ASP CA C 14 57.509 57.509 57.021 0.488 25767 6537 1 8 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.574 -0.573 25767 6538 1 8 . 1 1 14 14 ASP H H 14 7.669 7.669 7.699 -0.030 25767 6539 1 8 . 1 1 15 15 PHE N N 15 119.588 119.588 118.203 1.385 25767 6540 1 8 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.199 0.145 25767 6541 1 8 . 1 1 15 15 PHE C C 15 178.373 178.373 177.980 0.393 25767 6542 1 8 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.566 0.671 25767 6543 1 8 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.727 -1.232 25767 6544 1 8 . 1 1 15 15 PHE H H 15 7.913 7.913 8.090 -0.177 25767 6545 1 8 . 1 1 16 16 ASP N N 16 121.705 121.705 119.894 1.811 25767 6546 1 8 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.441 -0.446 25767 6547 1 8 . 1 1 16 16 ASP C C 16 180.071 180.071 179.436 0.635 25767 6548 1 8 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.171 0.978 25767 6549 1 8 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.650 0.837 25767 6550 1 8 . 1 1 16 16 ASP H H 16 8.324 8.324 8.001 0.323 25767 6551 1 8 . 1 1 17 17 LYS N N 17 118.825 118.825 119.542 -0.717 25767 6552 1 8 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.105 -0.068 25767 6553 1 8 . 1 1 17 17 LYS C C 17 178.407 178.407 177.989 0.418 25767 6554 1 8 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.835 0.226 25767 6555 1 8 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.586 -0.002 25767 6556 1 8 . 1 1 17 17 LYS H H 17 7.834 7.834 7.740 0.094 25767 6557 1 8 . 1 1 18 18 VAL N N 18 110.562 110.562 116.928 -6.366 25767 6558 1 8 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.008 0.508 25767 6559 1 8 . 1 1 18 18 VAL C C 18 176.144 176.144 176.456 -0.312 25767 6560 1 8 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.369 -2.495 25767 6561 1 8 . 1 1 18 18 VAL CB C 18 31.160 31.160 32.122 -0.962 25767 6562 1 8 . 1 1 18 18 VAL H H 18 7.185 7.185 7.534 -0.349 25767 6563 1 8 . 1 1 19 19 GLY N N 19 109.272 109.272 106.982 2.290 25767 6564 1 8 . 1 1 19 19 GLY C C 19 175.043 175.043 174.991 0.052 25767 6565 1 8 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.396 0.435 25767 6566 1 8 . 1 1 19 19 GLY H H 19 7.723 7.723 7.674 0.049 25767 6567 1 8 . 1 1 20 20 LEU N N 20 125.428 125.428 122.580 2.848 25767 6568 1 8 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.678 -0.358 25767 6569 1 8 . 1 1 20 20 LEU C C 20 177.949 177.949 177.192 0.757 25767 6570 1 8 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.332 -0.528 25767 6571 1 8 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.001 0.916 25767 6572 1 8 . 1 1 20 20 LEU H H 20 8.083 8.083 8.048 0.035 25767 6573 1 8 . 1 1 21 21 GLY N N 21 107.804 107.804 109.978 -2.174 25767 6574 1 8 . 1 1 21 21 GLY C C 21 176.278 176.278 175.983 0.295 25767 6575 1 8 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.345 -0.051 25767 6576 1 8 . 1 1 21 21 GLY H H 21 7.982 7.982 7.927 0.055 25767 6577 1 8 . 1 1 22 22 ILE N N 22 121.319 121.319 122.239 -0.920 25767 6578 1 8 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.700 0.210 25767 6579 1 8 . 1 1 22 22 ILE C C 22 176.604 176.604 177.864 -1.260 25767 6580 1 8 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.111 -1.665 25767 6581 1 8 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.697 -1.131 25767 6582 1 8 . 1 1 22 22 ILE H H 22 8.478 8.478 7.863 0.615 25767 6583 1 8 . 1 1 23 23 ILE N N 23 120.377 120.377 119.593 0.784 25767 6584 1 8 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.792 -0.079 25767 6585 1 8 . 1 1 23 23 ILE C C 23 178.581 178.581 178.250 0.331 25767 6586 1 8 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.227 1.019 25767 6587 1 8 . 1 1 23 23 ILE CB C 23 36.199 36.199 36.145 0.054 25767 6588 1 8 . 1 1 23 23 ILE H H 23 6.869 6.869 7.652 -0.783 25767 6589 1 8 . 1 1 24 24 GLY N N 24 103.449 103.449 108.468 -5.019 25767 6590 1 8 . 1 1 24 24 GLY C C 24 175.308 175.308 175.783 -0.475 25767 6591 1 8 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.185 0.757 25767 6592 1 8 . 1 1 24 24 GLY H H 24 7.488 7.488 7.769 -0.281 25767 6593 1 8 . 1 1 25 25 TYR N N 25 124.685 124.685 124.442 0.243 25767 6594 1 8 . 1 1 25 25 TYR HA H 25 3.666 3.666 4.124 -0.458 25767 6595 1 8 . 1 1 25 25 TYR C C 25 176.208 176.208 177.386 -1.178 25767 6596 1 8 . 1 1 25 25 TYR CA C 25 61.371 61.371 61.396 -0.025 25767 6597 1 8 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.509 -0.242 25767 6598 1 8 . 1 1 25 25 TYR H H 25 7.931 7.931 8.255 -0.324 25767 6599 1 8 . 1 1 26 26 TYR N N 26 117.001 117.001 119.745 -2.744 25767 6600 1 8 . 1 1 26 26 TYR HA H 26 3.941 3.941 4.049 -0.108 25767 6601 1 8 . 1 1 26 26 TYR C C 26 178.753 178.753 177.533 1.220 25767 6602 1 8 . 1 1 26 26 TYR CA C 26 64.260 64.260 62.023 2.237 25767 6603 1 8 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.971 -1.450 25767 6604 1 8 . 1 1 26 26 TYR H H 26 7.693 7.693 7.943 -0.250 25767 6605 1 8 . 1 1 27 27 LEU N N 27 118.657 118.657 118.564 0.093 25767 6606 1 8 . 1 1 27 27 LEU HA H 27 4.311 4.311 4.102 0.209 25767 6607 1 8 . 1 1 27 27 LEU CA C 27 58.297 58.297 57.981 0.316 25767 6608 1 8 . 1 1 27 27 LEU CB C 27 42.723 42.723 41.196 1.527 25767 6609 1 8 . 1 1 27 27 LEU H H 27 8.339 8.339 8.445 -0.106 25767 6610 1 8 . 1 1 28 28 GLN N N 28 118.593 118.593 118.752 -0.159 25767 6611 1 8 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.808 -0.157 25767 6612 1 8 . 1 1 28 28 GLN C C 28 177.282 177.282 178.496 -1.214 25767 6613 1 8 . 1 1 28 28 GLN CA C 28 58.829 58.829 59.227 -0.398 25767 6614 1 8 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.641 1.007 25767 6615 1 8 . 1 1 28 28 GLN H H 28 7.970 7.970 8.260 -0.290 25767 6616 1 8 . 1 1 29 29 LEU N N 29 122.111 122.111 119.718 2.393 25767 6617 1 8 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.746 0.198 25767 6618 1 8 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.602 1.063 25767 6619 1 8 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.353 0.654 25767 6620 1 8 . 1 1 29 29 LEU H H 29 7.979 7.979 7.448 0.531 25767 6621 1 8 . 1 1 30 30 TYR N N 30 119.283 119.283 120.096 -0.813 25767 6622 1 8 . 1 1 30 30 TYR C C 30 175.775 175.775 177.232 -1.457 25767 6623 1 8 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.833 -1.739 25767 6624 1 8 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.369 0.704 25767 6625 1 8 . 1 1 30 30 TYR H H 30 8.093 8.093 7.582 0.511 25767 6626 1 8 . 1 1 31 31 ALA N N 31 121.327 121.327 122.095 -0.768 25767 6627 1 8 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.867 -0.499 25767 6628 1 8 . 1 1 31 31 ALA C C 31 178.955 178.955 178.708 0.247 25767 6629 1 8 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.350 0.197 25767 6630 1 8 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.286 -0.323 25767 6631 1 8 . 1 1 31 31 ALA H H 31 8.394 8.394 8.265 0.129 25767 6632 1 8 . 1 1 32 32 VAL N N 32 116.757 116.757 118.450 -1.693 25767 6633 1 8 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.545 -0.285 25767 6634 1 8 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.658 2.004 25767 6635 1 8 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.637 -0.666 25767 6636 1 8 . 1 1 32 32 VAL H H 32 8.020 8.020 7.595 0.425 25767 6637 1 8 . 1 1 33 33 GLU N N 33 118.775 118.775 119.702 -0.927 25767 6638 1 8 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.789 0.200 25767 6639 1 8 . 1 1 33 33 GLU C C 33 179.746 179.746 178.923 0.823 25767 6640 1 8 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.387 0.616 25767 6641 1 8 . 1 1 33 33 GLU H H 33 7.358 7.358 7.556 -0.198 25767 6642 1 8 . 1 1 34 34 LEU N N 34 120.632 120.632 121.774 -1.142 25767 6643 1 8 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.892 -0.243 25767 6644 1 8 . 1 1 34 34 LEU C C 34 180.336 180.336 178.723 1.613 25767 6645 1 8 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.692 -0.017 25767 6646 1 8 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.795 -0.207 25767 6647 1 8 . 1 1 34 34 LEU H H 34 8.390 8.390 7.809 0.581 25767 6648 1 8 . 1 1 35 35 ILE N N 35 121.240 121.240 118.222 3.018 25767 6649 1 8 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.674 -0.132 25767 6650 1 8 . 1 1 35 35 ILE C C 35 178.604 178.604 177.599 1.005 25767 6651 1 8 . 1 1 35 35 ILE CA C 35 65.547 65.547 64.841 0.706 25767 6652 1 8 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.907 0.824 25767 6653 1 8 . 1 1 35 35 ILE H H 35 8.129 8.129 7.495 0.634 25767 6654 1 8 . 1 1 36 36 LEU N N 36 115.637 115.637 116.962 -1.325 25767 6655 1 8 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.091 -0.083 25767 6656 1 8 . 1 1 36 36 LEU C C 36 178.001 178.001 178.424 -0.423 25767 6657 1 8 . 1 1 36 36 LEU CA C 36 56.076 56.076 56.809 -0.732 25767 6658 1 8 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.987 -2.053 25767 6659 1 8 . 1 1 36 36 LEU H H 36 8.416 8.416 7.751 0.665 25767 6660 1 8 . 1 1 37 37 SER N N 37 114.106 114.106 112.319 1.787 25767 6661 1 8 . 1 1 37 37 SER HA H 37 3.991 3.991 4.223 -0.232 25767 6662 1 8 . 1 1 37 37 SER C C 37 173.997 173.997 175.223 -1.226 25767 6663 1 8 . 1 1 37 37 SER CA C 37 60.311 60.311 59.664 0.647 25767 6664 1 8 . 1 1 37 37 SER CB C 37 63.746 63.746 63.704 0.042 25767 6665 1 8 . 1 1 37 37 SER H H 37 7.517 7.517 7.818 -0.301 25767 6666 1 8 . 1 1 38 38 GLU N N 38 123.003 123.003 122.393 0.610 25767 6667 1 8 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.232 0.137 25767 6668 1 8 . 1 1 38 38 GLU C C 38 175.780 175.780 175.994 -0.214 25767 6669 1 8 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.965 -0.599 25767 6670 1 8 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.948 -0.655 25767 6671 1 8 . 1 1 38 38 GLU H H 38 7.151 7.151 7.605 -0.454 25767 6672 1 8 . 1 1 39 39 GLU N N 39 126.166 126.166 121.938 4.228 25767 6673 1 8 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.166 -0.157 25767 6674 1 8 . 1 1 39 39 GLU C C 39 176.652 176.652 175.764 0.888 25767 6675 1 8 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.140 2.058 25767 6676 1 8 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.360 -0.325 25767 6677 1 8 . 1 1 39 39 GLU H H 39 8.587 8.587 8.346 0.241 25767 6678 1 8 . 1 1 40 40 ASP N N 40 120.047 120.047 120.227 -0.180 25767 6679 1 8 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.415 0.135 25767 6680 1 8 . 1 1 40 40 ASP C C 40 175.035 175.035 175.959 -0.924 25767 6681 1 8 . 1 1 40 40 ASP CA C 40 53.368 53.368 54.916 -1.548 25767 6682 1 8 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.791 -0.768 25767 6683 1 8 . 1 1 40 40 ASP H H 40 8.504 8.504 8.458 0.046 25767 6684 1 8 . 1 1 41 41 ARG N N 41 120.671 120.671 121.976 -1.305 25767 6685 1 8 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.642 -0.253 25767 6686 1 8 . 1 1 41 41 ARG C C 41 175.755 175.755 176.105 -0.350 25767 6687 1 8 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.718 0.290 25767 6688 1 8 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.681 -1.132 25767 6689 1 8 . 1 1 41 41 ARG H H 41 7.672 7.672 8.140 -0.468 25767 6690 1 8 . 1 1 42 42 SER N N 42 120.330 120.330 115.562 4.768 25767 6691 1 8 . 1 1 42 42 SER HA H 42 3.837 3.837 4.346 -0.509 25767 6692 1 8 . 1 1 42 42 SER CA C 42 57.326 57.326 58.389 -1.063 25767 6693 1 8 . 1 1 42 42 SER CB C 42 65.762 65.762 64.248 1.514 25767 6694 1 8 . 1 1 42 42 SER H H 42 8.544 8.544 8.549 -0.005 25767 6695 1 8 . 1 1 43 43 GLN HA H 43 3.989 3.989 4.010 -0.021 25767 6696 1 8 . 1 1 43 43 GLN C C 43 178.907 178.907 178.177 0.730 25767 6697 1 8 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.234 1.136 25767 6698 1 8 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.050 -0.088 25767 6699 1 8 . 1 1 44 44 GLU N N 44 120.328 120.328 120.429 -0.101 25767 6700 1 8 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.961 0.052 25767 6701 1 8 . 1 1 44 44 GLU C C 44 179.824 179.824 178.776 1.048 25767 6702 1 8 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.308 0.737 25767 6703 1 8 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.294 -0.646 25767 6704 1 8 . 1 1 44 44 GLU H H 44 8.938 8.938 7.673 1.265 25767 6705 1 8 . 1 1 45 45 MET N N 45 121.030 121.030 117.040 3.990 25767 6706 1 8 . 1 1 45 45 MET HA H 45 4.412 4.412 4.264 0.148 25767 6707 1 8 . 1 1 45 45 MET C C 45 180.357 180.357 178.275 2.082 25767 6708 1 8 . 1 1 45 45 MET CA C 45 57.209 57.209 58.686 -1.477 25767 6709 1 8 . 1 1 45 45 MET CB C 45 32.436 32.436 32.141 0.295 25767 6710 1 8 . 1 1 45 45 MET H H 45 7.756 7.756 7.749 0.007 25767 6711 1 8 . 1 1 46 46 THR N N 46 120.008 120.008 116.874 3.134 25767 6712 1 8 . 1 1 46 46 THR HA H 46 4.071 4.071 3.881 0.190 25767 6713 1 8 . 1 1 46 46 THR CA C 46 67.096 67.096 67.135 -0.039 25767 6714 1 8 . 1 1 46 46 THR CB C 46 68.954 68.954 68.481 0.473 25767 6715 1 8 . 1 1 46 46 THR H H 46 8.187 8.187 7.286 0.901 25767 6716 1 8 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.127 -0.018 25767 6717 1 8 . 1 1 47 47 ALA C C 47 180.118 180.118 179.263 0.855 25767 6718 1 8 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.944 0.395 25767 6719 1 8 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.331 -0.498 25767 6720 1 8 . 1 1 47 47 ALA H H 47 8.238 8.238 8.115 0.123 25767 6721 1 8 . 1 1 48 48 LEU N N 48 122.093 122.093 120.713 1.380 25767 6722 1 8 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.057 0.206 25767 6723 1 8 . 1 1 48 48 LEU C C 48 179.103 179.103 178.623 0.480 25767 6724 1 8 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.516 0.225 25767 6725 1 8 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.712 -0.916 25767 6726 1 8 . 1 1 48 48 LEU H H 48 7.778 7.778 7.585 0.193 25767 6727 1 8 . 1 1 49 49 ALA N N 49 120.130 120.130 120.490 -0.360 25767 6728 1 8 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.948 -0.227 25767 6729 1 8 . 1 1 49 49 ALA C C 49 178.676 178.676 179.409 -0.733 25767 6730 1 8 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.377 0.344 25767 6731 1 8 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.051 -0.224 25767 6732 1 8 . 1 1 49 49 ALA H H 49 8.432 8.432 8.547 -0.115 25767 6733 1 8 . 1 1 50 50 THR N N 50 113.333 113.333 115.591 -2.258 25767 6734 1 8 . 1 1 50 50 THR HA H 50 3.895 3.895 3.822 0.073 25767 6735 1 8 . 1 1 50 50 THR C C 50 174.948 174.948 176.445 -1.497 25767 6736 1 8 . 1 1 50 50 THR CA C 50 67.334 67.334 67.995 -0.661 25767 6737 1 8 . 1 1 50 50 THR CB C 50 68.864 68.864 68.634 0.230 25767 6738 1 8 . 1 1 50 50 THR H H 50 7.857 7.857 7.823 0.034 25767 6739 1 8 . 1 1 51 51 GLU N N 51 122.698 122.698 122.069 0.629 25767 6740 1 8 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.012 0.056 25767 6741 1 8 . 1 1 51 51 GLU C C 51 179.997 179.997 178.541 1.456 25767 6742 1 8 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.269 0.164 25767 6743 1 8 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.716 -0.199 25767 6744 1 8 . 1 1 51 51 GLU H H 51 7.817 7.817 7.602 0.215 25767 6745 1 8 . 1 1 52 52 LEU N N 52 121.100 121.100 121.202 -0.102 25767 6746 1 8 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.057 0.072 25767 6747 1 8 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.769 0.120 25767 6748 1 8 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.749 0.198 25767 6749 1 8 . 1 1 52 52 LEU H H 52 8.628 8.628 7.639 0.989 25767 6750 1 8 . 1 1 53 53 LEU N N 53 119.935 119.935 120.008 -0.073 25767 6751 1 8 . 1 1 53 53 LEU C C 53 179.671 179.671 178.283 1.388 25767 6752 1 8 . 1 1 53 53 LEU H H 53 8.303 8.303 7.824 0.479 25767 6753 1 8 . 1 1 54 54 ASP N N 54 120.339 120.339 118.830 1.509 25767 6754 1 8 . 1 1 54 54 ASP C C 54 179.106 179.106 178.392 0.714 25767 6755 1 8 . 1 1 54 54 ASP H H 54 7.901 7.901 7.973 -0.072 25767 6756 1 8 . 1 1 55 55 THR N N 55 120.237 120.237 116.967 3.270 25767 6757 1 8 . 1 1 55 55 THR HA H 55 3.696 3.696 4.045 -0.349 25767 6758 1 8 . 1 1 55 55 THR CA C 55 67.340 67.340 67.425 -0.085 25767 6759 1 8 . 1 1 55 55 THR CB C 55 68.151 68.151 68.605 -0.454 25767 6760 1 8 . 1 1 55 55 THR H H 55 8.262 8.262 7.659 0.603 25767 6761 1 8 . 1 1 56 56 ILE N N 56 123.953 123.953 122.724 1.229 25767 6762 1 8 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.777 0.066 25767 6763 1 8 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.982 -0.088 25767 6764 1 8 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.787 0.346 25767 6765 1 8 . 1 1 56 56 ILE H H 56 8.930 8.930 7.794 1.136 25767 6766 1 8 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.763 -0.182 25767 6767 1 8 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.128 -0.097 25767 6768 1 8 . 1 1 58 58 ALA C C 58 179.875 179.875 179.500 0.375 25767 6769 1 8 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.848 0.418 25767 6770 1 8 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.304 -0.319 25767 6771 1 8 . 1 1 58 58 ALA H H 58 7.764 7.764 8.578 -0.814 25767 6772 1 8 . 1 1 59 59 PHE N N 59 121.988 121.988 119.999 1.989 25767 6773 1 8 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.151 0.075 25767 6774 1 8 . 1 1 59 59 PHE CA C 59 61.439 61.439 60.655 0.784 25767 6775 1 8 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.029 0.334 25767 6776 1 8 . 1 1 59 59 PHE H H 59 8.159 8.159 8.436 -0.277 25767 6777 1 8 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.625 -0.084 25767 6778 1 8 . 1 1 60 60 LYS C C 60 179.438 179.438 178.765 0.673 25767 6779 1 8 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.433 0.703 25767 6780 1 8 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.229 -0.171 25767 6781 1 8 . 1 1 61 61 LYS N N 61 119.262 119.262 117.438 1.824 25767 6782 1 8 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.190 -0.245 25767 6783 1 8 . 1 1 61 61 LYS C C 61 178.730 178.730 177.779 0.951 25767 6784 1 8 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.141 1.901 25767 6785 1 8 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.088 0.554 25767 6786 1 8 . 1 1 61 61 LYS H H 61 7.832 7.832 7.773 0.059 25767 6787 1 8 . 1 1 62 62 GLU N N 62 120.790 120.790 120.818 -0.028 25767 6788 1 8 . 1 1 62 62 GLU HA H 62 3.935 3.935 3.987 -0.052 25767 6789 1 8 . 1 1 62 62 GLU C C 62 178.424 178.424 178.115 0.309 25767 6790 1 8 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.866 -0.152 25767 6791 1 8 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.380 -0.150 25767 6792 1 8 . 1 1 62 62 GLU H H 62 7.982 7.982 7.721 0.261 25767 6793 1 8 . 1 1 63 63 ILE N N 63 118.463 118.463 116.691 1.772 25767 6794 1 8 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.781 -0.092 25767 6795 1 8 . 1 1 63 63 ILE C C 63 177.555 177.555 177.378 0.177 25767 6796 1 8 . 1 1 63 63 ILE CA C 63 61.499 61.499 63.240 -1.741 25767 6797 1 8 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.572 -2.048 25767 6798 1 8 . 1 1 63 63 ILE H H 63 7.732 7.732 7.307 0.425 25767 6799 1 8 . 1 1 64 64 GLY N N 64 107.973 107.973 107.172 0.801 25767 6800 1 8 . 1 1 64 64 GLY C C 64 175.271 175.271 174.983 0.288 25767 6801 1 8 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.187 -0.284 25767 6802 1 8 . 1 1 64 64 GLY H H 64 7.661 7.661 7.856 -0.195 25767 6803 1 8 . 1 1 65 65 GLY N N 65 108.464 108.464 107.141 1.323 25767 6804 1 8 . 1 1 65 65 GLY C C 65 174.800 174.800 175.438 -0.638 25767 6805 1 8 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.253 0.393 25767 6806 1 8 . 1 1 65 65 GLY H H 65 7.808 7.808 7.908 -0.100 25767 6807 1 8 . 1 1 66 66 GLU N N 66 121.162 121.162 121.309 -0.147 25767 6808 1 8 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.032 0.073 25767 6809 1 8 . 1 1 66 66 GLU C C 66 177.230 177.230 178.667 -1.437 25767 6810 1 8 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.287 -2.063 25767 6811 1 8 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.625 0.367 25767 6812 1 8 . 1 1 66 66 GLU H H 66 8.203 8.203 7.866 0.337 25767 6813 1 8 . 1 1 67 67 SER N N 67 116.468 116.468 114.336 2.132 25767 6814 1 8 . 1 1 67 67 SER HA H 67 4.249 4.249 4.200 0.049 25767 6815 1 8 . 1 1 67 67 SER C C 67 174.640 174.640 176.062 -1.422 25767 6816 1 8 . 1 1 67 67 SER CA C 67 58.930 58.930 60.685 -1.755 25767 6817 1 8 . 1 1 67 67 SER CB C 67 63.912 63.912 63.116 0.796 25767 6818 1 8 . 1 1 67 67 SER H H 67 8.206 8.206 8.217 -0.011 25767 6819 1 8 . 1 1 68 68 GLU N N 68 122.400 122.400 121.082 1.318 25767 6820 1 8 . 1 1 68 68 GLU HA H 68 4.153 4.153 3.968 0.185 25767 6821 1 8 . 1 1 68 68 GLU C C 68 176.349 176.349 176.742 -0.393 25767 6822 1 8 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.656 -1.833 25767 6823 1 8 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.427 0.554 25767 6824 1 8 . 1 1 68 68 GLU H H 68 8.168 8.168 8.386 -0.218 25767 6825 1 8 . 1 1 69 69 ALA N N 69 124.342 124.342 119.519 4.823 25767 6826 1 8 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.172 0.016 25767 6827 1 8 . 1 1 69 69 ALA C C 69 178.027 178.027 178.242 -0.215 25767 6828 1 8 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.702 -1.144 25767 6829 1 8 . 1 1 69 69 ALA CB C 69 19.492 19.492 19.234 0.258 25767 6830 1 8 . 1 1 69 69 ALA H H 69 7.939 7.939 7.341 0.598 25767 6831 1 8 . 1 1 70 70 GLU N N 70 121.059 121.059 117.489 3.570 25767 6832 1 8 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.417 -0.303 25767 6833 1 8 . 1 1 70 70 GLU C C 70 176.519 176.519 174.826 1.693 25767 6834 1 8 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.562 1.742 25767 6835 1 8 . 1 1 70 70 GLU CB C 70 29.827 29.827 31.976 -2.149 25767 6836 1 8 . 1 1 70 70 GLU H H 70 8.430 8.430 7.741 0.689 25767 6837 1 8 . 1 1 71 71 ASP N N 71 120.274 120.274 121.166 -0.892 25767 6838 1 8 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.361 0.171 25767 6839 1 8 . 1 1 71 71 ASP C C 71 176.369 176.369 177.104 -0.735 25767 6840 1 8 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.394 -1.143 25767 6841 1 8 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.684 1.156 25767 6842 1 8 . 1 1 71 71 ASP H H 71 8.305 8.305 8.867 -0.562 25767 6843 1 8 . 1 1 72 72 SER N N 72 116.165 116.165 111.998 4.167 25767 6844 1 8 . 1 1 72 72 SER HA H 72 4.241 4.241 4.124 0.117 25767 6845 1 8 . 1 1 72 72 SER C C 72 174.567 174.567 175.623 -1.056 25767 6846 1 8 . 1 1 72 72 SER CA C 72 59.031 59.031 60.898 -1.867 25767 6847 1 8 . 1 1 72 72 SER CB C 72 64.040 64.040 63.558 0.482 25767 6848 1 8 . 1 1 72 72 SER H H 72 7.964 7.964 8.518 -0.554 25767 6849 1 8 . 1 1 73 73 ASP N N 73 122.440 122.440 122.207 0.233 25767 6850 1 8 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.047 0.487 25767 6851 1 8 . 1 1 73 73 ASP C C 73 176.882 176.882 177.963 -1.081 25767 6852 1 8 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.157 -2.714 25767 6853 1 8 . 1 1 73 73 ASP CB C 73 41.336 41.336 39.836 1.500 25767 6854 1 8 . 1 1 73 73 ASP H H 73 8.392 8.392 8.553 -0.161 25767 6855 1 8 . 1 1 74 74 LYS N N 74 123.270 123.270 120.734 2.536 25767 6856 1 8 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.104 -0.011 25767 6857 1 8 . 1 1 74 74 LYS C C 74 177.608 177.608 178.462 -0.854 25767 6858 1 8 . 1 1 74 74 LYS CA C 74 57.465 57.465 60.150 -2.685 25767 6859 1 8 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.382 -0.236 25767 6860 1 8 . 1 1 74 74 LYS H H 74 8.317 8.317 8.199 0.118 25767 6861 1 8 . 1 1 75 75 SER N N 75 116.557 116.557 115.797 0.760 25767 6862 1 8 . 1 1 75 75 SER HA H 75 4.197 4.197 4.198 -0.001 25767 6863 1 8 . 1 1 75 75 SER C C 75 175.988 175.988 176.709 -0.721 25767 6864 1 8 . 1 1 75 75 SER CA C 75 60.434 60.434 61.657 -1.222 25767 6865 1 8 . 1 1 75 75 SER CB C 75 63.172 63.172 62.664 0.508 25767 6866 1 8 . 1 1 75 75 SER H H 75 8.387 8.387 7.825 0.562 25767 6867 1 8 . 1 1 76 76 LEU N N 76 123.910 123.910 122.750 1.160 25767 6868 1 8 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.924 0.246 25767 6869 1 8 . 1 1 76 76 LEU C C 76 178.083 178.083 179.228 -1.145 25767 6870 1 8 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.775 -1.283 25767 6871 1 8 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.360 0.337 25767 6872 1 8 . 1 1 76 76 LEU H H 76 8.059 8.059 8.074 -0.015 25767 6873 1 8 . 1 1 77 77 HIS N N 77 120.620 120.620 118.862 1.758 25767 6874 1 8 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.329 -0.041 25767 6875 1 8 . 1 1 77 77 HIS C C 77 177.667 177.667 178.308 -0.641 25767 6876 1 8 . 1 1 77 77 HIS CA C 77 58.422 58.422 59.130 -0.708 25767 6877 1 8 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.326 0.938 25767 6878 1 8 . 1 1 77 77 HIS H H 77 7.936 7.936 8.246 -0.310 25767 6879 1 8 . 1 1 78 78 VAL N N 78 121.774 121.774 120.213 1.561 25767 6880 1 8 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.768 -0.091 25767 6881 1 8 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.128 -0.522 25767 6882 1 8 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.202 0.662 25767 6883 1 8 . 1 1 78 78 VAL H H 78 7.916 7.916 7.912 0.004 25767 6884 1 8 . 1 1 79 79 MET N N 79 119.660 119.660 118.478 1.182 25767 6885 1 8 . 1 1 79 79 MET HA H 79 3.925 3.925 4.016 -0.091 25767 6886 1 8 . 1 1 79 79 MET C C 79 177.077 177.077 178.634 -1.557 25767 6887 1 8 . 1 1 79 79 MET CA C 79 58.862 58.862 59.764 -0.902 25767 6888 1 8 . 1 1 79 79 MET CB C 79 32.852 32.852 32.141 0.711 25767 6889 1 8 . 1 1 79 79 MET H H 79 8.149 8.149 8.087 0.062 25767 6890 1 8 . 1 1 80 80 ASN N N 80 117.337 117.337 117.925 -0.588 25767 6891 1 8 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.848 -0.710 25767 6892 1 8 . 1 1 80 80 ASN C C 80 178.133 178.133 178.255 -0.122 25767 6893 1 8 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.741 0.298 25767 6894 1 8 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.689 0.307 25767 6895 1 8 . 1 1 80 80 ASN H H 80 8.202 8.202 8.845 -0.643 25767 6896 1 8 . 1 1 81 81 THR N N 81 115.517 115.517 118.317 -2.800 25767 6897 1 8 . 1 1 81 81 THR HA H 81 3.896 3.896 4.144 -0.248 25767 6898 1 8 . 1 1 81 81 THR C C 81 175.186 175.186 176.203 -1.017 25767 6899 1 8 . 1 1 81 81 THR CA C 81 66.221 66.221 67.368 -1.147 25767 6900 1 8 . 1 1 81 81 THR CB C 81 69.087 69.087 68.909 0.178 25767 6901 1 8 . 1 1 81 81 THR H H 81 7.944 7.944 8.114 -0.170 25767 6902 1 8 . 1 1 82 82 LEU N N 82 119.074 119.074 120.270 -1.196 25767 6903 1 8 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.124 -0.143 25767 6904 1 8 . 1 1 82 82 LEU C C 82 177.583 177.583 177.962 -0.379 25767 6905 1 8 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.276 -0.736 25767 6906 1 8 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.822 -0.029 25767 6907 1 8 . 1 1 82 82 LEU H H 82 7.547 7.547 7.762 -0.215 25767 6908 1 8 . 1 1 83 83 ILE N N 83 118.085 118.085 115.871 2.214 25767 6909 1 8 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.483 0.360 25767 6910 1 8 . 1 1 83 83 ILE C C 83 176.413 176.413 177.350 -0.937 25767 6911 1 8 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.846 -1.119 25767 6912 1 8 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.144 -0.446 25767 6913 1 8 . 1 1 83 83 ILE H H 83 7.409 7.409 7.716 -0.307 25767 6914 1 8 . 1 1 84 84 HIS N N 84 116.152 116.152 115.723 0.429 25767 6915 1 8 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.387 0.208 25767 6916 1 8 . 1 1 84 84 HIS C C 84 175.707 175.707 175.542 0.165 25767 6917 1 8 . 1 1 84 84 HIS CA C 84 58.628 58.628 58.506 0.122 25767 6918 1 8 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.572 0.831 25767 6919 1 8 . 1 1 84 84 HIS H H 84 7.194 7.194 7.710 -0.516 25767 6920 1 8 . 1 1 85 85 ASP N N 85 122.322 122.322 119.210 3.112 25767 6921 1 8 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.776 -0.242 25767 6922 1 8 . 1 1 85 85 ASP C C 85 175.580 175.580 176.547 -0.967 25767 6923 1 8 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.246 0.099 25767 6924 1 8 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.492 -0.374 25767 6925 1 8 . 1 1 85 85 ASP H H 85 8.505 8.505 7.782 0.723 25767 6926 1 8 . 1 1 86 86 GLN N N 86 122.783 122.783 127.203 -4.420 25767 6927 1 8 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.097 -0.134 25767 6928 1 8 . 1 1 86 86 GLN C C 86 178.581 178.581 177.870 0.711 25767 6929 1 8 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.217 -1.263 25767 6930 1 8 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.244 -0.350 25767 6931 1 8 . 1 1 86 86 GLN H H 86 8.803 8.803 8.818 -0.015 25767 6932 1 8 . 1 1 87 87 GLU N N 87 121.794 121.794 119.604 2.190 25767 6933 1 8 . 1 1 87 87 GLU HA H 87 4.013 4.013 4.055 -0.042 25767 6934 1 8 . 1 1 87 87 GLU C C 87 178.290 178.290 178.943 -0.653 25767 6935 1 8 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.842 -0.804 25767 6936 1 8 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.271 -0.291 25767 6937 1 8 . 1 1 87 87 GLU H H 87 8.072 8.072 8.384 -0.312 25767 6938 1 8 . 1 1 88 88 LYS N N 88 119.345 119.345 118.090 1.255 25767 6939 1 8 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.138 -0.383 25767 6940 1 8 . 1 1 88 88 LYS C C 88 180.040 180.040 178.703 1.337 25767 6941 1 8 . 1 1 88 88 LYS CA C 88 59.411 59.411 58.947 0.465 25767 6942 1 8 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.707 0.300 25767 6943 1 8 . 1 1 88 88 LYS H H 88 7.588 7.588 7.972 -0.384 25767 6944 1 8 . 1 1 89 89 ALA N N 89 123.933 123.933 122.736 1.197 25767 6945 1 8 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.228 -0.489 25767 6946 1 8 . 1 1 89 89 ALA C C 89 177.457 177.457 179.583 -2.126 25767 6947 1 8 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.231 0.739 25767 6948 1 8 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.302 0.354 25767 6949 1 8 . 1 1 89 89 ALA H H 89 8.500 8.500 7.424 1.076 25767 6950 1 8 . 1 1 90 90 LYS N N 90 119.244 119.244 119.973 -0.729 25767 6951 1 8 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.920 0.124 25767 6952 1 8 . 1 1 90 90 LYS C C 90 177.774 177.774 178.649 -0.875 25767 6953 1 8 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.625 -0.547 25767 6954 1 8 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.478 -2.237 25767 6955 1 8 . 1 1 90 90 LYS H H 90 6.845 6.845 7.975 -1.130 25767 6956 1 8 . 1 1 91 91 ILE N N 91 117.718 117.718 117.293 0.425 25767 6957 1 8 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.644 -0.246 25767 6958 1 8 . 1 1 91 91 ILE C C 91 177.670 177.670 177.576 0.094 25767 6959 1 8 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.806 -0.808 25767 6960 1 8 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.031 0.770 25767 6961 1 8 . 1 1 91 91 ILE H H 91 7.293 7.293 7.917 -0.624 25767 6962 1 8 . 1 1 92 92 TYR N N 92 121.868 121.868 121.422 0.446 25767 6963 1 8 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.072 0.051 25767 6964 1 8 . 1 1 92 92 TYR C C 92 178.781 178.781 177.567 1.214 25767 6965 1 8 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.370 -0.728 25767 6966 1 8 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.805 0.416 25767 6967 1 8 . 1 1 92 92 TYR H H 92 8.016 8.016 7.844 0.172 25767 6968 1 8 . 1 1 93 93 MET N N 93 118.984 118.984 118.290 0.694 25767 6969 1 8 . 1 1 93 93 MET HA H 93 3.952 3.952 4.101 -0.149 25767 6970 1 8 . 1 1 93 93 MET C C 93 179.925 179.925 178.266 1.659 25767 6971 1 8 . 1 1 93 93 MET CA C 93 57.589 57.589 59.372 -1.783 25767 6972 1 8 . 1 1 93 93 MET CB C 93 30.752 30.752 32.747 -1.995 25767 6973 1 8 . 1 1 93 93 MET H H 93 8.464 8.464 8.608 -0.144 25767 6974 1 8 . 1 1 94 94 LEU N N 94 125.441 125.441 122.204 3.237 25767 6975 1 8 . 1 1 94 94 LEU HA H 94 3.870 3.870 4.042 -0.172 25767 6976 1 8 . 1 1 94 94 LEU C C 94 177.937 177.937 178.649 -0.712 25767 6977 1 8 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.169 0.593 25767 6978 1 8 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.599 0.163 25767 6979 1 8 . 1 1 94 94 LEU H H 94 8.927 8.927 8.924 0.003 25767 6980 1 8 . 1 1 95 95 ASN N N 95 119.066 119.066 117.577 1.489 25767 6981 1 8 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.372 -0.110 25767 6982 1 8 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.036 0.237 25767 6983 1 8 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.045 -0.440 25767 6984 1 8 . 1 1 95 95 ASN H H 95 8.691 8.691 8.279 0.412 25767 6985 1 8 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.279 0.386 25767 6986 1 8 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.537 0.534 25767 6987 1 8 . 1 1 96 96 PHE H H 96 8.317 8.317 7.953 0.364 25767 6988 1 8 . 1 1 97 97 THR N N 97 118.178 118.178 114.948 3.230 25767 6989 1 8 . 1 1 97 97 THR HA H 97 3.338 3.338 3.834 -0.496 25767 6990 1 8 . 1 1 97 97 THR C C 97 176.074 176.074 176.609 -0.535 25767 6991 1 8 . 1 1 97 97 THR CA C 97 67.986 67.986 66.538 1.448 25767 6992 1 8 . 1 1 97 97 THR H H 97 8.214 8.214 8.842 -0.628 25767 6993 1 8 . 1 1 98 98 MET N N 98 120.097 120.097 122.223 -2.126 25767 6994 1 8 . 1 1 98 98 MET HA H 98 4.403 4.403 4.072 0.331 25767 6995 1 8 . 1 1 98 98 MET C C 98 178.696 178.696 177.861 0.835 25767 6996 1 8 . 1 1 98 98 MET CA C 98 57.029 57.029 59.501 -2.472 25767 6997 1 8 . 1 1 98 98 MET CB C 98 29.898 29.898 32.267 -2.369 25767 6998 1 8 . 1 1 98 98 MET H H 98 8.885 8.885 8.706 0.179 25767 6999 1 8 . 1 1 99 99 SER N N 99 114.959 114.959 115.745 -0.786 25767 7000 1 8 . 1 1 99 99 SER HA H 99 4.199 4.199 4.151 0.048 25767 7001 1 8 . 1 1 99 99 SER C C 99 176.565 176.565 176.707 -0.142 25767 7002 1 8 . 1 1 99 99 SER CA C 99 61.965 61.965 61.474 0.491 25767 7003 1 8 . 1 1 99 99 SER CB C 99 62.565 62.565 62.673 -0.108 25767 7004 1 8 . 1 1 99 99 SER H H 99 7.515 7.515 7.721 -0.206 25767 7005 1 8 . 1 1 100 100 LEU N N 100 125.380 125.380 122.450 2.930 25767 7006 1 8 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.938 -0.162 25767 7007 1 8 . 1 1 100 100 LEU C C 100 177.689 177.689 178.940 -1.251 25767 7008 1 8 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.560 0.497 25767 7009 1 8 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.456 0.094 25767 7010 1 8 . 1 1 100 100 LEU H H 100 7.400 7.400 7.625 -0.225 25767 7011 1 8 . 1 1 101 101 TYR N N 101 120.597 120.597 120.716 -0.119 25767 7012 1 8 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.905 0.211 25767 7013 1 8 . 1 1 101 101 TYR C C 101 176.825 176.825 177.484 -0.659 25767 7014 1 8 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.479 -0.591 25767 7015 1 8 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.439 0.554 25767 7016 1 8 . 1 1 101 101 TYR H H 101 8.880 8.880 8.703 0.177 25767 7017 1 8 . 1 1 102 102 ASN N N 102 116.869 116.869 116.219 0.650 25767 7018 1 8 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.321 -0.155 25767 7019 1 8 . 1 1 102 102 ASN C C 102 179.089 179.089 177.615 1.474 25767 7020 1 8 . 1 1 102 102 ASN CA C 102 56.212 56.212 55.954 0.258 25767 7021 1 8 . 1 1 102 102 ASN CB C 102 37.734 37.734 37.815 -0.081 25767 7022 1 8 . 1 1 102 102 ASN H H 102 8.543 8.543 7.977 0.566 25767 7023 1 8 . 1 1 103 103 GLU N N 103 121.259 121.259 120.989 0.270 25767 7024 1 8 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.941 0.045 25767 7025 1 8 . 1 1 103 103 GLU C C 103 179.968 179.968 178.851 1.117 25767 7026 1 8 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.576 -0.059 25767 7027 1 8 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.637 -0.087 25767 7028 1 8 . 1 1 103 103 GLU H H 103 7.872 7.872 8.140 -0.268 25767 7029 1 8 . 1 1 104 104 LYS N N 104 120.268 120.268 119.216 1.052 25767 7030 1 8 . 1 1 104 104 LYS HA H 104 4.046 4.046 3.959 0.087 25767 7031 1 8 . 1 1 104 104 LYS C C 104 178.355 178.355 179.037 -0.682 25767 7032 1 8 . 1 1 104 104 LYS CA C 104 56.735 56.735 58.665 -1.930 25767 7033 1 8 . 1 1 104 104 LYS CB C 104 29.113 29.113 31.950 -2.837 25767 7034 1 8 . 1 1 104 104 LYS H H 104 8.384 8.384 8.337 0.047 25767 7035 1 8 . 1 1 105 105 LEU N N 105 121.622 121.622 119.825 1.797 25767 7036 1 8 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.663 0.078 25767 7037 1 8 . 1 1 105 105 LEU C C 105 180.552 180.552 178.843 1.709 25767 7038 1 8 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.049 0.123 25767 7039 1 8 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.312 -0.282 25767 7040 1 8 . 1 1 105 105 LEU H H 105 8.400 8.400 7.639 0.761 25767 7041 1 8 . 1 1 106 106 LYS N N 106 119.498 119.498 117.473 2.025 25767 7042 1 8 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.832 0.082 25767 7043 1 8 . 1 1 106 106 LYS C C 106 178.419 178.419 178.856 -0.437 25767 7044 1 8 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.770 -0.387 25767 7045 1 8 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.958 -0.150 25767 7046 1 8 . 1 1 106 106 LYS H H 106 7.067 7.067 7.573 -0.506 25767 7047 1 8 . 1 1 107 107 GLN N N 107 121.405 121.405 120.119 1.286 25767 7048 1 8 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.994 -0.143 25767 7049 1 8 . 1 1 107 107 GLN C C 107 177.935 177.935 178.584 -0.649 25767 7050 1 8 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.531 -0.050 25767 7051 1 8 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.017 -1.219 25767 7052 1 8 . 1 1 107 107 GLN H H 107 7.460 7.460 8.099 -0.639 25767 7053 1 8 . 1 1 108 108 LEU N N 108 119.561 119.561 117.911 1.650 25767 7054 1 8 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.774 0.027 25767 7055 1 8 . 1 1 108 108 LEU C C 108 179.195 179.195 178.478 0.717 25767 7056 1 8 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.333 1.060 25767 7057 1 8 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.850 -0.584 25767 7058 1 8 . 1 1 108 108 LEU H H 108 8.208 8.208 8.232 -0.024 25767 7059 1 8 . 1 1 109 109 LYS N N 109 118.535 118.535 116.982 1.553 25767 7060 1 8 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.244 0.008 25767 7061 1 8 . 1 1 109 109 LYS C C 109 177.726 177.726 177.952 -0.226 25767 7062 1 8 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.659 0.071 25767 7063 1 8 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.928 -0.518 25767 7064 1 8 . 1 1 109 109 LYS H H 109 7.168 7.168 7.519 -0.351 25767 7065 1 8 . 1 1 110 110 ASP N N 110 117.463 117.463 116.758 0.705 25767 7066 1 8 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.637 -0.032 25767 7067 1 8 . 1 1 110 110 ASP C C 110 177.360 177.360 176.725 0.635 25767 7068 1 8 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.834 1.062 25767 7069 1 8 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.702 0.875 25767 7070 1 8 . 1 1 110 110 ASP H H 110 7.861 7.861 8.401 -0.540 25767 7071 1 8 . 1 1 111 111 GLY N N 111 113.059 113.059 108.623 4.436 25767 7072 1 8 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.846 -0.795 25767 7073 1 8 . 1 1 111 111 GLY H H 111 8.479 8.479 7.803 0.676 25767 7074 1 8 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.075 0.388 25767 7075 1 8 . 1 1 112 112 PRO C C 112 175.090 175.090 175.669 -0.579 25767 7076 1 8 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.170 -0.806 25767 7077 1 8 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.728 2.122 25767 7078 1 8 . 1 1 113 113 TRP N N 113 123.164 123.164 121.925 1.239 25767 7079 1 8 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.771 -0.061 25767 7080 1 8 . 1 1 113 113 TRP C C 113 174.605 174.605 175.761 -1.156 25767 7081 1 8 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.222 0.683 25767 7082 1 8 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.338 -3.045 25767 7083 1 8 . 1 1 113 113 TRP H H 113 8.687 8.687 8.319 0.368 25767 7084 1 8 . 1 1 114 114 ASP N N 114 121.356 121.356 123.077 -1.721 25767 7085 1 8 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.928 -0.067 25767 7086 1 8 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.979 -0.730 25767 7087 1 8 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.134 -0.993 25767 7088 1 8 . 1 1 114 114 ASP H H 114 6.985 6.985 8.316 -1.331 25767 7089 1 8 . 1 1 115 115 VAL N N 115 118.649 118.649 119.364 -0.715 25767 7090 1 8 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.916 -0.074 25767 7091 1 8 . 1 1 115 115 VAL C C 115 177.739 177.739 177.483 0.256 25767 7092 1 8 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.785 -0.216 25767 7093 1 8 . 1 1 115 115 VAL CB C 115 31.677 31.677 31.965 -0.288 25767 7094 1 8 . 1 1 115 115 VAL H H 115 8.206 8.206 8.467 -0.261 25767 7095 1 8 . 1 1 116 116 MET N N 116 120.401 120.401 118.691 1.710 25767 7096 1 8 . 1 1 116 116 MET HA H 116 4.303 4.303 4.219 0.084 25767 7097 1 8 . 1 1 116 116 MET C C 116 179.269 179.269 178.447 0.822 25767 7098 1 8 . 1 1 116 116 MET CA C 116 57.634 57.634 59.038 -1.404 25767 7099 1 8 . 1 1 116 116 MET CB C 116 30.414 30.414 31.829 -1.415 25767 7100 1 8 . 1 1 116 116 MET H H 116 7.642 7.642 8.134 -0.492 25767 7101 1 8 . 1 1 117 117 LEU N N 117 125.503 125.503 119.222 6.281 25767 7102 1 8 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.099 0.146 25767 7103 1 8 . 1 1 117 117 LEU C C 117 178.445 178.445 179.303 -0.858 25767 7104 1 8 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.927 0.273 25767 7105 1 8 . 1 1 117 117 LEU CB C 117 40.089 40.089 40.644 -0.555 25767 7106 1 8 . 1 1 117 117 LEU H H 117 8.157 8.157 7.698 0.459 25767 7107 1 8 . 1 1 118 118 LYS N N 118 119.052 119.052 119.742 -0.690 25767 7108 1 8 . 1 1 118 118 LYS HA H 118 3.805 3.805 4.021 -0.216 25767 7109 1 8 . 1 1 118 118 LYS C C 118 178.251 178.251 179.306 -1.055 25767 7110 1 8 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.288 0.238 25767 7111 1 8 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.189 -0.061 25767 7112 1 8 . 1 1 118 118 LYS H H 118 7.400 7.400 7.670 -0.270 25767 7113 1 8 . 1 1 119 119 ARG N N 119 117.999 117.999 119.227 -1.228 25767 7114 1 8 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.249 -0.029 25767 7115 1 8 . 1 1 119 119 ARG C C 119 180.441 180.441 179.104 1.337 25767 7116 1 8 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.448 0.369 25767 7117 1 8 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.204 -0.119 25767 7118 1 8 . 1 1 119 119 ARG H H 119 8.265 8.265 8.010 0.255 25767 7119 1 8 . 1 1 120 120 SER N N 120 118.073 118.073 116.443 1.630 25767 7120 1 8 . 1 1 120 120 SER HA H 120 4.182 4.182 4.308 -0.126 25767 7121 1 8 . 1 1 120 120 SER C C 120 176.215 176.215 176.502 -0.287 25767 7122 1 8 . 1 1 120 120 SER CA C 120 62.817 62.817 62.489 0.328 25767 7123 1 8 . 1 1 120 120 SER CB C 120 63.550 63.550 62.656 0.894 25767 7124 1 8 . 1 1 120 120 SER H H 120 8.633 8.633 7.850 0.783 25767 7125 1 8 . 1 1 121 121 LEU N N 121 125.029 125.029 122.106 2.923 25767 7126 1 8 . 1 1 121 121 LEU HA H 121 4.219 4.219 3.961 0.258 25767 7127 1 8 . 1 1 121 121 LEU C C 121 179.679 179.679 178.483 1.196 25767 7128 1 8 . 1 1 121 121 LEU CA C 121 58.849 58.849 58.313 0.536 25767 7129 1 8 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.435 -0.661 25767 7130 1 8 . 1 1 121 121 LEU H H 121 8.313 8.313 8.050 0.263 25767 7131 1 8 . 1 1 122 122 TRP N N 122 120.217 120.217 119.426 0.791 25767 7132 1 8 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.402 -0.062 25767 7133 1 8 . 1 1 122 122 TRP C C 122 177.527 177.527 179.116 -1.589 25767 7134 1 8 . 1 1 122 122 TRP CA C 122 61.758 61.758 60.592 1.166 25767 7135 1 8 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.273 0.375 25767 7136 1 8 . 1 1 122 122 TRP H H 122 7.928 7.928 8.061 -0.133 25767 7137 1 8 . 1 1 123 123 CYS N N 123 119.669 119.669 120.318 -0.649 25767 7138 1 8 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.233 -0.026 25767 7139 1 8 . 1 1 123 123 CYS C C 123 177.057 177.057 176.962 0.095 25767 7140 1 8 . 1 1 123 123 CYS CA C 123 62.600 62.600 61.780 0.820 25767 7141 1 8 . 1 1 123 123 CYS CB C 123 25.899 25.899 26.576 -0.677 25767 7142 1 8 . 1 1 123 123 CYS H H 123 8.273 8.273 8.343 -0.070 25767 7143 1 8 . 1 1 124 124 CYS N N 124 116.898 116.898 121.348 -4.450 25767 7144 1 8 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.107 -0.259 25767 7145 1 8 . 1 1 124 124 CYS C C 124 175.759 175.759 177.102 -1.343 25767 7146 1 8 . 1 1 124 124 CYS CA C 124 65.653 65.653 64.413 1.240 25767 7147 1 8 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.970 -0.452 25767 7148 1 8 . 1 1 124 124 CYS H H 124 8.122 8.122 8.267 -0.145 25767 7149 1 8 . 1 1 125 125 ILE N N 125 120.498 120.498 120.834 -0.336 25767 7150 1 8 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.668 -0.080 25767 7151 1 8 . 1 1 125 125 ILE C C 125 179.337 179.337 177.544 1.793 25767 7152 1 8 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.806 1.788 25767 7153 1 8 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.410 0.270 25767 7154 1 8 . 1 1 125 125 ILE H H 125 8.092 8.092 8.624 -0.532 25767 7155 1 8 . 1 1 126 126 ASP N N 126 125.084 125.084 120.241 4.843 25767 7156 1 8 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.458 0.159 25767 7157 1 8 . 1 1 126 126 ASP C C 126 178.299 178.299 178.837 -0.538 25767 7158 1 8 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.476 1.528 25767 7159 1 8 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.313 -0.017 25767 7160 1 8 . 1 1 126 126 ASP H H 126 9.049 9.049 8.167 0.882 25767 7161 1 8 . 1 1 127 127 LEU N N 127 122.591 122.591 121.273 1.318 25767 7162 1 8 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.986 -0.119 25767 7163 1 8 . 1 1 127 127 LEU C C 127 179.655 179.655 177.775 1.880 25767 7164 1 8 . 1 1 127 127 LEU CA C 127 58.661 58.661 57.991 0.670 25767 7165 1 8 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.837 0.358 25767 7166 1 8 . 1 1 127 127 LEU H H 127 8.888 8.888 7.751 1.137 25767 7167 1 8 . 1 1 128 128 PHE N N 128 117.498 117.498 119.320 -1.822 25767 7168 1 8 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.081 0.241 25767 7169 1 8 . 1 1 128 128 PHE C C 128 178.533 178.533 177.250 1.283 25767 7170 1 8 . 1 1 128 128 PHE CA C 128 60.932 60.932 61.961 -1.029 25767 7171 1 8 . 1 1 128 128 PHE CB C 128 39.053 39.053 39.164 -0.111 25767 7172 1 8 . 1 1 128 128 PHE H H 128 8.947 8.947 8.051 0.896 25767 7173 1 8 . 1 1 129 129 SER N N 129 115.398 115.398 116.467 -1.069 25767 7174 1 8 . 1 1 129 129 SER HA H 129 4.046 4.046 4.229 -0.183 25767 7175 1 8 . 1 1 129 129 SER C C 129 175.168 175.168 176.768 -1.600 25767 7176 1 8 . 1 1 129 129 SER CA C 129 63.015 63.015 62.611 0.404 25767 7177 1 8 . 1 1 129 129 SER H H 129 8.578 8.578 8.533 0.045 25767 7178 1 8 . 1 1 130 130 CYS N N 130 125.556 125.556 121.196 4.360 25767 7179 1 8 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.118 -0.009 25767 7180 1 8 . 1 1 130 130 CYS C C 130 175.294 175.294 176.642 -1.348 25767 7181 1 8 . 1 1 130 130 CYS CA C 130 61.438 61.438 64.988 -3.550 25767 7182 1 8 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.180 -0.130 25767 7183 1 8 . 1 1 130 130 CYS H H 130 8.289 8.289 8.123 0.166 25767 7184 1 8 . 1 1 131 131 ILE N N 131 120.232 120.232 120.962 -0.730 25767 7185 1 8 . 1 1 131 131 ILE HA H 131 4.033 4.033 3.956 0.077 25767 7186 1 8 . 1 1 131 131 ILE C C 131 177.297 177.297 178.579 -1.282 25767 7187 1 8 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.419 -0.767 25767 7188 1 8 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.700 1.402 25767 7189 1 8 . 1 1 131 131 ILE H H 131 7.943 7.943 7.691 0.252 25767 7190 1 8 . 1 1 132 132 LEU N N 132 116.422 116.422 120.703 -4.281 25767 7191 1 8 . 1 1 132 132 LEU HA H 132 3.845 3.845 3.920 -0.075 25767 7192 1 8 . 1 1 132 132 LEU C C 132 177.816 177.816 178.482 -0.666 25767 7193 1 8 . 1 1 132 132 LEU CA C 132 57.078 57.078 57.999 -0.921 25767 7194 1 8 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.591 0.622 25767 7195 1 8 . 1 1 132 132 LEU H H 132 7.846 7.846 8.107 -0.261 25767 7196 1 8 . 1 1 133 133 HIS N N 133 116.929 116.929 118.671 -1.742 25767 7197 1 8 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.280 -0.141 25767 7198 1 8 . 1 1 133 133 HIS C C 133 178.669 178.669 177.790 0.879 25767 7199 1 8 . 1 1 133 133 HIS CA C 133 59.736 59.736 60.185 -0.449 25767 7200 1 8 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.334 2.818 25767 7201 1 8 . 1 1 133 133 HIS H H 133 7.822 7.822 8.471 -0.649 25767 7202 1 8 . 1 1 134 134 LEU N N 134 116.898 116.898 119.789 -2.891 25767 7203 1 8 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.203 -0.470 25767 7204 1 8 . 1 1 134 134 LEU C C 134 179.402 179.402 179.000 0.402 25767 7205 1 8 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.775 -0.548 25767 7206 1 8 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.216 -2.677 25767 7207 1 8 . 1 1 134 134 LEU H H 134 8.688 8.688 7.886 0.802 25767 7208 1 8 . 1 1 135 135 TRP N N 135 115.602 115.602 118.023 -2.421 25767 7209 1 8 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.626 0.382 25767 7210 1 8 . 1 1 135 135 TRP C C 135 175.022 175.022 178.076 -3.054 25767 7211 1 8 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.385 1.041 25767 7212 1 8 . 1 1 135 135 TRP CB C 135 27.085 27.085 29.098 -2.013 25767 7213 1 8 . 1 1 135 135 TRP H H 135 7.638 7.638 8.412 -0.774 25767 7214 1 8 . 1 1 136 136 LYS N N 136 119.721 119.721 123.121 -3.400 25767 7215 1 8 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.963 -0.147 25767 7216 1 8 . 1 1 136 136 LYS C C 136 178.279 178.279 178.254 0.025 25767 7217 1 8 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.744 0.449 25767 7218 1 8 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.843 1.214 25767 7219 1 8 . 1 1 136 136 LYS H H 136 6.538 6.538 8.443 -1.905 25767 7220 1 8 . 1 1 137 137 GLU N N 137 115.407 115.407 115.944 -0.537 25767 7221 1 8 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.142 0.025 25767 7222 1 8 . 1 1 137 137 GLU C C 137 176.700 176.700 177.363 -0.663 25767 7223 1 8 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.521 -0.671 25767 7224 1 8 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.007 0.153 25767 7225 1 8 . 1 1 137 137 GLU H H 137 8.596 8.596 8.173 0.423 25767 7226 1 8 . 1 1 138 138 ASN N N 138 116.669 116.669 116.432 0.237 25767 7227 1 8 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.817 0.089 25767 7228 1 8 . 1 1 138 138 ASN C C 138 173.481 173.481 174.949 -1.468 25767 7229 1 8 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.908 -1.094 25767 7230 1 8 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.614 1.223 25767 7231 1 8 . 1 1 138 138 ASN H H 138 8.343 8.343 8.132 0.211 25767 7232 1 8 . 1 1 139 139 ILE N N 139 120.703 120.703 119.675 1.028 25767 7233 1 8 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.283 0.061 25767 7234 1 8 . 1 1 139 139 ILE C C 139 175.241 175.241 175.306 -0.065 25767 7235 1 8 . 1 1 139 139 ILE CA C 139 60.792 60.792 58.794 1.998 25767 7236 1 8 . 1 1 139 139 ILE CB C 139 40.274 40.274 38.307 1.967 25767 7237 1 8 . 1 1 139 139 ILE H H 139 7.167 7.167 7.619 -0.452 25767 7238 1 8 . 1 1 140 140 SER N N 140 123.284 123.284 119.794 3.490 25767 7239 1 8 . 1 1 140 140 SER HA H 140 4.345 4.345 4.529 -0.184 25767 7240 1 8 . 1 1 140 140 SER CA C 140 58.095 58.095 57.056 1.039 25767 7241 1 8 . 1 1 140 140 SER CB C 140 65.370 65.370 64.555 0.815 25767 7242 1 8 . 1 1 140 140 SER H H 140 8.727 8.727 8.224 0.503 25767 7243 1 8 . 1 1 142 142 THR N N 142 113.868 113.868 116.056 -2.188 25767 7244 1 8 . 1 1 142 142 THR HA H 142 3.976 3.976 4.145 -0.169 25767 7245 1 8 . 1 1 142 142 THR C C 142 177.559 177.559 176.466 1.093 25767 7246 1 8 . 1 1 142 142 THR CA C 142 66.007 66.007 66.735 -0.728 25767 7247 1 8 . 1 1 142 142 THR CB C 142 68.530 68.530 68.686 -0.157 25767 7248 1 8 . 1 1 142 142 THR H H 142 8.243 8.243 7.867 0.376 25767 7249 1 8 . 1 1 143 143 SER N N 143 120.786 120.786 117.056 3.730 25767 7250 1 8 . 1 1 143 143 SER C C 143 175.844 175.844 176.702 -0.858 25767 7251 1 8 . 1 1 143 143 SER CA C 143 62.102 62.102 61.379 0.723 25767 7252 1 8 . 1 1 143 143 SER CB C 143 63.086 63.086 62.789 0.297 25767 7253 1 8 . 1 1 143 143 SER H H 143 7.915 7.915 8.177 -0.262 25767 7254 1 8 . 1 1 144 144 THR N N 144 120.946 120.946 117.999 2.947 25767 7255 1 8 . 1 1 144 144 THR HA H 144 4.299 4.299 4.036 0.263 25767 7256 1 8 . 1 1 144 144 THR C C 144 175.874 175.874 176.419 -0.545 25767 7257 1 8 . 1 1 144 144 THR CA C 144 67.487 67.487 66.314 1.173 25767 7258 1 8 . 1 1 144 144 THR CB C 144 68.485 68.485 68.708 -0.223 25767 7259 1 8 . 1 1 144 144 THR H H 144 8.746 8.746 8.547 0.199 25767 7260 1 8 . 1 1 145 145 ASN N N 145 120.069 120.069 120.085 -0.016 25767 7261 1 8 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.366 -0.058 25767 7262 1 8 . 1 1 145 145 ASN C C 145 177.917 177.917 177.652 0.265 25767 7263 1 8 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.812 -0.475 25767 7264 1 8 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.557 -0.457 25767 7265 1 8 . 1 1 145 145 ASN H H 145 7.940 7.940 8.270 -0.330 25767 7266 1 8 . 1 1 146 146 SER N N 146 116.905 116.905 116.171 0.734 25767 7267 1 8 . 1 1 146 146 SER HA H 146 3.936 3.936 4.140 -0.204 25767 7268 1 8 . 1 1 146 146 SER C C 146 176.963 176.963 176.434 0.529 25767 7269 1 8 . 1 1 146 146 SER CA C 146 61.997 61.997 61.905 0.092 25767 7270 1 8 . 1 1 146 146 SER CB C 146 62.879 62.879 63.186 -0.307 25767 7271 1 8 . 1 1 146 146 SER H H 146 7.951 7.951 7.782 0.169 25767 7272 1 8 . 1 1 147 147 LEU N N 147 123.253 123.253 122.558 0.695 25767 7273 1 8 . 1 1 147 147 LEU HA H 147 3.875 3.875 4.040 -0.165 25767 7274 1 8 . 1 1 147 147 LEU C C 147 178.726 178.726 178.076 0.650 25767 7275 1 8 . 1 1 147 147 LEU CA C 147 58.580 58.580 57.670 0.910 25767 7276 1 8 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.739 -0.879 25767 7277 1 8 . 1 1 147 147 LEU H H 147 8.168 8.168 7.397 0.771 25767 7278 1 8 . 1 1 148 148 GLN N N 148 118.212 118.212 117.991 0.221 25767 7279 1 8 . 1 1 148 148 GLN HA H 148 3.817 3.817 3.979 -0.162 25767 7280 1 8 . 1 1 148 148 GLN C C 148 179.686 179.686 178.856 0.830 25767 7281 1 8 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.409 0.834 25767 7282 1 8 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.698 0.022 25767 7283 1 8 . 1 1 148 148 GLN H H 148 8.295 8.295 8.902 -0.607 25767 7284 1 8 . 1 1 149 149 LYS N N 149 120.770 120.770 120.318 0.452 25767 7285 1 8 . 1 1 149 149 LYS HA H 149 3.901 3.901 4.004 -0.103 25767 7286 1 8 . 1 1 149 149 LYS C C 149 178.006 178.006 179.116 -1.110 25767 7287 1 8 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.643 -0.111 25767 7288 1 8 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.119 -0.227 25767 7289 1 8 . 1 1 149 149 LYS H H 149 7.955 7.955 7.839 0.116 25767 7290 1 8 . 1 1 150 150 ARG N N 150 119.244 119.244 118.885 0.359 25767 7291 1 8 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.987 -0.147 25767 7292 1 8 . 1 1 150 150 ARG C C 150 178.858 178.858 178.809 0.049 25767 7293 1 8 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.648 -0.277 25767 7294 1 8 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.870 -1.066 25767 7295 1 8 . 1 1 150 150 ARG H H 150 7.020 7.020 7.513 -0.493 25767 7296 1 8 . 1 1 151 151 ILE N N 151 121.183 121.183 119.570 1.613 25767 7297 1 8 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.816 -0.457 25767 7298 1 8 . 1 1 151 151 ILE C C 151 177.327 177.327 177.770 -0.443 25767 7299 1 8 . 1 1 151 151 ILE CA C 151 67.196 67.196 62.627 4.569 25767 7300 1 8 . 1 1 151 151 ILE CB C 151 38.272 38.272 36.627 1.645 25767 7301 1 8 . 1 1 151 151 ILE H H 151 7.574 7.574 7.770 -0.196 25767 7302 1 8 . 1 1 152 152 LYS N N 152 119.521 119.521 120.933 -1.412 25767 7303 1 8 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.843 -0.070 25767 7304 1 8 . 1 1 152 152 LYS C C 152 178.016 178.016 178.566 -0.550 25767 7305 1 8 . 1 1 152 152 LYS CA C 152 59.830 59.830 60.128 -0.298 25767 7306 1 8 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.441 -0.860 25767 7307 1 8 . 1 1 152 152 LYS H H 152 7.629 7.629 8.401 -0.772 25767 7308 1 8 . 1 1 153 153 TYR N N 153 120.178 120.178 120.512 -0.334 25767 7309 1 8 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.130 -0.058 25767 7310 1 8 . 1 1 153 153 TYR C C 153 178.195 178.195 177.922 0.273 25767 7311 1 8 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.881 -0.565 25767 7312 1 8 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.427 -1.154 25767 7313 1 8 . 1 1 153 153 TYR H H 153 8.407 8.407 8.397 0.010 25767 7314 1 8 . 1 1 154 154 CYS N N 154 117.013 117.013 117.778 -0.765 25767 7315 1 8 . 1 1 154 154 CYS HA H 154 4.072 4.072 3.865 0.207 25767 7316 1 8 . 1 1 154 154 CYS C C 154 176.827 176.827 176.619 0.208 25767 7317 1 8 . 1 1 154 154 CYS CA C 154 65.780 65.780 64.588 1.192 25767 7318 1 8 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.805 0.355 25767 7319 1 8 . 1 1 154 154 CYS H H 154 8.291 8.291 7.848 0.443 25767 7320 1 8 . 1 1 155 155 LYS N N 155 118.753 118.753 120.375 -1.622 25767 7321 1 8 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.698 -0.027 25767 7322 1 8 . 1 1 155 155 LYS C C 155 179.904 179.904 178.877 1.027 25767 7323 1 8 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.538 0.946 25767 7324 1 8 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.218 -0.275 25767 7325 1 8 . 1 1 155 155 LYS H H 155 7.934 7.934 7.959 -0.025 25767 7326 1 8 . 1 1 156 156 ILE N N 156 123.873 123.873 120.645 3.228 25767 7327 1 8 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.618 -0.034 25767 7328 1 8 . 1 1 156 156 ILE C C 156 179.501 179.501 177.560 1.941 25767 7329 1 8 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.502 -0.262 25767 7330 1 8 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.870 -0.228 25767 7331 1 8 . 1 1 156 156 ILE H H 156 8.314 8.314 8.511 -0.197 25767 7332 1 8 . 1 1 157 157 TYR N N 157 121.132 121.132 120.027 1.105 25767 7333 1 8 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.926 0.239 25767 7334 1 8 . 1 1 157 157 TYR C C 157 178.558 178.558 177.407 1.151 25767 7335 1 8 . 1 1 157 157 TYR CA C 157 62.110 62.110 62.217 -0.107 25767 7336 1 8 . 1 1 157 157 TYR H H 157 8.442 8.442 7.524 0.918 25767 7337 1 8 . 1 1 158 158 LEU N N 158 120.964 120.964 118.543 2.421 25767 7338 1 8 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.770 0.142 25767 7339 1 8 . 1 1 158 158 LEU C C 158 180.130 180.130 179.242 0.888 25767 7340 1 8 . 1 1 158 158 LEU CA C 158 58.686 58.686 58.011 0.675 25767 7341 1 8 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.336 0.394 25767 7342 1 8 . 1 1 158 158 LEU H H 158 8.469 8.469 7.686 0.783 25767 7343 1 8 . 1 1 159 159 SER N N 159 116.653 116.653 115.459 1.194 25767 7344 1 8 . 1 1 159 159 SER HA H 159 4.246 4.246 4.174 0.072 25767 7345 1 8 . 1 1 159 159 SER CA C 159 61.460 61.460 61.816 -0.356 25767 7346 1 8 . 1 1 159 159 SER CB C 159 62.849 62.849 62.511 0.338 25767 7347 1 8 . 1 1 159 159 SER H H 159 7.758 7.758 8.213 -0.455 25767 7348 1 8 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.390 -2.017 25767 7349 1 8 . 1 1 160 160 LYS CB C 160 29.832 29.832 32.089 -2.257 25767 7350 1 8 . 1 1 160 160 LYS H H 160 8.425 8.425 7.670 0.755 25767 7351 1 8 . 1 1 161 161 LEU N N 161 121.686 121.686 119.217 2.469 25767 7352 1 8 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.937 0.226 25767 7353 1 8 . 1 1 161 161 LEU C C 161 180.224 180.224 179.030 1.194 25767 7354 1 8 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.806 -0.222 25767 7355 1 8 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.498 -0.036 25767 7356 1 8 . 1 1 161 161 LEU H H 161 8.323 8.323 7.460 0.863 25767 7357 1 8 . 1 1 162 162 ALA N N 162 123.102 123.102 120.932 2.170 25767 7358 1 8 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.048 0.082 25767 7359 1 8 . 1 1 162 162 ALA C C 162 179.487 179.487 179.229 0.258 25767 7360 1 8 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.703 0.041 25767 7361 1 8 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.431 -0.028 25767 7362 1 8 . 1 1 162 162 ALA H H 162 7.978 7.978 7.597 0.381 25767 7363 1 8 . 1 1 163 163 LYS N N 163 116.069 116.069 116.279 -0.210 25767 7364 1 8 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.297 -0.074 25767 7365 1 8 . 1 1 163 163 LYS C C 163 176.987 176.987 176.464 0.523 25767 7366 1 8 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.102 0.504 25767 7367 1 8 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.684 0.522 25767 7368 1 8 . 1 1 163 163 LYS H H 163 7.697 7.697 7.731 -0.034 25767 7369 1 8 . 1 1 164 164 GLY N N 164 108.540 108.540 107.047 1.493 25767 7370 1 8 . 1 1 164 164 GLY C C 164 174.721 174.721 174.304 0.417 25767 7371 1 8 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.966 0.825 25767 7372 1 8 . 1 1 164 164 GLY H H 164 7.772 7.772 7.703 0.069 25767 7373 1 8 . 1 1 165 165 GLU N N 165 119.886 119.886 120.127 -0.241 25767 7374 1 8 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.406 -0.356 25767 7375 1 8 . 1 1 165 165 GLU C C 165 176.027 176.027 174.969 1.058 25767 7376 1 8 . 1 1 165 165 GLU CA C 165 56.853 56.853 54.848 2.005 25767 7377 1 8 . 1 1 165 165 GLU CB C 165 30.338 30.338 31.254 -0.916 25767 7378 1 8 . 1 1 165 165 GLU H H 165 8.065 8.065 8.345 -0.280 25767 7379 1 8 . 1 1 166 166 ILE N N 166 117.926 117.926 120.502 -2.576 25767 7380 1 8 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.947 -0.045 25767 7381 1 8 . 1 1 166 166 ILE C C 166 174.138 174.138 176.421 -2.283 25767 7382 1 8 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.535 1.919 25767 7383 1 8 . 1 1 166 166 ILE CB C 166 40.202 40.202 39.526 0.676 25767 7384 1 8 . 1 1 166 166 ILE H H 166 7.282 7.282 8.133 -0.851 25767 7385 1 9 . 1 1 2 2 ALA N N 2 122.811 122.811 124.220 -1.409 25767 7386 1 9 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.186 -0.163 25767 7387 1 9 . 1 1 2 2 ALA C C 2 179.915 179.915 179.667 0.248 25767 7388 1 9 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.324 -0.207 25767 7389 1 9 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.234 0.305 25767 7390 1 9 . 1 1 2 2 ALA H H 2 8.509 8.509 8.256 0.253 25767 7391 1 9 . 1 1 3 3 SER N N 3 115.308 115.308 114.808 0.500 25767 7392 1 9 . 1 1 3 3 SER HA H 3 4.097 4.097 4.119 -0.022 25767 7393 1 9 . 1 1 3 3 SER C C 3 176.706 176.706 176.373 0.333 25767 7394 1 9 . 1 1 3 3 SER CA C 3 60.665 60.665 61.644 -0.979 25767 7395 1 9 . 1 1 3 3 SER CB C 3 62.710 62.710 62.274 0.436 25767 7396 1 9 . 1 1 3 3 SER H H 3 7.996 7.996 8.697 -0.701 25767 7397 1 9 . 1 1 4 4 ASN N N 4 122.688 122.688 120.050 2.638 25767 7398 1 9 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.356 -0.052 25767 7399 1 9 . 1 1 4 4 ASN C C 4 176.258 176.258 177.121 -0.863 25767 7400 1 9 . 1 1 4 4 ASN CA C 4 55.701 55.701 56.134 -0.433 25767 7401 1 9 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.185 0.991 25767 7402 1 9 . 1 1 4 4 ASN H H 4 8.075 8.075 8.359 -0.284 25767 7403 1 9 . 1 1 5 5 ALA N N 5 121.900 121.900 122.377 -0.477 25767 7404 1 9 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.143 -0.568 25767 7405 1 9 . 1 1 5 5 ALA C C 5 178.475 178.475 179.327 -0.852 25767 7406 1 9 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.963 0.870 25767 7407 1 9 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.157 -0.542 25767 7408 1 9 . 1 1 5 5 ALA H H 5 8.659 8.659 7.713 0.946 25767 7409 1 9 . 1 1 6 6 ALA N N 6 117.768 117.768 121.550 -3.782 25767 7410 1 9 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.998 -0.211 25767 7411 1 9 . 1 1 6 6 ALA C C 6 180.494 180.494 179.449 1.045 25767 7412 1 9 . 1 1 6 6 ALA CA C 6 55.350 55.350 54.974 0.376 25767 7413 1 9 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.258 -0.355 25767 7414 1 9 . 1 1 6 6 ALA H H 6 7.864 7.864 7.727 0.137 25767 7415 1 9 . 1 1 7 7 ARG N N 7 121.173 121.173 119.227 1.946 25767 7416 1 9 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.097 -0.194 25767 7417 1 9 . 1 1 7 7 ARG C C 7 179.189 179.189 178.554 0.635 25767 7418 1 9 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.322 0.990 25767 7419 1 9 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.605 -0.383 25767 7420 1 9 . 1 1 7 7 ARG H H 7 7.514 7.514 8.218 -0.704 25767 7421 1 9 . 1 1 8 8 VAL N N 8 122.979 122.979 119.763 3.216 25767 7422 1 9 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.724 -0.471 25767 7423 1 9 . 1 1 8 8 VAL C C 8 177.821 177.821 177.880 -0.059 25767 7424 1 9 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.675 1.097 25767 7425 1 9 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.301 0.140 25767 7426 1 9 . 1 1 8 8 VAL H H 8 8.101 8.101 7.759 0.342 25767 7427 1 9 . 1 1 9 9 VAL N N 9 119.801 119.801 119.676 0.125 25767 7428 1 9 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.572 -0.306 25767 7429 1 9 . 1 1 9 9 VAL C C 9 177.373 177.373 177.754 -0.381 25767 7430 1 9 . 1 1 9 9 VAL CA C 9 67.484 67.484 66.622 0.862 25767 7431 1 9 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.750 0.875 25767 7432 1 9 . 1 1 9 9 VAL H H 9 8.362 8.362 7.754 0.608 25767 7433 1 9 . 1 1 10 10 ALA N N 10 122.360 122.360 121.809 0.551 25767 7434 1 9 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.035 -0.099 25767 7435 1 9 . 1 1 10 10 ALA C C 10 180.762 180.762 179.403 1.359 25767 7436 1 9 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.623 -0.180 25767 7437 1 9 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.338 -0.601 25767 7438 1 9 . 1 1 10 10 ALA H H 10 7.776 7.776 7.804 -0.028 25767 7439 1 9 . 1 1 11 11 THR N N 11 117.376 117.376 112.277 5.099 25767 7440 1 9 . 1 1 11 11 THR HA H 11 3.816 3.816 4.072 -0.256 25767 7441 1 9 . 1 1 11 11 THR C C 11 175.775 175.775 176.418 -0.643 25767 7442 1 9 . 1 1 11 11 THR CA C 11 66.509 66.509 65.860 0.649 25767 7443 1 9 . 1 1 11 11 THR CB C 11 68.588 68.588 68.828 -0.240 25767 7444 1 9 . 1 1 11 11 THR H H 11 8.180 8.180 7.780 0.400 25767 7445 1 9 . 1 1 12 12 ALA N N 12 125.308 125.308 124.752 0.556 25767 7446 1 9 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.717 0.280 25767 7447 1 9 . 1 1 12 12 ALA C C 12 179.399 179.399 179.427 -0.028 25767 7448 1 9 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.397 0.679 25767 7449 1 9 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.262 0.982 25767 7450 1 9 . 1 1 12 12 ALA H H 12 8.671 8.671 8.289 0.382 25767 7451 1 9 . 1 1 13 13 LYS N N 13 116.977 116.977 118.332 -1.355 25767 7452 1 9 . 1 1 13 13 LYS C C 13 179.646 179.646 178.778 0.868 25767 7453 1 9 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.820 -0.899 25767 7454 1 9 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.235 -0.792 25767 7455 1 9 . 1 1 13 13 LYS H H 13 8.061 8.061 7.929 0.132 25767 7456 1 9 . 1 1 14 14 ASP N N 14 121.988 121.988 120.163 1.825 25767 7457 1 9 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.491 -0.138 25767 7458 1 9 . 1 1 14 14 ASP C C 14 179.446 179.446 178.751 0.695 25767 7459 1 9 . 1 1 14 14 ASP CA C 14 57.509 57.509 57.011 0.498 25767 7460 1 9 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.663 -0.662 25767 7461 1 9 . 1 1 14 14 ASP H H 14 7.669 7.669 7.724 -0.055 25767 7462 1 9 . 1 1 15 15 PHE N N 15 119.588 119.588 118.359 1.229 25767 7463 1 9 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.236 0.108 25767 7464 1 9 . 1 1 15 15 PHE C C 15 178.373 178.373 178.153 0.220 25767 7465 1 9 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.148 1.089 25767 7466 1 9 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.640 -1.144 25767 7467 1 9 . 1 1 15 15 PHE H H 15 7.913 7.913 8.658 -0.745 25767 7468 1 9 . 1 1 16 16 ASP N N 16 121.705 121.705 119.886 1.819 25767 7469 1 9 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.471 -0.476 25767 7470 1 9 . 1 1 16 16 ASP C C 16 180.071 180.071 178.991 1.080 25767 7471 1 9 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.077 1.072 25767 7472 1 9 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.456 1.030 25767 7473 1 9 . 1 1 16 16 ASP H H 16 8.324 8.324 8.121 0.203 25767 7474 1 9 . 1 1 17 17 LYS N N 17 118.825 118.825 119.391 -0.566 25767 7475 1 9 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.095 -0.058 25767 7476 1 9 . 1 1 17 17 LYS C C 17 178.407 178.407 178.006 0.401 25767 7477 1 9 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.995 0.066 25767 7478 1 9 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.509 0.075 25767 7479 1 9 . 1 1 17 17 LYS H H 17 7.834 7.834 7.744 0.090 25767 7480 1 9 . 1 1 18 18 VAL N N 18 110.562 110.562 117.258 -6.696 25767 7481 1 9 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.029 0.487 25767 7482 1 9 . 1 1 18 18 VAL C C 18 176.144 176.144 176.463 -0.319 25767 7483 1 9 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.066 -2.192 25767 7484 1 9 . 1 1 18 18 VAL CB C 18 31.160 31.160 32.045 -0.885 25767 7485 1 9 . 1 1 18 18 VAL H H 18 7.185 7.185 7.560 -0.375 25767 7486 1 9 . 1 1 19 19 GLY N N 19 109.272 109.272 107.237 2.035 25767 7487 1 9 . 1 1 19 19 GLY C C 19 175.043 175.043 174.859 0.184 25767 7488 1 9 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.259 0.572 25767 7489 1 9 . 1 1 19 19 GLY H H 19 7.723 7.723 7.666 0.057 25767 7490 1 9 . 1 1 20 20 LEU N N 20 125.428 125.428 121.646 3.782 25767 7491 1 9 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.623 -0.303 25767 7492 1 9 . 1 1 20 20 LEU C C 20 177.949 177.949 177.414 0.535 25767 7493 1 9 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.433 -0.629 25767 7494 1 9 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.557 0.360 25767 7495 1 9 . 1 1 20 20 LEU H H 20 8.083 8.083 7.935 0.148 25767 7496 1 9 . 1 1 21 21 GLY N N 21 107.804 107.804 110.322 -2.518 25767 7497 1 9 . 1 1 21 21 GLY C C 21 176.278 176.278 176.218 0.060 25767 7498 1 9 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.679 -0.385 25767 7499 1 9 . 1 1 21 21 GLY H H 21 7.982 7.982 8.006 -0.024 25767 7500 1 9 . 1 1 22 22 ILE N N 22 121.319 121.319 121.870 -0.551 25767 7501 1 9 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.824 0.086 25767 7502 1 9 . 1 1 22 22 ILE C C 22 176.604 176.604 177.807 -1.203 25767 7503 1 9 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.467 -2.021 25767 7504 1 9 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.596 -1.030 25767 7505 1 9 . 1 1 22 22 ILE H H 22 8.478 8.478 8.005 0.473 25767 7506 1 9 . 1 1 23 23 ILE N N 23 120.377 120.377 119.800 0.577 25767 7507 1 9 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.916 -0.203 25767 7508 1 9 . 1 1 23 23 ILE C C 23 178.581 178.581 178.502 0.079 25767 7509 1 9 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.164 1.082 25767 7510 1 9 . 1 1 23 23 ILE CB C 23 36.199 36.199 36.172 0.028 25767 7511 1 9 . 1 1 23 23 ILE H H 23 6.869 6.869 7.614 -0.745 25767 7512 1 9 . 1 1 24 24 GLY N N 24 103.449 103.449 109.085 -5.636 25767 7513 1 9 . 1 1 24 24 GLY C C 24 175.308 175.308 175.620 -0.312 25767 7514 1 9 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.382 0.561 25767 7515 1 9 . 1 1 24 24 GLY H H 24 7.488 7.488 8.380 -0.892 25767 7516 1 9 . 1 1 25 25 TYR N N 25 124.685 124.685 124.277 0.408 25767 7517 1 9 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.602 0.064 25767 7518 1 9 . 1 1 25 25 TYR C C 25 176.208 176.208 177.333 -1.125 25767 7519 1 9 . 1 1 25 25 TYR CA C 25 61.371 61.371 61.117 0.254 25767 7520 1 9 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.560 -0.294 25767 7521 1 9 . 1 1 25 25 TYR H H 25 7.931 7.931 8.313 -0.382 25767 7522 1 9 . 1 1 26 26 TYR N N 26 117.001 117.001 119.836 -2.835 25767 7523 1 9 . 1 1 26 26 TYR HA H 26 3.941 3.941 4.047 -0.106 25767 7524 1 9 . 1 1 26 26 TYR C C 26 178.753 178.753 177.505 1.248 25767 7525 1 9 . 1 1 26 26 TYR CA C 26 64.260 64.260 61.797 2.463 25767 7526 1 9 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.899 -1.378 25767 7527 1 9 . 1 1 26 26 TYR H H 26 7.693 7.693 7.958 -0.265 25767 7528 1 9 . 1 1 27 27 LEU N N 27 118.657 118.657 119.348 -0.691 25767 7529 1 9 . 1 1 27 27 LEU HA H 27 4.311 4.311 3.936 0.375 25767 7530 1 9 . 1 1 27 27 LEU CA C 27 58.297 58.297 58.259 0.038 25767 7531 1 9 . 1 1 27 27 LEU CB C 27 42.723 42.723 41.079 1.644 25767 7532 1 9 . 1 1 27 27 LEU H H 27 8.339 8.339 8.847 -0.508 25767 7533 1 9 . 1 1 28 28 GLN N N 28 118.593 118.593 119.069 -0.476 25767 7534 1 9 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.843 -0.192 25767 7535 1 9 . 1 1 28 28 GLN C C 28 177.282 177.282 178.574 -1.292 25767 7536 1 9 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.888 -0.059 25767 7537 1 9 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.369 1.279 25767 7538 1 9 . 1 1 28 28 GLN H H 28 7.970 7.970 8.225 -0.255 25767 7539 1 9 . 1 1 29 29 LEU N N 29 122.111 122.111 119.678 2.433 25767 7540 1 9 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.712 0.232 25767 7541 1 9 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.621 1.045 25767 7542 1 9 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.338 0.670 25767 7543 1 9 . 1 1 29 29 LEU H H 29 7.979 7.979 7.414 0.565 25767 7544 1 9 . 1 1 30 30 TYR N N 30 119.283 119.283 120.038 -0.755 25767 7545 1 9 . 1 1 30 30 TYR C C 30 175.775 175.775 177.267 -1.492 25767 7546 1 9 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.804 -1.710 25767 7547 1 9 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.281 0.792 25767 7548 1 9 . 1 1 30 30 TYR H H 30 8.093 8.093 7.547 0.546 25767 7549 1 9 . 1 1 31 31 ALA N N 31 121.327 121.327 122.143 -0.816 25767 7550 1 9 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.863 -0.495 25767 7551 1 9 . 1 1 31 31 ALA C C 31 178.955 178.955 179.124 -0.169 25767 7552 1 9 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.254 0.293 25767 7553 1 9 . 1 1 31 31 ALA CB C 31 17.963 17.963 17.772 0.191 25767 7554 1 9 . 1 1 31 31 ALA H H 31 8.394 8.394 8.210 0.184 25767 7555 1 9 . 1 1 32 32 VAL N N 32 116.757 116.757 118.456 -1.699 25767 7556 1 9 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.538 -0.278 25767 7557 1 9 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.767 1.895 25767 7558 1 9 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.656 -0.685 25767 7559 1 9 . 1 1 32 32 VAL H H 32 8.020 8.020 7.542 0.478 25767 7560 1 9 . 1 1 33 33 GLU N N 33 118.775 118.775 119.923 -1.148 25767 7561 1 9 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.802 0.187 25767 7562 1 9 . 1 1 33 33 GLU C C 33 179.746 179.746 178.908 0.838 25767 7563 1 9 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.278 0.725 25767 7564 1 9 . 1 1 33 33 GLU H H 33 7.358 7.358 7.629 -0.271 25767 7565 1 9 . 1 1 34 34 LEU N N 34 120.632 120.632 121.899 -1.267 25767 7566 1 9 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.738 -0.089 25767 7567 1 9 . 1 1 34 34 LEU C C 34 180.336 180.336 178.787 1.549 25767 7568 1 9 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.566 0.109 25767 7569 1 9 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.246 0.342 25767 7570 1 9 . 1 1 34 34 LEU H H 34 8.390 8.390 8.180 0.210 25767 7571 1 9 . 1 1 35 35 ILE N N 35 121.240 121.240 117.748 3.492 25767 7572 1 9 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.648 -0.106 25767 7573 1 9 . 1 1 35 35 ILE C C 35 178.604 178.604 177.630 0.974 25767 7574 1 9 . 1 1 35 35 ILE CA C 35 65.547 65.547 64.644 0.903 25767 7575 1 9 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.914 0.817 25767 7576 1 9 . 1 1 35 35 ILE H H 35 8.129 8.129 7.608 0.521 25767 7577 1 9 . 1 1 36 36 LEU N N 36 115.637 115.637 117.268 -1.631 25767 7578 1 9 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.072 -0.064 25767 7579 1 9 . 1 1 36 36 LEU C C 36 178.001 178.001 178.218 -0.217 25767 7580 1 9 . 1 1 36 36 LEU CA C 36 56.076 56.076 56.727 -0.651 25767 7581 1 9 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.976 -2.042 25767 7582 1 9 . 1 1 36 36 LEU H H 36 8.416 8.416 7.806 0.610 25767 7583 1 9 . 1 1 37 37 SER N N 37 114.106 114.106 111.844 2.262 25767 7584 1 9 . 1 1 37 37 SER HA H 37 3.991 3.991 4.218 -0.227 25767 7585 1 9 . 1 1 37 37 SER C C 37 173.997 173.997 175.281 -1.284 25767 7586 1 9 . 1 1 37 37 SER CA C 37 60.311 60.311 59.573 0.738 25767 7587 1 9 . 1 1 37 37 SER CB C 37 63.746 63.746 63.510 0.236 25767 7588 1 9 . 1 1 37 37 SER H H 37 7.517 7.517 7.719 -0.202 25767 7589 1 9 . 1 1 38 38 GLU N N 38 123.003 123.003 122.209 0.794 25767 7590 1 9 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.251 0.118 25767 7591 1 9 . 1 1 38 38 GLU C C 38 175.780 175.780 175.844 -0.064 25767 7592 1 9 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.806 -0.441 25767 7593 1 9 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.575 -0.281 25767 7594 1 9 . 1 1 38 38 GLU H H 38 7.151 7.151 7.459 -0.308 25767 7595 1 9 . 1 1 39 39 GLU N N 39 126.166 126.166 122.882 3.284 25767 7596 1 9 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.086 -0.077 25767 7597 1 9 . 1 1 39 39 GLU C C 39 176.652 176.652 176.056 0.596 25767 7598 1 9 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.922 1.276 25767 7599 1 9 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.299 -0.264 25767 7600 1 9 . 1 1 39 39 GLU H H 39 8.587 8.587 8.551 0.036 25767 7601 1 9 . 1 1 40 40 ASP N N 40 120.047 120.047 120.917 -0.870 25767 7602 1 9 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.405 0.145 25767 7603 1 9 . 1 1 40 40 ASP C C 40 175.035 175.035 175.574 -0.539 25767 7604 1 9 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.381 -2.013 25767 7605 1 9 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.986 -0.964 25767 7606 1 9 . 1 1 40 40 ASP H H 40 8.504 8.504 8.500 0.004 25767 7607 1 9 . 1 1 41 41 ARG N N 41 120.671 120.671 123.328 -2.657 25767 7608 1 9 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.628 -0.239 25767 7609 1 9 . 1 1 41 41 ARG C C 41 175.755 175.755 175.720 0.035 25767 7610 1 9 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.475 0.533 25767 7611 1 9 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.576 -1.027 25767 7612 1 9 . 1 1 41 41 ARG H H 41 7.672 7.672 8.219 -0.546 25767 7613 1 9 . 1 1 42 42 SER N N 42 120.330 120.330 116.194 4.136 25767 7614 1 9 . 1 1 42 42 SER HA H 42 3.837 3.837 4.330 -0.493 25767 7615 1 9 . 1 1 42 42 SER CA C 42 57.326 57.326 58.570 -1.244 25767 7616 1 9 . 1 1 42 42 SER CB C 42 65.762 65.762 64.014 1.748 25767 7617 1 9 . 1 1 42 42 SER H H 42 8.544 8.544 8.532 0.012 25767 7618 1 9 . 1 1 43 43 GLN HA H 43 3.989 3.989 3.983 0.006 25767 7619 1 9 . 1 1 43 43 GLN C C 43 178.907 178.907 177.660 1.247 25767 7620 1 9 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.840 0.530 25767 7621 1 9 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.465 -0.502 25767 7622 1 9 . 1 1 44 44 GLU N N 44 120.328 120.328 118.403 1.925 25767 7623 1 9 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.928 0.085 25767 7624 1 9 . 1 1 44 44 GLU C C 44 179.824 179.824 179.019 0.805 25767 7625 1 9 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.248 0.797 25767 7626 1 9 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.004 -0.356 25767 7627 1 9 . 1 1 44 44 GLU H H 44 8.938 8.938 8.721 0.217 25767 7628 1 9 . 1 1 45 45 MET N N 45 121.030 121.030 117.311 3.719 25767 7629 1 9 . 1 1 45 45 MET HA H 45 4.412 4.412 4.260 0.152 25767 7630 1 9 . 1 1 45 45 MET C C 45 180.357 180.357 178.239 2.118 25767 7631 1 9 . 1 1 45 45 MET CA C 45 57.209 57.209 58.005 -0.796 25767 7632 1 9 . 1 1 45 45 MET CB C 45 32.436 32.436 32.027 0.409 25767 7633 1 9 . 1 1 45 45 MET H H 45 7.756 7.756 7.971 -0.215 25767 7634 1 9 . 1 1 46 46 THR N N 46 120.008 120.008 117.054 2.954 25767 7635 1 9 . 1 1 46 46 THR HA H 46 4.071 4.071 3.860 0.211 25767 7636 1 9 . 1 1 46 46 THR CA C 46 67.096 67.096 67.414 -0.318 25767 7637 1 9 . 1 1 46 46 THR CB C 46 68.954 68.954 68.433 0.521 25767 7638 1 9 . 1 1 46 46 THR H H 46 8.187 8.187 7.779 0.408 25767 7639 1 9 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.134 -0.025 25767 7640 1 9 . 1 1 47 47 ALA C C 47 180.118 180.118 179.062 1.056 25767 7641 1 9 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.860 0.479 25767 7642 1 9 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.455 -0.623 25767 7643 1 9 . 1 1 47 47 ALA H H 47 8.238 8.238 7.759 0.479 25767 7644 1 9 . 1 1 48 48 LEU N N 48 122.093 122.093 120.651 1.442 25767 7645 1 9 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.048 0.215 25767 7646 1 9 . 1 1 48 48 LEU C C 48 179.103 179.103 178.548 0.555 25767 7647 1 9 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.513 0.227 25767 7648 1 9 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.693 -0.897 25767 7649 1 9 . 1 1 48 48 LEU H H 48 7.778 7.778 7.579 0.199 25767 7650 1 9 . 1 1 49 49 ALA N N 49 120.130 120.130 119.993 0.137 25767 7651 1 9 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.958 -0.237 25767 7652 1 9 . 1 1 49 49 ALA C C 49 178.676 178.676 179.401 -0.725 25767 7653 1 9 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.543 0.178 25767 7654 1 9 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.082 -0.255 25767 7655 1 9 . 1 1 49 49 ALA H H 49 8.432 8.432 8.385 0.047 25767 7656 1 9 . 1 1 50 50 THR N N 50 113.333 113.333 112.906 0.427 25767 7657 1 9 . 1 1 50 50 THR HA H 50 3.895 3.895 3.894 0.001 25767 7658 1 9 . 1 1 50 50 THR C C 50 174.948 174.948 176.586 -1.638 25767 7659 1 9 . 1 1 50 50 THR CA C 50 67.334 67.334 66.183 1.151 25767 7660 1 9 . 1 1 50 50 THR CB C 50 68.864 68.864 67.987 0.877 25767 7661 1 9 . 1 1 50 50 THR H H 50 7.857 7.857 7.740 0.117 25767 7662 1 9 . 1 1 51 51 GLU N N 51 122.698 122.698 122.477 0.221 25767 7663 1 9 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.035 0.033 25767 7664 1 9 . 1 1 51 51 GLU C C 51 179.997 179.997 178.873 1.124 25767 7665 1 9 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.346 0.087 25767 7666 1 9 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.504 0.013 25767 7667 1 9 . 1 1 51 51 GLU H H 51 7.817 7.817 7.641 0.176 25767 7668 1 9 . 1 1 52 52 LEU N N 52 121.100 121.100 119.445 1.655 25767 7669 1 9 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.061 0.068 25767 7670 1 9 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.448 0.441 25767 7671 1 9 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.698 0.249 25767 7672 1 9 . 1 1 52 52 LEU H H 52 8.628 8.628 7.726 0.902 25767 7673 1 9 . 1 1 53 53 LEU N N 53 119.935 119.935 120.547 -0.612 25767 7674 1 9 . 1 1 53 53 LEU C C 53 179.671 179.671 178.348 1.323 25767 7675 1 9 . 1 1 53 53 LEU H H 53 8.303 8.303 7.943 0.360 25767 7676 1 9 . 1 1 54 54 ASP N N 54 120.339 120.339 118.219 2.120 25767 7677 1 9 . 1 1 54 54 ASP C C 54 179.106 179.106 178.358 0.748 25767 7678 1 9 . 1 1 54 54 ASP H H 54 7.901 7.901 7.873 0.028 25767 7679 1 9 . 1 1 55 55 THR N N 55 120.237 120.237 116.852 3.385 25767 7680 1 9 . 1 1 55 55 THR HA H 55 3.696 3.696 4.043 -0.347 25767 7681 1 9 . 1 1 55 55 THR CA C 55 67.340 67.340 66.562 0.778 25767 7682 1 9 . 1 1 55 55 THR CB C 55 68.151 68.151 68.504 -0.353 25767 7683 1 9 . 1 1 55 55 THR H H 55 8.262 8.262 7.634 0.628 25767 7684 1 9 . 1 1 56 56 ILE N N 56 123.953 123.953 121.611 2.342 25767 7685 1 9 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.834 0.009 25767 7686 1 9 . 1 1 56 56 ILE CA C 56 65.894 65.894 63.628 2.266 25767 7687 1 9 . 1 1 56 56 ILE CB C 56 38.133 38.133 36.373 1.760 25767 7688 1 9 . 1 1 56 56 ILE H H 56 8.930 8.930 7.834 1.096 25767 7689 1 9 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.417 0.164 25767 7690 1 9 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.163 -0.132 25767 7691 1 9 . 1 1 58 58 ALA C C 58 179.875 179.875 179.478 0.397 25767 7692 1 9 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.789 0.476 25767 7693 1 9 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.399 -0.414 25767 7694 1 9 . 1 1 58 58 ALA H H 58 7.764 7.764 8.320 -0.556 25767 7695 1 9 . 1 1 59 59 PHE N N 59 121.988 121.988 120.171 1.817 25767 7696 1 9 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.189 0.037 25767 7697 1 9 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.156 0.283 25767 7698 1 9 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.305 0.058 25767 7699 1 9 . 1 1 59 59 PHE H H 59 8.159 8.159 8.648 -0.489 25767 7700 1 9 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.843 -0.302 25767 7701 1 9 . 1 1 60 60 LYS C C 60 179.438 179.438 178.973 0.465 25767 7702 1 9 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.502 0.634 25767 7703 1 9 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.443 -0.385 25767 7704 1 9 . 1 1 61 61 LYS N N 61 119.262 119.262 118.239 1.023 25767 7705 1 9 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.190 -0.245 25767 7706 1 9 . 1 1 61 61 LYS C C 61 178.730 178.730 178.462 0.268 25767 7707 1 9 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.557 1.485 25767 7708 1 9 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.077 0.565 25767 7709 1 9 . 1 1 61 61 LYS H H 61 7.832 7.832 8.028 -0.196 25767 7710 1 9 . 1 1 62 62 GLU N N 62 120.790 120.790 120.591 0.199 25767 7711 1 9 . 1 1 62 62 GLU HA H 62 3.935 3.935 4.006 -0.071 25767 7712 1 9 . 1 1 62 62 GLU C C 62 178.424 178.424 178.120 0.304 25767 7713 1 9 . 1 1 62 62 GLU CA C 62 58.714 58.714 59.037 -0.323 25767 7714 1 9 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.261 -0.031 25767 7715 1 9 . 1 1 62 62 GLU H H 62 7.982 7.982 8.125 -0.143 25767 7716 1 9 . 1 1 63 63 ILE N N 63 118.463 118.463 116.939 1.524 25767 7717 1 9 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.825 -0.136 25767 7718 1 9 . 1 1 63 63 ILE C C 63 177.555 177.555 177.279 0.276 25767 7719 1 9 . 1 1 63 63 ILE CA C 63 61.499 61.499 62.884 -1.385 25767 7720 1 9 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.452 -1.928 25767 7721 1 9 . 1 1 63 63 ILE H H 63 7.732 7.732 7.321 0.411 25767 7722 1 9 . 1 1 64 64 GLY N N 64 107.973 107.973 107.097 0.876 25767 7723 1 9 . 1 1 64 64 GLY C C 64 175.271 175.271 175.094 0.177 25767 7724 1 9 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.157 -0.255 25767 7725 1 9 . 1 1 64 64 GLY H H 64 7.661 7.661 7.870 -0.209 25767 7726 1 9 . 1 1 65 65 GLY N N 65 108.464 108.464 107.323 1.141 25767 7727 1 9 . 1 1 65 65 GLY C C 65 174.800 174.800 175.732 -0.932 25767 7728 1 9 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.368 0.278 25767 7729 1 9 . 1 1 65 65 GLY H H 65 7.808 7.808 8.074 -0.266 25767 7730 1 9 . 1 1 66 66 GLU N N 66 121.162 121.162 121.366 -0.204 25767 7731 1 9 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.100 0.005 25767 7732 1 9 . 1 1 66 66 GLU C C 66 177.230 177.230 178.734 -1.504 25767 7733 1 9 . 1 1 66 66 GLU CA C 66 57.224 57.224 58.904 -1.680 25767 7734 1 9 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.564 0.427 25767 7735 1 9 . 1 1 66 66 GLU H H 66 8.203 8.203 7.770 0.433 25767 7736 1 9 . 1 1 67 67 SER N N 67 116.468 116.468 115.186 1.282 25767 7737 1 9 . 1 1 67 67 SER HA H 67 4.249 4.249 4.217 0.032 25767 7738 1 9 . 1 1 67 67 SER C C 67 174.640 174.640 176.817 -2.177 25767 7739 1 9 . 1 1 67 67 SER CA C 67 58.930 58.930 61.266 -2.336 25767 7740 1 9 . 1 1 67 67 SER CB C 67 63.912 63.912 62.941 0.971 25767 7741 1 9 . 1 1 67 67 SER H H 67 8.206 8.206 8.073 0.133 25767 7742 1 9 . 1 1 68 68 GLU N N 68 122.400 122.400 119.723 2.677 25767 7743 1 9 . 1 1 68 68 GLU HA H 68 4.153 4.153 3.989 0.164 25767 7744 1 9 . 1 1 68 68 GLU C C 68 176.349 176.349 177.047 -0.698 25767 7745 1 9 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.472 -1.649 25767 7746 1 9 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.346 0.635 25767 7747 1 9 . 1 1 68 68 GLU H H 68 8.168 8.168 8.477 -0.309 25767 7748 1 9 . 1 1 69 69 ALA N N 69 124.342 124.342 120.180 4.162 25767 7749 1 9 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.007 0.181 25767 7750 1 9 . 1 1 69 69 ALA C C 69 178.027 178.027 178.176 -0.149 25767 7751 1 9 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.852 -1.294 25767 7752 1 9 . 1 1 69 69 ALA CB C 69 19.492 19.492 18.920 0.572 25767 7753 1 9 . 1 1 69 69 ALA H H 69 7.939 7.939 7.406 0.533 25767 7754 1 9 . 1 1 70 70 GLU N N 70 121.059 121.059 117.985 3.074 25767 7755 1 9 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.427 -0.313 25767 7756 1 9 . 1 1 70 70 GLU C C 70 176.519 176.519 175.338 1.181 25767 7757 1 9 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.268 2.036 25767 7758 1 9 . 1 1 70 70 GLU CB C 70 29.827 29.827 30.508 -0.681 25767 7759 1 9 . 1 1 70 70 GLU H H 70 8.430 8.430 7.558 0.872 25767 7760 1 9 . 1 1 71 71 ASP N N 71 120.274 120.274 123.036 -2.762 25767 7761 1 9 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.284 0.248 25767 7762 1 9 . 1 1 71 71 ASP C C 71 176.369 176.369 176.824 -0.455 25767 7763 1 9 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.234 -0.983 25767 7764 1 9 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.738 1.102 25767 7765 1 9 . 1 1 71 71 ASP H H 71 8.305 8.305 9.092 -0.787 25767 7766 1 9 . 1 1 72 72 SER N N 72 116.165 116.165 114.087 2.078 25767 7767 1 9 . 1 1 72 72 SER HA H 72 4.241 4.241 3.937 0.304 25767 7768 1 9 . 1 1 72 72 SER C C 72 174.567 174.567 175.369 -0.802 25767 7769 1 9 . 1 1 72 72 SER CA C 72 59.031 59.031 61.433 -2.402 25767 7770 1 9 . 1 1 72 72 SER CB C 72 64.040 64.040 63.145 0.895 25767 7771 1 9 . 1 1 72 72 SER H H 72 7.964 7.964 8.178 -0.214 25767 7772 1 9 . 1 1 73 73 ASP N N 73 122.440 122.440 120.355 2.085 25767 7773 1 9 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.077 0.457 25767 7774 1 9 . 1 1 73 73 ASP C C 73 176.882 176.882 178.029 -1.147 25767 7775 1 9 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.195 -2.752 25767 7776 1 9 . 1 1 73 73 ASP CB C 73 41.336 41.336 39.822 1.514 25767 7777 1 9 . 1 1 73 73 ASP H H 73 8.392 8.392 8.662 -0.270 25767 7778 1 9 . 1 1 74 74 LYS N N 74 123.270 123.270 119.766 3.504 25767 7779 1 9 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.007 0.086 25767 7780 1 9 . 1 1 74 74 LYS C C 74 177.608 177.608 179.012 -1.404 25767 7781 1 9 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.349 -1.884 25767 7782 1 9 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.343 -0.197 25767 7783 1 9 . 1 1 74 74 LYS H H 74 8.317 8.317 7.374 0.943 25767 7784 1 9 . 1 1 75 75 SER N N 75 116.557 116.557 115.677 0.880 25767 7785 1 9 . 1 1 75 75 SER HA H 75 4.197 4.197 4.184 0.013 25767 7786 1 9 . 1 1 75 75 SER C C 75 175.988 175.988 176.396 -0.408 25767 7787 1 9 . 1 1 75 75 SER CA C 75 60.434 60.434 61.170 -0.737 25767 7788 1 9 . 1 1 75 75 SER CB C 75 63.172 63.172 62.548 0.624 25767 7789 1 9 . 1 1 75 75 SER H H 75 8.387 8.387 7.735 0.652 25767 7790 1 9 . 1 1 76 76 LEU N N 76 123.910 123.910 121.455 2.455 25767 7791 1 9 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.907 0.263 25767 7792 1 9 . 1 1 76 76 LEU C C 76 178.083 178.083 179.223 -1.140 25767 7793 1 9 . 1 1 76 76 LEU CA C 76 56.492 56.492 58.115 -1.623 25767 7794 1 9 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.521 0.176 25767 7795 1 9 . 1 1 76 76 LEU H H 76 8.059 8.059 8.016 0.043 25767 7796 1 9 . 1 1 77 77 HIS N N 77 120.620 120.620 118.815 1.805 25767 7797 1 9 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.256 0.032 25767 7798 1 9 . 1 1 77 77 HIS C C 77 177.667 177.667 178.301 -0.634 25767 7799 1 9 . 1 1 77 77 HIS CA C 77 58.422 58.422 58.961 -0.539 25767 7800 1 9 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.986 0.278 25767 7801 1 9 . 1 1 77 77 HIS H H 77 7.936 7.936 7.865 0.071 25767 7802 1 9 . 1 1 78 78 VAL N N 78 121.774 121.774 120.298 1.476 25767 7803 1 9 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.711 -0.034 25767 7804 1 9 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.690 -1.084 25767 7805 1 9 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.626 0.238 25767 7806 1 9 . 1 1 78 78 VAL H H 78 7.916 7.916 8.313 -0.397 25767 7807 1 9 . 1 1 79 79 MET N N 79 119.660 119.660 117.899 1.761 25767 7808 1 9 . 1 1 79 79 MET HA H 79 3.925 3.925 4.124 -0.199 25767 7809 1 9 . 1 1 79 79 MET C C 79 177.077 177.077 178.917 -1.840 25767 7810 1 9 . 1 1 79 79 MET CA C 79 58.862 58.862 57.421 1.441 25767 7811 1 9 . 1 1 79 79 MET CB C 79 32.852 32.852 31.090 1.762 25767 7812 1 9 . 1 1 79 79 MET H H 79 8.149 8.149 8.546 -0.397 25767 7813 1 9 . 1 1 80 80 ASN N N 80 117.337 117.337 118.268 -0.931 25767 7814 1 9 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.793 -0.655 25767 7815 1 9 . 1 1 80 80 ASN C C 80 178.133 178.133 178.538 -0.405 25767 7816 1 9 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.538 0.501 25767 7817 1 9 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.792 0.204 25767 7818 1 9 . 1 1 80 80 ASN H H 80 8.202 8.202 8.801 -0.599 25767 7819 1 9 . 1 1 81 81 THR N N 81 115.517 115.517 118.164 -2.647 25767 7820 1 9 . 1 1 81 81 THR HA H 81 3.896 3.896 4.103 -0.207 25767 7821 1 9 . 1 1 81 81 THR C C 81 175.186 175.186 176.142 -0.956 25767 7822 1 9 . 1 1 81 81 THR CA C 81 66.221 66.221 66.918 -0.697 25767 7823 1 9 . 1 1 81 81 THR CB C 81 69.087 69.087 68.782 0.305 25767 7824 1 9 . 1 1 81 81 THR H H 81 7.944 7.944 8.101 -0.157 25767 7825 1 9 . 1 1 82 82 LEU N N 82 119.074 119.074 120.521 -1.447 25767 7826 1 9 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.120 -0.139 25767 7827 1 9 . 1 1 82 82 LEU C C 82 177.583 177.583 178.124 -0.541 25767 7828 1 9 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.467 -0.927 25767 7829 1 9 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.940 -0.147 25767 7830 1 9 . 1 1 82 82 LEU H H 82 7.547 7.547 7.628 -0.081 25767 7831 1 9 . 1 1 83 83 ILE N N 83 118.085 118.085 115.715 2.370 25767 7832 1 9 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.354 0.489 25767 7833 1 9 . 1 1 83 83 ILE C C 83 176.413 176.413 177.078 -0.665 25767 7834 1 9 . 1 1 83 83 ILE CA C 83 62.727 62.727 62.981 -0.254 25767 7835 1 9 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.127 -0.429 25767 7836 1 9 . 1 1 83 83 ILE H H 83 7.409 7.409 7.472 -0.063 25767 7837 1 9 . 1 1 84 84 HIS N N 84 116.152 116.152 114.912 1.240 25767 7838 1 9 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.481 0.114 25767 7839 1 9 . 1 1 84 84 HIS C C 84 175.707 175.707 175.138 0.569 25767 7840 1 9 . 1 1 84 84 HIS CA C 84 58.628 58.628 57.895 0.733 25767 7841 1 9 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.974 0.429 25767 7842 1 9 . 1 1 84 84 HIS H H 84 7.194 7.194 7.881 -0.687 25767 7843 1 9 . 1 1 85 85 ASP N N 85 122.322 122.322 119.936 2.386 25767 7844 1 9 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.800 -0.266 25767 7845 1 9 . 1 1 85 85 ASP C C 85 175.580 175.580 176.433 -0.853 25767 7846 1 9 . 1 1 85 85 ASP CA C 85 53.345 53.345 52.923 0.422 25767 7847 1 9 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.353 -0.235 25767 7848 1 9 . 1 1 85 85 ASP H H 85 8.505 8.505 7.937 0.568 25767 7849 1 9 . 1 1 86 86 GLN N N 86 122.783 122.783 127.167 -4.384 25767 7850 1 9 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.088 -0.125 25767 7851 1 9 . 1 1 86 86 GLN C C 86 178.581 178.581 177.906 0.675 25767 7852 1 9 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.466 -1.512 25767 7853 1 9 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.235 -0.341 25767 7854 1 9 . 1 1 86 86 GLN H H 86 8.803 8.803 8.721 0.082 25767 7855 1 9 . 1 1 87 87 GLU N N 87 121.794 121.794 119.295 2.499 25767 7856 1 9 . 1 1 87 87 GLU HA H 87 4.013 4.013 4.038 -0.025 25767 7857 1 9 . 1 1 87 87 GLU C C 87 178.290 178.290 178.912 -0.622 25767 7858 1 9 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.560 -0.522 25767 7859 1 9 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.038 -0.059 25767 7860 1 9 . 1 1 87 87 GLU H H 87 8.072 8.072 8.127 -0.055 25767 7861 1 9 . 1 1 88 88 LYS N N 88 119.345 119.345 119.567 -0.222 25767 7862 1 9 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.112 -0.357 25767 7863 1 9 . 1 1 88 88 LYS C C 88 180.040 180.040 178.530 1.510 25767 7864 1 9 . 1 1 88 88 LYS CA C 88 59.411 59.411 59.065 0.346 25767 7865 1 9 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.920 0.087 25767 7866 1 9 . 1 1 88 88 LYS H H 88 7.588 7.588 8.541 -0.953 25767 7867 1 9 . 1 1 89 89 ALA N N 89 123.933 123.933 121.846 2.087 25767 7868 1 9 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.197 -0.459 25767 7869 1 9 . 1 1 89 89 ALA C C 89 177.457 177.457 179.378 -1.921 25767 7870 1 9 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.321 0.649 25767 7871 1 9 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.319 0.337 25767 7872 1 9 . 1 1 89 89 ALA H H 89 8.500 8.500 7.751 0.749 25767 7873 1 9 . 1 1 90 90 LYS N N 90 119.244 119.244 120.011 -0.767 25767 7874 1 9 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.944 0.100 25767 7875 1 9 . 1 1 90 90 LYS C C 90 177.774 177.774 178.796 -1.022 25767 7876 1 9 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.600 -0.522 25767 7877 1 9 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.453 -2.212 25767 7878 1 9 . 1 1 90 90 LYS H H 90 6.845 6.845 8.045 -1.200 25767 7879 1 9 . 1 1 91 91 ILE N N 91 117.718 117.718 116.891 0.827 25767 7880 1 9 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.667 -0.269 25767 7881 1 9 . 1 1 91 91 ILE C C 91 177.670 177.670 177.439 0.231 25767 7882 1 9 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.605 -0.607 25767 7883 1 9 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.231 0.570 25767 7884 1 9 . 1 1 91 91 ILE H H 91 7.293 7.293 8.123 -0.830 25767 7885 1 9 . 1 1 92 92 TYR N N 92 121.868 121.868 121.601 0.267 25767 7886 1 9 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.053 0.070 25767 7887 1 9 . 1 1 92 92 TYR C C 92 178.781 178.781 177.570 1.211 25767 7888 1 9 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.398 -0.756 25767 7889 1 9 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.790 0.431 25767 7890 1 9 . 1 1 92 92 TYR H H 92 8.016 8.016 7.888 0.128 25767 7891 1 9 . 1 1 93 93 MET N N 93 118.984 118.984 118.339 0.645 25767 7892 1 9 . 1 1 93 93 MET HA H 93 3.952 3.952 4.078 -0.126 25767 7893 1 9 . 1 1 93 93 MET C C 93 179.925 179.925 178.372 1.553 25767 7894 1 9 . 1 1 93 93 MET CA C 93 57.589 57.589 59.631 -2.042 25767 7895 1 9 . 1 1 93 93 MET CB C 93 30.752 30.752 32.589 -1.837 25767 7896 1 9 . 1 1 93 93 MET H H 93 8.464 8.464 8.721 -0.257 25767 7897 1 9 . 1 1 94 94 LEU N N 94 125.441 125.441 121.448 3.993 25767 7898 1 9 . 1 1 94 94 LEU HA H 94 3.870 3.870 3.994 -0.124 25767 7899 1 9 . 1 1 94 94 LEU C C 94 177.937 177.937 179.368 -1.431 25767 7900 1 9 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.086 0.675 25767 7901 1 9 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.315 0.447 25767 7902 1 9 . 1 1 94 94 LEU H H 94 8.927 8.927 8.482 0.445 25767 7903 1 9 . 1 1 95 95 ASN N N 95 119.066 119.066 118.157 0.909 25767 7904 1 9 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.344 -0.082 25767 7905 1 9 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.850 -0.577 25767 7906 1 9 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.593 -0.988 25767 7907 1 9 . 1 1 95 95 ASN H H 95 8.691 8.691 8.079 0.612 25767 7908 1 9 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.248 0.417 25767 7909 1 9 . 1 1 96 96 PHE CA C 96 62.071 62.071 62.101 -0.030 25767 7910 1 9 . 1 1 96 96 PHE H H 96 8.317 8.317 8.090 0.227 25767 7911 1 9 . 1 1 97 97 THR N N 97 118.178 118.178 115.046 3.132 25767 7912 1 9 . 1 1 97 97 THR HA H 97 3.338 3.338 3.978 -0.640 25767 7913 1 9 . 1 1 97 97 THR C C 97 176.074 176.074 176.811 -0.737 25767 7914 1 9 . 1 1 97 97 THR CA C 97 67.986 67.986 66.058 1.928 25767 7915 1 9 . 1 1 97 97 THR H H 97 8.214 8.214 8.920 -0.706 25767 7916 1 9 . 1 1 98 98 MET N N 98 120.097 120.097 121.992 -1.895 25767 7917 1 9 . 1 1 98 98 MET HA H 98 4.403 4.403 3.982 0.421 25767 7918 1 9 . 1 1 98 98 MET C C 98 178.696 178.696 177.676 1.020 25767 7919 1 9 . 1 1 98 98 MET CA C 98 57.029 57.029 59.724 -2.695 25767 7920 1 9 . 1 1 98 98 MET CB C 98 29.898 29.898 32.433 -2.535 25767 7921 1 9 . 1 1 98 98 MET H H 98 8.885 8.885 8.873 0.012 25767 7922 1 9 . 1 1 99 99 SER N N 99 114.959 114.959 115.628 -0.669 25767 7923 1 9 . 1 1 99 99 SER HA H 99 4.199 4.199 4.149 0.050 25767 7924 1 9 . 1 1 99 99 SER C C 99 176.565 176.565 176.827 -0.262 25767 7925 1 9 . 1 1 99 99 SER CA C 99 61.965 61.965 61.479 0.486 25767 7926 1 9 . 1 1 99 99 SER CB C 99 62.565 62.565 63.005 -0.440 25767 7927 1 9 . 1 1 99 99 SER H H 99 7.515 7.515 8.034 -0.519 25767 7928 1 9 . 1 1 100 100 LEU N N 100 125.380 125.380 124.014 1.366 25767 7929 1 9 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.893 -0.117 25767 7930 1 9 . 1 1 100 100 LEU C C 100 177.689 177.689 178.332 -0.643 25767 7931 1 9 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.181 0.876 25767 7932 1 9 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.315 0.235 25767 7933 1 9 . 1 1 100 100 LEU H H 100 7.400 7.400 8.437 -1.037 25767 7934 1 9 . 1 1 101 101 TYR N N 101 120.597 120.597 120.417 0.180 25767 7935 1 9 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.887 0.229 25767 7936 1 9 . 1 1 101 101 TYR C C 101 176.825 176.825 177.248 -0.423 25767 7937 1 9 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.524 -0.636 25767 7938 1 9 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.265 0.728 25767 7939 1 9 . 1 1 101 101 TYR H H 101 8.880 8.880 8.867 0.013 25767 7940 1 9 . 1 1 102 102 ASN N N 102 116.869 116.869 116.331 0.538 25767 7941 1 9 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.288 -0.122 25767 7942 1 9 . 1 1 102 102 ASN C C 102 179.089 179.089 177.633 1.456 25767 7943 1 9 . 1 1 102 102 ASN CA C 102 56.212 56.212 55.950 0.262 25767 7944 1 9 . 1 1 102 102 ASN CB C 102 37.734 37.734 37.812 -0.078 25767 7945 1 9 . 1 1 102 102 ASN H H 102 8.543 8.543 7.935 0.608 25767 7946 1 9 . 1 1 103 103 GLU N N 103 121.259 121.259 120.863 0.396 25767 7947 1 9 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.919 0.067 25767 7948 1 9 . 1 1 103 103 GLU C C 103 179.968 179.968 178.453 1.515 25767 7949 1 9 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.256 0.261 25767 7950 1 9 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.633 -0.083 25767 7951 1 9 . 1 1 103 103 GLU H H 103 7.872 7.872 8.311 -0.439 25767 7952 1 9 . 1 1 104 104 LYS N N 104 120.268 120.268 120.357 -0.089 25767 7953 1 9 . 1 1 104 104 LYS HA H 104 4.046 4.046 3.906 0.140 25767 7954 1 9 . 1 1 104 104 LYS C C 104 178.355 178.355 178.746 -0.391 25767 7955 1 9 . 1 1 104 104 LYS CA C 104 56.735 56.735 59.548 -2.813 25767 7956 1 9 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.127 -3.014 25767 7957 1 9 . 1 1 104 104 LYS H H 104 8.384 8.384 8.204 0.180 25767 7958 1 9 . 1 1 105 105 LEU N N 105 121.622 121.622 118.925 2.697 25767 7959 1 9 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.734 0.007 25767 7960 1 9 . 1 1 105 105 LEU C C 105 180.552 180.552 178.885 1.667 25767 7961 1 9 . 1 1 105 105 LEU CA C 105 58.172 58.172 57.651 0.521 25767 7962 1 9 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.484 -0.454 25767 7963 1 9 . 1 1 105 105 LEU H H 105 8.400 8.400 7.533 0.867 25767 7964 1 9 . 1 1 106 106 LYS N N 106 119.498 119.498 118.704 0.794 25767 7965 1 9 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.835 0.079 25767 7966 1 9 . 1 1 106 106 LYS C C 106 178.419 178.419 179.004 -0.585 25767 7967 1 9 . 1 1 106 106 LYS CA C 106 59.383 59.383 60.044 -0.661 25767 7968 1 9 . 1 1 106 106 LYS CB C 106 31.808 31.808 32.010 -0.202 25767 7969 1 9 . 1 1 106 106 LYS H H 106 7.067 7.067 7.605 -0.538 25767 7970 1 9 . 1 1 107 107 GLN N N 107 121.405 121.405 118.891 2.514 25767 7971 1 9 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.954 -0.103 25767 7972 1 9 . 1 1 107 107 GLN C C 107 177.935 177.935 178.919 -0.984 25767 7973 1 9 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.792 -0.311 25767 7974 1 9 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.556 -1.758 25767 7975 1 9 . 1 1 107 107 GLN H H 107 7.460 7.460 8.101 -0.641 25767 7976 1 9 . 1 1 108 108 LEU N N 108 119.561 119.561 118.899 0.662 25767 7977 1 9 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.795 0.006 25767 7978 1 9 . 1 1 108 108 LEU C C 108 179.195 179.195 178.138 1.057 25767 7979 1 9 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.461 0.932 25767 7980 1 9 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.767 -0.501 25767 7981 1 9 . 1 1 108 108 LEU H H 108 8.208 8.208 7.675 0.533 25767 7982 1 9 . 1 1 109 109 LYS N N 109 118.535 118.535 116.863 1.672 25767 7983 1 9 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.140 0.112 25767 7984 1 9 . 1 1 109 109 LYS C C 109 177.726 177.726 178.065 -0.339 25767 7985 1 9 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.669 0.061 25767 7986 1 9 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.816 -0.406 25767 7987 1 9 . 1 1 109 109 LYS H H 109 7.168 7.168 7.565 -0.397 25767 7988 1 9 . 1 1 110 110 ASP N N 110 117.463 117.463 116.870 0.593 25767 7989 1 9 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.607 -0.002 25767 7990 1 9 . 1 1 110 110 ASP C C 110 177.360 177.360 176.763 0.597 25767 7991 1 9 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.963 0.933 25767 7992 1 9 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.569 1.008 25767 7993 1 9 . 1 1 110 110 ASP H H 110 7.861 7.861 8.403 -0.542 25767 7994 1 9 . 1 1 111 111 GLY N N 111 113.059 113.059 108.495 4.564 25767 7995 1 9 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.765 -0.713 25767 7996 1 9 . 1 1 111 111 GLY H H 111 8.479 8.479 7.786 0.693 25767 7997 1 9 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.076 0.387 25767 7998 1 9 . 1 1 112 112 PRO C C 112 175.090 175.090 175.682 -0.592 25767 7999 1 9 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.045 -0.681 25767 8000 1 9 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.842 2.008 25767 8001 1 9 . 1 1 113 113 TRP N N 113 123.164 123.164 121.966 1.198 25767 8002 1 9 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.737 -0.027 25767 8003 1 9 . 1 1 113 113 TRP C C 113 174.605 174.605 175.092 -0.487 25767 8004 1 9 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.112 0.793 25767 8005 1 9 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.218 -2.925 25767 8006 1 9 . 1 1 113 113 TRP H H 113 8.687 8.687 8.499 0.188 25767 8007 1 9 . 1 1 114 114 ASP N N 114 121.356 121.356 122.353 -0.997 25767 8008 1 9 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.941 -0.080 25767 8009 1 9 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.790 -0.541 25767 8010 1 9 . 1 1 114 114 ASP CB C 114 43.141 43.141 43.787 -0.646 25767 8011 1 9 . 1 1 114 114 ASP H H 114 6.985 6.985 8.392 -1.407 25767 8012 1 9 . 1 1 115 115 VAL N N 115 118.649 118.649 119.368 -0.719 25767 8013 1 9 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.890 -0.048 25767 8014 1 9 . 1 1 115 115 VAL C C 115 177.739 177.739 177.585 0.154 25767 8015 1 9 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.950 -0.381 25767 8016 1 9 . 1 1 115 115 VAL CB C 115 31.677 31.677 31.893 -0.216 25767 8017 1 9 . 1 1 115 115 VAL H H 115 8.206 8.206 8.450 -0.244 25767 8018 1 9 . 1 1 116 116 MET N N 116 120.401 120.401 118.399 2.002 25767 8019 1 9 . 1 1 116 116 MET HA H 116 4.303 4.303 4.234 0.069 25767 8020 1 9 . 1 1 116 116 MET C C 116 179.269 179.269 178.464 0.805 25767 8021 1 9 . 1 1 116 116 MET CA C 116 57.634 57.634 59.013 -1.379 25767 8022 1 9 . 1 1 116 116 MET CB C 116 30.414 30.414 31.815 -1.401 25767 8023 1 9 . 1 1 116 116 MET H H 116 7.642 7.642 8.106 -0.464 25767 8024 1 9 . 1 1 117 117 LEU N N 117 125.503 125.503 119.352 6.151 25767 8025 1 9 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.108 0.137 25767 8026 1 9 . 1 1 117 117 LEU C C 117 178.445 178.445 179.404 -0.959 25767 8027 1 9 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.876 0.324 25767 8028 1 9 . 1 1 117 117 LEU CB C 117 40.089 40.089 40.674 -0.585 25767 8029 1 9 . 1 1 117 117 LEU H H 117 8.157 8.157 7.529 0.628 25767 8030 1 9 . 1 1 118 118 LYS N N 118 119.052 119.052 119.648 -0.596 25767 8031 1 9 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.953 -0.148 25767 8032 1 9 . 1 1 118 118 LYS C C 118 178.251 178.251 179.277 -1.026 25767 8033 1 9 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.222 0.304 25767 8034 1 9 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.144 -0.016 25767 8035 1 9 . 1 1 118 118 LYS H H 118 7.400 7.400 7.867 -0.467 25767 8036 1 9 . 1 1 119 119 ARG N N 119 117.999 117.999 119.248 -1.249 25767 8037 1 9 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.321 -0.101 25767 8038 1 9 . 1 1 119 119 ARG C C 119 180.441 180.441 179.068 1.373 25767 8039 1 9 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.532 0.285 25767 8040 1 9 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.187 -0.102 25767 8041 1 9 . 1 1 119 119 ARG H H 119 8.265 8.265 7.993 0.272 25767 8042 1 9 . 1 1 120 120 SER N N 120 118.073 118.073 116.709 1.364 25767 8043 1 9 . 1 1 120 120 SER HA H 120 4.182 4.182 4.292 -0.110 25767 8044 1 9 . 1 1 120 120 SER C C 120 176.215 176.215 176.773 -0.558 25767 8045 1 9 . 1 1 120 120 SER CA C 120 62.817 62.817 62.451 0.366 25767 8046 1 9 . 1 1 120 120 SER CB C 120 63.550 63.550 62.987 0.563 25767 8047 1 9 . 1 1 120 120 SER H H 120 8.633 8.633 7.823 0.810 25767 8048 1 9 . 1 1 121 121 LEU N N 121 125.029 125.029 121.967 3.062 25767 8049 1 9 . 1 1 121 121 LEU HA H 121 4.219 4.219 3.932 0.287 25767 8050 1 9 . 1 1 121 121 LEU C C 121 179.679 179.679 178.572 1.107 25767 8051 1 9 . 1 1 121 121 LEU CA C 121 58.849 58.849 57.977 0.872 25767 8052 1 9 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.351 -0.577 25767 8053 1 9 . 1 1 121 121 LEU H H 121 8.313 8.313 8.070 0.243 25767 8054 1 9 . 1 1 122 122 TRP N N 122 120.217 120.217 119.474 0.743 25767 8055 1 9 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.385 -0.045 25767 8056 1 9 . 1 1 122 122 TRP C C 122 177.527 177.527 178.891 -1.364 25767 8057 1 9 . 1 1 122 122 TRP CA C 122 61.758 61.758 61.261 0.497 25767 8058 1 9 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.096 0.552 25767 8059 1 9 . 1 1 122 122 TRP H H 122 7.928 7.928 7.802 0.126 25767 8060 1 9 . 1 1 123 123 CYS N N 123 119.669 119.669 119.041 0.628 25767 8061 1 9 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.147 0.060 25767 8062 1 9 . 1 1 123 123 CYS C C 123 177.057 177.057 177.156 -0.099 25767 8063 1 9 . 1 1 123 123 CYS CA C 123 62.600 62.600 63.468 -0.868 25767 8064 1 9 . 1 1 123 123 CYS CB C 123 25.899 25.899 27.492 -1.593 25767 8065 1 9 . 1 1 123 123 CYS H H 123 8.273 8.273 8.311 -0.038 25767 8066 1 9 . 1 1 124 124 CYS N N 124 116.898 116.898 119.732 -2.834 25767 8067 1 9 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.096 -0.248 25767 8068 1 9 . 1 1 124 124 CYS C C 124 175.759 175.759 176.595 -0.836 25767 8069 1 9 . 1 1 124 124 CYS CA C 124 65.653 65.653 65.413 0.240 25767 8070 1 9 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.476 0.041 25767 8071 1 9 . 1 1 124 124 CYS H H 124 8.122 8.122 8.416 -0.294 25767 8072 1 9 . 1 1 125 125 ILE N N 125 120.498 120.498 120.924 -0.426 25767 8073 1 9 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.710 -0.122 25767 8074 1 9 . 1 1 125 125 ILE C C 125 179.337 179.337 177.465 1.872 25767 8075 1 9 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.773 1.821 25767 8076 1 9 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.447 0.232 25767 8077 1 9 . 1 1 125 125 ILE H H 125 8.092 8.092 7.925 0.167 25767 8078 1 9 . 1 1 126 126 ASP N N 126 125.084 125.084 121.553 3.531 25767 8079 1 9 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.515 0.102 25767 8080 1 9 . 1 1 126 126 ASP C C 126 178.299 178.299 179.241 -0.942 25767 8081 1 9 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.326 1.678 25767 8082 1 9 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.251 0.045 25767 8083 1 9 . 1 1 126 126 ASP H H 126 9.049 9.049 7.966 1.083 25767 8084 1 9 . 1 1 127 127 LEU N N 127 122.591 122.591 120.173 2.418 25767 8085 1 9 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.972 -0.105 25767 8086 1 9 . 1 1 127 127 LEU C C 127 179.655 179.655 179.151 0.504 25767 8087 1 9 . 1 1 127 127 LEU CA C 127 58.661 58.661 58.122 0.539 25767 8088 1 9 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.840 0.354 25767 8089 1 9 . 1 1 127 127 LEU H H 127 8.888 8.888 7.865 1.023 25767 8090 1 9 . 1 1 128 128 PHE N N 128 117.498 117.498 120.097 -2.599 25767 8091 1 9 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.220 0.102 25767 8092 1 9 . 1 1 128 128 PHE C C 128 178.533 178.533 177.482 1.051 25767 8093 1 9 . 1 1 128 128 PHE CA C 128 60.932 60.932 61.479 -0.547 25767 8094 1 9 . 1 1 128 128 PHE CB C 128 39.053 39.053 39.476 -0.423 25767 8095 1 9 . 1 1 128 128 PHE H H 128 8.947 8.947 8.185 0.762 25767 8096 1 9 . 1 1 129 129 SER N N 129 115.398 115.398 116.060 -0.662 25767 8097 1 9 . 1 1 129 129 SER HA H 129 4.046 4.046 4.298 -0.252 25767 8098 1 9 . 1 1 129 129 SER C C 129 175.168 175.168 176.974 -1.806 25767 8099 1 9 . 1 1 129 129 SER CA C 129 63.015 63.015 61.776 1.239 25767 8100 1 9 . 1 1 129 129 SER H H 129 8.578 8.578 9.071 -0.493 25767 8101 1 9 . 1 1 130 130 CYS N N 130 125.556 125.556 122.224 3.332 25767 8102 1 9 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.207 -0.098 25767 8103 1 9 . 1 1 130 130 CYS C C 130 175.294 175.294 176.786 -1.492 25767 8104 1 9 . 1 1 130 130 CYS CA C 130 61.438 61.438 64.848 -3.410 25767 8105 1 9 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.544 -0.494 25767 8106 1 9 . 1 1 130 130 CYS H H 130 8.289 8.289 8.513 -0.224 25767 8107 1 9 . 1 1 131 131 ILE N N 131 120.232 120.232 120.983 -0.751 25767 8108 1 9 . 1 1 131 131 ILE HA H 131 4.033 4.033 4.045 -0.012 25767 8109 1 9 . 1 1 131 131 ILE C C 131 177.297 177.297 178.482 -1.185 25767 8110 1 9 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.424 -0.772 25767 8111 1 9 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.928 1.173 25767 8112 1 9 . 1 1 131 131 ILE H H 131 7.943 7.943 7.780 0.163 25767 8113 1 9 . 1 1 132 132 LEU N N 132 116.422 116.422 120.729 -4.307 25767 8114 1 9 . 1 1 132 132 LEU HA H 132 3.845 3.845 3.865 -0.020 25767 8115 1 9 . 1 1 132 132 LEU C C 132 177.816 177.816 178.419 -0.603 25767 8116 1 9 . 1 1 132 132 LEU CA C 132 57.078 57.078 57.974 -0.896 25767 8117 1 9 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.466 0.747 25767 8118 1 9 . 1 1 132 132 LEU H H 132 7.846 7.846 8.016 -0.170 25767 8119 1 9 . 1 1 133 133 HIS N N 133 116.929 116.929 118.655 -1.726 25767 8120 1 9 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.292 -0.153 25767 8121 1 9 . 1 1 133 133 HIS C C 133 178.669 178.669 177.942 0.727 25767 8122 1 9 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.953 -0.217 25767 8123 1 9 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.367 2.785 25767 8124 1 9 . 1 1 133 133 HIS H H 133 7.822 7.822 8.326 -0.504 25767 8125 1 9 . 1 1 134 134 LEU N N 134 116.898 116.898 121.802 -4.904 25767 8126 1 9 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.199 -0.466 25767 8127 1 9 . 1 1 134 134 LEU C C 134 179.402 179.402 178.714 0.688 25767 8128 1 9 . 1 1 134 134 LEU CA C 134 57.227 57.227 58.070 -0.843 25767 8129 1 9 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.239 -2.700 25767 8130 1 9 . 1 1 134 134 LEU H H 134 8.688 8.688 7.957 0.731 25767 8131 1 9 . 1 1 135 135 TRP N N 135 115.602 115.602 117.671 -2.069 25767 8132 1 9 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.613 0.395 25767 8133 1 9 . 1 1 135 135 TRP C C 135 175.022 175.022 177.902 -2.880 25767 8134 1 9 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.430 0.996 25767 8135 1 9 . 1 1 135 135 TRP CB C 135 27.085 27.085 28.820 -1.736 25767 8136 1 9 . 1 1 135 135 TRP H H 135 7.638 7.638 8.508 -0.870 25767 8137 1 9 . 1 1 136 136 LYS N N 136 119.721 119.721 122.945 -3.224 25767 8138 1 9 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.994 -0.178 25767 8139 1 9 . 1 1 136 136 LYS C C 136 178.279 178.279 178.345 -0.066 25767 8140 1 9 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.128 1.065 25767 8141 1 9 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.713 1.344 25767 8142 1 9 . 1 1 136 136 LYS H H 136 6.538 6.538 8.184 -1.646 25767 8143 1 9 . 1 1 137 137 GLU N N 137 115.407 115.407 116.390 -0.983 25767 8144 1 9 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.104 0.063 25767 8145 1 9 . 1 1 137 137 GLU C C 137 176.700 176.700 177.262 -0.562 25767 8146 1 9 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.638 -0.788 25767 8147 1 9 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.026 0.133 25767 8148 1 9 . 1 1 137 137 GLU H H 137 8.596 8.596 8.132 0.464 25767 8149 1 9 . 1 1 138 138 ASN N N 138 116.669 116.669 116.439 0.230 25767 8150 1 9 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.814 0.092 25767 8151 1 9 . 1 1 138 138 ASN C C 138 173.481 173.481 174.902 -1.421 25767 8152 1 9 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.864 -1.050 25767 8153 1 9 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.618 1.219 25767 8154 1 9 . 1 1 138 138 ASN H H 138 8.343 8.343 8.142 0.201 25767 8155 1 9 . 1 1 139 139 ILE N N 139 120.703 120.703 120.546 0.157 25767 8156 1 9 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.313 0.031 25767 8157 1 9 . 1 1 139 139 ILE C C 139 175.241 175.241 175.863 -0.622 25767 8158 1 9 . 1 1 139 139 ILE CA C 139 60.792 60.792 58.761 2.031 25767 8159 1 9 . 1 1 139 139 ILE CB C 139 40.274 40.274 38.462 1.812 25767 8160 1 9 . 1 1 139 139 ILE H H 139 7.167 7.167 7.571 -0.404 25767 8161 1 9 . 1 1 140 140 SER N N 140 123.284 123.284 121.502 1.782 25767 8162 1 9 . 1 1 140 140 SER HA H 140 4.345 4.345 4.514 -0.169 25767 8163 1 9 . 1 1 140 140 SER CA C 140 58.095 58.095 57.258 0.837 25767 8164 1 9 . 1 1 140 140 SER CB C 140 65.370 65.370 64.653 0.716 25767 8165 1 9 . 1 1 140 140 SER H H 140 8.727 8.727 8.534 0.193 25767 8166 1 9 . 1 1 142 142 THR N N 142 113.868 113.868 115.459 -1.591 25767 8167 1 9 . 1 1 142 142 THR HA H 142 3.976 3.976 4.252 -0.276 25767 8168 1 9 . 1 1 142 142 THR C C 142 177.559 177.559 176.864 0.695 25767 8169 1 9 . 1 1 142 142 THR CA C 142 66.007 66.007 65.963 0.044 25767 8170 1 9 . 1 1 142 142 THR CB C 142 68.530 68.530 68.424 0.106 25767 8171 1 9 . 1 1 142 142 THR H H 142 8.243 8.243 8.218 0.025 25767 8172 1 9 . 1 1 143 143 SER N N 143 120.786 120.786 117.874 2.912 25767 8173 1 9 . 1 1 143 143 SER C C 143 175.844 175.844 176.930 -1.086 25767 8174 1 9 . 1 1 143 143 SER CA C 143 62.102 62.102 61.991 0.111 25767 8175 1 9 . 1 1 143 143 SER CB C 143 63.086 63.086 62.328 0.758 25767 8176 1 9 . 1 1 143 143 SER H H 143 7.915 7.915 8.195 -0.280 25767 8177 1 9 . 1 1 144 144 THR N N 144 120.946 120.946 118.606 2.340 25767 8178 1 9 . 1 1 144 144 THR HA H 144 4.299 4.299 4.040 0.259 25767 8179 1 9 . 1 1 144 144 THR C C 144 175.874 175.874 175.901 -0.027 25767 8180 1 9 . 1 1 144 144 THR CA C 144 67.487 67.487 66.763 0.724 25767 8181 1 9 . 1 1 144 144 THR CB C 144 68.485 68.485 68.715 -0.230 25767 8182 1 9 . 1 1 144 144 THR H H 144 8.746 8.746 8.580 0.166 25767 8183 1 9 . 1 1 145 145 ASN N N 145 120.069 120.069 119.324 0.745 25767 8184 1 9 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.408 -0.100 25767 8185 1 9 . 1 1 145 145 ASN C C 145 177.917 177.917 177.528 0.389 25767 8186 1 9 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.812 -0.475 25767 8187 1 9 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.516 -0.416 25767 8188 1 9 . 1 1 145 145 ASN H H 145 7.940 7.940 7.833 0.107 25767 8189 1 9 . 1 1 146 146 SER N N 146 116.905 116.905 116.718 0.187 25767 8190 1 9 . 1 1 146 146 SER HA H 146 3.936 3.936 4.217 -0.281 25767 8191 1 9 . 1 1 146 146 SER C C 146 176.963 176.963 176.910 0.053 25767 8192 1 9 . 1 1 146 146 SER CA C 146 61.997 61.997 62.063 -0.066 25767 8193 1 9 . 1 1 146 146 SER CB C 146 62.879 62.879 62.692 0.187 25767 8194 1 9 . 1 1 146 146 SER H H 146 7.951 7.951 7.883 0.068 25767 8195 1 9 . 1 1 147 147 LEU N N 147 123.253 123.253 121.795 1.458 25767 8196 1 9 . 1 1 147 147 LEU HA H 147 3.875 3.875 4.064 -0.189 25767 8197 1 9 . 1 1 147 147 LEU C C 147 178.726 178.726 179.234 -0.508 25767 8198 1 9 . 1 1 147 147 LEU CA C 147 58.580 58.580 57.872 0.708 25767 8199 1 9 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.574 -0.714 25767 8200 1 9 . 1 1 147 147 LEU H H 147 8.168 8.168 7.735 0.433 25767 8201 1 9 . 1 1 148 148 GLN N N 148 118.212 118.212 118.760 -0.548 25767 8202 1 9 . 1 1 148 148 GLN HA H 148 3.817 3.817 4.152 -0.335 25767 8203 1 9 . 1 1 148 148 GLN C C 148 179.686 179.686 178.504 1.182 25767 8204 1 9 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.778 0.465 25767 8205 1 9 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.970 -0.250 25767 8206 1 9 . 1 1 148 148 GLN H H 148 8.295 8.295 8.774 -0.479 25767 8207 1 9 . 1 1 149 149 LYS N N 149 120.770 120.770 120.627 0.143 25767 8208 1 9 . 1 1 149 149 LYS HA H 149 3.901 3.901 4.003 -0.102 25767 8209 1 9 . 1 1 149 149 LYS C C 149 178.006 178.006 179.114 -1.108 25767 8210 1 9 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.749 -0.217 25767 8211 1 9 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.227 -0.335 25767 8212 1 9 . 1 1 149 149 LYS H H 149 7.955 7.955 8.313 -0.358 25767 8213 1 9 . 1 1 150 150 ARG N N 150 119.244 119.244 118.872 0.372 25767 8214 1 9 . 1 1 150 150 ARG HA H 150 3.840 3.840 4.041 -0.201 25767 8215 1 9 . 1 1 150 150 ARG C C 150 178.858 178.858 178.922 -0.064 25767 8216 1 9 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.590 -0.219 25767 8217 1 9 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.998 -1.194 25767 8218 1 9 . 1 1 150 150 ARG H H 150 7.020 7.020 7.556 -0.536 25767 8219 1 9 . 1 1 151 151 ILE N N 151 121.183 121.183 120.011 1.172 25767 8220 1 9 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.783 -0.424 25767 8221 1 9 . 1 1 151 151 ILE C C 151 177.327 177.327 177.578 -0.251 25767 8222 1 9 . 1 1 151 151 ILE CA C 151 67.196 67.196 65.192 2.004 25767 8223 1 9 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.741 0.531 25767 8224 1 9 . 1 1 151 151 ILE H H 151 7.574 7.574 7.783 -0.209 25767 8225 1 9 . 1 1 152 152 LYS N N 152 119.521 119.521 120.845 -1.324 25767 8226 1 9 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.938 -0.165 25767 8227 1 9 . 1 1 152 152 LYS C C 152 178.016 178.016 178.184 -0.168 25767 8228 1 9 . 1 1 152 152 LYS CA C 152 59.830 59.830 59.172 0.658 25767 8229 1 9 . 1 1 152 152 LYS CB C 152 31.581 31.581 31.902 -0.321 25767 8230 1 9 . 1 1 152 152 LYS H H 152 7.629 7.629 8.378 -0.749 25767 8231 1 9 . 1 1 153 153 TYR N N 153 120.178 120.178 120.264 -0.086 25767 8232 1 9 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.170 -0.098 25767 8233 1 9 . 1 1 153 153 TYR C C 153 178.195 178.195 177.872 0.323 25767 8234 1 9 . 1 1 153 153 TYR CA C 153 61.316 61.316 62.078 -0.762 25767 8235 1 9 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.457 -1.184 25767 8236 1 9 . 1 1 153 153 TYR H H 153 8.407 8.407 8.029 0.378 25767 8237 1 9 . 1 1 154 154 CYS N N 154 117.013 117.013 118.023 -1.010 25767 8238 1 9 . 1 1 154 154 CYS HA H 154 4.072 4.072 3.944 0.128 25767 8239 1 9 . 1 1 154 154 CYS C C 154 176.827 176.827 176.705 0.122 25767 8240 1 9 . 1 1 154 154 CYS CA C 154 65.780 65.780 64.478 1.302 25767 8241 1 9 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.692 0.468 25767 8242 1 9 . 1 1 154 154 CYS H H 154 8.291 8.291 7.912 0.379 25767 8243 1 9 . 1 1 155 155 LYS N N 155 118.753 118.753 120.624 -1.871 25767 8244 1 9 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.829 -0.158 25767 8245 1 9 . 1 1 155 155 LYS C C 155 179.904 179.904 178.981 0.923 25767 8246 1 9 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.656 0.828 25767 8247 1 9 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.265 -0.322 25767 8248 1 9 . 1 1 155 155 LYS H H 155 7.934 7.934 8.239 -0.305 25767 8249 1 9 . 1 1 156 156 ILE N N 156 123.873 123.873 120.900 2.973 25767 8250 1 9 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.604 -0.020 25767 8251 1 9 . 1 1 156 156 ILE C C 156 179.501 179.501 177.754 1.747 25767 8252 1 9 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.604 -0.364 25767 8253 1 9 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.974 -0.332 25767 8254 1 9 . 1 1 156 156 ILE H H 156 8.314 8.314 8.600 -0.286 25767 8255 1 9 . 1 1 157 157 TYR N N 157 121.132 121.132 119.895 1.237 25767 8256 1 9 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.911 0.254 25767 8257 1 9 . 1 1 157 157 TYR C C 157 178.558 178.558 177.380 1.178 25767 8258 1 9 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.841 0.269 25767 8259 1 9 . 1 1 157 157 TYR H H 157 8.442 8.442 7.639 0.803 25767 8260 1 9 . 1 1 158 158 LEU N N 158 120.964 120.964 119.689 1.275 25767 8261 1 9 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.728 0.184 25767 8262 1 9 . 1 1 158 158 LEU C C 158 180.130 180.130 178.509 1.621 25767 8263 1 9 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.690 0.997 25767 8264 1 9 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.575 0.155 25767 8265 1 9 . 1 1 158 158 LEU H H 158 8.469 8.469 7.892 0.577 25767 8266 1 9 . 1 1 159 159 SER N N 159 116.653 116.653 115.150 1.503 25767 8267 1 9 . 1 1 159 159 SER HA H 159 4.246 4.246 3.974 0.272 25767 8268 1 9 . 1 1 159 159 SER CA C 159 61.460 61.460 62.175 -0.715 25767 8269 1 9 . 1 1 159 159 SER CB C 159 62.849 62.849 62.798 0.051 25767 8270 1 9 . 1 1 159 159 SER H H 159 7.758 7.758 8.258 -0.500 25767 8271 1 9 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.269 -1.896 25767 8272 1 9 . 1 1 160 160 LYS CB C 160 29.832 29.832 31.994 -2.162 25767 8273 1 9 . 1 1 160 160 LYS H H 160 8.425 8.425 7.339 1.086 25767 8274 1 9 . 1 1 161 161 LEU N N 161 121.686 121.686 118.864 2.822 25767 8275 1 9 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.781 0.382 25767 8276 1 9 . 1 1 161 161 LEU C C 161 180.224 180.224 178.944 1.280 25767 8277 1 9 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.568 0.016 25767 8278 1 9 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.324 0.138 25767 8279 1 9 . 1 1 161 161 LEU H H 161 8.323 8.323 7.297 1.026 25767 8280 1 9 . 1 1 162 162 ALA N N 162 123.102 123.102 120.996 2.106 25767 8281 1 9 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.032 0.098 25767 8282 1 9 . 1 1 162 162 ALA C C 162 179.487 179.487 179.287 0.200 25767 8283 1 9 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.706 0.038 25767 8284 1 9 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.365 0.038 25767 8285 1 9 . 1 1 162 162 ALA H H 162 7.978 7.978 7.576 0.402 25767 8286 1 9 . 1 1 163 163 LYS N N 163 116.069 116.069 116.249 -0.180 25767 8287 1 9 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.263 -0.040 25767 8288 1 9 . 1 1 163 163 LYS C C 163 176.987 176.987 176.624 0.363 25767 8289 1 9 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.316 0.290 25767 8290 1 9 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.728 0.478 25767 8291 1 9 . 1 1 163 163 LYS H H 163 7.697 7.697 7.728 -0.031 25767 8292 1 9 . 1 1 164 164 GLY N N 164 108.540 108.540 107.132 1.408 25767 8293 1 9 . 1 1 164 164 GLY C C 164 174.721 174.721 173.898 0.823 25767 8294 1 9 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.879 0.912 25767 8295 1 9 . 1 1 164 164 GLY H H 164 7.772 7.772 7.540 0.232 25767 8296 1 9 . 1 1 165 165 GLU N N 165 119.886 119.886 120.750 -0.864 25767 8297 1 9 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.375 -0.325 25767 8298 1 9 . 1 1 165 165 GLU C C 165 176.027 176.027 174.996 1.031 25767 8299 1 9 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.054 1.799 25767 8300 1 9 . 1 1 165 165 GLU CB C 165 30.338 30.338 30.918 -0.580 25767 8301 1 9 . 1 1 165 165 GLU H H 165 8.065 8.065 7.737 0.328 25767 8302 1 9 . 1 1 166 166 ILE N N 166 117.926 117.926 122.912 -4.986 25767 8303 1 9 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.805 0.097 25767 8304 1 9 . 1 1 166 166 ILE C C 166 174.138 174.138 176.249 -2.111 25767 8305 1 9 . 1 1 166 166 ILE CA C 166 60.455 60.455 59.118 1.337 25767 8306 1 9 . 1 1 166 166 ILE CB C 166 40.202 40.202 38.281 1.921 25767 8307 1 9 . 1 1 166 166 ILE H H 166 7.282 7.282 8.181 -0.899 25767 8308 1 10 . 1 1 2 2 ALA N N 2 122.811 122.811 124.846 -2.035 25767 8309 1 10 . 1 1 2 2 ALA HA H 2 4.023 4.023 3.951 0.072 25767 8310 1 10 . 1 1 2 2 ALA C C 2 179.915 179.915 179.155 0.760 25767 8311 1 10 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.460 -0.343 25767 8312 1 10 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.206 0.333 25767 8313 1 10 . 1 1 2 2 ALA H H 2 8.509 8.509 8.772 -0.263 25767 8314 1 10 . 1 1 3 3 SER N N 3 115.308 115.308 114.337 0.971 25767 8315 1 10 . 1 1 3 3 SER HA H 3 4.097 4.097 4.240 -0.143 25767 8316 1 10 . 1 1 3 3 SER C C 3 176.706 176.706 176.340 0.366 25767 8317 1 10 . 1 1 3 3 SER CA C 3 60.665 60.665 61.174 -0.509 25767 8318 1 10 . 1 1 3 3 SER CB C 3 62.710 62.710 62.024 0.686 25767 8319 1 10 . 1 1 3 3 SER H H 3 7.996 7.996 8.543 -0.547 25767 8320 1 10 . 1 1 4 4 ASN N N 4 122.688 122.688 119.688 3.000 25767 8321 1 10 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.405 -0.101 25767 8322 1 10 . 1 1 4 4 ASN C C 4 176.258 176.258 177.381 -1.123 25767 8323 1 10 . 1 1 4 4 ASN CA C 4 55.701 55.701 55.968 -0.267 25767 8324 1 10 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.536 0.641 25767 8325 1 10 . 1 1 4 4 ASN H H 4 8.075 8.075 8.302 -0.227 25767 8326 1 10 . 1 1 5 5 ALA N N 5 121.900 121.900 122.944 -1.044 25767 8327 1 10 . 1 1 5 5 ALA HA H 5 3.575 3.575 3.978 -0.403 25767 8328 1 10 . 1 1 5 5 ALA C C 5 178.475 178.475 178.915 -0.440 25767 8329 1 10 . 1 1 5 5 ALA CA C 5 55.833 55.833 55.028 0.805 25767 8330 1 10 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.333 -0.718 25767 8331 1 10 . 1 1 5 5 ALA H H 5 8.659 8.659 7.673 0.986 25767 8332 1 10 . 1 1 6 6 ALA N N 6 117.768 117.768 121.530 -3.762 25767 8333 1 10 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.988 -0.201 25767 8334 1 10 . 1 1 6 6 ALA C C 6 180.494 180.494 179.450 1.044 25767 8335 1 10 . 1 1 6 6 ALA CA C 6 55.350 55.350 54.997 0.353 25767 8336 1 10 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.233 -0.331 25767 8337 1 10 . 1 1 6 6 ALA H H 6 7.864 7.864 7.728 0.136 25767 8338 1 10 . 1 1 7 7 ARG N N 7 121.173 121.173 119.175 1.998 25767 8339 1 10 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.095 -0.192 25767 8340 1 10 . 1 1 7 7 ARG C C 7 179.189 179.189 178.551 0.638 25767 8341 1 10 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.323 0.989 25767 8342 1 10 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.593 -0.371 25767 8343 1 10 . 1 1 7 7 ARG H H 7 7.514 7.514 8.000 -0.486 25767 8344 1 10 . 1 1 8 8 VAL N N 8 122.979 122.979 119.860 3.119 25767 8345 1 10 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.727 -0.474 25767 8346 1 10 . 1 1 8 8 VAL C C 8 177.821 177.821 177.869 -0.048 25767 8347 1 10 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.621 1.151 25767 8348 1 10 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.256 0.185 25767 8349 1 10 . 1 1 8 8 VAL H H 8 8.101 8.101 7.747 0.354 25767 8350 1 10 . 1 1 9 9 VAL N N 9 119.801 119.801 119.832 -0.031 25767 8351 1 10 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.592 -0.326 25767 8352 1 10 . 1 1 9 9 VAL C C 9 177.373 177.373 177.796 -0.423 25767 8353 1 10 . 1 1 9 9 VAL CA C 9 67.484 67.484 66.370 1.114 25767 8354 1 10 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.487 1.138 25767 8355 1 10 . 1 1 9 9 VAL H H 9 8.362 8.362 7.800 0.562 25767 8356 1 10 . 1 1 10 10 ALA N N 10 122.360 122.360 121.858 0.502 25767 8357 1 10 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.030 -0.094 25767 8358 1 10 . 1 1 10 10 ALA C C 10 180.762 180.762 179.444 1.318 25767 8359 1 10 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.649 -0.205 25767 8360 1 10 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.318 -0.581 25767 8361 1 10 . 1 1 10 10 ALA H H 10 7.776 7.776 7.792 -0.016 25767 8362 1 10 . 1 1 11 11 THR N N 11 117.376 117.376 112.310 5.066 25767 8363 1 10 . 1 1 11 11 THR HA H 11 3.816 3.816 4.057 -0.241 25767 8364 1 10 . 1 1 11 11 THR C C 11 175.775 175.775 176.423 -0.648 25767 8365 1 10 . 1 1 11 11 THR CA C 11 66.509 66.509 65.850 0.659 25767 8366 1 10 . 1 1 11 11 THR CB C 11 68.588 68.588 68.754 -0.166 25767 8367 1 10 . 1 1 11 11 THR H H 11 8.180 8.180 7.766 0.414 25767 8368 1 10 . 1 1 12 12 ALA N N 12 125.308 125.308 124.784 0.524 25767 8369 1 10 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.774 0.223 25767 8370 1 10 . 1 1 12 12 ALA C C 12 179.399 179.399 179.454 -0.055 25767 8371 1 10 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.367 0.709 25767 8372 1 10 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.254 0.990 25767 8373 1 10 . 1 1 12 12 ALA H H 12 8.671 8.671 8.342 0.329 25767 8374 1 10 . 1 1 13 13 LYS N N 13 116.977 116.977 118.567 -1.590 25767 8375 1 10 . 1 1 13 13 LYS C C 13 179.646 179.646 178.803 0.843 25767 8376 1 10 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.901 -0.980 25767 8377 1 10 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.225 -0.782 25767 8378 1 10 . 1 1 13 13 LYS H H 13 8.061 8.061 8.075 -0.014 25767 8379 1 10 . 1 1 14 14 ASP N N 14 121.988 121.988 120.098 1.890 25767 8380 1 10 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.498 -0.145 25767 8381 1 10 . 1 1 14 14 ASP C C 14 179.446 179.446 178.789 0.657 25767 8382 1 10 . 1 1 14 14 ASP CA C 14 57.509 57.509 57.014 0.495 25767 8383 1 10 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.687 -0.686 25767 8384 1 10 . 1 1 14 14 ASP H H 14 7.669 7.669 7.713 -0.044 25767 8385 1 10 . 1 1 15 15 PHE N N 15 119.588 119.588 118.440 1.148 25767 8386 1 10 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.246 0.098 25767 8387 1 10 . 1 1 15 15 PHE C C 15 178.373 178.373 178.124 0.249 25767 8388 1 10 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.113 1.124 25767 8389 1 10 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.654 -1.157 25767 8390 1 10 . 1 1 15 15 PHE H H 15 7.913 7.913 8.749 -0.836 25767 8391 1 10 . 1 1 16 16 ASP N N 16 121.705 121.705 119.912 1.793 25767 8392 1 10 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.474 -0.479 25767 8393 1 10 . 1 1 16 16 ASP C C 16 180.071 180.071 179.038 1.033 25767 8394 1 10 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.134 1.015 25767 8395 1 10 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.420 1.067 25767 8396 1 10 . 1 1 16 16 ASP H H 16 8.324 8.324 8.447 -0.123 25767 8397 1 10 . 1 1 17 17 LYS N N 17 118.825 118.825 119.235 -0.410 25767 8398 1 10 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.112 -0.075 25767 8399 1 10 . 1 1 17 17 LYS C C 17 178.407 178.407 178.145 0.262 25767 8400 1 10 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.950 0.111 25767 8401 1 10 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.557 0.027 25767 8402 1 10 . 1 1 17 17 LYS H H 17 7.834 7.834 7.762 0.072 25767 8403 1 10 . 1 1 18 18 VAL N N 18 110.562 110.562 117.235 -6.673 25767 8404 1 10 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.019 0.497 25767 8405 1 10 . 1 1 18 18 VAL C C 18 176.144 176.144 176.458 -0.314 25767 8406 1 10 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.029 -2.155 25767 8407 1 10 . 1 1 18 18 VAL CB C 18 31.160 31.160 32.147 -0.987 25767 8408 1 10 . 1 1 18 18 VAL H H 18 7.185 7.185 7.583 -0.398 25767 8409 1 10 . 1 1 19 19 GLY N N 19 109.272 109.272 107.596 1.676 25767 8410 1 10 . 1 1 19 19 GLY C C 19 175.043 175.043 174.946 0.097 25767 8411 1 10 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.425 0.407 25767 8412 1 10 . 1 1 19 19 GLY H H 19 7.723 7.723 7.804 -0.081 25767 8413 1 10 . 1 1 20 20 LEU N N 20 125.428 125.428 121.482 3.946 25767 8414 1 10 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.678 -0.358 25767 8415 1 10 . 1 1 20 20 LEU C C 20 177.949 177.949 177.485 0.464 25767 8416 1 10 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.439 -0.635 25767 8417 1 10 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.651 0.266 25767 8418 1 10 . 1 1 20 20 LEU H H 20 8.083 8.083 8.050 0.033 25767 8419 1 10 . 1 1 21 21 GLY N N 21 107.804 107.804 110.205 -2.401 25767 8420 1 10 . 1 1 21 21 GLY C C 21 176.278 176.278 176.309 -0.031 25767 8421 1 10 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.691 -0.397 25767 8422 1 10 . 1 1 21 21 GLY H H 21 7.982 7.982 7.918 0.064 25767 8423 1 10 . 1 1 22 22 ILE N N 22 121.319 121.319 121.731 -0.412 25767 8424 1 10 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.908 0.002 25767 8425 1 10 . 1 1 22 22 ILE C C 22 176.604 176.604 177.761 -1.157 25767 8426 1 10 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.525 -2.079 25767 8427 1 10 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.816 -1.250 25767 8428 1 10 . 1 1 22 22 ILE H H 22 8.478 8.478 8.059 0.419 25767 8429 1 10 . 1 1 23 23 ILE N N 23 120.377 120.377 119.884 0.493 25767 8430 1 10 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.850 -0.137 25767 8431 1 10 . 1 1 23 23 ILE C C 23 178.581 178.581 178.354 0.227 25767 8432 1 10 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.301 0.945 25767 8433 1 10 . 1 1 23 23 ILE CB C 23 36.199 36.199 36.229 -0.030 25767 8434 1 10 . 1 1 23 23 ILE H H 23 6.869 6.869 7.648 -0.779 25767 8435 1 10 . 1 1 24 24 GLY N N 24 103.449 103.449 108.309 -4.860 25767 8436 1 10 . 1 1 24 24 GLY C C 24 175.308 175.308 175.686 -0.378 25767 8437 1 10 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.228 0.715 25767 8438 1 10 . 1 1 24 24 GLY H H 24 7.488 7.488 8.109 -0.621 25767 8439 1 10 . 1 1 25 25 TYR N N 25 124.685 124.685 124.150 0.535 25767 8440 1 10 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.814 -0.148 25767 8441 1 10 . 1 1 25 25 TYR C C 25 176.208 176.208 177.117 -0.909 25767 8442 1 10 . 1 1 25 25 TYR CA C 25 61.371 61.371 60.740 0.631 25767 8443 1 10 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.264 0.003 25767 8444 1 10 . 1 1 25 25 TYR H H 25 7.931 7.931 8.082 -0.151 25767 8445 1 10 . 1 1 26 26 TYR N N 26 117.001 117.001 119.854 -2.853 25767 8446 1 10 . 1 1 26 26 TYR HA H 26 3.941 3.941 3.994 -0.053 25767 8447 1 10 . 1 1 26 26 TYR C C 26 178.753 178.753 177.470 1.283 25767 8448 1 10 . 1 1 26 26 TYR CA C 26 64.260 64.260 62.066 2.194 25767 8449 1 10 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.744 -1.223 25767 8450 1 10 . 1 1 26 26 TYR H H 26 7.693 7.693 7.924 -0.231 25767 8451 1 10 . 1 1 27 27 LEU N N 27 118.657 118.657 117.175 1.482 25767 8452 1 10 . 1 1 27 27 LEU HA H 27 4.311 4.311 3.983 0.328 25767 8453 1 10 . 1 1 27 27 LEU CA C 27 58.297 58.297 57.926 0.371 25767 8454 1 10 . 1 1 27 27 LEU CB C 27 42.723 42.723 40.779 1.944 25767 8455 1 10 . 1 1 27 27 LEU H H 27 8.339 8.339 7.999 0.340 25767 8456 1 10 . 1 1 28 28 GLN N N 28 118.593 118.593 118.851 -0.258 25767 8457 1 10 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.780 -0.129 25767 8458 1 10 . 1 1 28 28 GLN C C 28 177.282 177.282 178.482 -1.200 25767 8459 1 10 . 1 1 28 28 GLN CA C 28 58.829 58.829 59.072 -0.243 25767 8460 1 10 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.467 1.181 25767 8461 1 10 . 1 1 28 28 GLN H H 28 7.970 7.970 7.608 0.362 25767 8462 1 10 . 1 1 29 29 LEU N N 29 122.111 122.111 119.494 2.617 25767 8463 1 10 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.715 0.229 25767 8464 1 10 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.548 1.118 25767 8465 1 10 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.245 0.763 25767 8466 1 10 . 1 1 29 29 LEU H H 29 7.979 7.979 7.282 0.697 25767 8467 1 10 . 1 1 30 30 TYR N N 30 119.283 119.283 120.206 -0.923 25767 8468 1 10 . 1 1 30 30 TYR C C 30 175.775 175.775 177.245 -1.470 25767 8469 1 10 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.673 -1.579 25767 8470 1 10 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.333 0.740 25767 8471 1 10 . 1 1 30 30 TYR H H 30 8.093 8.093 7.561 0.532 25767 8472 1 10 . 1 1 31 31 ALA N N 31 121.327 121.327 122.249 -0.922 25767 8473 1 10 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.822 -0.454 25767 8474 1 10 . 1 1 31 31 ALA C C 31 178.955 178.955 178.837 0.118 25767 8475 1 10 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.313 0.234 25767 8476 1 10 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.174 -0.211 25767 8477 1 10 . 1 1 31 31 ALA H H 31 8.394 8.394 8.417 -0.023 25767 8478 1 10 . 1 1 32 32 VAL N N 32 116.757 116.757 118.387 -1.630 25767 8479 1 10 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.535 -0.275 25767 8480 1 10 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.678 1.984 25767 8481 1 10 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.636 -0.665 25767 8482 1 10 . 1 1 32 32 VAL H H 32 8.020 8.020 7.600 0.420 25767 8483 1 10 . 1 1 33 33 GLU N N 33 118.775 118.775 119.625 -0.850 25767 8484 1 10 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.782 0.207 25767 8485 1 10 . 1 1 33 33 GLU C C 33 179.746 179.746 178.947 0.799 25767 8486 1 10 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.338 0.665 25767 8487 1 10 . 1 1 33 33 GLU H H 33 7.358 7.358 7.532 -0.174 25767 8488 1 10 . 1 1 34 34 LEU N N 34 120.632 120.632 121.623 -0.991 25767 8489 1 10 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.839 -0.190 25767 8490 1 10 . 1 1 34 34 LEU C C 34 180.336 180.336 178.480 1.856 25767 8491 1 10 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.611 0.064 25767 8492 1 10 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.712 -0.124 25767 8493 1 10 . 1 1 34 34 LEU H H 34 8.390 8.390 7.863 0.527 25767 8494 1 10 . 1 1 35 35 ILE N N 35 121.240 121.240 118.759 2.481 25767 8495 1 10 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.579 -0.037 25767 8496 1 10 . 1 1 35 35 ILE C C 35 178.604 178.604 178.318 0.286 25767 8497 1 10 . 1 1 35 35 ILE CA C 35 65.547 65.547 65.217 0.330 25767 8498 1 10 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.675 1.056 25767 8499 1 10 . 1 1 35 35 ILE H H 35 8.129 8.129 7.610 0.519 25767 8500 1 10 . 1 1 36 36 LEU N N 36 115.637 115.637 117.880 -2.243 25767 8501 1 10 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.013 -0.005 25767 8502 1 10 . 1 1 36 36 LEU C C 36 178.001 178.001 177.919 0.082 25767 8503 1 10 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.124 -1.048 25767 8504 1 10 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.619 -1.685 25767 8505 1 10 . 1 1 36 36 LEU H H 36 8.416 8.416 7.746 0.670 25767 8506 1 10 . 1 1 37 37 SER N N 37 114.106 114.106 112.137 1.969 25767 8507 1 10 . 1 1 37 37 SER HA H 37 3.991 3.991 4.210 -0.219 25767 8508 1 10 . 1 1 37 37 SER C C 37 173.997 173.997 175.506 -1.509 25767 8509 1 10 . 1 1 37 37 SER CA C 37 60.311 60.311 59.360 0.951 25767 8510 1 10 . 1 1 37 37 SER CB C 37 63.746 63.746 63.605 0.141 25767 8511 1 10 . 1 1 37 37 SER H H 37 7.517 7.517 7.616 -0.099 25767 8512 1 10 . 1 1 38 38 GLU N N 38 123.003 123.003 122.194 0.809 25767 8513 1 10 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.324 0.045 25767 8514 1 10 . 1 1 38 38 GLU C C 38 175.780 175.780 176.319 -0.539 25767 8515 1 10 . 1 1 38 38 GLU CA C 38 55.365 55.365 56.186 -0.821 25767 8516 1 10 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.337 -0.044 25767 8517 1 10 . 1 1 38 38 GLU H H 38 7.151 7.151 7.484 -0.333 25767 8518 1 10 . 1 1 39 39 GLU N N 39 126.166 126.166 122.031 4.135 25767 8519 1 10 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.140 -0.131 25767 8520 1 10 . 1 1 39 39 GLU C C 39 176.652 176.652 176.047 0.605 25767 8521 1 10 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.492 1.706 25767 8522 1 10 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.310 -0.275 25767 8523 1 10 . 1 1 39 39 GLU H H 39 8.587 8.587 8.382 0.205 25767 8524 1 10 . 1 1 40 40 ASP N N 40 120.047 120.047 121.745 -1.698 25767 8525 1 10 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.444 0.106 25767 8526 1 10 . 1 1 40 40 ASP C C 40 175.035 175.035 175.938 -0.903 25767 8527 1 10 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.108 -1.740 25767 8528 1 10 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.768 -0.745 25767 8529 1 10 . 1 1 40 40 ASP H H 40 8.504 8.504 8.523 -0.019 25767 8530 1 10 . 1 1 41 41 ARG N N 41 120.671 120.671 122.767 -2.096 25767 8531 1 10 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.601 -0.212 25767 8532 1 10 . 1 1 41 41 ARG C C 41 175.755 175.755 175.611 0.144 25767 8533 1 10 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.413 0.595 25767 8534 1 10 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.956 -1.407 25767 8535 1 10 . 1 1 41 41 ARG H H 41 7.672 7.672 8.261 -0.589 25767 8536 1 10 . 1 1 42 42 SER N N 42 120.330 120.330 116.091 4.239 25767 8537 1 10 . 1 1 42 42 SER HA H 42 3.837 3.837 4.336 -0.499 25767 8538 1 10 . 1 1 42 42 SER CA C 42 57.326 57.326 58.441 -1.115 25767 8539 1 10 . 1 1 42 42 SER CB C 42 65.762 65.762 64.014 1.748 25767 8540 1 10 . 1 1 42 42 SER H H 42 8.544 8.544 8.195 0.349 25767 8541 1 10 . 1 1 43 43 GLN HA H 43 3.989 3.989 3.977 0.012 25767 8542 1 10 . 1 1 43 43 GLN C C 43 178.907 178.907 177.738 1.169 25767 8543 1 10 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.439 0.931 25767 8544 1 10 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.592 -0.629 25767 8545 1 10 . 1 1 44 44 GLU N N 44 120.328 120.328 120.043 0.285 25767 8546 1 10 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.955 0.058 25767 8547 1 10 . 1 1 44 44 GLU C C 44 179.824 179.824 178.529 1.295 25767 8548 1 10 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.156 0.889 25767 8549 1 10 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.322 -0.674 25767 8550 1 10 . 1 1 44 44 GLU H H 44 8.938 8.938 7.690 1.248 25767 8551 1 10 . 1 1 45 45 MET N N 45 121.030 121.030 117.557 3.473 25767 8552 1 10 . 1 1 45 45 MET HA H 45 4.412 4.412 4.196 0.216 25767 8553 1 10 . 1 1 45 45 MET C C 45 180.357 180.357 177.905 2.452 25767 8554 1 10 . 1 1 45 45 MET CA C 45 57.209 57.209 59.192 -1.983 25767 8555 1 10 . 1 1 45 45 MET CB C 45 32.436 32.436 32.547 -0.112 25767 8556 1 10 . 1 1 45 45 MET H H 45 7.756 7.756 7.822 -0.066 25767 8557 1 10 . 1 1 46 46 THR N N 46 120.008 120.008 116.290 3.718 25767 8558 1 10 . 1 1 46 46 THR HA H 46 4.071 4.071 3.903 0.168 25767 8559 1 10 . 1 1 46 46 THR CA C 46 67.096 67.096 66.644 0.452 25767 8560 1 10 . 1 1 46 46 THR CB C 46 68.954 68.954 68.373 0.581 25767 8561 1 10 . 1 1 46 46 THR H H 46 8.187 8.187 7.459 0.728 25767 8562 1 10 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.108 0.001 25767 8563 1 10 . 1 1 47 47 ALA C C 47 180.118 180.118 179.290 0.828 25767 8564 1 10 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.943 0.396 25767 8565 1 10 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.219 -0.387 25767 8566 1 10 . 1 1 47 47 ALA H H 47 8.238 8.238 7.803 0.435 25767 8567 1 10 . 1 1 48 48 LEU N N 48 122.093 122.093 120.589 1.504 25767 8568 1 10 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.053 0.210 25767 8569 1 10 . 1 1 48 48 LEU C C 48 179.103 179.103 178.612 0.491 25767 8570 1 10 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.501 0.239 25767 8571 1 10 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.695 -0.899 25767 8572 1 10 . 1 1 48 48 LEU H H 48 7.778 7.778 7.567 0.211 25767 8573 1 10 . 1 1 49 49 ALA N N 49 120.130 120.130 120.649 -0.519 25767 8574 1 10 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.960 -0.239 25767 8575 1 10 . 1 1 49 49 ALA C C 49 178.676 178.676 179.585 -0.909 25767 8576 1 10 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.293 0.428 25767 8577 1 10 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.098 -0.271 25767 8578 1 10 . 1 1 49 49 ALA H H 49 8.432 8.432 8.309 0.123 25767 8579 1 10 . 1 1 50 50 THR N N 50 113.333 113.333 115.410 -2.077 25767 8580 1 10 . 1 1 50 50 THR HA H 50 3.895 3.895 3.845 0.050 25767 8581 1 10 . 1 1 50 50 THR C C 50 174.948 174.948 176.511 -1.563 25767 8582 1 10 . 1 1 50 50 THR CA C 50 67.334 67.334 67.588 -0.254 25767 8583 1 10 . 1 1 50 50 THR CB C 50 68.864 68.864 68.603 0.261 25767 8584 1 10 . 1 1 50 50 THR H H 50 7.857 7.857 7.871 -0.014 25767 8585 1 10 . 1 1 51 51 GLU N N 51 122.698 122.698 122.178 0.520 25767 8586 1 10 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.035 0.033 25767 8587 1 10 . 1 1 51 51 GLU C C 51 179.997 179.997 178.732 1.265 25767 8588 1 10 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.264 0.169 25767 8589 1 10 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.599 -0.082 25767 8590 1 10 . 1 1 51 51 GLU H H 51 7.817 7.817 7.688 0.129 25767 8591 1 10 . 1 1 52 52 LEU N N 52 121.100 121.100 121.206 -0.106 25767 8592 1 10 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.050 0.079 25767 8593 1 10 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.776 0.113 25767 8594 1 10 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.742 0.205 25767 8595 1 10 . 1 1 52 52 LEU H H 52 8.628 8.628 7.632 0.996 25767 8596 1 10 . 1 1 53 53 LEU N N 53 119.935 119.935 119.927 0.008 25767 8597 1 10 . 1 1 53 53 LEU C C 53 179.671 179.671 178.309 1.362 25767 8598 1 10 . 1 1 53 53 LEU H H 53 8.303 8.303 7.811 0.492 25767 8599 1 10 . 1 1 54 54 ASP N N 54 120.339 120.339 118.595 1.744 25767 8600 1 10 . 1 1 54 54 ASP C C 54 179.106 179.106 178.313 0.793 25767 8601 1 10 . 1 1 54 54 ASP H H 54 7.901 7.901 7.891 0.010 25767 8602 1 10 . 1 1 55 55 THR N N 55 120.237 120.237 116.838 3.399 25767 8603 1 10 . 1 1 55 55 THR HA H 55 3.696 3.696 4.058 -0.362 25767 8604 1 10 . 1 1 55 55 THR CA C 55 67.340 67.340 66.514 0.826 25767 8605 1 10 . 1 1 55 55 THR CB C 55 68.151 68.151 68.375 -0.224 25767 8606 1 10 . 1 1 55 55 THR H H 55 8.262 8.262 7.702 0.560 25767 8607 1 10 . 1 1 56 56 ILE N N 56 123.953 123.953 122.291 1.662 25767 8608 1 10 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.868 -0.025 25767 8609 1 10 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.709 0.185 25767 8610 1 10 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.630 0.502 25767 8611 1 10 . 1 1 56 56 ILE H H 56 8.930 8.930 7.756 1.174 25767 8612 1 10 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.399 0.182 25767 8613 1 10 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.142 -0.111 25767 8614 1 10 . 1 1 58 58 ALA C C 58 179.875 179.875 179.463 0.412 25767 8615 1 10 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.872 0.394 25767 8616 1 10 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.346 -0.361 25767 8617 1 10 . 1 1 58 58 ALA H H 58 7.764 7.764 8.355 -0.591 25767 8618 1 10 . 1 1 59 59 PHE N N 59 121.988 121.988 119.897 2.091 25767 8619 1 10 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.169 0.057 25767 8620 1 10 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.365 0.074 25767 8621 1 10 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.278 0.085 25767 8622 1 10 . 1 1 59 59 PHE H H 59 8.159 8.159 8.440 -0.281 25767 8623 1 10 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.884 -0.343 25767 8624 1 10 . 1 1 60 60 LYS C C 60 179.438 179.438 178.987 0.451 25767 8625 1 10 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.528 0.608 25767 8626 1 10 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.429 -0.371 25767 8627 1 10 . 1 1 61 61 LYS N N 61 119.262 119.262 118.288 0.974 25767 8628 1 10 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.185 -0.240 25767 8629 1 10 . 1 1 61 61 LYS C C 61 178.730 178.730 178.393 0.337 25767 8630 1 10 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.563 1.479 25767 8631 1 10 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.062 0.580 25767 8632 1 10 . 1 1 61 61 LYS H H 61 7.832 7.832 8.157 -0.325 25767 8633 1 10 . 1 1 62 62 GLU N N 62 120.790 120.790 120.428 0.362 25767 8634 1 10 . 1 1 62 62 GLU HA H 62 3.935 3.935 4.003 -0.068 25767 8635 1 10 . 1 1 62 62 GLU C C 62 178.424 178.424 178.097 0.327 25767 8636 1 10 . 1 1 62 62 GLU CA C 62 58.714 58.714 59.001 -0.287 25767 8637 1 10 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.224 0.005 25767 8638 1 10 . 1 1 62 62 GLU H H 62 7.982 7.982 8.071 -0.089 25767 8639 1 10 . 1 1 63 63 ILE N N 63 118.463 118.463 116.401 2.062 25767 8640 1 10 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.793 -0.104 25767 8641 1 10 . 1 1 63 63 ILE C C 63 177.555 177.555 177.264 0.291 25767 8642 1 10 . 1 1 63 63 ILE CA C 63 61.499 61.499 63.139 -1.640 25767 8643 1 10 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.567 -2.043 25767 8644 1 10 . 1 1 63 63 ILE H H 63 7.732 7.732 7.357 0.375 25767 8645 1 10 . 1 1 64 64 GLY N N 64 107.973 107.973 107.040 0.933 25767 8646 1 10 . 1 1 64 64 GLY C C 64 175.271 175.271 175.067 0.204 25767 8647 1 10 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.187 -0.285 25767 8648 1 10 . 1 1 64 64 GLY H H 64 7.661 7.661 7.794 -0.133 25767 8649 1 10 . 1 1 65 65 GLY N N 65 108.464 108.464 107.409 1.055 25767 8650 1 10 . 1 1 65 65 GLY C C 65 174.800 174.800 175.498 -0.698 25767 8651 1 10 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.387 0.259 25767 8652 1 10 . 1 1 65 65 GLY H H 65 7.808 7.808 8.000 -0.192 25767 8653 1 10 . 1 1 66 66 GLU N N 66 121.162 121.162 121.490 -0.328 25767 8654 1 10 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.088 0.017 25767 8655 1 10 . 1 1 66 66 GLU C C 66 177.230 177.230 178.089 -0.859 25767 8656 1 10 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.163 -1.939 25767 8657 1 10 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.723 0.270 25767 8658 1 10 . 1 1 66 66 GLU H H 66 8.203 8.203 7.692 0.511 25767 8659 1 10 . 1 1 67 67 SER N N 67 116.468 116.468 114.380 2.088 25767 8660 1 10 . 1 1 67 67 SER HA H 67 4.249 4.249 4.192 0.057 25767 8661 1 10 . 1 1 67 67 SER C C 67 174.640 174.640 176.502 -1.862 25767 8662 1 10 . 1 1 67 67 SER CA C 67 58.930 58.930 61.091 -2.161 25767 8663 1 10 . 1 1 67 67 SER CB C 67 63.912 63.912 62.919 0.993 25767 8664 1 10 . 1 1 67 67 SER H H 67 8.206 8.206 7.804 0.402 25767 8665 1 10 . 1 1 68 68 GLU N N 68 122.400 122.400 121.394 1.006 25767 8666 1 10 . 1 1 68 68 GLU HA H 68 4.153 4.153 3.987 0.166 25767 8667 1 10 . 1 1 68 68 GLU C C 68 176.349 176.349 176.915 -0.566 25767 8668 1 10 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.789 -1.966 25767 8669 1 10 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.269 0.712 25767 8670 1 10 . 1 1 68 68 GLU H H 68 8.168 8.168 8.446 -0.278 25767 8671 1 10 . 1 1 69 69 ALA N N 69 124.342 124.342 119.519 4.823 25767 8672 1 10 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.117 0.071 25767 8673 1 10 . 1 1 69 69 ALA C C 69 178.027 178.027 177.806 0.221 25767 8674 1 10 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.767 -1.209 25767 8675 1 10 . 1 1 69 69 ALA CB C 69 19.492 19.492 19.262 0.230 25767 8676 1 10 . 1 1 69 69 ALA H H 69 7.939 7.939 7.323 0.616 25767 8677 1 10 . 1 1 70 70 GLU N N 70 121.059 121.059 118.255 2.804 25767 8678 1 10 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.286 -0.172 25767 8679 1 10 . 1 1 70 70 GLU C C 70 176.519 176.519 175.312 1.207 25767 8680 1 10 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.737 1.567 25767 8681 1 10 . 1 1 70 70 GLU CB C 70 29.827 29.827 30.297 -0.470 25767 8682 1 10 . 1 1 70 70 GLU H H 70 8.430 8.430 7.602 0.828 25767 8683 1 10 . 1 1 71 71 ASP N N 71 120.274 120.274 122.392 -2.118 25767 8684 1 10 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.295 0.237 25767 8685 1 10 . 1 1 71 71 ASP C C 71 176.369 176.369 176.785 -0.416 25767 8686 1 10 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.327 -1.076 25767 8687 1 10 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.172 1.668 25767 8688 1 10 . 1 1 71 71 ASP H H 71 8.305 8.305 8.942 -0.637 25767 8689 1 10 . 1 1 72 72 SER N N 72 116.165 116.165 113.354 2.811 25767 8690 1 10 . 1 1 72 72 SER HA H 72 4.241 4.241 4.014 0.227 25767 8691 1 10 . 1 1 72 72 SER C C 72 174.567 174.567 175.700 -1.133 25767 8692 1 10 . 1 1 72 72 SER CA C 72 59.031 59.031 61.580 -2.549 25767 8693 1 10 . 1 1 72 72 SER CB C 72 64.040 64.040 63.422 0.618 25767 8694 1 10 . 1 1 72 72 SER H H 72 7.964 7.964 8.264 -0.300 25767 8695 1 10 . 1 1 73 73 ASP N N 73 122.440 122.440 121.249 1.191 25767 8696 1 10 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.022 0.512 25767 8697 1 10 . 1 1 73 73 ASP C C 73 176.882 176.882 177.434 -0.552 25767 8698 1 10 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.158 -2.715 25767 8699 1 10 . 1 1 73 73 ASP CB C 73 41.336 41.336 40.062 1.274 25767 8700 1 10 . 1 1 73 73 ASP H H 73 8.392 8.392 8.512 -0.120 25767 8701 1 10 . 1 1 74 74 LYS N N 74 123.270 123.270 120.120 3.150 25767 8702 1 10 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.033 0.060 25767 8703 1 10 . 1 1 74 74 LYS C C 74 177.608 177.608 178.831 -1.223 25767 8704 1 10 . 1 1 74 74 LYS CA C 74 57.465 57.465 58.942 -1.477 25767 8705 1 10 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.606 -0.460 25767 8706 1 10 . 1 1 74 74 LYS H H 74 8.317 8.317 7.926 0.391 25767 8707 1 10 . 1 1 75 75 SER N N 75 116.557 116.557 116.383 0.174 25767 8708 1 10 . 1 1 75 75 SER HA H 75 4.197 4.197 4.152 0.045 25767 8709 1 10 . 1 1 75 75 SER C C 75 175.988 175.988 176.810 -0.822 25767 8710 1 10 . 1 1 75 75 SER CA C 75 60.434 60.434 61.976 -1.542 25767 8711 1 10 . 1 1 75 75 SER CB C 75 63.172 63.172 62.643 0.529 25767 8712 1 10 . 1 1 75 75 SER H H 75 8.387 8.387 8.549 -0.162 25767 8713 1 10 . 1 1 76 76 LEU N N 76 123.910 123.910 121.369 2.541 25767 8714 1 10 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.926 0.244 25767 8715 1 10 . 1 1 76 76 LEU C C 76 178.083 178.083 178.898 -0.815 25767 8716 1 10 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.824 -1.332 25767 8717 1 10 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.522 0.175 25767 8718 1 10 . 1 1 76 76 LEU H H 76 8.059 8.059 8.055 0.004 25767 8719 1 10 . 1 1 77 77 HIS N N 77 120.620 120.620 118.646 1.974 25767 8720 1 10 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.196 0.092 25767 8721 1 10 . 1 1 77 77 HIS C C 77 177.667 177.667 177.989 -0.322 25767 8722 1 10 . 1 1 77 77 HIS CA C 77 58.422 58.422 58.744 -0.322 25767 8723 1 10 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.946 0.318 25767 8724 1 10 . 1 1 77 77 HIS H H 77 7.936 7.936 7.581 0.355 25767 8725 1 10 . 1 1 78 78 VAL N N 78 121.774 121.774 119.483 2.291 25767 8726 1 10 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.719 -0.042 25767 8727 1 10 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.265 -0.659 25767 8728 1 10 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.251 0.613 25767 8729 1 10 . 1 1 78 78 VAL H H 78 7.916 7.916 8.336 -0.420 25767 8730 1 10 . 1 1 79 79 MET N N 79 119.660 119.660 118.185 1.475 25767 8731 1 10 . 1 1 79 79 MET HA H 79 3.925 3.925 4.144 -0.219 25767 8732 1 10 . 1 1 79 79 MET C C 79 177.077 177.077 178.867 -1.790 25767 8733 1 10 . 1 1 79 79 MET CA C 79 58.862 58.862 57.664 1.198 25767 8734 1 10 . 1 1 79 79 MET CB C 79 32.852 32.852 31.012 1.840 25767 8735 1 10 . 1 1 79 79 MET H H 79 8.149 8.149 8.188 -0.039 25767 8736 1 10 . 1 1 80 80 ASN N N 80 117.337 117.337 118.523 -1.186 25767 8737 1 10 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.753 -0.615 25767 8738 1 10 . 1 1 80 80 ASN C C 80 178.133 178.133 178.495 -0.362 25767 8739 1 10 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.390 0.649 25767 8740 1 10 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.603 0.393 25767 8741 1 10 . 1 1 80 80 ASN H H 80 8.202 8.202 8.747 -0.545 25767 8742 1 10 . 1 1 81 81 THR N N 81 115.517 115.517 118.117 -2.600 25767 8743 1 10 . 1 1 81 81 THR HA H 81 3.896 3.896 4.063 -0.167 25767 8744 1 10 . 1 1 81 81 THR C C 81 175.186 175.186 176.362 -1.176 25767 8745 1 10 . 1 1 81 81 THR CA C 81 66.221 66.221 67.454 -1.232 25767 8746 1 10 . 1 1 81 81 THR CB C 81 69.087 69.087 69.032 0.055 25767 8747 1 10 . 1 1 81 81 THR H H 81 7.944 7.944 8.185 -0.241 25767 8748 1 10 . 1 1 82 82 LEU N N 82 119.074 119.074 120.450 -1.376 25767 8749 1 10 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.115 -0.134 25767 8750 1 10 . 1 1 82 82 LEU C C 82 177.583 177.583 178.219 -0.636 25767 8751 1 10 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.336 -0.796 25767 8752 1 10 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.880 -0.087 25767 8753 1 10 . 1 1 82 82 LEU H H 82 7.547 7.547 7.748 -0.201 25767 8754 1 10 . 1 1 83 83 ILE N N 83 118.085 118.085 116.158 1.927 25767 8755 1 10 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.579 0.264 25767 8756 1 10 . 1 1 83 83 ILE C C 83 176.413 176.413 177.492 -1.079 25767 8757 1 10 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.998 -1.271 25767 8758 1 10 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.232 -0.534 25767 8759 1 10 . 1 1 83 83 ILE H H 83 7.409 7.409 7.575 -0.166 25767 8760 1 10 . 1 1 84 84 HIS N N 84 116.152 116.152 115.793 0.359 25767 8761 1 10 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.376 0.219 25767 8762 1 10 . 1 1 84 84 HIS C C 84 175.707 175.707 175.593 0.114 25767 8763 1 10 . 1 1 84 84 HIS CA C 84 58.628 58.628 58.471 0.157 25767 8764 1 10 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.570 0.833 25767 8765 1 10 . 1 1 84 84 HIS H H 84 7.194 7.194 8.016 -0.822 25767 8766 1 10 . 1 1 85 85 ASP N N 85 122.322 122.322 119.394 2.928 25767 8767 1 10 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.763 -0.229 25767 8768 1 10 . 1 1 85 85 ASP C C 85 175.580 175.580 176.605 -1.025 25767 8769 1 10 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.286 0.059 25767 8770 1 10 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.368 -0.250 25767 8771 1 10 . 1 1 85 85 ASP H H 85 8.505 8.505 7.893 0.612 25767 8772 1 10 . 1 1 86 86 GLN N N 86 122.783 122.783 127.281 -4.498 25767 8773 1 10 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.088 -0.125 25767 8774 1 10 . 1 1 86 86 GLN C C 86 178.581 178.581 177.895 0.686 25767 8775 1 10 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.255 -1.301 25767 8776 1 10 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.240 -0.346 25767 8777 1 10 . 1 1 86 86 GLN H H 86 8.803 8.803 8.758 0.045 25767 8778 1 10 . 1 1 87 87 GLU N N 87 121.794 121.794 119.668 2.126 25767 8779 1 10 . 1 1 87 87 GLU HA H 87 4.013 4.013 3.987 0.026 25767 8780 1 10 . 1 1 87 87 GLU C C 87 178.290 178.290 178.943 -0.653 25767 8781 1 10 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.835 -0.797 25767 8782 1 10 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.222 -0.242 25767 8783 1 10 . 1 1 87 87 GLU H H 87 8.072 8.072 8.409 -0.337 25767 8784 1 10 . 1 1 88 88 LYS N N 88 119.345 119.345 118.449 0.896 25767 8785 1 10 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.132 -0.377 25767 8786 1 10 . 1 1 88 88 LYS C C 88 180.040 180.040 178.855 1.185 25767 8787 1 10 . 1 1 88 88 LYS CA C 88 59.411 59.411 58.782 0.629 25767 8788 1 10 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.736 0.271 25767 8789 1 10 . 1 1 88 88 LYS H H 88 7.588 7.588 7.746 -0.158 25767 8790 1 10 . 1 1 89 89 ALA N N 89 123.933 123.933 122.714 1.219 25767 8791 1 10 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.220 -0.481 25767 8792 1 10 . 1 1 89 89 ALA C C 89 177.457 177.457 179.606 -2.149 25767 8793 1 10 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.342 0.628 25767 8794 1 10 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.272 0.384 25767 8795 1 10 . 1 1 89 89 ALA H H 89 8.500 8.500 7.702 0.798 25767 8796 1 10 . 1 1 90 90 LYS N N 90 119.244 119.244 120.084 -0.840 25767 8797 1 10 . 1 1 90 90 LYS HA H 90 4.044 4.044 4.028 0.016 25767 8798 1 10 . 1 1 90 90 LYS C C 90 177.774 177.774 178.870 -1.096 25767 8799 1 10 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.699 -0.621 25767 8800 1 10 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.489 -2.248 25767 8801 1 10 . 1 1 90 90 LYS H H 90 6.845 6.845 8.219 -1.374 25767 8802 1 10 . 1 1 91 91 ILE N N 91 117.718 117.718 116.902 0.816 25767 8803 1 10 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.718 -0.320 25767 8804 1 10 . 1 1 91 91 ILE C C 91 177.670 177.670 177.542 0.128 25767 8805 1 10 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.540 -0.542 25767 8806 1 10 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.098 0.703 25767 8807 1 10 . 1 1 91 91 ILE H H 91 7.293 7.293 7.995 -0.702 25767 8808 1 10 . 1 1 92 92 TYR N N 92 121.868 121.868 121.729 0.139 25767 8809 1 10 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.074 0.049 25767 8810 1 10 . 1 1 92 92 TYR C C 92 178.781 178.781 177.610 1.171 25767 8811 1 10 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.456 -0.814 25767 8812 1 10 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.838 0.383 25767 8813 1 10 . 1 1 92 92 TYR H H 92 8.016 8.016 8.058 -0.042 25767 8814 1 10 . 1 1 93 93 MET N N 93 118.984 118.984 117.856 1.128 25767 8815 1 10 . 1 1 93 93 MET HA H 93 3.952 3.952 4.095 -0.143 25767 8816 1 10 . 1 1 93 93 MET C C 93 179.925 179.925 178.310 1.615 25767 8817 1 10 . 1 1 93 93 MET CA C 93 57.589 57.589 59.268 -1.679 25767 8818 1 10 . 1 1 93 93 MET CB C 93 30.752 30.752 32.648 -1.896 25767 8819 1 10 . 1 1 93 93 MET H H 93 8.464 8.464 8.884 -0.420 25767 8820 1 10 . 1 1 94 94 LEU N N 94 125.441 125.441 121.953 3.488 25767 8821 1 10 . 1 1 94 94 LEU HA H 94 3.870 3.870 4.084 -0.214 25767 8822 1 10 . 1 1 94 94 LEU C C 94 177.937 177.937 178.595 -0.658 25767 8823 1 10 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.178 0.583 25767 8824 1 10 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.623 0.139 25767 8825 1 10 . 1 1 94 94 LEU H H 94 8.927 8.927 8.464 0.463 25767 8826 1 10 . 1 1 95 95 ASN N N 95 119.066 119.066 117.899 1.167 25767 8827 1 10 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.381 -0.119 25767 8828 1 10 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.085 0.188 25767 8829 1 10 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.074 -0.469 25767 8830 1 10 . 1 1 95 95 ASN H H 95 8.691 8.691 8.366 0.325 25767 8831 1 10 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.237 0.428 25767 8832 1 10 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.793 0.278 25767 8833 1 10 . 1 1 96 96 PHE H H 96 8.317 8.317 8.015 0.302 25767 8834 1 10 . 1 1 97 97 THR N N 97 118.178 118.178 114.380 3.798 25767 8835 1 10 . 1 1 97 97 THR HA H 97 3.338 3.338 3.900 -0.562 25767 8836 1 10 . 1 1 97 97 THR C C 97 176.074 176.074 176.947 -0.873 25767 8837 1 10 . 1 1 97 97 THR CA C 97 67.986 67.986 66.426 1.560 25767 8838 1 10 . 1 1 97 97 THR H H 97 8.214 8.214 8.702 -0.488 25767 8839 1 10 . 1 1 98 98 MET N N 98 120.097 120.097 122.561 -2.464 25767 8840 1 10 . 1 1 98 98 MET HA H 98 4.403 4.403 4.072 0.331 25767 8841 1 10 . 1 1 98 98 MET C C 98 178.696 178.696 177.928 0.768 25767 8842 1 10 . 1 1 98 98 MET CA C 98 57.029 57.029 59.581 -2.552 25767 8843 1 10 . 1 1 98 98 MET CB C 98 29.898 29.898 32.519 -2.621 25767 8844 1 10 . 1 1 98 98 MET H H 98 8.885 8.885 8.645 0.240 25767 8845 1 10 . 1 1 99 99 SER N N 99 114.959 114.959 115.889 -0.930 25767 8846 1 10 . 1 1 99 99 SER HA H 99 4.199 4.199 4.175 0.024 25767 8847 1 10 . 1 1 99 99 SER C C 99 176.565 176.565 176.679 -0.114 25767 8848 1 10 . 1 1 99 99 SER CA C 99 61.965 61.965 61.515 0.450 25767 8849 1 10 . 1 1 99 99 SER CB C 99 62.565 62.565 62.676 -0.111 25767 8850 1 10 . 1 1 99 99 SER H H 99 7.515 7.515 8.330 -0.815 25767 8851 1 10 . 1 1 100 100 LEU N N 100 125.380 125.380 124.215 1.165 25767 8852 1 10 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.906 -0.130 25767 8853 1 10 . 1 1 100 100 LEU C C 100 177.689 177.689 178.119 -0.430 25767 8854 1 10 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.185 0.872 25767 8855 1 10 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.488 0.062 25767 8856 1 10 . 1 1 100 100 LEU H H 100 7.400 7.400 8.506 -1.106 25767 8857 1 10 . 1 1 101 101 TYR N N 101 120.597 120.597 119.913 0.684 25767 8858 1 10 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.909 0.207 25767 8859 1 10 . 1 1 101 101 TYR C C 101 176.825 176.825 177.338 -0.513 25767 8860 1 10 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.628 -0.740 25767 8861 1 10 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.278 0.715 25767 8862 1 10 . 1 1 101 101 TYR H H 101 8.880 8.880 8.882 -0.002 25767 8863 1 10 . 1 1 102 102 ASN N N 102 116.869 116.869 116.405 0.464 25767 8864 1 10 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.260 -0.094 25767 8865 1 10 . 1 1 102 102 ASN C C 102 179.089 179.089 177.615 1.474 25767 8866 1 10 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.040 0.172 25767 8867 1 10 . 1 1 102 102 ASN CB C 102 37.734 37.734 37.778 -0.044 25767 8868 1 10 . 1 1 102 102 ASN H H 102 8.543 8.543 7.977 0.566 25767 8869 1 10 . 1 1 103 103 GLU N N 103 121.259 121.259 120.704 0.555 25767 8870 1 10 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.927 0.059 25767 8871 1 10 . 1 1 103 103 GLU C C 103 179.968 179.968 178.518 1.450 25767 8872 1 10 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.249 0.268 25767 8873 1 10 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.630 -0.080 25767 8874 1 10 . 1 1 103 103 GLU H H 103 7.872 7.872 7.946 -0.074 25767 8875 1 10 . 1 1 104 104 LYS N N 104 120.268 120.268 120.077 0.191 25767 8876 1 10 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.164 -0.118 25767 8877 1 10 . 1 1 104 104 LYS C C 104 178.355 178.355 178.846 -0.491 25767 8878 1 10 . 1 1 104 104 LYS CA C 104 56.735 56.735 59.165 -2.430 25767 8879 1 10 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.210 -3.097 25767 8880 1 10 . 1 1 104 104 LYS H H 104 8.384 8.384 7.840 0.544 25767 8881 1 10 . 1 1 105 105 LEU N N 105 121.622 121.622 119.179 2.443 25767 8882 1 10 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.664 0.077 25767 8883 1 10 . 1 1 105 105 LEU C C 105 180.552 180.552 178.786 1.766 25767 8884 1 10 . 1 1 105 105 LEU CA C 105 58.172 58.172 57.672 0.500 25767 8885 1 10 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.481 -0.452 25767 8886 1 10 . 1 1 105 105 LEU H H 105 8.400 8.400 7.690 0.710 25767 8887 1 10 . 1 1 106 106 LYS N N 106 119.498 119.498 118.261 1.237 25767 8888 1 10 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.832 0.082 25767 8889 1 10 . 1 1 106 106 LYS C C 106 178.419 178.419 178.955 -0.536 25767 8890 1 10 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.977 -0.595 25767 8891 1 10 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.948 -0.140 25767 8892 1 10 . 1 1 106 106 LYS H H 106 7.067 7.067 7.567 -0.500 25767 8893 1 10 . 1 1 107 107 GLN N N 107 121.405 121.405 118.865 2.540 25767 8894 1 10 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.967 -0.116 25767 8895 1 10 . 1 1 107 107 GLN C C 107 177.935 177.935 178.882 -0.947 25767 8896 1 10 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.724 -0.243 25767 8897 1 10 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.490 -1.692 25767 8898 1 10 . 1 1 107 107 GLN H H 107 7.460 7.460 7.689 -0.229 25767 8899 1 10 . 1 1 108 108 LEU N N 108 119.561 119.561 119.026 0.535 25767 8900 1 10 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.861 -0.060 25767 8901 1 10 . 1 1 108 108 LEU C C 108 179.195 179.195 178.193 1.002 25767 8902 1 10 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.501 0.892 25767 8903 1 10 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.671 -0.405 25767 8904 1 10 . 1 1 108 108 LEU H H 108 8.208 8.208 7.619 0.589 25767 8905 1 10 . 1 1 109 109 LYS N N 109 118.535 118.535 116.699 1.836 25767 8906 1 10 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.202 0.050 25767 8907 1 10 . 1 1 109 109 LYS C C 109 177.726 177.726 178.076 -0.350 25767 8908 1 10 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.624 0.106 25767 8909 1 10 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.846 -0.437 25767 8910 1 10 . 1 1 109 109 LYS H H 109 7.168 7.168 7.486 -0.318 25767 8911 1 10 . 1 1 110 110 ASP N N 110 117.463 117.463 116.973 0.490 25767 8912 1 10 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.600 0.005 25767 8913 1 10 . 1 1 110 110 ASP C C 110 177.360 177.360 176.792 0.568 25767 8914 1 10 . 1 1 110 110 ASP CA C 110 55.896 55.896 55.012 0.884 25767 8915 1 10 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.540 1.037 25767 8916 1 10 . 1 1 110 110 ASP H H 110 7.861 7.861 8.291 -0.430 25767 8917 1 10 . 1 1 111 111 GLY N N 111 113.059 113.059 108.440 4.619 25767 8918 1 10 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.817 -0.765 25767 8919 1 10 . 1 1 111 111 GLY H H 111 8.479 8.479 7.818 0.661 25767 8920 1 10 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.003 0.460 25767 8921 1 10 . 1 1 112 112 PRO C C 112 175.090 175.090 175.606 -0.516 25767 8922 1 10 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.150 -0.786 25767 8923 1 10 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.699 2.151 25767 8924 1 10 . 1 1 113 113 TRP N N 113 123.164 123.164 121.627 1.537 25767 8925 1 10 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.741 -0.031 25767 8926 1 10 . 1 1 113 113 TRP C C 113 174.605 174.605 175.155 -0.550 25767 8927 1 10 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.140 0.765 25767 8928 1 10 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.466 -3.173 25767 8929 1 10 . 1 1 113 113 TRP H H 113 8.687 8.687 8.413 0.274 25767 8930 1 10 . 1 1 114 114 ASP N N 114 121.356 121.356 122.158 -0.802 25767 8931 1 10 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.939 -0.078 25767 8932 1 10 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.780 -0.531 25767 8933 1 10 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.051 -0.910 25767 8934 1 10 . 1 1 114 114 ASP H H 114 6.985 6.985 8.444 -1.459 25767 8935 1 10 . 1 1 115 115 VAL N N 115 118.649 118.649 119.289 -0.640 25767 8936 1 10 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.922 -0.080 25767 8937 1 10 . 1 1 115 115 VAL C C 115 177.739 177.739 177.462 0.277 25767 8938 1 10 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.605 -0.036 25767 8939 1 10 . 1 1 115 115 VAL CB C 115 31.677 31.677 31.951 -0.274 25767 8940 1 10 . 1 1 115 115 VAL H H 115 8.206 8.206 8.471 -0.265 25767 8941 1 10 . 1 1 116 116 MET N N 116 120.401 120.401 118.193 2.208 25767 8942 1 10 . 1 1 116 116 MET HA H 116 4.303 4.303 4.200 0.103 25767 8943 1 10 . 1 1 116 116 MET C C 116 179.269 179.269 178.431 0.838 25767 8944 1 10 . 1 1 116 116 MET CA C 116 57.634 57.634 59.091 -1.457 25767 8945 1 10 . 1 1 116 116 MET CB C 116 30.414 30.414 31.835 -1.421 25767 8946 1 10 . 1 1 116 116 MET H H 116 7.642 7.642 8.125 -0.483 25767 8947 1 10 . 1 1 117 117 LEU N N 117 125.503 125.503 119.475 6.028 25767 8948 1 10 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.049 0.196 25767 8949 1 10 . 1 1 117 117 LEU C C 117 178.445 178.445 179.356 -0.911 25767 8950 1 10 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.476 0.724 25767 8951 1 10 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.238 -1.149 25767 8952 1 10 . 1 1 117 117 LEU H H 117 8.157 8.157 7.537 0.620 25767 8953 1 10 . 1 1 118 118 LYS N N 118 119.052 119.052 119.144 -0.092 25767 8954 1 10 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.933 -0.128 25767 8955 1 10 . 1 1 118 118 LYS C C 118 178.251 178.251 179.276 -1.025 25767 8956 1 10 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.233 0.293 25767 8957 1 10 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.201 -0.073 25767 8958 1 10 . 1 1 118 118 LYS H H 118 7.400 7.400 7.512 -0.112 25767 8959 1 10 . 1 1 119 119 ARG N N 119 117.999 117.999 119.051 -1.052 25767 8960 1 10 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.295 -0.075 25767 8961 1 10 . 1 1 119 119 ARG C C 119 180.441 180.441 179.121 1.320 25767 8962 1 10 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.703 0.114 25767 8963 1 10 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.258 -0.173 25767 8964 1 10 . 1 1 119 119 ARG H H 119 8.265 8.265 7.950 0.315 25767 8965 1 10 . 1 1 120 120 SER N N 120 118.073 118.073 116.240 1.833 25767 8966 1 10 . 1 1 120 120 SER HA H 120 4.182 4.182 4.310 -0.128 25767 8967 1 10 . 1 1 120 120 SER C C 120 176.215 176.215 176.646 -0.431 25767 8968 1 10 . 1 1 120 120 SER CA C 120 62.817 62.817 61.983 0.834 25767 8969 1 10 . 1 1 120 120 SER CB C 120 63.550 63.550 62.827 0.723 25767 8970 1 10 . 1 1 120 120 SER H H 120 8.633 8.633 7.961 0.672 25767 8971 1 10 . 1 1 121 121 LEU N N 121 125.029 125.029 123.107 1.922 25767 8972 1 10 . 1 1 121 121 LEU HA H 121 4.219 4.219 3.990 0.229 25767 8973 1 10 . 1 1 121 121 LEU C C 121 179.679 179.679 178.688 0.991 25767 8974 1 10 . 1 1 121 121 LEU CA C 121 58.849 58.849 57.959 0.890 25767 8975 1 10 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.374 -0.600 25767 8976 1 10 . 1 1 121 121 LEU H H 121 8.313 8.313 8.007 0.306 25767 8977 1 10 . 1 1 122 122 TRP N N 122 120.217 120.217 119.253 0.964 25767 8978 1 10 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.378 -0.038 25767 8979 1 10 . 1 1 122 122 TRP C C 122 177.527 177.527 178.891 -1.364 25767 8980 1 10 . 1 1 122 122 TRP CA C 122 61.758 61.758 60.941 0.817 25767 8981 1 10 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.120 0.528 25767 8982 1 10 . 1 1 122 122 TRP H H 122 7.928 7.928 7.917 0.011 25767 8983 1 10 . 1 1 123 123 CYS N N 123 119.669 119.669 118.873 0.796 25767 8984 1 10 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.211 -0.004 25767 8985 1 10 . 1 1 123 123 CYS C C 123 177.057 177.057 177.423 -0.366 25767 8986 1 10 . 1 1 123 123 CYS CA C 123 62.600 62.600 62.751 -0.151 25767 8987 1 10 . 1 1 123 123 CYS CB C 123 25.899 25.899 26.072 -0.173 25767 8988 1 10 . 1 1 123 123 CYS H H 123 8.273 8.273 8.290 -0.017 25767 8989 1 10 . 1 1 124 124 CYS N N 124 116.898 116.898 120.163 -3.265 25767 8990 1 10 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.103 -0.255 25767 8991 1 10 . 1 1 124 124 CYS C C 124 175.759 175.759 176.842 -1.083 25767 8992 1 10 . 1 1 124 124 CYS CA C 124 65.653 65.653 65.076 0.577 25767 8993 1 10 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.739 -0.222 25767 8994 1 10 . 1 1 124 124 CYS H H 124 8.122 8.122 8.515 -0.393 25767 8995 1 10 . 1 1 125 125 ILE N N 125 120.498 120.498 120.883 -0.385 25767 8996 1 10 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.669 -0.081 25767 8997 1 10 . 1 1 125 125 ILE C C 125 179.337 179.337 177.536 1.801 25767 8998 1 10 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.807 1.787 25767 8999 1 10 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.471 0.208 25767 9000 1 10 . 1 1 125 125 ILE H H 125 8.092 8.092 8.361 -0.269 25767 9001 1 10 . 1 1 126 126 ASP N N 126 125.084 125.084 120.071 5.013 25767 9002 1 10 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.441 0.176 25767 9003 1 10 . 1 1 126 126 ASP C C 126 178.299 178.299 178.777 -0.478 25767 9004 1 10 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.402 1.602 25767 9005 1 10 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.185 0.111 25767 9006 1 10 . 1 1 126 126 ASP H H 126 9.049 9.049 8.169 0.880 25767 9007 1 10 . 1 1 127 127 LEU N N 127 122.591 122.591 121.336 1.255 25767 9008 1 10 . 1 1 127 127 LEU HA H 127 3.867 3.867 4.009 -0.142 25767 9009 1 10 . 1 1 127 127 LEU C C 127 179.655 179.655 177.732 1.923 25767 9010 1 10 . 1 1 127 127 LEU CA C 127 58.661 58.661 57.978 0.683 25767 9011 1 10 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.798 0.396 25767 9012 1 10 . 1 1 127 127 LEU H H 127 8.888 8.888 8.025 0.863 25767 9013 1 10 . 1 1 128 128 PHE N N 128 117.498 117.498 119.475 -1.977 25767 9014 1 10 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.116 0.206 25767 9015 1 10 . 1 1 128 128 PHE C C 128 178.533 178.533 176.900 1.633 25767 9016 1 10 . 1 1 128 128 PHE CA C 128 60.932 60.932 61.938 -1.006 25767 9017 1 10 . 1 1 128 128 PHE CB C 128 39.053 39.053 39.298 -0.245 25767 9018 1 10 . 1 1 128 128 PHE H H 128 8.947 8.947 8.148 0.799 25767 9019 1 10 . 1 1 129 129 SER N N 129 115.398 115.398 115.993 -0.595 25767 9020 1 10 . 1 1 129 129 SER HA H 129 4.046 4.046 4.288 -0.242 25767 9021 1 10 . 1 1 129 129 SER C C 129 175.168 175.168 177.087 -1.919 25767 9022 1 10 . 1 1 129 129 SER CA C 129 63.015 63.015 62.494 0.521 25767 9023 1 10 . 1 1 129 129 SER H H 129 8.578 8.578 9.029 -0.451 25767 9024 1 10 . 1 1 130 130 CYS N N 130 125.556 125.556 120.819 4.737 25767 9025 1 10 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.232 -0.123 25767 9026 1 10 . 1 1 130 130 CYS C C 130 175.294 175.294 176.931 -1.637 25767 9027 1 10 . 1 1 130 130 CYS CA C 130 61.438 61.438 64.778 -3.340 25767 9028 1 10 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.196 -0.146 25767 9029 1 10 . 1 1 130 130 CYS H H 130 8.289 8.289 8.522 -0.233 25767 9030 1 10 . 1 1 131 131 ILE N N 131 120.232 120.232 120.966 -0.734 25767 9031 1 10 . 1 1 131 131 ILE HA H 131 4.033 4.033 3.940 0.093 25767 9032 1 10 . 1 1 131 131 ILE C C 131 177.297 177.297 178.644 -1.347 25767 9033 1 10 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.509 -0.857 25767 9034 1 10 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.764 1.338 25767 9035 1 10 . 1 1 131 131 ILE H H 131 7.943 7.943 7.768 0.175 25767 9036 1 10 . 1 1 132 132 LEU N N 132 116.422 116.422 120.811 -4.389 25767 9037 1 10 . 1 1 132 132 LEU HA H 132 3.845 3.845 3.865 -0.020 25767 9038 1 10 . 1 1 132 132 LEU C C 132 177.816 177.816 178.482 -0.666 25767 9039 1 10 . 1 1 132 132 LEU CA C 132 57.078 57.078 57.954 -0.876 25767 9040 1 10 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.434 0.779 25767 9041 1 10 . 1 1 132 132 LEU H H 132 7.846 7.846 8.281 -0.435 25767 9042 1 10 . 1 1 133 133 HIS N N 133 116.929 116.929 118.453 -1.524 25767 9043 1 10 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.275 -0.136 25767 9044 1 10 . 1 1 133 133 HIS C C 133 178.669 178.669 177.744 0.925 25767 9045 1 10 . 1 1 133 133 HIS CA C 133 59.736 59.736 60.002 -0.266 25767 9046 1 10 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.402 2.750 25767 9047 1 10 . 1 1 133 133 HIS H H 133 7.822 7.822 8.355 -0.533 25767 9048 1 10 . 1 1 134 134 LEU N N 134 116.898 116.898 119.941 -3.043 25767 9049 1 10 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.135 -0.402 25767 9050 1 10 . 1 1 134 134 LEU C C 134 179.402 179.402 178.939 0.463 25767 9051 1 10 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.750 -0.523 25767 9052 1 10 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.070 -2.531 25767 9053 1 10 . 1 1 134 134 LEU H H 134 8.688 8.688 7.824 0.864 25767 9054 1 10 . 1 1 135 135 TRP N N 135 115.602 115.602 117.429 -1.827 25767 9055 1 10 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.574 0.434 25767 9056 1 10 . 1 1 135 135 TRP C C 135 175.022 175.022 177.999 -2.977 25767 9057 1 10 . 1 1 135 135 TRP CA C 135 59.426 59.426 57.956 1.470 25767 9058 1 10 . 1 1 135 135 TRP CB C 135 27.085 27.085 29.058 -1.973 25767 9059 1 10 . 1 1 135 135 TRP H H 135 7.638 7.638 8.343 -0.705 25767 9060 1 10 . 1 1 136 136 LYS N N 136 119.721 119.721 122.651 -2.930 25767 9061 1 10 . 1 1 136 136 LYS HA H 136 3.816 3.816 4.013 -0.197 25767 9062 1 10 . 1 1 136 136 LYS C C 136 178.279 178.279 178.554 -0.275 25767 9063 1 10 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.155 1.038 25767 9064 1 10 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.624 1.433 25767 9065 1 10 . 1 1 136 136 LYS H H 136 6.538 6.538 8.073 -1.535 25767 9066 1 10 . 1 1 137 137 GLU N N 137 115.407 115.407 115.635 -0.228 25767 9067 1 10 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.166 0.001 25767 9068 1 10 . 1 1 137 137 GLU C C 137 176.700 176.700 177.270 -0.570 25767 9069 1 10 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.513 -0.663 25767 9070 1 10 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.102 0.057 25767 9071 1 10 . 1 1 137 137 GLU H H 137 8.596 8.596 8.109 0.487 25767 9072 1 10 . 1 1 138 138 ASN N N 138 116.669 116.669 116.951 -0.282 25767 9073 1 10 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.814 0.092 25767 9074 1 10 . 1 1 138 138 ASN C C 138 173.481 173.481 175.010 -1.529 25767 9075 1 10 . 1 1 138 138 ASN CA C 138 52.814 52.814 54.097 -1.283 25767 9076 1 10 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.769 1.068 25767 9077 1 10 . 1 1 138 138 ASN H H 138 8.343 8.343 8.055 0.288 25767 9078 1 10 . 1 1 139 139 ILE N N 139 120.703 120.703 119.794 0.909 25767 9079 1 10 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.248 0.096 25767 9080 1 10 . 1 1 139 139 ILE C C 139 175.241 175.241 174.680 0.561 25767 9081 1 10 . 1 1 139 139 ILE CA C 139 60.792 60.792 60.247 0.545 25767 9082 1 10 . 1 1 139 139 ILE CB C 139 40.274 40.274 40.228 0.046 25767 9083 1 10 . 1 1 139 139 ILE H H 139 7.167 7.167 7.407 -0.240 25767 9084 1 10 . 1 1 140 140 SER N N 140 123.284 123.284 120.220 3.064 25767 9085 1 10 . 1 1 140 140 SER HA H 140 4.345 4.345 4.505 -0.160 25767 9086 1 10 . 1 1 140 140 SER CA C 140 58.095 58.095 57.544 0.551 25767 9087 1 10 . 1 1 140 140 SER CB C 140 65.370 65.370 65.012 0.358 25767 9088 1 10 . 1 1 140 140 SER H H 140 8.727 8.727 8.233 0.494 25767 9089 1 10 . 1 1 142 142 THR N N 142 113.868 113.868 116.111 -2.243 25767 9090 1 10 . 1 1 142 142 THR HA H 142 3.976 3.976 4.122 -0.146 25767 9091 1 10 . 1 1 142 142 THR C C 142 177.559 177.559 176.944 0.615 25767 9092 1 10 . 1 1 142 142 THR CA C 142 66.007 66.007 66.092 -0.085 25767 9093 1 10 . 1 1 142 142 THR CB C 142 68.530 68.530 68.447 0.083 25767 9094 1 10 . 1 1 142 142 THR H H 142 8.243 8.243 8.079 0.164 25767 9095 1 10 . 1 1 143 143 SER N N 143 120.786 120.786 118.118 2.668 25767 9096 1 10 . 1 1 143 143 SER C C 143 175.844 175.844 176.780 -0.936 25767 9097 1 10 . 1 1 143 143 SER CA C 143 62.102 62.102 62.385 -0.283 25767 9098 1 10 . 1 1 143 143 SER CB C 143 63.086 63.086 62.739 0.347 25767 9099 1 10 . 1 1 143 143 SER H H 143 7.915 7.915 8.287 -0.372 25767 9100 1 10 . 1 1 144 144 THR N N 144 120.946 120.946 118.268 2.678 25767 9101 1 10 . 1 1 144 144 THR HA H 144 4.299 4.299 4.072 0.227 25767 9102 1 10 . 1 1 144 144 THR C C 144 175.874 175.874 175.922 -0.048 25767 9103 1 10 . 1 1 144 144 THR CA C 144 67.487 67.487 66.931 0.556 25767 9104 1 10 . 1 1 144 144 THR CB C 144 68.485 68.485 68.720 -0.235 25767 9105 1 10 . 1 1 144 144 THR H H 144 8.746 8.746 8.438 0.308 25767 9106 1 10 . 1 1 145 145 ASN N N 145 120.069 120.069 119.305 0.764 25767 9107 1 10 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.400 -0.092 25767 9108 1 10 . 1 1 145 145 ASN C C 145 177.917 177.917 177.529 0.388 25767 9109 1 10 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.809 -0.472 25767 9110 1 10 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.510 -0.410 25767 9111 1 10 . 1 1 145 145 ASN H H 145 7.940 7.940 8.051 -0.111 25767 9112 1 10 . 1 1 146 146 SER N N 146 116.905 116.905 116.989 -0.084 25767 9113 1 10 . 1 1 146 146 SER HA H 146 3.936 3.936 4.200 -0.264 25767 9114 1 10 . 1 1 146 146 SER C C 146 176.963 176.963 176.792 0.171 25767 9115 1 10 . 1 1 146 146 SER CA C 146 61.997 61.997 62.202 -0.205 25767 9116 1 10 . 1 1 146 146 SER CB C 146 62.879 62.879 62.747 0.132 25767 9117 1 10 . 1 1 146 146 SER H H 146 7.951 7.951 7.756 0.195 25767 9118 1 10 . 1 1 147 147 LEU N N 147 123.253 123.253 121.920 1.333 25767 9119 1 10 . 1 1 147 147 LEU HA H 147 3.875 3.875 3.993 -0.118 25767 9120 1 10 . 1 1 147 147 LEU C C 147 178.726 178.726 179.032 -0.306 25767 9121 1 10 . 1 1 147 147 LEU CA C 147 58.580 58.580 58.267 0.313 25767 9122 1 10 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.785 -0.925 25767 9123 1 10 . 1 1 147 147 LEU H H 147 8.168 8.168 7.753 0.415 25767 9124 1 10 . 1 1 148 148 GLN N N 148 118.212 118.212 118.742 -0.530 25767 9125 1 10 . 1 1 148 148 GLN HA H 148 3.817 3.817 4.045 -0.228 25767 9126 1 10 . 1 1 148 148 GLN C C 148 179.686 179.686 178.665 1.021 25767 9127 1 10 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.674 0.569 25767 9128 1 10 . 1 1 148 148 GLN CB C 148 27.720 27.720 28.058 -0.338 25767 9129 1 10 . 1 1 148 148 GLN H H 148 8.295 8.295 8.838 -0.543 25767 9130 1 10 . 1 1 149 149 LYS N N 149 120.770 120.770 120.362 0.408 25767 9131 1 10 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.970 -0.069 25767 9132 1 10 . 1 1 149 149 LYS C C 149 178.006 178.006 179.065 -1.059 25767 9133 1 10 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.600 -0.068 25767 9134 1 10 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.229 -0.337 25767 9135 1 10 . 1 1 149 149 LYS H H 149 7.955 7.955 8.262 -0.307 25767 9136 1 10 . 1 1 150 150 ARG N N 150 119.244 119.244 118.789 0.455 25767 9137 1 10 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.933 -0.093 25767 9138 1 10 . 1 1 150 150 ARG C C 150 178.858 178.858 178.667 0.191 25767 9139 1 10 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.484 -0.113 25767 9140 1 10 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.782 -0.978 25767 9141 1 10 . 1 1 150 150 ARG H H 150 7.020 7.020 7.491 -0.471 25767 9142 1 10 . 1 1 151 151 ILE N N 151 121.183 121.183 119.654 1.529 25767 9143 1 10 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.726 -0.367 25767 9144 1 10 . 1 1 151 151 ILE C C 151 177.327 177.327 178.118 -0.791 25767 9145 1 10 . 1 1 151 151 ILE CA C 151 67.196 67.196 62.733 4.463 25767 9146 1 10 . 1 1 151 151 ILE CB C 151 38.272 38.272 36.603 1.669 25767 9147 1 10 . 1 1 151 151 ILE H H 151 7.574 7.574 7.705 -0.131 25767 9148 1 10 . 1 1 152 152 LYS N N 152 119.521 119.521 120.890 -1.369 25767 9149 1 10 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.824 -0.051 25767 9150 1 10 . 1 1 152 152 LYS C C 152 178.016 178.016 178.525 -0.509 25767 9151 1 10 . 1 1 152 152 LYS CA C 152 59.830 59.830 60.255 -0.425 25767 9152 1 10 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.365 -0.784 25767 9153 1 10 . 1 1 152 152 LYS H H 152 7.629 7.629 7.839 -0.210 25767 9154 1 10 . 1 1 153 153 TYR N N 153 120.178 120.178 120.756 -0.578 25767 9155 1 10 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.135 -0.063 25767 9156 1 10 . 1 1 153 153 TYR C C 153 178.195 178.195 177.873 0.322 25767 9157 1 10 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.864 -0.547 25767 9158 1 10 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.472 -1.199 25767 9159 1 10 . 1 1 153 153 TYR H H 153 8.407 8.407 7.903 0.504 25767 9160 1 10 . 1 1 154 154 CYS N N 154 117.013 117.013 118.041 -1.028 25767 9161 1 10 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.210 -0.138 25767 9162 1 10 . 1 1 154 154 CYS C C 154 176.827 176.827 177.260 -0.433 25767 9163 1 10 . 1 1 154 154 CYS CA C 154 65.780 65.780 61.422 4.358 25767 9164 1 10 . 1 1 154 154 CYS CB C 154 28.160 28.160 26.523 1.637 25767 9165 1 10 . 1 1 154 154 CYS H H 154 8.291 8.291 7.890 0.401 25767 9166 1 10 . 1 1 155 155 LYS N N 155 118.753 118.753 120.742 -1.989 25767 9167 1 10 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.876 -0.205 25767 9168 1 10 . 1 1 155 155 LYS C C 155 179.904 179.904 179.068 0.836 25767 9169 1 10 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.544 0.941 25767 9170 1 10 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.188 -0.245 25767 9171 1 10 . 1 1 155 155 LYS H H 155 7.934 7.934 8.038 -0.104 25767 9172 1 10 . 1 1 156 156 ILE N N 156 123.873 123.873 121.044 2.829 25767 9173 1 10 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.595 -0.011 25767 9174 1 10 . 1 1 156 156 ILE C C 156 179.501 179.501 177.708 1.793 25767 9175 1 10 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.643 -0.403 25767 9176 1 10 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.870 -0.228 25767 9177 1 10 . 1 1 156 156 ILE H H 156 8.314 8.314 8.515 -0.201 25767 9178 1 10 . 1 1 157 157 TYR N N 157 121.132 121.132 119.781 1.351 25767 9179 1 10 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.946 0.219 25767 9180 1 10 . 1 1 157 157 TYR C C 157 178.558 178.558 177.426 1.132 25767 9181 1 10 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.952 0.158 25767 9182 1 10 . 1 1 157 157 TYR H H 157 8.442 8.442 7.524 0.918 25767 9183 1 10 . 1 1 158 158 LEU N N 158 120.964 120.964 119.623 1.341 25767 9184 1 10 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.789 0.123 25767 9185 1 10 . 1 1 158 158 LEU C C 158 180.130 180.130 178.615 1.515 25767 9186 1 10 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.724 0.962 25767 9187 1 10 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.501 0.229 25767 9188 1 10 . 1 1 158 158 LEU H H 158 8.469 8.469 7.739 0.730 25767 9189 1 10 . 1 1 159 159 SER N N 159 116.653 116.653 115.310 1.343 25767 9190 1 10 . 1 1 159 159 SER HA H 159 4.246 4.246 4.046 0.200 25767 9191 1 10 . 1 1 159 159 SER CA C 159 61.460 61.460 62.097 -0.637 25767 9192 1 10 . 1 1 159 159 SER CB C 159 62.849 62.849 62.462 0.387 25767 9193 1 10 . 1 1 159 159 SER H H 159 7.758 7.758 8.379 -0.621 25767 9194 1 10 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.237 -1.864 25767 9195 1 10 . 1 1 160 160 LYS CB C 160 29.832 29.832 32.132 -2.300 25767 9196 1 10 . 1 1 160 160 LYS H H 160 8.425 8.425 7.338 1.087 25767 9197 1 10 . 1 1 161 161 LEU N N 161 121.686 121.686 118.880 2.806 25767 9198 1 10 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.826 0.337 25767 9199 1 10 . 1 1 161 161 LEU C C 161 180.224 180.224 178.983 1.241 25767 9200 1 10 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.600 -0.016 25767 9201 1 10 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.428 0.034 25767 9202 1 10 . 1 1 161 161 LEU H H 161 8.323 8.323 7.385 0.938 25767 9203 1 10 . 1 1 162 162 ALA N N 162 123.102 123.102 121.078 2.024 25767 9204 1 10 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.046 0.084 25767 9205 1 10 . 1 1 162 162 ALA C C 162 179.487 179.487 179.290 0.197 25767 9206 1 10 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.720 0.024 25767 9207 1 10 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.378 0.025 25767 9208 1 10 . 1 1 162 162 ALA H H 162 7.978 7.978 7.780 0.198 25767 9209 1 10 . 1 1 163 163 LYS N N 163 116.069 116.069 116.236 -0.167 25767 9210 1 10 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.268 -0.045 25767 9211 1 10 . 1 1 163 163 LYS C C 163 176.987 176.987 176.638 0.349 25767 9212 1 10 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.347 0.259 25767 9213 1 10 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.742 0.465 25767 9214 1 10 . 1 1 163 163 LYS H H 163 7.697 7.697 7.743 -0.046 25767 9215 1 10 . 1 1 164 164 GLY N N 164 108.540 108.540 106.533 2.007 25767 9216 1 10 . 1 1 164 164 GLY C C 164 174.721 174.721 174.471 0.250 25767 9217 1 10 . 1 1 164 164 GLY CA C 164 45.791 45.791 45.082 0.709 25767 9218 1 10 . 1 1 164 164 GLY H H 164 7.772 7.772 7.549 0.223 25767 9219 1 10 . 1 1 165 165 GLU N N 165 119.886 119.886 120.455 -0.569 25767 9220 1 10 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.425 -0.375 25767 9221 1 10 . 1 1 165 165 GLU C C 165 176.027 176.027 175.292 0.735 25767 9222 1 10 . 1 1 165 165 GLU CA C 165 56.853 56.853 54.722 2.131 25767 9223 1 10 . 1 1 165 165 GLU CB C 165 30.338 30.338 30.915 -0.577 25767 9224 1 10 . 1 1 165 165 GLU H H 165 8.065 8.065 7.795 0.270 25767 9225 1 10 . 1 1 166 166 ILE N N 166 117.926 117.926 120.293 -2.367 25767 9226 1 10 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.766 0.136 25767 9227 1 10 . 1 1 166 166 ILE C C 166 174.138 174.138 176.186 -2.048 25767 9228 1 10 . 1 1 166 166 ILE CA C 166 60.455 60.455 59.319 1.136 25767 9229 1 10 . 1 1 166 166 ILE CB C 166 40.202 40.202 38.197 2.005 25767 9230 1 10 . 1 1 166 166 ILE H H 166 7.282 7.282 8.145 -0.863 25767 9231 1 11 . 1 1 2 2 ALA N N 2 122.811 122.811 122.502 0.309 25767 9232 1 11 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.327 -0.304 25767 9233 1 11 . 1 1 2 2 ALA C C 2 179.915 179.915 178.641 1.274 25767 9234 1 11 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.289 -0.172 25767 9235 1 11 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.222 0.317 25767 9236 1 11 . 1 1 2 2 ALA H H 2 8.509 8.509 8.531 -0.022 25767 9237 1 11 . 1 1 3 3 SER N N 3 115.308 115.308 112.935 2.373 25767 9238 1 11 . 1 1 3 3 SER HA H 3 4.097 4.097 4.173 -0.076 25767 9239 1 11 . 1 1 3 3 SER C C 3 176.706 176.706 176.527 0.179 25767 9240 1 11 . 1 1 3 3 SER CA C 3 60.665 60.665 61.476 -0.811 25767 9241 1 11 . 1 1 3 3 SER CB C 3 62.710 62.710 62.597 0.113 25767 9242 1 11 . 1 1 3 3 SER H H 3 7.996 7.996 8.455 -0.459 25767 9243 1 11 . 1 1 4 4 ASN N N 4 122.688 122.688 120.920 1.768 25767 9244 1 11 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.409 -0.105 25767 9245 1 11 . 1 1 4 4 ASN C C 4 176.258 176.258 177.542 -1.284 25767 9246 1 11 . 1 1 4 4 ASN CA C 4 55.701 55.701 55.898 -0.197 25767 9247 1 11 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.477 0.700 25767 9248 1 11 . 1 1 4 4 ASN H H 4 8.075 8.075 7.454 0.621 25767 9249 1 11 . 1 1 5 5 ALA N N 5 121.900 121.900 122.388 -0.488 25767 9250 1 11 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.162 -0.587 25767 9251 1 11 . 1 1 5 5 ALA C C 5 178.475 178.475 179.426 -0.951 25767 9252 1 11 . 1 1 5 5 ALA CA C 5 55.833 55.833 55.009 0.824 25767 9253 1 11 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.187 -0.572 25767 9254 1 11 . 1 1 5 5 ALA H H 5 8.659 8.659 7.717 0.942 25767 9255 1 11 . 1 1 6 6 ALA N N 6 117.768 117.768 121.424 -3.656 25767 9256 1 11 . 1 1 6 6 ALA HA H 6 3.787 3.787 4.014 -0.227 25767 9257 1 11 . 1 1 6 6 ALA C C 6 180.494 180.494 179.442 1.052 25767 9258 1 11 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.021 0.329 25767 9259 1 11 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.041 -0.139 25767 9260 1 11 . 1 1 6 6 ALA H H 6 7.864 7.864 7.737 0.127 25767 9261 1 11 . 1 1 7 7 ARG N N 7 121.173 121.173 119.476 1.697 25767 9262 1 11 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.112 -0.209 25767 9263 1 11 . 1 1 7 7 ARG C C 7 179.189 179.189 178.701 0.488 25767 9264 1 11 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.877 0.435 25767 9265 1 11 . 1 1 7 7 ARG CB C 7 29.222 29.222 30.002 -0.780 25767 9266 1 11 . 1 1 7 7 ARG H H 7 7.514 7.514 8.143 -0.629 25767 9267 1 11 . 1 1 8 8 VAL N N 8 122.979 122.979 119.278 3.701 25767 9268 1 11 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.871 -0.618 25767 9269 1 11 . 1 1 8 8 VAL C C 8 177.821 177.821 178.396 -0.575 25767 9270 1 11 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.508 1.264 25767 9271 1 11 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.214 0.227 25767 9272 1 11 . 1 1 8 8 VAL H H 8 8.101 8.101 7.791 0.310 25767 9273 1 11 . 1 1 9 9 VAL N N 9 119.801 119.801 120.248 -0.447 25767 9274 1 11 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.590 -0.324 25767 9275 1 11 . 1 1 9 9 VAL C C 9 177.373 177.373 177.459 -0.086 25767 9276 1 11 . 1 1 9 9 VAL CA C 9 67.484 67.484 67.211 0.273 25767 9277 1 11 . 1 1 9 9 VAL CB C 9 31.625 31.625 31.245 0.380 25767 9278 1 11 . 1 1 9 9 VAL H H 9 8.362 8.362 7.780 0.582 25767 9279 1 11 . 1 1 10 10 ALA N N 10 122.360 122.360 121.287 1.073 25767 9280 1 11 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.026 -0.090 25767 9281 1 11 . 1 1 10 10 ALA C C 10 180.762 180.762 179.434 1.328 25767 9282 1 11 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.578 -0.134 25767 9283 1 11 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.108 -0.371 25767 9284 1 11 . 1 1 10 10 ALA H H 10 7.776 7.776 7.749 0.027 25767 9285 1 11 . 1 1 11 11 THR N N 11 117.376 117.376 111.624 5.752 25767 9286 1 11 . 1 1 11 11 THR HA H 11 3.816 3.816 3.983 -0.167 25767 9287 1 11 . 1 1 11 11 THR C C 11 175.775 175.775 176.604 -0.829 25767 9288 1 11 . 1 1 11 11 THR CA C 11 66.509 66.509 65.591 0.918 25767 9289 1 11 . 1 1 11 11 THR CB C 11 68.588 68.588 69.135 -0.547 25767 9290 1 11 . 1 1 11 11 THR H H 11 8.180 8.180 7.724 0.456 25767 9291 1 11 . 1 1 12 12 ALA N N 12 125.308 125.308 125.327 -0.019 25767 9292 1 11 . 1 1 12 12 ALA HA H 12 3.997 3.997 4.152 -0.155 25767 9293 1 11 . 1 1 12 12 ALA C C 12 179.399 179.399 179.575 -0.176 25767 9294 1 11 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.606 0.470 25767 9295 1 11 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.429 0.815 25767 9296 1 11 . 1 1 12 12 ALA H H 12 8.671 8.671 8.546 0.125 25767 9297 1 11 . 1 1 13 13 LYS N N 13 116.977 116.977 118.241 -1.264 25767 9298 1 11 . 1 1 13 13 LYS C C 13 179.646 179.646 178.689 0.957 25767 9299 1 11 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.782 -0.861 25767 9300 1 11 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.187 -0.744 25767 9301 1 11 . 1 1 13 13 LYS H H 13 8.061 8.061 7.992 0.069 25767 9302 1 11 . 1 1 14 14 ASP N N 14 121.988 121.988 120.182 1.806 25767 9303 1 11 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.364 -0.011 25767 9304 1 11 . 1 1 14 14 ASP C C 14 179.446 179.446 178.468 0.978 25767 9305 1 11 . 1 1 14 14 ASP CA C 14 57.509 57.509 56.840 0.668 25767 9306 1 11 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.343 -0.342 25767 9307 1 11 . 1 1 14 14 ASP H H 14 7.669 7.669 7.616 0.053 25767 9308 1 11 . 1 1 15 15 PHE N N 15 119.588 119.588 118.180 1.408 25767 9309 1 11 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.173 0.171 25767 9310 1 11 . 1 1 15 15 PHE C C 15 178.373 178.373 177.977 0.396 25767 9311 1 11 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.788 0.449 25767 9312 1 11 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.763 -1.267 25767 9313 1 11 . 1 1 15 15 PHE H H 15 7.913 7.913 8.094 -0.181 25767 9314 1 11 . 1 1 16 16 ASP N N 16 121.705 121.705 120.151 1.554 25767 9315 1 11 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.415 -0.420 25767 9316 1 11 . 1 1 16 16 ASP C C 16 180.071 180.071 178.386 1.685 25767 9317 1 11 . 1 1 16 16 ASP CA C 16 58.149 58.149 56.894 1.255 25767 9318 1 11 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.695 0.792 25767 9319 1 11 . 1 1 16 16 ASP H H 16 8.324 8.324 7.946 0.378 25767 9320 1 11 . 1 1 17 17 LYS N N 17 118.825 118.825 118.536 0.289 25767 9321 1 11 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.104 -0.067 25767 9322 1 11 . 1 1 17 17 LYS C C 17 178.407 178.407 178.272 0.135 25767 9323 1 11 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.540 0.521 25767 9324 1 11 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.538 0.046 25767 9325 1 11 . 1 1 17 17 LYS H H 17 7.834 7.834 7.636 0.198 25767 9326 1 11 . 1 1 18 18 VAL N N 18 110.562 110.562 116.825 -6.263 25767 9327 1 11 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.084 0.432 25767 9328 1 11 . 1 1 18 18 VAL C C 18 176.144 176.144 176.707 -0.563 25767 9329 1 11 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.049 -2.175 25767 9330 1 11 . 1 1 18 18 VAL CB C 18 31.160 31.160 31.790 -0.630 25767 9331 1 11 . 1 1 18 18 VAL H H 18 7.185 7.185 7.480 -0.295 25767 9332 1 11 . 1 1 19 19 GLY N N 19 109.272 109.272 107.193 2.079 25767 9333 1 11 . 1 1 19 19 GLY C C 19 175.043 175.043 174.881 0.162 25767 9334 1 11 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.508 0.323 25767 9335 1 11 . 1 1 19 19 GLY H H 19 7.723 7.723 7.698 0.025 25767 9336 1 11 . 1 1 20 20 LEU N N 20 125.428 125.428 122.785 2.643 25767 9337 1 11 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.643 -0.323 25767 9338 1 11 . 1 1 20 20 LEU C C 20 177.949 177.949 177.086 0.863 25767 9339 1 11 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.271 -0.467 25767 9340 1 11 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.745 0.172 25767 9341 1 11 . 1 1 20 20 LEU H H 20 8.083 8.083 7.960 0.123 25767 9342 1 11 . 1 1 21 21 GLY N N 21 107.804 107.804 110.003 -2.199 25767 9343 1 11 . 1 1 21 21 GLY C C 21 176.278 176.278 176.240 0.038 25767 9344 1 11 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.631 -0.337 25767 9345 1 11 . 1 1 21 21 GLY H H 21 7.982 7.982 7.900 0.082 25767 9346 1 11 . 1 1 22 22 ILE N N 22 121.319 121.319 121.726 -0.407 25767 9347 1 11 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.827 0.083 25767 9348 1 11 . 1 1 22 22 ILE C C 22 176.604 176.604 177.594 -0.990 25767 9349 1 11 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.380 -1.934 25767 9350 1 11 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.798 -1.232 25767 9351 1 11 . 1 1 22 22 ILE H H 22 8.478 8.478 7.956 0.522 25767 9352 1 11 . 1 1 23 23 ILE N N 23 120.377 120.377 119.768 0.609 25767 9353 1 11 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.656 0.057 25767 9354 1 11 . 1 1 23 23 ILE C C 23 178.581 178.581 178.257 0.324 25767 9355 1 11 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.334 0.912 25767 9356 1 11 . 1 1 23 23 ILE CB C 23 36.199 36.199 35.848 0.351 25767 9357 1 11 . 1 1 23 23 ILE H H 23 6.869 6.869 7.606 -0.737 25767 9358 1 11 . 1 1 24 24 GLY N N 24 103.449 103.449 108.030 -4.581 25767 9359 1 11 . 1 1 24 24 GLY C C 24 175.308 175.308 175.744 -0.436 25767 9360 1 11 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.205 0.738 25767 9361 1 11 . 1 1 24 24 GLY H H 24 7.488 7.488 7.848 -0.360 25767 9362 1 11 . 1 1 25 25 TYR N N 25 124.685 124.685 123.795 0.890 25767 9363 1 11 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.503 0.163 25767 9364 1 11 . 1 1 25 25 TYR C C 25 176.208 176.208 176.768 -0.560 25767 9365 1 11 . 1 1 25 25 TYR CA C 25 61.371 61.371 61.644 -0.273 25767 9366 1 11 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.149 0.118 25767 9367 1 11 . 1 1 25 25 TYR H H 25 7.931 7.931 8.202 -0.271 25767 9368 1 11 . 1 1 26 26 TYR N N 26 117.001 117.001 119.746 -2.745 25767 9369 1 11 . 1 1 26 26 TYR HA H 26 3.941 3.941 3.988 -0.047 25767 9370 1 11 . 1 1 26 26 TYR C C 26 178.753 178.753 177.458 1.295 25767 9371 1 11 . 1 1 26 26 TYR CA C 26 64.260 64.260 61.963 2.297 25767 9372 1 11 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.788 -1.267 25767 9373 1 11 . 1 1 26 26 TYR H H 26 7.693 7.693 7.891 -0.198 25767 9374 1 11 . 1 1 27 27 LEU N N 27 118.657 118.657 117.358 1.299 25767 9375 1 11 . 1 1 27 27 LEU HA H 27 4.311 4.311 4.073 0.238 25767 9376 1 11 . 1 1 27 27 LEU CA C 27 58.297 58.297 57.972 0.325 25767 9377 1 11 . 1 1 27 27 LEU CB C 27 42.723 42.723 41.249 1.474 25767 9378 1 11 . 1 1 27 27 LEU H H 27 8.339 8.339 7.952 0.387 25767 9379 1 11 . 1 1 28 28 GLN N N 28 118.593 118.593 118.446 0.147 25767 9380 1 11 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.901 -0.250 25767 9381 1 11 . 1 1 28 28 GLN C C 28 177.282 177.282 178.674 -1.392 25767 9382 1 11 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.826 0.003 25767 9383 1 11 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.365 1.283 25767 9384 1 11 . 1 1 28 28 GLN H H 28 7.970 7.970 8.180 -0.210 25767 9385 1 11 . 1 1 29 29 LEU N N 29 122.111 122.111 119.648 2.463 25767 9386 1 11 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.733 0.211 25767 9387 1 11 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.633 1.033 25767 9388 1 11 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.288 0.720 25767 9389 1 11 . 1 1 29 29 LEU H H 29 7.979 7.979 7.457 0.522 25767 9390 1 11 . 1 1 30 30 TYR N N 30 119.283 119.283 119.977 -0.694 25767 9391 1 11 . 1 1 30 30 TYR C C 30 175.775 175.775 177.086 -1.311 25767 9392 1 11 . 1 1 30 30 TYR CA C 30 59.094 59.094 61.542 -2.448 25767 9393 1 11 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.171 0.902 25767 9394 1 11 . 1 1 30 30 TYR H H 30 8.093 8.093 7.518 0.575 25767 9395 1 11 . 1 1 31 31 ALA N N 31 121.327 121.327 122.147 -0.820 25767 9396 1 11 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.861 -0.493 25767 9397 1 11 . 1 1 31 31 ALA C C 31 178.955 178.955 178.702 0.253 25767 9398 1 11 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.411 0.136 25767 9399 1 11 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.286 -0.323 25767 9400 1 11 . 1 1 31 31 ALA H H 31 8.394 8.394 8.405 -0.011 25767 9401 1 11 . 1 1 32 32 VAL N N 32 116.757 116.757 118.792 -2.035 25767 9402 1 11 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.591 -0.331 25767 9403 1 11 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.909 1.752 25767 9404 1 11 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.735 -0.764 25767 9405 1 11 . 1 1 32 32 VAL H H 32 8.020 8.020 7.546 0.474 25767 9406 1 11 . 1 1 33 33 GLU N N 33 118.775 118.775 119.882 -1.107 25767 9407 1 11 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.872 0.117 25767 9408 1 11 . 1 1 33 33 GLU C C 33 179.746 179.746 178.627 1.119 25767 9409 1 11 . 1 1 33 33 GLU CA C 33 60.003 60.003 58.911 1.091 25767 9410 1 11 . 1 1 33 33 GLU H H 33 7.358 7.358 7.605 -0.247 25767 9411 1 11 . 1 1 34 34 LEU N N 34 120.632 120.632 121.092 -0.460 25767 9412 1 11 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.810 -0.161 25767 9413 1 11 . 1 1 34 34 LEU C C 34 180.336 180.336 178.529 1.807 25767 9414 1 11 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.782 -0.107 25767 9415 1 11 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.700 -0.112 25767 9416 1 11 . 1 1 34 34 LEU H H 34 8.390 8.390 7.787 0.603 25767 9417 1 11 . 1 1 35 35 ILE N N 35 121.240 121.240 118.755 2.485 25767 9418 1 11 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.738 -0.196 25767 9419 1 11 . 1 1 35 35 ILE C C 35 178.604 178.604 178.432 0.172 25767 9420 1 11 . 1 1 35 35 ILE CA C 35 65.547 65.547 65.085 0.462 25767 9421 1 11 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.660 1.071 25767 9422 1 11 . 1 1 35 35 ILE H H 35 8.129 8.129 7.547 0.582 25767 9423 1 11 . 1 1 36 36 LEU N N 36 115.637 115.637 118.070 -2.433 25767 9424 1 11 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.005 0.003 25767 9425 1 11 . 1 1 36 36 LEU C C 36 178.001 178.001 177.878 0.123 25767 9426 1 11 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.195 -1.119 25767 9427 1 11 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.606 -1.672 25767 9428 1 11 . 1 1 36 36 LEU H H 36 8.416 8.416 7.787 0.629 25767 9429 1 11 . 1 1 37 37 SER N N 37 114.106 114.106 112.251 1.855 25767 9430 1 11 . 1 1 37 37 SER HA H 37 3.991 3.991 4.205 -0.214 25767 9431 1 11 . 1 1 37 37 SER C C 37 173.997 173.997 175.419 -1.422 25767 9432 1 11 . 1 1 37 37 SER CA C 37 60.311 60.311 59.690 0.621 25767 9433 1 11 . 1 1 37 37 SER CB C 37 63.746 63.746 63.676 0.070 25767 9434 1 11 . 1 1 37 37 SER H H 37 7.517 7.517 7.530 -0.013 25767 9435 1 11 . 1 1 38 38 GLU N N 38 123.003 123.003 121.962 1.041 25767 9436 1 11 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.191 0.178 25767 9437 1 11 . 1 1 38 38 GLU C C 38 175.780 175.780 175.926 -0.146 25767 9438 1 11 . 1 1 38 38 GLU CA C 38 55.365 55.365 56.477 -1.112 25767 9439 1 11 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.372 -0.079 25767 9440 1 11 . 1 1 38 38 GLU H H 38 7.151 7.151 7.412 -0.261 25767 9441 1 11 . 1 1 39 39 GLU N N 39 126.166 126.166 122.008 4.158 25767 9442 1 11 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.148 -0.139 25767 9443 1 11 . 1 1 39 39 GLU C C 39 176.652 176.652 175.897 0.755 25767 9444 1 11 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.684 1.514 25767 9445 1 11 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.090 -0.055 25767 9446 1 11 . 1 1 39 39 GLU H H 39 8.587 8.587 8.433 0.154 25767 9447 1 11 . 1 1 40 40 ASP N N 40 120.047 120.047 121.095 -1.048 25767 9448 1 11 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.486 0.064 25767 9449 1 11 . 1 1 40 40 ASP C C 40 175.035 175.035 175.655 -0.620 25767 9450 1 11 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.113 -1.745 25767 9451 1 11 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.974 -0.952 25767 9452 1 11 . 1 1 40 40 ASP H H 40 8.504 8.504 8.558 -0.054 25767 9453 1 11 . 1 1 41 41 ARG N N 41 120.671 120.671 123.654 -2.983 25767 9454 1 11 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.615 -0.226 25767 9455 1 11 . 1 1 41 41 ARG C C 41 175.755 175.755 175.998 -0.243 25767 9456 1 11 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.786 0.222 25767 9457 1 11 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.298 -0.749 25767 9458 1 11 . 1 1 41 41 ARG H H 41 7.672 7.672 8.288 -0.616 25767 9459 1 11 . 1 1 42 42 SER N N 42 120.330 120.330 117.252 3.078 25767 9460 1 11 . 1 1 42 42 SER HA H 42 3.837 3.837 4.348 -0.511 25767 9461 1 11 . 1 1 42 42 SER CA C 42 57.326 57.326 58.243 -0.917 25767 9462 1 11 . 1 1 42 42 SER CB C 42 65.762 65.762 63.727 2.035 25767 9463 1 11 . 1 1 42 42 SER H H 42 8.544 8.544 8.324 0.220 25767 9464 1 11 . 1 1 43 43 GLN HA H 43 3.989 3.989 3.974 0.015 25767 9465 1 11 . 1 1 43 43 GLN C C 43 178.907 178.907 178.097 0.810 25767 9466 1 11 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.870 0.500 25767 9467 1 11 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.816 -0.853 25767 9468 1 11 . 1 1 44 44 GLU N N 44 120.328 120.328 119.089 1.239 25767 9469 1 11 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.976 0.037 25767 9470 1 11 . 1 1 44 44 GLU C C 44 179.824 179.824 178.660 1.164 25767 9471 1 11 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.351 0.694 25767 9472 1 11 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.091 -0.443 25767 9473 1 11 . 1 1 44 44 GLU H H 44 8.938 8.938 8.690 0.248 25767 9474 1 11 . 1 1 45 45 MET N N 45 121.030 121.030 118.466 2.564 25767 9475 1 11 . 1 1 45 45 MET HA H 45 4.412 4.412 4.200 0.212 25767 9476 1 11 . 1 1 45 45 MET C C 45 180.357 180.357 178.095 2.262 25767 9477 1 11 . 1 1 45 45 MET CA C 45 57.209 57.209 58.166 -0.957 25767 9478 1 11 . 1 1 45 45 MET CB C 45 32.436 32.436 32.573 -0.137 25767 9479 1 11 . 1 1 45 45 MET H H 45 7.756 7.756 7.723 0.033 25767 9480 1 11 . 1 1 46 46 THR N N 46 120.008 120.008 116.442 3.566 25767 9481 1 11 . 1 1 46 46 THR HA H 46 4.071 4.071 3.835 0.236 25767 9482 1 11 . 1 1 46 46 THR CA C 46 67.096 67.096 67.360 -0.264 25767 9483 1 11 . 1 1 46 46 THR CB C 46 68.954 68.954 68.655 0.299 25767 9484 1 11 . 1 1 46 46 THR H H 46 8.187 8.187 7.427 0.760 25767 9485 1 11 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.105 0.004 25767 9486 1 11 . 1 1 47 47 ALA C C 47 180.118 180.118 179.248 0.870 25767 9487 1 11 . 1 1 47 47 ALA CA C 47 55.339 55.339 55.035 0.305 25767 9488 1 11 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.309 -0.477 25767 9489 1 11 . 1 1 47 47 ALA H H 47 8.238 8.238 8.255 -0.017 25767 9490 1 11 . 1 1 48 48 LEU N N 48 122.093 122.093 120.516 1.577 25767 9491 1 11 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.058 0.205 25767 9492 1 11 . 1 1 48 48 LEU C C 48 179.103 179.103 178.622 0.481 25767 9493 1 11 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.548 0.192 25767 9494 1 11 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.716 -0.920 25767 9495 1 11 . 1 1 48 48 LEU H H 48 7.778 7.778 7.548 0.230 25767 9496 1 11 . 1 1 49 49 ALA N N 49 120.130 120.130 120.543 -0.413 25767 9497 1 11 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.953 -0.232 25767 9498 1 11 . 1 1 49 49 ALA C C 49 178.676 178.676 179.412 -0.736 25767 9499 1 11 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.362 0.359 25767 9500 1 11 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.060 -0.233 25767 9501 1 11 . 1 1 49 49 ALA H H 49 8.432 8.432 8.194 0.238 25767 9502 1 11 . 1 1 50 50 THR N N 50 113.333 113.333 115.542 -2.209 25767 9503 1 11 . 1 1 50 50 THR HA H 50 3.895 3.895 3.826 0.069 25767 9504 1 11 . 1 1 50 50 THR C C 50 174.948 174.948 176.485 -1.537 25767 9505 1 11 . 1 1 50 50 THR CA C 50 67.334 67.334 68.010 -0.676 25767 9506 1 11 . 1 1 50 50 THR CB C 50 68.864 68.864 68.641 0.223 25767 9507 1 11 . 1 1 50 50 THR H H 50 7.857 7.857 8.040 -0.183 25767 9508 1 11 . 1 1 51 51 GLU N N 51 122.698 122.698 122.084 0.614 25767 9509 1 11 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.021 0.047 25767 9510 1 11 . 1 1 51 51 GLU C C 51 179.997 179.997 178.523 1.474 25767 9511 1 11 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.252 0.181 25767 9512 1 11 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.712 -0.195 25767 9513 1 11 . 1 1 51 51 GLU H H 51 7.817 7.817 7.618 0.199 25767 9514 1 11 . 1 1 52 52 LEU N N 52 121.100 121.100 121.355 -0.255 25767 9515 1 11 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.054 0.075 25767 9516 1 11 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.872 0.017 25767 9517 1 11 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.762 0.185 25767 9518 1 11 . 1 1 52 52 LEU H H 52 8.628 8.628 7.616 1.012 25767 9519 1 11 . 1 1 53 53 LEU N N 53 119.935 119.935 119.613 0.322 25767 9520 1 11 . 1 1 53 53 LEU C C 53 179.671 179.671 178.381 1.290 25767 9521 1 11 . 1 1 53 53 LEU H H 53 8.303 8.303 7.809 0.494 25767 9522 1 11 . 1 1 54 54 ASP N N 54 120.339 120.339 119.319 1.020 25767 9523 1 11 . 1 1 54 54 ASP C C 54 179.106 179.106 178.554 0.552 25767 9524 1 11 . 1 1 54 54 ASP H H 54 7.901 7.901 7.963 -0.062 25767 9525 1 11 . 1 1 55 55 THR N N 55 120.237 120.237 117.212 3.025 25767 9526 1 11 . 1 1 55 55 THR HA H 55 3.696 3.696 3.979 -0.283 25767 9527 1 11 . 1 1 55 55 THR CA C 55 67.340 67.340 66.909 0.431 25767 9528 1 11 . 1 1 55 55 THR CB C 55 68.151 68.151 68.795 -0.644 25767 9529 1 11 . 1 1 55 55 THR H H 55 8.262 8.262 7.755 0.507 25767 9530 1 11 . 1 1 56 56 ILE N N 56 123.953 123.953 122.008 1.945 25767 9531 1 11 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.616 0.227 25767 9532 1 11 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.862 0.032 25767 9533 1 11 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.572 0.562 25767 9534 1 11 . 1 1 56 56 ILE H H 56 8.930 8.930 7.579 1.351 25767 9535 1 11 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.736 -0.155 25767 9536 1 11 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.130 -0.099 25767 9537 1 11 . 1 1 58 58 ALA C C 58 179.875 179.875 179.479 0.396 25767 9538 1 11 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.806 0.460 25767 9539 1 11 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.289 -0.304 25767 9540 1 11 . 1 1 58 58 ALA H H 58 7.764 7.764 8.434 -0.670 25767 9541 1 11 . 1 1 59 59 PHE N N 59 121.988 121.988 119.884 2.104 25767 9542 1 11 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.122 0.104 25767 9543 1 11 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.681 -0.242 25767 9544 1 11 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.248 0.115 25767 9545 1 11 . 1 1 59 59 PHE H H 59 8.159 8.159 8.625 -0.466 25767 9546 1 11 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.919 -0.378 25767 9547 1 11 . 1 1 60 60 LYS C C 60 179.438 179.438 178.725 0.713 25767 9548 1 11 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.675 0.461 25767 9549 1 11 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.329 -0.271 25767 9550 1 11 . 1 1 61 61 LYS N N 61 119.262 119.262 117.553 1.709 25767 9551 1 11 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.217 -0.272 25767 9552 1 11 . 1 1 61 61 LYS C C 61 178.730 178.730 177.768 0.962 25767 9553 1 11 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.173 1.869 25767 9554 1 11 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.076 0.566 25767 9555 1 11 . 1 1 61 61 LYS H H 61 7.832 7.832 7.786 0.046 25767 9556 1 11 . 1 1 62 62 GLU N N 62 120.790 120.790 120.801 -0.011 25767 9557 1 11 . 1 1 62 62 GLU HA H 62 3.935 3.935 3.944 -0.009 25767 9558 1 11 . 1 1 62 62 GLU C C 62 178.424 178.424 177.990 0.434 25767 9559 1 11 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.804 -0.090 25767 9560 1 11 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.207 0.023 25767 9561 1 11 . 1 1 62 62 GLU H H 62 7.982 7.982 7.682 0.300 25767 9562 1 11 . 1 1 63 63 ILE N N 63 118.463 118.463 116.715 1.748 25767 9563 1 11 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.766 -0.077 25767 9564 1 11 . 1 1 63 63 ILE C C 63 177.555 177.555 177.438 0.117 25767 9565 1 11 . 1 1 63 63 ILE CA C 63 61.499 61.499 63.219 -1.720 25767 9566 1 11 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.597 -2.073 25767 9567 1 11 . 1 1 63 63 ILE H H 63 7.732 7.732 7.291 0.441 25767 9568 1 11 . 1 1 64 64 GLY N N 64 107.973 107.973 107.193 0.780 25767 9569 1 11 . 1 1 64 64 GLY C C 64 175.271 175.271 174.971 0.300 25767 9570 1 11 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.078 -0.176 25767 9571 1 11 . 1 1 64 64 GLY H H 64 7.661 7.661 7.886 -0.225 25767 9572 1 11 . 1 1 65 65 GLY N N 65 108.464 108.464 106.856 1.608 25767 9573 1 11 . 1 1 65 65 GLY C C 65 174.800 174.800 175.381 -0.581 25767 9574 1 11 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.233 0.413 25767 9575 1 11 . 1 1 65 65 GLY H H 65 7.808 7.808 7.944 -0.136 25767 9576 1 11 . 1 1 66 66 GLU N N 66 121.162 121.162 121.133 0.029 25767 9577 1 11 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.041 0.064 25767 9578 1 11 . 1 1 66 66 GLU C C 66 177.230 177.230 177.984 -0.754 25767 9579 1 11 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.486 -2.262 25767 9580 1 11 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.662 0.330 25767 9581 1 11 . 1 1 66 66 GLU H H 66 8.203 8.203 7.831 0.372 25767 9582 1 11 . 1 1 67 67 SER N N 67 116.468 116.468 113.784 2.684 25767 9583 1 11 . 1 1 67 67 SER HA H 67 4.249 4.249 4.205 0.044 25767 9584 1 11 . 1 1 67 67 SER C C 67 174.640 174.640 176.895 -2.255 25767 9585 1 11 . 1 1 67 67 SER CA C 67 58.930 58.930 61.860 -2.930 25767 9586 1 11 . 1 1 67 67 SER CB C 67 63.912 63.912 62.902 1.010 25767 9587 1 11 . 1 1 67 67 SER H H 67 8.206 8.206 8.406 -0.200 25767 9588 1 11 . 1 1 68 68 GLU N N 68 122.400 122.400 120.847 1.553 25767 9589 1 11 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.088 0.065 25767 9590 1 11 . 1 1 68 68 GLU C C 68 176.349 176.349 177.052 -0.703 25767 9591 1 11 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.554 -1.732 25767 9592 1 11 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.092 0.889 25767 9593 1 11 . 1 1 68 68 GLU H H 68 8.168 8.168 8.536 -0.368 25767 9594 1 11 . 1 1 69 69 ALA N N 69 124.342 124.342 119.734 4.608 25767 9595 1 11 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.147 0.041 25767 9596 1 11 . 1 1 69 69 ALA C C 69 178.027 178.027 178.100 -0.073 25767 9597 1 11 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.610 -1.052 25767 9598 1 11 . 1 1 69 69 ALA CB C 69 19.492 19.492 19.246 0.246 25767 9599 1 11 . 1 1 69 69 ALA H H 69 7.939 7.939 7.412 0.526 25767 9600 1 11 . 1 1 70 70 GLU N N 70 121.059 121.059 117.495 3.564 25767 9601 1 11 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.419 -0.305 25767 9602 1 11 . 1 1 70 70 GLU C C 70 176.519 176.519 174.829 1.690 25767 9603 1 11 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.547 1.757 25767 9604 1 11 . 1 1 70 70 GLU CB C 70 29.827 29.827 31.970 -2.143 25767 9605 1 11 . 1 1 70 70 GLU H H 70 8.430 8.430 7.744 0.686 25767 9606 1 11 . 1 1 71 71 ASP N N 71 120.274 120.274 121.389 -1.115 25767 9607 1 11 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.351 0.181 25767 9608 1 11 . 1 1 71 71 ASP C C 71 176.369 176.369 177.100 -0.731 25767 9609 1 11 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.373 -1.121 25767 9610 1 11 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.636 1.204 25767 9611 1 11 . 1 1 71 71 ASP H H 71 8.305 8.305 8.877 -0.572 25767 9612 1 11 . 1 1 72 72 SER N N 72 116.165 116.165 112.360 3.805 25767 9613 1 11 . 1 1 72 72 SER HA H 72 4.241 4.241 4.154 0.087 25767 9614 1 11 . 1 1 72 72 SER C C 72 174.567 174.567 175.769 -1.202 25767 9615 1 11 . 1 1 72 72 SER CA C 72 59.031 59.031 61.092 -2.061 25767 9616 1 11 . 1 1 72 72 SER CB C 72 64.040 64.040 63.575 0.465 25767 9617 1 11 . 1 1 72 72 SER H H 72 7.964 7.964 8.507 -0.543 25767 9618 1 11 . 1 1 73 73 ASP N N 73 122.440 122.440 122.664 -0.224 25767 9619 1 11 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.421 0.113 25767 9620 1 11 . 1 1 73 73 ASP C C 73 176.882 176.882 178.216 -1.334 25767 9621 1 11 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.412 -2.969 25767 9622 1 11 . 1 1 73 73 ASP CB C 73 41.336 41.336 39.677 1.659 25767 9623 1 11 . 1 1 73 73 ASP H H 73 8.392 8.392 8.569 -0.177 25767 9624 1 11 . 1 1 74 74 LYS N N 74 123.270 123.270 121.043 2.227 25767 9625 1 11 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.026 0.067 25767 9626 1 11 . 1 1 74 74 LYS C C 74 177.608 177.608 178.327 -0.719 25767 9627 1 11 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.979 -2.514 25767 9628 1 11 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.266 -0.120 25767 9629 1 11 . 1 1 74 74 LYS H H 74 8.317 8.317 8.181 0.136 25767 9630 1 11 . 1 1 75 75 SER N N 75 116.557 116.557 116.358 0.199 25767 9631 1 11 . 1 1 75 75 SER HA H 75 4.197 4.197 4.196 0.001 25767 9632 1 11 . 1 1 75 75 SER C C 75 175.988 175.988 176.909 -0.921 25767 9633 1 11 . 1 1 75 75 SER CA C 75 60.434 60.434 61.893 -1.459 25767 9634 1 11 . 1 1 75 75 SER CB C 75 63.172 63.172 62.712 0.460 25767 9635 1 11 . 1 1 75 75 SER H H 75 8.387 8.387 8.064 0.323 25767 9636 1 11 . 1 1 76 76 LEU N N 76 123.910 123.910 122.037 1.873 25767 9637 1 11 . 1 1 76 76 LEU HA H 76 4.170 4.170 4.025 0.145 25767 9638 1 11 . 1 1 76 76 LEU C C 76 178.083 178.083 178.804 -0.721 25767 9639 1 11 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.814 -1.322 25767 9640 1 11 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.593 0.104 25767 9641 1 11 . 1 1 76 76 LEU H H 76 8.059 8.059 8.462 -0.403 25767 9642 1 11 . 1 1 77 77 HIS N N 77 120.620 120.620 119.399 1.221 25767 9643 1 11 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.266 0.022 25767 9644 1 11 . 1 1 77 77 HIS C C 77 177.667 177.667 177.813 -0.146 25767 9645 1 11 . 1 1 77 77 HIS CA C 77 58.422 58.422 59.954 -1.532 25767 9646 1 11 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.827 0.437 25767 9647 1 11 . 1 1 77 77 HIS H H 77 7.936 7.936 8.260 -0.324 25767 9648 1 11 . 1 1 78 78 VAL N N 78 121.774 121.774 119.687 2.087 25767 9649 1 11 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.400 0.277 25767 9650 1 11 . 1 1 78 78 VAL CA C 78 65.606 65.606 67.000 -1.394 25767 9651 1 11 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.802 0.062 25767 9652 1 11 . 1 1 78 78 VAL H H 78 7.916 7.916 8.022 -0.106 25767 9653 1 11 . 1 1 79 79 MET N N 79 119.660 119.660 118.389 1.271 25767 9654 1 11 . 1 1 79 79 MET HA H 79 3.925 3.925 3.876 0.049 25767 9655 1 11 . 1 1 79 79 MET C C 79 177.077 177.077 178.382 -1.305 25767 9656 1 11 . 1 1 79 79 MET CA C 79 58.862 58.862 59.495 -0.633 25767 9657 1 11 . 1 1 79 79 MET CB C 79 32.852 32.852 32.191 0.661 25767 9658 1 11 . 1 1 79 79 MET H H 79 8.149 8.149 7.926 0.223 25767 9659 1 11 . 1 1 80 80 ASN N N 80 117.337 117.337 118.132 -0.795 25767 9660 1 11 . 1 1 80 80 ASN HA H 80 4.138 4.138 3.795 0.343 25767 9661 1 11 . 1 1 80 80 ASN C C 80 178.133 178.133 177.632 0.501 25767 9662 1 11 . 1 1 80 80 ASN CA C 80 57.039 57.039 55.782 1.257 25767 9663 1 11 . 1 1 80 80 ASN CB C 80 38.996 38.996 37.823 1.173 25767 9664 1 11 . 1 1 80 80 ASN H H 80 8.202 8.202 8.636 -0.434 25767 9665 1 11 . 1 1 81 81 THR N N 81 115.517 115.517 118.243 -2.726 25767 9666 1 11 . 1 1 81 81 THR HA H 81 3.896 3.896 4.021 -0.125 25767 9667 1 11 . 1 1 81 81 THR C C 81 175.186 175.186 176.447 -1.261 25767 9668 1 11 . 1 1 81 81 THR CA C 81 66.221 66.221 66.274 -0.053 25767 9669 1 11 . 1 1 81 81 THR CB C 81 69.087 69.087 68.371 0.716 25767 9670 1 11 . 1 1 81 81 THR H H 81 7.944 7.944 7.930 0.014 25767 9671 1 11 . 1 1 82 82 LEU N N 82 119.074 119.074 120.341 -1.267 25767 9672 1 11 . 1 1 82 82 LEU HA H 82 3.981 3.981 3.984 -0.003 25767 9673 1 11 . 1 1 82 82 LEU C C 82 177.583 177.583 178.025 -0.442 25767 9674 1 11 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.317 -0.777 25767 9675 1 11 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.655 0.138 25767 9676 1 11 . 1 1 82 82 LEU H H 82 7.547 7.547 7.695 -0.148 25767 9677 1 11 . 1 1 83 83 ILE N N 83 118.085 118.085 115.948 2.137 25767 9678 1 11 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.292 0.551 25767 9679 1 11 . 1 1 83 83 ILE C C 83 176.413 176.413 177.888 -1.475 25767 9680 1 11 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.783 -1.056 25767 9681 1 11 . 1 1 83 83 ILE CB C 83 37.698 37.698 37.900 -0.202 25767 9682 1 11 . 1 1 83 83 ILE H H 83 7.409 7.409 7.500 -0.091 25767 9683 1 11 . 1 1 84 84 HIS N N 84 116.152 116.152 116.353 -0.201 25767 9684 1 11 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.357 0.238 25767 9685 1 11 . 1 1 84 84 HIS C C 84 175.707 175.707 175.724 -0.017 25767 9686 1 11 . 1 1 84 84 HIS CA C 84 58.628 58.628 56.310 2.317 25767 9687 1 11 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.218 1.185 25767 9688 1 11 . 1 1 84 84 HIS H H 84 7.194 7.194 7.394 -0.200 25767 9689 1 11 . 1 1 85 85 ASP N N 85 122.322 122.322 119.395 2.927 25767 9690 1 11 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.820 -0.286 25767 9691 1 11 . 1 1 85 85 ASP C C 85 175.580 175.580 176.515 -0.935 25767 9692 1 11 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.045 0.300 25767 9693 1 11 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.568 -0.450 25767 9694 1 11 . 1 1 85 85 ASP H H 85 8.505 8.505 7.693 0.812 25767 9695 1 11 . 1 1 86 86 GLN N N 86 122.783 122.783 127.137 -4.354 25767 9696 1 11 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.099 -0.136 25767 9697 1 11 . 1 1 86 86 GLN C C 86 178.581 178.581 177.880 0.701 25767 9698 1 11 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.301 -1.347 25767 9699 1 11 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.284 -0.390 25767 9700 1 11 . 1 1 86 86 GLN H H 86 8.803 8.803 8.900 -0.097 25767 9701 1 11 . 1 1 87 87 GLU N N 87 121.794 121.794 119.639 2.155 25767 9702 1 11 . 1 1 87 87 GLU HA H 87 4.013 4.013 3.953 0.060 25767 9703 1 11 . 1 1 87 87 GLU C C 87 178.290 178.290 178.857 -0.567 25767 9704 1 11 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.925 -0.887 25767 9705 1 11 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.229 -0.249 25767 9706 1 11 . 1 1 87 87 GLU H H 87 8.072 8.072 8.439 -0.367 25767 9707 1 11 . 1 1 88 88 LYS N N 88 119.345 119.345 118.287 1.058 25767 9708 1 11 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.085 -0.330 25767 9709 1 11 . 1 1 88 88 LYS C C 88 180.040 180.040 178.783 1.257 25767 9710 1 11 . 1 1 88 88 LYS CA C 88 59.411 59.411 58.770 0.641 25767 9711 1 11 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.598 0.409 25767 9712 1 11 . 1 1 88 88 LYS H H 88 7.588 7.588 7.809 -0.221 25767 9713 1 11 . 1 1 89 89 ALA N N 89 123.933 123.933 122.453 1.480 25767 9714 1 11 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.137 -0.398 25767 9715 1 11 . 1 1 89 89 ALA C C 89 177.457 177.457 179.577 -2.120 25767 9716 1 11 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.291 0.679 25767 9717 1 11 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.262 0.394 25767 9718 1 11 . 1 1 89 89 ALA H H 89 8.500 8.500 7.689 0.811 25767 9719 1 11 . 1 1 90 90 LYS N N 90 119.244 119.244 119.644 -0.400 25767 9720 1 11 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.843 0.201 25767 9721 1 11 . 1 1 90 90 LYS C C 90 177.774 177.774 178.803 -1.029 25767 9722 1 11 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.735 -0.657 25767 9723 1 11 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.389 -2.148 25767 9724 1 11 . 1 1 90 90 LYS H H 90 6.845 6.845 7.858 -1.013 25767 9725 1 11 . 1 1 91 91 ILE N N 91 117.718 117.718 117.687 0.031 25767 9726 1 11 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.636 -0.238 25767 9727 1 11 . 1 1 91 91 ILE C C 91 177.670 177.670 177.577 0.093 25767 9728 1 11 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.828 -0.830 25767 9729 1 11 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.018 0.783 25767 9730 1 11 . 1 1 91 91 ILE H H 91 7.293 7.293 8.024 -0.731 25767 9731 1 11 . 1 1 92 92 TYR N N 92 121.868 121.868 120.944 0.924 25767 9732 1 11 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.052 0.071 25767 9733 1 11 . 1 1 92 92 TYR C C 92 178.781 178.781 177.439 1.342 25767 9734 1 11 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.078 -0.437 25767 9735 1 11 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.728 0.493 25767 9736 1 11 . 1 1 92 92 TYR H H 92 8.016 8.016 7.962 0.054 25767 9737 1 11 . 1 1 93 93 MET N N 93 118.984 118.984 119.330 -0.346 25767 9738 1 11 . 1 1 93 93 MET HA H 93 3.952 3.952 4.037 -0.085 25767 9739 1 11 . 1 1 93 93 MET C C 93 179.925 179.925 177.858 2.067 25767 9740 1 11 . 1 1 93 93 MET CA C 93 57.589 57.589 58.911 -1.322 25767 9741 1 11 . 1 1 93 93 MET CB C 93 30.752 30.752 32.635 -1.883 25767 9742 1 11 . 1 1 93 93 MET H H 93 8.464 8.464 8.601 -0.137 25767 9743 1 11 . 1 1 94 94 LEU N N 94 125.441 125.441 120.462 4.979 25767 9744 1 11 . 1 1 94 94 LEU HA H 94 3.870 3.870 3.759 0.111 25767 9745 1 11 . 1 1 94 94 LEU C C 94 177.937 177.937 178.340 -0.403 25767 9746 1 11 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.354 0.407 25767 9747 1 11 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.420 0.342 25767 9748 1 11 . 1 1 94 94 LEU H H 94 8.927 8.927 8.846 0.081 25767 9749 1 11 . 1 1 95 95 ASN N N 95 119.066 119.066 118.087 0.979 25767 9750 1 11 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.304 -0.042 25767 9751 1 11 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.552 -0.279 25767 9752 1 11 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.312 -0.707 25767 9753 1 11 . 1 1 95 95 ASN H H 95 8.691 8.691 8.206 0.485 25767 9754 1 11 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.448 0.217 25767 9755 1 11 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.282 0.789 25767 9756 1 11 . 1 1 96 96 PHE H H 96 8.317 8.317 7.878 0.439 25767 9757 1 11 . 1 1 97 97 THR N N 97 118.178 118.178 117.393 0.785 25767 9758 1 11 . 1 1 97 97 THR HA H 97 3.338 3.338 3.838 -0.500 25767 9759 1 11 . 1 1 97 97 THR C C 97 176.074 176.074 176.959 -0.885 25767 9760 1 11 . 1 1 97 97 THR CA C 97 67.986 67.986 67.218 0.768 25767 9761 1 11 . 1 1 97 97 THR H H 97 8.214 8.214 8.925 -0.711 25767 9762 1 11 . 1 1 98 98 MET N N 98 120.097 120.097 119.956 0.141 25767 9763 1 11 . 1 1 98 98 MET HA H 98 4.403 4.403 4.411 -0.008 25767 9764 1 11 . 1 1 98 98 MET C C 98 178.696 178.696 178.349 0.347 25767 9765 1 11 . 1 1 98 98 MET CA C 98 57.029 57.029 56.967 0.062 25767 9766 1 11 . 1 1 98 98 MET CB C 98 29.898 29.898 31.387 -1.489 25767 9767 1 11 . 1 1 98 98 MET H H 98 8.885 8.885 8.496 0.389 25767 9768 1 11 . 1 1 99 99 SER N N 99 114.959 114.959 116.221 -1.262 25767 9769 1 11 . 1 1 99 99 SER HA H 99 4.199 4.199 4.130 0.069 25767 9770 1 11 . 1 1 99 99 SER C C 99 176.565 176.565 176.781 -0.216 25767 9771 1 11 . 1 1 99 99 SER CA C 99 61.965 61.965 60.982 0.983 25767 9772 1 11 . 1 1 99 99 SER CB C 99 62.565 62.565 63.115 -0.550 25767 9773 1 11 . 1 1 99 99 SER H H 99 7.515 7.515 7.904 -0.389 25767 9774 1 11 . 1 1 100 100 LEU N N 100 125.380 125.380 123.946 1.434 25767 9775 1 11 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.860 -0.084 25767 9776 1 11 . 1 1 100 100 LEU C C 100 177.689 177.689 177.987 -0.298 25767 9777 1 11 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.574 0.483 25767 9778 1 11 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.539 0.011 25767 9779 1 11 . 1 1 100 100 LEU H H 100 7.400 7.400 8.229 -0.829 25767 9780 1 11 . 1 1 101 101 TYR N N 101 120.597 120.597 119.666 0.931 25767 9781 1 11 . 1 1 101 101 TYR HA H 101 4.116 4.116 4.090 0.026 25767 9782 1 11 . 1 1 101 101 TYR C C 101 176.825 176.825 177.110 -0.285 25767 9783 1 11 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.167 -0.279 25767 9784 1 11 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.406 0.587 25767 9785 1 11 . 1 1 101 101 TYR H H 101 8.880 8.880 8.401 0.479 25767 9786 1 11 . 1 1 102 102 ASN N N 102 116.869 116.869 116.622 0.247 25767 9787 1 11 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.312 -0.146 25767 9788 1 11 . 1 1 102 102 ASN C C 102 179.089 179.089 177.894 1.195 25767 9789 1 11 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.127 0.085 25767 9790 1 11 . 1 1 102 102 ASN CB C 102 37.734 37.734 37.679 0.055 25767 9791 1 11 . 1 1 102 102 ASN H H 102 8.543 8.543 8.014 0.529 25767 9792 1 11 . 1 1 103 103 GLU N N 103 121.259 121.259 120.333 0.926 25767 9793 1 11 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.910 0.076 25767 9794 1 11 . 1 1 103 103 GLU C C 103 179.968 179.968 178.859 1.109 25767 9795 1 11 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.456 0.061 25767 9796 1 11 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.381 0.169 25767 9797 1 11 . 1 1 103 103 GLU H H 103 7.872 7.872 7.805 0.067 25767 9798 1 11 . 1 1 104 104 LYS N N 104 120.268 120.268 118.973 1.295 25767 9799 1 11 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.202 -0.156 25767 9800 1 11 . 1 1 104 104 LYS C C 104 178.355 178.355 179.030 -0.675 25767 9801 1 11 . 1 1 104 104 LYS CA C 104 56.735 56.735 58.319 -1.584 25767 9802 1 11 . 1 1 104 104 LYS CB C 104 29.113 29.113 31.909 -2.796 25767 9803 1 11 . 1 1 104 104 LYS H H 104 8.384 8.384 7.498 0.886 25767 9804 1 11 . 1 1 105 105 LEU N N 105 121.622 121.622 119.257 2.365 25767 9805 1 11 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.728 0.013 25767 9806 1 11 . 1 1 105 105 LEU C C 105 180.552 180.552 178.616 1.936 25767 9807 1 11 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.273 -0.101 25767 9808 1 11 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.184 -0.154 25767 9809 1 11 . 1 1 105 105 LEU H H 105 8.400 8.400 7.634 0.766 25767 9810 1 11 . 1 1 106 106 LYS N N 106 119.498 119.498 118.448 1.050 25767 9811 1 11 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.828 0.086 25767 9812 1 11 . 1 1 106 106 LYS C C 106 178.419 178.419 179.020 -0.601 25767 9813 1 11 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.943 -0.560 25767 9814 1 11 . 1 1 106 106 LYS CB C 106 31.808 31.808 32.004 -0.196 25767 9815 1 11 . 1 1 106 106 LYS H H 106 7.067 7.067 7.615 -0.548 25767 9816 1 11 . 1 1 107 107 GLN N N 107 121.405 121.405 118.836 2.569 25767 9817 1 11 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.930 -0.079 25767 9818 1 11 . 1 1 107 107 GLN C C 107 177.935 177.935 178.875 -0.940 25767 9819 1 11 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.693 -0.212 25767 9820 1 11 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.475 -1.677 25767 9821 1 11 . 1 1 107 107 GLN H H 107 7.460 7.460 7.757 -0.297 25767 9822 1 11 . 1 1 108 108 LEU N N 108 119.561 119.561 119.264 0.297 25767 9823 1 11 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.486 0.315 25767 9824 1 11 . 1 1 108 108 LEU C C 108 179.195 179.195 177.936 1.259 25767 9825 1 11 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.385 1.008 25767 9826 1 11 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.662 -0.396 25767 9827 1 11 . 1 1 108 108 LEU H H 108 8.208 8.208 7.568 0.640 25767 9828 1 11 . 1 1 109 109 LYS N N 109 118.535 118.535 116.383 2.152 25767 9829 1 11 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.105 0.147 25767 9830 1 11 . 1 1 109 109 LYS C C 109 177.726 177.726 178.114 -0.388 25767 9831 1 11 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.522 0.208 25767 9832 1 11 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.791 -0.381 25767 9833 1 11 . 1 1 109 109 LYS H H 109 7.168 7.168 7.467 -0.299 25767 9834 1 11 . 1 1 110 110 ASP N N 110 117.463 117.463 117.068 0.395 25767 9835 1 11 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.572 0.033 25767 9836 1 11 . 1 1 110 110 ASP C C 110 177.360 177.360 176.691 0.669 25767 9837 1 11 . 1 1 110 110 ASP CA C 110 55.896 55.896 55.196 0.700 25767 9838 1 11 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.422 1.155 25767 9839 1 11 . 1 1 110 110 ASP H H 110 7.861 7.861 8.404 -0.543 25767 9840 1 11 . 1 1 111 111 GLY N N 111 113.059 113.059 107.909 5.150 25767 9841 1 11 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.641 -0.589 25767 9842 1 11 . 1 1 111 111 GLY H H 111 8.479 8.479 7.675 0.804 25767 9843 1 11 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.175 0.288 25767 9844 1 11 . 1 1 112 112 PRO C C 112 175.090 175.090 175.702 -0.612 25767 9845 1 11 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.264 -0.900 25767 9846 1 11 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.829 2.021 25767 9847 1 11 . 1 1 113 113 TRP N N 113 123.164 123.164 121.725 1.439 25767 9848 1 11 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.674 0.036 25767 9849 1 11 . 1 1 113 113 TRP C C 113 174.605 174.605 175.204 -0.599 25767 9850 1 11 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.369 0.536 25767 9851 1 11 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.360 -3.067 25767 9852 1 11 . 1 1 113 113 TRP H H 113 8.687 8.687 8.655 0.032 25767 9853 1 11 . 1 1 114 114 ASP N N 114 121.356 121.356 122.384 -1.028 25767 9854 1 11 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.983 -0.122 25767 9855 1 11 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.761 -0.512 25767 9856 1 11 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.298 -1.157 25767 9857 1 11 . 1 1 114 114 ASP H H 114 6.985 6.985 8.355 -1.370 25767 9858 1 11 . 1 1 115 115 VAL N N 115 118.649 118.649 118.182 0.467 25767 9859 1 11 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.857 -0.015 25767 9860 1 11 . 1 1 115 115 VAL C C 115 177.739 177.739 177.388 0.351 25767 9861 1 11 . 1 1 115 115 VAL CA C 115 65.569 65.569 66.024 -0.455 25767 9862 1 11 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.110 -0.433 25767 9863 1 11 . 1 1 115 115 VAL H H 115 8.206 8.206 8.443 -0.237 25767 9864 1 11 . 1 1 116 116 MET N N 116 120.401 120.401 118.881 1.520 25767 9865 1 11 . 1 1 116 116 MET HA H 116 4.303 4.303 4.200 0.103 25767 9866 1 11 . 1 1 116 116 MET C C 116 179.269 179.269 178.418 0.851 25767 9867 1 11 . 1 1 116 116 MET CA C 116 57.634 57.634 58.936 -1.302 25767 9868 1 11 . 1 1 116 116 MET CB C 116 30.414 30.414 31.938 -1.524 25767 9869 1 11 . 1 1 116 116 MET H H 116 7.642 7.642 8.128 -0.486 25767 9870 1 11 . 1 1 117 117 LEU N N 117 125.503 125.503 119.039 6.464 25767 9871 1 11 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.020 0.225 25767 9872 1 11 . 1 1 117 117 LEU C C 117 178.445 178.445 179.194 -0.749 25767 9873 1 11 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.495 0.705 25767 9874 1 11 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.137 -1.048 25767 9875 1 11 . 1 1 117 117 LEU H H 117 8.157 8.157 7.630 0.527 25767 9876 1 11 . 1 1 118 118 LYS N N 118 119.052 119.052 119.694 -0.642 25767 9877 1 11 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.981 -0.176 25767 9878 1 11 . 1 1 118 118 LYS C C 118 178.251 178.251 179.382 -1.131 25767 9879 1 11 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.126 0.400 25767 9880 1 11 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.142 -0.014 25767 9881 1 11 . 1 1 118 118 LYS H H 118 7.400 7.400 7.632 -0.232 25767 9882 1 11 . 1 1 119 119 ARG N N 119 117.999 117.999 119.236 -1.237 25767 9883 1 11 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.340 -0.120 25767 9884 1 11 . 1 1 119 119 ARG C C 119 180.441 180.441 179.084 1.357 25767 9885 1 11 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.516 0.301 25767 9886 1 11 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.219 -0.134 25767 9887 1 11 . 1 1 119 119 ARG H H 119 8.265 8.265 7.980 0.285 25767 9888 1 11 . 1 1 120 120 SER N N 120 118.073 118.073 116.221 1.852 25767 9889 1 11 . 1 1 120 120 SER HA H 120 4.182 4.182 4.303 -0.121 25767 9890 1 11 . 1 1 120 120 SER C C 120 176.215 176.215 176.644 -0.429 25767 9891 1 11 . 1 1 120 120 SER CA C 120 62.817 62.817 62.250 0.567 25767 9892 1 11 . 1 1 120 120 SER CB C 120 63.550 63.550 63.200 0.349 25767 9893 1 11 . 1 1 120 120 SER H H 120 8.633 8.633 7.837 0.796 25767 9894 1 11 . 1 1 121 121 LEU N N 121 125.029 125.029 123.221 1.808 25767 9895 1 11 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.080 0.139 25767 9896 1 11 . 1 1 121 121 LEU C C 121 179.679 179.679 177.721 1.958 25767 9897 1 11 . 1 1 121 121 LEU CA C 121 58.849 58.849 58.321 0.528 25767 9898 1 11 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.686 -0.912 25767 9899 1 11 . 1 1 121 121 LEU H H 121 8.313 8.313 8.140 0.173 25767 9900 1 11 . 1 1 122 122 TRP N N 122 120.217 120.217 119.414 0.803 25767 9901 1 11 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.344 -0.004 25767 9902 1 11 . 1 1 122 122 TRP C C 122 177.527 177.527 178.821 -1.294 25767 9903 1 11 . 1 1 122 122 TRP CA C 122 61.758 61.758 61.211 0.548 25767 9904 1 11 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.046 0.602 25767 9905 1 11 . 1 1 122 122 TRP H H 122 7.928 7.928 7.837 0.091 25767 9906 1 11 . 1 1 123 123 CYS N N 123 119.669 119.669 118.734 0.935 25767 9907 1 11 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.484 -0.277 25767 9908 1 11 . 1 1 123 123 CYS C C 123 177.057 177.057 177.525 -0.468 25767 9909 1 11 . 1 1 123 123 CYS CA C 123 62.600 62.600 62.564 0.036 25767 9910 1 11 . 1 1 123 123 CYS CB C 123 25.899 25.899 26.090 -0.192 25767 9911 1 11 . 1 1 123 123 CYS H H 123 8.273 8.273 8.285 -0.012 25767 9912 1 11 . 1 1 124 124 CYS N N 124 116.898 116.898 119.822 -2.924 25767 9913 1 11 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.238 -0.390 25767 9914 1 11 . 1 1 124 124 CYS C C 124 175.759 175.759 177.148 -1.389 25767 9915 1 11 . 1 1 124 124 CYS CA C 124 65.653 65.653 64.185 1.468 25767 9916 1 11 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.046 0.471 25767 9917 1 11 . 1 1 124 124 CYS H H 124 8.122 8.122 8.012 0.110 25767 9918 1 11 . 1 1 125 125 ILE N N 125 120.498 120.498 121.092 -0.594 25767 9919 1 11 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.808 -0.221 25767 9920 1 11 . 1 1 125 125 ILE C C 125 179.337 179.337 177.819 1.518 25767 9921 1 11 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.941 1.653 25767 9922 1 11 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.572 0.107 25767 9923 1 11 . 1 1 125 125 ILE H H 125 8.092 8.092 8.451 -0.359 25767 9924 1 11 . 1 1 126 126 ASP N N 126 125.084 125.084 120.836 4.248 25767 9925 1 11 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.448 0.169 25767 9926 1 11 . 1 1 126 126 ASP C C 126 178.299 178.299 178.986 -0.687 25767 9927 1 11 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.683 1.321 25767 9928 1 11 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.199 0.097 25767 9929 1 11 . 1 1 126 126 ASP H H 126 9.049 9.049 8.274 0.775 25767 9930 1 11 . 1 1 127 127 LEU N N 127 122.591 122.591 120.086 2.505 25767 9931 1 11 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.873 -0.006 25767 9932 1 11 . 1 1 127 127 LEU C C 127 179.655 179.655 178.978 0.677 25767 9933 1 11 . 1 1 127 127 LEU CA C 127 58.661 58.661 58.030 0.631 25767 9934 1 11 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.574 0.620 25767 9935 1 11 . 1 1 127 127 LEU H H 127 8.888 8.888 7.671 1.217 25767 9936 1 11 . 1 1 128 128 PHE N N 128 117.498 117.498 118.502 -1.004 25767 9937 1 11 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.117 0.205 25767 9938 1 11 . 1 1 128 128 PHE C C 128 178.533 178.533 178.400 0.133 25767 9939 1 11 . 1 1 128 128 PHE CA C 128 60.932 60.932 62.390 -1.458 25767 9940 1 11 . 1 1 128 128 PHE CB C 128 39.053 39.053 38.401 0.652 25767 9941 1 11 . 1 1 128 128 PHE H H 128 8.947 8.947 7.913 1.034 25767 9942 1 11 . 1 1 129 129 SER N N 129 115.398 115.398 115.624 -0.226 25767 9943 1 11 . 1 1 129 129 SER HA H 129 4.046 4.046 4.284 -0.238 25767 9944 1 11 . 1 1 129 129 SER C C 129 175.168 175.168 176.938 -1.770 25767 9945 1 11 . 1 1 129 129 SER CA C 129 63.015 63.015 62.523 0.492 25767 9946 1 11 . 1 1 129 129 SER H H 129 8.578 8.578 8.812 -0.234 25767 9947 1 11 . 1 1 130 130 CYS N N 130 125.556 125.556 120.531 5.025 25767 9948 1 11 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.120 -0.011 25767 9949 1 11 . 1 1 130 130 CYS C C 130 175.294 175.294 176.934 -1.640 25767 9950 1 11 . 1 1 130 130 CYS CA C 130 61.438 61.438 64.757 -3.319 25767 9951 1 11 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.553 -0.503 25767 9952 1 11 . 1 1 130 130 CYS H H 130 8.289 8.289 8.365 -0.076 25767 9953 1 11 . 1 1 131 131 ILE N N 131 120.232 120.232 121.351 -1.119 25767 9954 1 11 . 1 1 131 131 ILE HA H 131 4.033 4.033 4.098 -0.065 25767 9955 1 11 . 1 1 131 131 ILE C C 131 177.297 177.297 178.727 -1.430 25767 9956 1 11 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.638 -0.986 25767 9957 1 11 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.963 1.139 25767 9958 1 11 . 1 1 131 131 ILE H H 131 7.943 7.943 8.350 -0.407 25767 9959 1 11 . 1 1 132 132 LEU N N 132 116.422 116.422 120.493 -4.071 25767 9960 1 11 . 1 1 132 132 LEU HA H 132 3.845 3.845 4.076 -0.231 25767 9961 1 11 . 1 1 132 132 LEU C C 132 177.816 177.816 178.541 -0.725 25767 9962 1 11 . 1 1 132 132 LEU CA C 132 57.078 57.078 58.100 -1.022 25767 9963 1 11 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.703 0.510 25767 9964 1 11 . 1 1 132 132 LEU H H 132 7.846 7.846 8.453 -0.607 25767 9965 1 11 . 1 1 133 133 HIS N N 133 116.929 116.929 118.942 -2.013 25767 9966 1 11 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.279 -0.140 25767 9967 1 11 . 1 1 133 133 HIS C C 133 178.669 178.669 177.514 1.155 25767 9968 1 11 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.991 -0.255 25767 9969 1 11 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.534 2.618 25767 9970 1 11 . 1 1 133 133 HIS H H 133 7.822 7.822 8.263 -0.441 25767 9971 1 11 . 1 1 134 134 LEU N N 134 116.898 116.898 120.053 -3.155 25767 9972 1 11 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.200 -0.467 25767 9973 1 11 . 1 1 134 134 LEU C C 134 179.402 179.402 179.058 0.344 25767 9974 1 11 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.819 -0.592 25767 9975 1 11 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.166 -2.627 25767 9976 1 11 . 1 1 134 134 LEU H H 134 8.688 8.688 8.047 0.641 25767 9977 1 11 . 1 1 135 135 TRP N N 135 115.602 115.602 117.938 -2.336 25767 9978 1 11 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.625 0.383 25767 9979 1 11 . 1 1 135 135 TRP C C 135 175.022 175.022 178.050 -3.028 25767 9980 1 11 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.418 1.008 25767 9981 1 11 . 1 1 135 135 TRP CB C 135 27.085 27.085 29.216 -2.131 25767 9982 1 11 . 1 1 135 135 TRP H H 135 7.638 7.638 8.422 -0.784 25767 9983 1 11 . 1 1 136 136 LYS N N 136 119.721 119.721 123.040 -3.319 25767 9984 1 11 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.975 -0.159 25767 9985 1 11 . 1 1 136 136 LYS C C 136 178.279 178.279 178.344 -0.065 25767 9986 1 11 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.699 0.494 25767 9987 1 11 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.835 1.222 25767 9988 1 11 . 1 1 136 136 LYS H H 136 6.538 6.538 8.350 -1.812 25767 9989 1 11 . 1 1 137 137 GLU N N 137 115.407 115.407 115.930 -0.523 25767 9990 1 11 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.144 0.023 25767 9991 1 11 . 1 1 137 137 GLU C C 137 176.700 176.700 177.374 -0.674 25767 9992 1 11 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.515 -0.665 25767 9993 1 11 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.006 0.153 25767 9994 1 11 . 1 1 137 137 GLU H H 137 8.596 8.596 8.234 0.362 25767 9995 1 11 . 1 1 138 138 ASN N N 138 116.669 116.669 116.413 0.256 25767 9996 1 11 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.824 0.082 25767 9997 1 11 . 1 1 138 138 ASN C C 138 173.481 173.481 174.974 -1.493 25767 9998 1 11 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.953 -1.139 25767 9999 1 11 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.687 1.150 25767 10000 1 11 . 1 1 138 138 ASN H H 138 8.343 8.343 8.166 0.177 25767 10001 1 11 . 1 1 139 139 ILE N N 139 120.703 120.703 120.797 -0.094 25767 10002 1 11 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.274 0.070 25767 10003 1 11 . 1 1 139 139 ILE C C 139 175.241 175.241 175.384 -0.143 25767 10004 1 11 . 1 1 139 139 ILE CA C 139 60.792 60.792 58.621 2.171 25767 10005 1 11 . 1 1 139 139 ILE CB C 139 40.274 40.274 38.688 1.586 25767 10006 1 11 . 1 1 139 139 ILE H H 139 7.167 7.167 7.622 -0.455 25767 10007 1 11 . 1 1 140 140 SER N N 140 123.284 123.284 120.237 3.047 25767 10008 1 11 . 1 1 140 140 SER HA H 140 4.345 4.345 4.507 -0.162 25767 10009 1 11 . 1 1 140 140 SER CA C 140 58.095 58.095 57.224 0.871 25767 10010 1 11 . 1 1 140 140 SER CB C 140 65.370 65.370 64.422 0.948 25767 10011 1 11 . 1 1 140 140 SER H H 140 8.727 8.727 8.317 0.410 25767 10012 1 11 . 1 1 142 142 THR N N 142 113.868 113.868 116.046 -2.178 25767 10013 1 11 . 1 1 142 142 THR HA H 142 3.976 3.976 4.150 -0.174 25767 10014 1 11 . 1 1 142 142 THR C C 142 177.559 177.559 176.882 0.677 25767 10015 1 11 . 1 1 142 142 THR CA C 142 66.007 66.007 65.917 0.090 25767 10016 1 11 . 1 1 142 142 THR CB C 142 68.530 68.530 68.656 -0.126 25767 10017 1 11 . 1 1 142 142 THR H H 142 8.243 8.243 8.014 0.229 25767 10018 1 11 . 1 1 143 143 SER N N 143 120.786 120.786 118.624 2.162 25767 10019 1 11 . 1 1 143 143 SER C C 143 175.844 175.844 176.758 -0.914 25767 10020 1 11 . 1 1 143 143 SER CA C 143 62.102 62.102 62.443 -0.341 25767 10021 1 11 . 1 1 143 143 SER CB C 143 63.086 63.086 62.860 0.226 25767 10022 1 11 . 1 1 143 143 SER H H 143 7.915 7.915 8.634 -0.719 25767 10023 1 11 . 1 1 144 144 THR N N 144 120.946 120.946 117.524 3.422 25767 10024 1 11 . 1 1 144 144 THR HA H 144 4.299 4.299 4.051 0.248 25767 10025 1 11 . 1 1 144 144 THR C C 144 175.874 175.874 176.072 -0.198 25767 10026 1 11 . 1 1 144 144 THR CA C 144 67.487 67.487 66.508 0.979 25767 10027 1 11 . 1 1 144 144 THR CB C 144 68.485 68.485 68.890 -0.405 25767 10028 1 11 . 1 1 144 144 THR H H 144 8.746 8.746 8.638 0.108 25767 10029 1 11 . 1 1 145 145 ASN N N 145 120.069 120.069 119.126 0.943 25767 10030 1 11 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.369 -0.061 25767 10031 1 11 . 1 1 145 145 ASN C C 145 177.917 177.917 177.502 0.415 25767 10032 1 11 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.651 -0.313 25767 10033 1 11 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.633 -0.533 25767 10034 1 11 . 1 1 145 145 ASN H H 145 7.940 7.940 7.857 0.083 25767 10035 1 11 . 1 1 146 146 SER N N 146 116.905 116.905 116.755 0.150 25767 10036 1 11 . 1 1 146 146 SER HA H 146 3.936 3.936 4.109 -0.173 25767 10037 1 11 . 1 1 146 146 SER C C 146 176.963 176.963 176.447 0.516 25767 10038 1 11 . 1 1 146 146 SER CA C 146 61.997 61.997 62.413 -0.416 25767 10039 1 11 . 1 1 146 146 SER CB C 146 62.879 62.879 63.118 -0.239 25767 10040 1 11 . 1 1 146 146 SER H H 146 7.951 7.951 7.754 0.197 25767 10041 1 11 . 1 1 147 147 LEU N N 147 123.253 123.253 121.788 1.465 25767 10042 1 11 . 1 1 147 147 LEU HA H 147 3.875 3.875 3.869 0.006 25767 10043 1 11 . 1 1 147 147 LEU C C 147 178.726 178.726 178.690 0.036 25767 10044 1 11 . 1 1 147 147 LEU CA C 147 58.580 58.580 58.617 -0.037 25767 10045 1 11 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.565 -0.705 25767 10046 1 11 . 1 1 147 147 LEU H H 147 8.168 8.168 7.679 0.489 25767 10047 1 11 . 1 1 148 148 GLN N N 148 118.212 118.212 117.965 0.247 25767 10048 1 11 . 1 1 148 148 GLN HA H 148 3.817 3.817 3.915 -0.098 25767 10049 1 11 . 1 1 148 148 GLN C C 148 179.686 179.686 178.487 1.199 25767 10050 1 11 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.538 0.705 25767 10051 1 11 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.781 -0.061 25767 10052 1 11 . 1 1 148 148 GLN H H 148 8.295 8.295 8.497 -0.202 25767 10053 1 11 . 1 1 149 149 LYS N N 149 120.770 120.770 120.587 0.183 25767 10054 1 11 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.956 -0.055 25767 10055 1 11 . 1 1 149 149 LYS C C 149 178.006 178.006 179.126 -1.120 25767 10056 1 11 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.710 -0.178 25767 10057 1 11 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.153 -0.261 25767 10058 1 11 . 1 1 149 149 LYS H H 149 7.955 7.955 7.996 -0.041 25767 10059 1 11 . 1 1 150 150 ARG N N 150 119.244 119.244 119.215 0.029 25767 10060 1 11 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.984 -0.144 25767 10061 1 11 . 1 1 150 150 ARG C C 150 178.858 178.858 178.892 -0.034 25767 10062 1 11 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.235 0.136 25767 10063 1 11 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.986 -1.182 25767 10064 1 11 . 1 1 150 150 ARG H H 150 7.020 7.020 7.567 -0.547 25767 10065 1 11 . 1 1 151 151 ILE N N 151 121.183 121.183 120.242 0.941 25767 10066 1 11 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.442 -0.083 25767 10067 1 11 . 1 1 151 151 ILE C C 151 177.327 177.327 177.460 -0.133 25767 10068 1 11 . 1 1 151 151 ILE CA C 151 67.196 67.196 65.149 2.047 25767 10069 1 11 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.466 0.806 25767 10070 1 11 . 1 1 151 151 ILE H H 151 7.574 7.574 7.852 -0.278 25767 10071 1 11 . 1 1 152 152 LYS N N 152 119.521 119.521 120.766 -1.245 25767 10072 1 11 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.872 -0.099 25767 10073 1 11 . 1 1 152 152 LYS C C 152 178.016 178.016 178.424 -0.408 25767 10074 1 11 . 1 1 152 152 LYS CA C 152 59.830 59.830 59.897 -0.067 25767 10075 1 11 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.325 -0.744 25767 10076 1 11 . 1 1 152 152 LYS H H 152 7.629 7.629 8.279 -0.650 25767 10077 1 11 . 1 1 153 153 TYR N N 153 120.178 120.178 120.717 -0.539 25767 10078 1 11 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.129 -0.057 25767 10079 1 11 . 1 1 153 153 TYR C C 153 178.195 178.195 177.657 0.538 25767 10080 1 11 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.850 -0.534 25767 10081 1 11 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.460 -1.187 25767 10082 1 11 . 1 1 153 153 TYR H H 153 8.407 8.407 8.100 0.307 25767 10083 1 11 . 1 1 154 154 CYS N N 154 117.013 117.013 118.413 -1.400 25767 10084 1 11 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.221 -0.149 25767 10085 1 11 . 1 1 154 154 CYS C C 154 176.827 176.827 176.956 -0.129 25767 10086 1 11 . 1 1 154 154 CYS CA C 154 65.780 65.780 60.853 4.927 25767 10087 1 11 . 1 1 154 154 CYS CB C 154 28.160 28.160 28.159 0.001 25767 10088 1 11 . 1 1 154 154 CYS H H 154 8.291 8.291 7.842 0.449 25767 10089 1 11 . 1 1 155 155 LYS N N 155 118.753 118.753 121.481 -2.728 25767 10090 1 11 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.813 -0.142 25767 10091 1 11 . 1 1 155 155 LYS C C 155 179.904 179.904 179.061 0.843 25767 10092 1 11 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.443 1.041 25767 10093 1 11 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.158 -0.215 25767 10094 1 11 . 1 1 155 155 LYS H H 155 7.934 7.934 7.960 -0.026 25767 10095 1 11 . 1 1 156 156 ILE N N 156 123.873 123.873 120.732 3.141 25767 10096 1 11 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.558 0.026 25767 10097 1 11 . 1 1 156 156 ILE C C 156 179.501 179.501 177.603 1.898 25767 10098 1 11 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.455 -0.215 25767 10099 1 11 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.788 -0.146 25767 10100 1 11 . 1 1 156 156 ILE H H 156 8.314 8.314 8.441 -0.127 25767 10101 1 11 . 1 1 157 157 TYR N N 157 121.132 121.132 119.884 1.248 25767 10102 1 11 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.973 0.192 25767 10103 1 11 . 1 1 157 157 TYR C C 157 178.558 178.558 177.530 1.028 25767 10104 1 11 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.919 0.191 25767 10105 1 11 . 1 1 157 157 TYR H H 157 8.442 8.442 7.583 0.859 25767 10106 1 11 . 1 1 158 158 LEU N N 158 120.964 120.964 119.927 1.037 25767 10107 1 11 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.840 0.072 25767 10108 1 11 . 1 1 158 158 LEU C C 158 180.130 180.130 178.707 1.423 25767 10109 1 11 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.632 1.054 25767 10110 1 11 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.535 0.195 25767 10111 1 11 . 1 1 158 158 LEU H H 158 8.469 8.469 8.009 0.460 25767 10112 1 11 . 1 1 159 159 SER N N 159 116.653 116.653 114.506 2.147 25767 10113 1 11 . 1 1 159 159 SER HA H 159 4.246 4.246 4.065 0.181 25767 10114 1 11 . 1 1 159 159 SER CA C 159 61.460 61.460 61.949 -0.489 25767 10115 1 11 . 1 1 159 159 SER CB C 159 62.849 62.849 62.676 0.173 25767 10116 1 11 . 1 1 159 159 SER H H 159 7.758 7.758 8.428 -0.670 25767 10117 1 11 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.144 -1.771 25767 10118 1 11 . 1 1 160 160 LYS CB C 160 29.832 29.832 31.928 -2.096 25767 10119 1 11 . 1 1 160 160 LYS H H 160 8.425 8.425 7.434 0.991 25767 10120 1 11 . 1 1 161 161 LEU N N 161 121.686 121.686 119.224 2.462 25767 10121 1 11 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.866 0.297 25767 10122 1 11 . 1 1 161 161 LEU C C 161 180.224 180.224 179.208 1.016 25767 10123 1 11 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.557 0.027 25767 10124 1 11 . 1 1 161 161 LEU CB C 161 41.462 41.462 40.957 0.505 25767 10125 1 11 . 1 1 161 161 LEU H H 161 8.323 8.323 7.453 0.870 25767 10126 1 11 . 1 1 162 162 ALA N N 162 123.102 123.102 120.948 2.154 25767 10127 1 11 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.063 0.067 25767 10128 1 11 . 1 1 162 162 ALA C C 162 179.487 179.487 179.257 0.230 25767 10129 1 11 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.693 0.051 25767 10130 1 11 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.537 -0.134 25767 10131 1 11 . 1 1 162 162 ALA H H 162 7.978 7.978 7.581 0.397 25767 10132 1 11 . 1 1 163 163 LYS N N 163 116.069 116.069 116.576 -0.507 25767 10133 1 11 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.265 -0.042 25767 10134 1 11 . 1 1 163 163 LYS C C 163 176.987 176.987 176.553 0.434 25767 10135 1 11 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.348 0.258 25767 10136 1 11 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.708 0.498 25767 10137 1 11 . 1 1 163 163 LYS H H 163 7.697 7.697 7.722 -0.025 25767 10138 1 11 . 1 1 164 164 GLY N N 164 108.540 108.540 106.376 2.164 25767 10139 1 11 . 1 1 164 164 GLY C C 164 174.721 174.721 174.297 0.424 25767 10140 1 11 . 1 1 164 164 GLY CA C 164 45.791 45.791 45.002 0.789 25767 10141 1 11 . 1 1 164 164 GLY H H 164 7.772 7.772 7.355 0.417 25767 10142 1 11 . 1 1 165 165 GLU N N 165 119.886 119.886 120.068 -0.182 25767 10143 1 11 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.330 -0.280 25767 10144 1 11 . 1 1 165 165 GLU C C 165 176.027 176.027 175.052 0.975 25767 10145 1 11 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.072 1.781 25767 10146 1 11 . 1 1 165 165 GLU CB C 165 30.338 30.338 31.022 -0.684 25767 10147 1 11 . 1 1 165 165 GLU H H 165 8.065 8.065 7.878 0.187 25767 10148 1 11 . 1 1 166 166 ILE N N 166 117.926 117.926 120.534 -2.608 25767 10149 1 11 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.801 0.101 25767 10150 1 11 . 1 1 166 166 ILE C C 166 174.138 174.138 176.592 -2.454 25767 10151 1 11 . 1 1 166 166 ILE CA C 166 60.455 60.455 59.035 1.420 25767 10152 1 11 . 1 1 166 166 ILE CB C 166 40.202 40.202 38.732 1.470 25767 10153 1 11 . 1 1 166 166 ILE H H 166 7.282 7.282 8.102 -0.820 25767 10154 1 12 . 1 1 2 2 ALA N N 2 122.811 122.811 125.004 -2.193 25767 10155 1 12 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.003 0.020 25767 10156 1 12 . 1 1 2 2 ALA C C 2 179.915 179.915 178.639 1.276 25767 10157 1 12 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.491 -0.374 25767 10158 1 12 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.359 0.180 25767 10159 1 12 . 1 1 2 2 ALA H H 2 8.509 8.509 8.933 -0.424 25767 10160 1 12 . 1 1 3 3 SER N N 3 115.308 115.308 112.454 2.854 25767 10161 1 12 . 1 1 3 3 SER HA H 3 4.097 4.097 4.081 0.016 25767 10162 1 12 . 1 1 3 3 SER C C 3 176.706 176.706 176.262 0.444 25767 10163 1 12 . 1 1 3 3 SER CA C 3 60.665 60.665 61.152 -0.487 25767 10164 1 12 . 1 1 3 3 SER CB C 3 62.710 62.710 62.770 -0.060 25767 10165 1 12 . 1 1 3 3 SER H H 3 7.996 7.996 8.479 -0.483 25767 10166 1 12 . 1 1 4 4 ASN N N 4 122.688 122.688 120.051 2.637 25767 10167 1 12 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.426 -0.122 25767 10168 1 12 . 1 1 4 4 ASN C C 4 176.258 176.258 177.226 -0.968 25767 10169 1 12 . 1 1 4 4 ASN CA C 4 55.701 55.701 55.910 -0.209 25767 10170 1 12 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.813 0.364 25767 10171 1 12 . 1 1 4 4 ASN H H 4 8.075 8.075 8.243 -0.168 25767 10172 1 12 . 1 1 5 5 ALA N N 5 121.900 121.900 122.134 -0.234 25767 10173 1 12 . 1 1 5 5 ALA HA H 5 3.575 3.575 3.968 -0.393 25767 10174 1 12 . 1 1 5 5 ALA C C 5 178.475 178.475 179.060 -0.585 25767 10175 1 12 . 1 1 5 5 ALA CA C 5 55.833 55.833 55.105 0.728 25767 10176 1 12 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.415 -0.799 25767 10177 1 12 . 1 1 5 5 ALA H H 5 8.659 8.659 7.625 1.034 25767 10178 1 12 . 1 1 6 6 ALA N N 6 117.768 117.768 121.508 -3.740 25767 10179 1 12 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.968 -0.181 25767 10180 1 12 . 1 1 6 6 ALA C C 6 180.494 180.494 179.423 1.071 25767 10181 1 12 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.061 0.289 25767 10182 1 12 . 1 1 6 6 ALA CB C 6 17.902 17.902 17.981 -0.079 25767 10183 1 12 . 1 1 6 6 ALA H H 6 7.864 7.864 7.695 0.169 25767 10184 1 12 . 1 1 7 7 ARG N N 7 121.173 121.173 119.298 1.875 25767 10185 1 12 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.081 -0.178 25767 10186 1 12 . 1 1 7 7 ARG C C 7 179.189 179.189 178.625 0.564 25767 10187 1 12 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.903 0.409 25767 10188 1 12 . 1 1 7 7 ARG CB C 7 29.222 29.222 30.090 -0.868 25767 10189 1 12 . 1 1 7 7 ARG H H 7 7.514 7.514 8.003 -0.489 25767 10190 1 12 . 1 1 8 8 VAL N N 8 122.979 122.979 119.666 3.313 25767 10191 1 12 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.751 -0.498 25767 10192 1 12 . 1 1 8 8 VAL C C 8 177.821 177.821 178.310 -0.489 25767 10193 1 12 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.328 1.444 25767 10194 1 12 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.085 0.356 25767 10195 1 12 . 1 1 8 8 VAL H H 8 8.101 8.101 7.796 0.305 25767 10196 1 12 . 1 1 9 9 VAL N N 9 119.801 119.801 120.248 -0.447 25767 10197 1 12 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.592 -0.326 25767 10198 1 12 . 1 1 9 9 VAL C C 9 177.373 177.373 177.472 -0.099 25767 10199 1 12 . 1 1 9 9 VAL CA C 9 67.484 67.484 65.864 1.620 25767 10200 1 12 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.322 1.303 25767 10201 1 12 . 1 1 9 9 VAL H H 9 8.362 8.362 7.872 0.490 25767 10202 1 12 . 1 1 10 10 ALA N N 10 122.360 122.360 121.538 0.822 25767 10203 1 12 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.045 -0.109 25767 10204 1 12 . 1 1 10 10 ALA C C 10 180.762 180.762 179.587 1.175 25767 10205 1 12 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.709 -0.265 25767 10206 1 12 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.148 -0.411 25767 10207 1 12 . 1 1 10 10 ALA H H 10 7.776 7.776 7.732 0.044 25767 10208 1 12 . 1 1 11 11 THR N N 11 117.376 117.376 112.452 4.924 25767 10209 1 12 . 1 1 11 11 THR HA H 11 3.816 3.816 4.079 -0.263 25767 10210 1 12 . 1 1 11 11 THR C C 11 175.775 175.775 176.350 -0.575 25767 10211 1 12 . 1 1 11 11 THR CA C 11 66.509 66.509 65.431 1.078 25767 10212 1 12 . 1 1 11 11 THR CB C 11 68.588 68.588 68.461 0.127 25767 10213 1 12 . 1 1 11 11 THR H H 11 8.180 8.180 7.683 0.497 25767 10214 1 12 . 1 1 12 12 ALA N N 12 125.308 125.308 125.548 -0.240 25767 10215 1 12 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.746 0.251 25767 10216 1 12 . 1 1 12 12 ALA C C 12 179.399 179.399 179.483 -0.084 25767 10217 1 12 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.459 0.618 25767 10218 1 12 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.224 1.020 25767 10219 1 12 . 1 1 12 12 ALA H H 12 8.671 8.671 8.414 0.257 25767 10220 1 12 . 1 1 13 13 LYS N N 13 116.977 116.977 118.467 -1.490 25767 10221 1 12 . 1 1 13 13 LYS C C 13 179.646 179.646 178.815 0.831 25767 10222 1 12 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.883 -0.962 25767 10223 1 12 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.243 -0.800 25767 10224 1 12 . 1 1 13 13 LYS H H 13 8.061 8.061 7.912 0.149 25767 10225 1 12 . 1 1 14 14 ASP N N 14 121.988 121.988 120.031 1.957 25767 10226 1 12 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.499 -0.146 25767 10227 1 12 . 1 1 14 14 ASP C C 14 179.446 179.446 178.804 0.642 25767 10228 1 12 . 1 1 14 14 ASP CA C 14 57.509 57.509 56.980 0.529 25767 10229 1 12 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.686 -0.685 25767 10230 1 12 . 1 1 14 14 ASP H H 14 7.669 7.669 7.714 -0.045 25767 10231 1 12 . 1 1 15 15 PHE N N 15 119.588 119.588 118.530 1.058 25767 10232 1 12 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.235 0.109 25767 10233 1 12 . 1 1 15 15 PHE C C 15 178.373 178.373 178.126 0.247 25767 10234 1 12 . 1 1 15 15 PHE CA C 15 62.237 62.237 60.873 1.364 25767 10235 1 12 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.626 -1.130 25767 10236 1 12 . 1 1 15 15 PHE H H 15 7.913 7.913 8.779 -0.866 25767 10237 1 12 . 1 1 16 16 ASP N N 16 121.705 121.705 119.823 1.882 25767 10238 1 12 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.476 -0.481 25767 10239 1 12 . 1 1 16 16 ASP C C 16 180.071 180.071 179.471 0.600 25767 10240 1 12 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.223 0.926 25767 10241 1 12 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.707 0.780 25767 10242 1 12 . 1 1 16 16 ASP H H 16 8.324 8.324 8.334 -0.010 25767 10243 1 12 . 1 1 17 17 LYS N N 17 118.825 118.825 119.555 -0.730 25767 10244 1 12 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.121 -0.084 25767 10245 1 12 . 1 1 17 17 LYS C C 17 178.407 178.407 177.982 0.425 25767 10246 1 12 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.769 0.292 25767 10247 1 12 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.567 0.017 25767 10248 1 12 . 1 1 17 17 LYS H H 17 7.834 7.834 7.732 0.102 25767 10249 1 12 . 1 1 18 18 VAL N N 18 110.562 110.562 117.268 -6.706 25767 10250 1 12 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.033 0.483 25767 10251 1 12 . 1 1 18 18 VAL C C 18 176.144 176.144 176.633 -0.489 25767 10252 1 12 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.128 -2.254 25767 10253 1 12 . 1 1 18 18 VAL CB C 18 31.160 31.160 31.809 -0.649 25767 10254 1 12 . 1 1 18 18 VAL H H 18 7.185 7.185 7.599 -0.414 25767 10255 1 12 . 1 1 19 19 GLY N N 19 109.272 109.272 107.786 1.486 25767 10256 1 12 . 1 1 19 19 GLY C C 19 175.043 175.043 174.763 0.280 25767 10257 1 12 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.364 0.467 25767 10258 1 12 . 1 1 19 19 GLY H H 19 7.723 7.723 7.879 -0.156 25767 10259 1 12 . 1 1 20 20 LEU N N 20 125.428 125.428 121.731 3.697 25767 10260 1 12 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.482 -0.162 25767 10261 1 12 . 1 1 20 20 LEU C C 20 177.949 177.949 177.299 0.650 25767 10262 1 12 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.281 -0.477 25767 10263 1 12 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.445 0.472 25767 10264 1 12 . 1 1 20 20 LEU H H 20 8.083 8.083 7.893 0.190 25767 10265 1 12 . 1 1 21 21 GLY N N 21 107.804 107.804 110.392 -2.588 25767 10266 1 12 . 1 1 21 21 GLY C C 21 176.278 176.278 176.121 0.157 25767 10267 1 12 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.604 -0.310 25767 10268 1 12 . 1 1 21 21 GLY H H 21 7.982 7.982 7.962 0.020 25767 10269 1 12 . 1 1 22 22 ILE N N 22 121.319 121.319 121.544 -0.225 25767 10270 1 12 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.762 0.148 25767 10271 1 12 . 1 1 22 22 ILE C C 22 176.604 176.604 177.856 -1.252 25767 10272 1 12 . 1 1 22 22 ILE CA C 22 61.446 61.446 62.985 -1.539 25767 10273 1 12 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.503 -0.937 25767 10274 1 12 . 1 1 22 22 ILE H H 22 8.478 8.478 8.032 0.446 25767 10275 1 12 . 1 1 23 23 ILE N N 23 120.377 120.377 120.480 -0.103 25767 10276 1 12 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.937 -0.224 25767 10277 1 12 . 1 1 23 23 ILE C C 23 178.581 178.581 178.711 -0.130 25767 10278 1 12 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.950 0.296 25767 10279 1 12 . 1 1 23 23 ILE CB C 23 36.199 36.199 36.512 -0.313 25767 10280 1 12 . 1 1 23 23 ILE H H 23 6.869 6.869 8.013 -1.144 25767 10281 1 12 . 1 1 24 24 GLY N N 24 103.449 103.449 108.251 -4.802 25767 10282 1 12 . 1 1 24 24 GLY C C 24 175.308 175.308 175.773 -0.465 25767 10283 1 12 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.317 0.626 25767 10284 1 12 . 1 1 24 24 GLY H H 24 7.488 7.488 8.644 -1.156 25767 10285 1 12 . 1 1 25 25 TYR N N 25 124.685 124.685 123.660 1.025 25767 10286 1 12 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.828 -0.162 25767 10287 1 12 . 1 1 25 25 TYR C C 25 176.208 176.208 176.805 -0.597 25767 10288 1 12 . 1 1 25 25 TYR CA C 25 61.371 61.371 61.577 -0.206 25767 10289 1 12 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.460 -0.193 25767 10290 1 12 . 1 1 25 25 TYR H H 25 7.931 7.931 8.065 -0.134 25767 10291 1 12 . 1 1 26 26 TYR N N 26 117.001 117.001 119.918 -2.917 25767 10292 1 12 . 1 1 26 26 TYR HA H 26 3.941 3.941 3.971 -0.030 25767 10293 1 12 . 1 1 26 26 TYR C C 26 178.753 178.753 177.491 1.262 25767 10294 1 12 . 1 1 26 26 TYR CA C 26 64.260 64.260 62.161 2.099 25767 10295 1 12 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.797 -1.276 25767 10296 1 12 . 1 1 26 26 TYR H H 26 7.693 7.693 7.979 -0.286 25767 10297 1 12 . 1 1 27 27 LEU N N 27 118.657 118.657 117.050 1.607 25767 10298 1 12 . 1 1 27 27 LEU HA H 27 4.311 4.311 3.975 0.336 25767 10299 1 12 . 1 1 27 27 LEU CA C 27 58.297 58.297 58.271 0.026 25767 10300 1 12 . 1 1 27 27 LEU CB C 27 42.723 42.723 40.681 2.042 25767 10301 1 12 . 1 1 27 27 LEU H H 27 8.339 8.339 8.055 0.284 25767 10302 1 12 . 1 1 28 28 GLN N N 28 118.593 118.593 118.312 0.281 25767 10303 1 12 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.874 -0.223 25767 10304 1 12 . 1 1 28 28 GLN C C 28 177.282 177.282 178.665 -1.383 25767 10305 1 12 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.657 0.171 25767 10306 1 12 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.232 1.416 25767 10307 1 12 . 1 1 28 28 GLN H H 28 7.970 7.970 7.744 0.226 25767 10308 1 12 . 1 1 29 29 LEU N N 29 122.111 122.111 119.652 2.459 25767 10309 1 12 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.711 0.233 25767 10310 1 12 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.583 1.083 25767 10311 1 12 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.154 0.854 25767 10312 1 12 . 1 1 29 29 LEU H H 29 7.979 7.979 7.450 0.529 25767 10313 1 12 . 1 1 30 30 TYR N N 30 119.283 119.283 120.467 -1.184 25767 10314 1 12 . 1 1 30 30 TYR C C 30 175.775 175.775 177.452 -1.677 25767 10315 1 12 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.843 -1.750 25767 10316 1 12 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.296 0.777 25767 10317 1 12 . 1 1 30 30 TYR H H 30 8.093 8.093 7.588 0.505 25767 10318 1 12 . 1 1 31 31 ALA N N 31 121.327 121.327 121.933 -0.606 25767 10319 1 12 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.807 -0.439 25767 10320 1 12 . 1 1 31 31 ALA C C 31 178.955 178.955 178.909 0.046 25767 10321 1 12 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.243 0.304 25767 10322 1 12 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.218 -0.255 25767 10323 1 12 . 1 1 31 31 ALA H H 31 8.394 8.394 8.342 0.052 25767 10324 1 12 . 1 1 32 32 VAL N N 32 116.757 116.757 118.953 -2.196 25767 10325 1 12 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.544 -0.284 25767 10326 1 12 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.860 1.802 25767 10327 1 12 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.635 -0.664 25767 10328 1 12 . 1 1 32 32 VAL H H 32 8.020 8.020 7.581 0.439 25767 10329 1 12 . 1 1 33 33 GLU N N 33 118.775 118.775 119.951 -1.176 25767 10330 1 12 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.843 0.146 25767 10331 1 12 . 1 1 33 33 GLU C C 33 179.746 179.746 178.686 1.060 25767 10332 1 12 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.360 0.643 25767 10333 1 12 . 1 1 33 33 GLU H H 33 7.358 7.358 7.702 -0.344 25767 10334 1 12 . 1 1 34 34 LEU N N 34 120.632 120.632 120.320 0.312 25767 10335 1 12 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.796 -0.147 25767 10336 1 12 . 1 1 34 34 LEU C C 34 180.336 180.336 178.178 2.158 25767 10337 1 12 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.740 -0.065 25767 10338 1 12 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.765 -0.177 25767 10339 1 12 . 1 1 34 34 LEU H H 34 8.390 8.390 7.697 0.693 25767 10340 1 12 . 1 1 35 35 ILE N N 35 121.240 121.240 118.367 2.873 25767 10341 1 12 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.517 0.025 25767 10342 1 12 . 1 1 35 35 ILE C C 35 178.604 178.604 178.561 0.043 25767 10343 1 12 . 1 1 35 35 ILE CA C 35 65.547 65.547 65.170 0.377 25767 10344 1 12 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.739 0.992 25767 10345 1 12 . 1 1 35 35 ILE H H 35 8.129 8.129 7.397 0.732 25767 10346 1 12 . 1 1 36 36 LEU N N 36 115.637 115.637 119.112 -3.475 25767 10347 1 12 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.016 -0.008 25767 10348 1 12 . 1 1 36 36 LEU C C 36 178.001 178.001 178.140 -0.139 25767 10349 1 12 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.139 -1.063 25767 10350 1 12 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.449 -1.515 25767 10351 1 12 . 1 1 36 36 LEU H H 36 8.416 8.416 7.947 0.469 25767 10352 1 12 . 1 1 37 37 SER N N 37 114.106 114.106 110.481 3.625 25767 10353 1 12 . 1 1 37 37 SER HA H 37 3.991 3.991 4.332 -0.341 25767 10354 1 12 . 1 1 37 37 SER C C 37 173.997 173.997 174.354 -0.357 25767 10355 1 12 . 1 1 37 37 SER CA C 37 60.311 60.311 58.786 1.525 25767 10356 1 12 . 1 1 37 37 SER CB C 37 63.746 63.746 63.456 0.290 25767 10357 1 12 . 1 1 37 37 SER H H 37 7.517 7.517 7.685 -0.168 25767 10358 1 12 . 1 1 38 38 GLU N N 38 123.003 123.003 121.548 1.455 25767 10359 1 12 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.333 0.036 25767 10360 1 12 . 1 1 38 38 GLU C C 38 175.780 175.780 176.087 -0.307 25767 10361 1 12 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.629 -0.264 25767 10362 1 12 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.974 -0.681 25767 10363 1 12 . 1 1 38 38 GLU H H 38 7.151 7.151 7.436 -0.285 25767 10364 1 12 . 1 1 39 39 GLU N N 39 126.166 126.166 122.523 3.643 25767 10365 1 12 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.123 -0.114 25767 10366 1 12 . 1 1 39 39 GLU C C 39 176.652 176.652 175.983 0.669 25767 10367 1 12 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.566 1.632 25767 10368 1 12 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.353 -0.318 25767 10369 1 12 . 1 1 39 39 GLU H H 39 8.587 8.587 8.367 0.220 25767 10370 1 12 . 1 1 40 40 ASP N N 40 120.047 120.047 121.420 -1.373 25767 10371 1 12 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.437 0.113 25767 10372 1 12 . 1 1 40 40 ASP C C 40 175.035 175.035 175.883 -0.848 25767 10373 1 12 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.182 -1.814 25767 10374 1 12 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.777 -0.754 25767 10375 1 12 . 1 1 40 40 ASP H H 40 8.504 8.504 8.508 -0.004 25767 10376 1 12 . 1 1 41 41 ARG N N 41 120.671 120.671 124.770 -4.099 25767 10377 1 12 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.641 -0.252 25767 10378 1 12 . 1 1 41 41 ARG C C 41 175.755 175.755 175.471 0.284 25767 10379 1 12 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.448 0.560 25767 10380 1 12 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.333 -0.784 25767 10381 1 12 . 1 1 41 41 ARG H H 41 7.672 7.672 8.323 -0.651 25767 10382 1 12 . 1 1 42 42 SER N N 42 120.330 120.330 116.378 3.952 25767 10383 1 12 . 1 1 42 42 SER HA H 42 3.837 3.837 4.340 -0.503 25767 10384 1 12 . 1 1 42 42 SER CA C 42 57.326 57.326 58.823 -1.497 25767 10385 1 12 . 1 1 42 42 SER CB C 42 65.762 65.762 63.987 1.775 25767 10386 1 12 . 1 1 42 42 SER H H 42 8.544 8.544 8.260 0.284 25767 10387 1 12 . 1 1 43 43 GLN HA H 43 3.989 3.989 4.017 -0.028 25767 10388 1 12 . 1 1 43 43 GLN C C 43 178.907 178.907 178.124 0.783 25767 10389 1 12 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.850 0.520 25767 10390 1 12 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.600 -0.637 25767 10391 1 12 . 1 1 44 44 GLU N N 44 120.328 120.328 119.660 0.668 25767 10392 1 12 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.942 0.071 25767 10393 1 12 . 1 1 44 44 GLU C C 44 179.824 179.824 178.840 0.984 25767 10394 1 12 . 1 1 44 44 GLU CA C 44 60.045 60.045 58.959 1.086 25767 10395 1 12 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.186 -0.538 25767 10396 1 12 . 1 1 44 44 GLU H H 44 8.938 8.938 7.857 1.081 25767 10397 1 12 . 1 1 45 45 MET N N 45 121.030 121.030 118.663 2.367 25767 10398 1 12 . 1 1 45 45 MET HA H 45 4.412 4.412 4.264 0.148 25767 10399 1 12 . 1 1 45 45 MET C C 45 180.357 180.357 177.913 2.444 25767 10400 1 12 . 1 1 45 45 MET CA C 45 57.209 57.209 57.895 -0.687 25767 10401 1 12 . 1 1 45 45 MET CB C 45 32.436 32.436 32.345 0.091 25767 10402 1 12 . 1 1 45 45 MET H H 45 7.756 7.756 7.671 0.085 25767 10403 1 12 . 1 1 46 46 THR N N 46 120.008 120.008 116.593 3.415 25767 10404 1 12 . 1 1 46 46 THR HA H 46 4.071 4.071 3.855 0.216 25767 10405 1 12 . 1 1 46 46 THR CA C 46 67.096 67.096 67.404 -0.308 25767 10406 1 12 . 1 1 46 46 THR CB C 46 68.954 68.954 68.261 0.693 25767 10407 1 12 . 1 1 46 46 THR H H 46 8.187 8.187 7.478 0.709 25767 10408 1 12 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.139 -0.030 25767 10409 1 12 . 1 1 47 47 ALA C C 47 180.118 180.118 179.030 1.088 25767 10410 1 12 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.802 0.537 25767 10411 1 12 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.342 -0.510 25767 10412 1 12 . 1 1 47 47 ALA H H 47 8.238 8.238 8.351 -0.113 25767 10413 1 12 . 1 1 48 48 LEU N N 48 122.093 122.093 120.627 1.466 25767 10414 1 12 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.044 0.219 25767 10415 1 12 . 1 1 48 48 LEU C C 48 179.103 179.103 178.609 0.494 25767 10416 1 12 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.535 0.205 25767 10417 1 12 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.689 -0.893 25767 10418 1 12 . 1 1 48 48 LEU H H 48 7.778 7.778 7.543 0.235 25767 10419 1 12 . 1 1 49 49 ALA N N 49 120.130 120.130 120.529 -0.399 25767 10420 1 12 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.962 -0.241 25767 10421 1 12 . 1 1 49 49 ALA C C 49 178.676 178.676 179.471 -0.795 25767 10422 1 12 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.403 0.318 25767 10423 1 12 . 1 1 49 49 ALA CB C 49 17.827 17.827 17.994 -0.167 25767 10424 1 12 . 1 1 49 49 ALA H H 49 8.432 8.432 8.135 0.297 25767 10425 1 12 . 1 1 50 50 THR N N 50 113.333 113.333 115.080 -1.747 25767 10426 1 12 . 1 1 50 50 THR HA H 50 3.895 3.895 3.884 0.011 25767 10427 1 12 . 1 1 50 50 THR C C 50 174.948 174.948 176.523 -1.575 25767 10428 1 12 . 1 1 50 50 THR CA C 50 67.334 67.334 66.779 0.555 25767 10429 1 12 . 1 1 50 50 THR CB C 50 68.864 68.864 68.205 0.659 25767 10430 1 12 . 1 1 50 50 THR H H 50 7.857 7.857 7.719 0.138 25767 10431 1 12 . 1 1 51 51 GLU N N 51 122.698 122.698 121.996 0.702 25767 10432 1 12 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.025 0.043 25767 10433 1 12 . 1 1 51 51 GLU C C 51 179.997 179.997 178.598 1.399 25767 10434 1 12 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.226 0.207 25767 10435 1 12 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.567 -0.050 25767 10436 1 12 . 1 1 51 51 GLU H H 51 7.817 7.817 7.606 0.211 25767 10437 1 12 . 1 1 52 52 LEU N N 52 121.100 121.100 121.270 -0.170 25767 10438 1 12 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.041 0.088 25767 10439 1 12 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.819 0.070 25767 10440 1 12 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.718 0.229 25767 10441 1 12 . 1 1 52 52 LEU H H 52 8.628 8.628 7.613 1.015 25767 10442 1 12 . 1 1 53 53 LEU N N 53 119.935 119.935 119.767 0.168 25767 10443 1 12 . 1 1 53 53 LEU C C 53 179.671 179.671 178.298 1.373 25767 10444 1 12 . 1 1 53 53 LEU H H 53 8.303 8.303 7.683 0.620 25767 10445 1 12 . 1 1 54 54 ASP N N 54 120.339 120.339 118.907 1.432 25767 10446 1 12 . 1 1 54 54 ASP C C 54 179.106 179.106 178.349 0.757 25767 10447 1 12 . 1 1 54 54 ASP H H 54 7.901 7.901 7.954 -0.053 25767 10448 1 12 . 1 1 55 55 THR N N 55 120.237 120.237 116.893 3.344 25767 10449 1 12 . 1 1 55 55 THR HA H 55 3.696 3.696 4.071 -0.375 25767 10450 1 12 . 1 1 55 55 THR CA C 55 67.340 67.340 66.590 0.750 25767 10451 1 12 . 1 1 55 55 THR CB C 55 68.151 68.151 68.389 -0.238 25767 10452 1 12 . 1 1 55 55 THR H H 55 8.262 8.262 7.809 0.453 25767 10453 1 12 . 1 1 56 56 ILE N N 56 123.953 123.953 122.039 1.914 25767 10454 1 12 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.665 0.178 25767 10455 1 12 . 1 1 56 56 ILE CA C 56 65.894 65.894 66.076 -0.183 25767 10456 1 12 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.584 0.549 25767 10457 1 12 . 1 1 56 56 ILE H H 56 8.930 8.930 7.681 1.249 25767 10458 1 12 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.805 -0.224 25767 10459 1 12 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.146 -0.115 25767 10460 1 12 . 1 1 58 58 ALA C C 58 179.875 179.875 179.456 0.419 25767 10461 1 12 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.767 0.499 25767 10462 1 12 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.331 -0.346 25767 10463 1 12 . 1 1 58 58 ALA H H 58 7.764 7.764 8.675 -0.911 25767 10464 1 12 . 1 1 59 59 PHE N N 59 121.988 121.988 120.161 1.827 25767 10465 1 12 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.171 0.055 25767 10466 1 12 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.333 0.106 25767 10467 1 12 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.357 0.006 25767 10468 1 12 . 1 1 59 59 PHE H H 59 8.159 8.159 8.593 -0.434 25767 10469 1 12 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.895 -0.354 25767 10470 1 12 . 1 1 60 60 LYS C C 60 179.438 179.438 178.782 0.656 25767 10471 1 12 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.587 0.550 25767 10472 1 12 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.466 -0.408 25767 10473 1 12 . 1 1 61 61 LYS N N 61 119.262 119.262 117.659 1.603 25767 10474 1 12 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.175 -0.230 25767 10475 1 12 . 1 1 61 61 LYS C C 61 178.730 178.730 177.162 1.568 25767 10476 1 12 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.440 1.602 25767 10477 1 12 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.115 0.527 25767 10478 1 12 . 1 1 61 61 LYS H H 61 7.832 7.832 7.719 0.113 25767 10479 1 12 . 1 1 62 62 GLU N N 62 120.790 120.790 118.756 2.034 25767 10480 1 12 . 1 1 62 62 GLU HA H 62 3.935 3.935 4.046 -0.111 25767 10481 1 12 . 1 1 62 62 GLU C C 62 178.424 178.424 177.852 0.572 25767 10482 1 12 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.529 0.185 25767 10483 1 12 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.508 -0.278 25767 10484 1 12 . 1 1 62 62 GLU H H 62 7.982 7.982 7.971 0.011 25767 10485 1 12 . 1 1 63 63 ILE N N 63 118.463 118.463 116.820 1.643 25767 10486 1 12 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.929 -0.240 25767 10487 1 12 . 1 1 63 63 ILE C C 63 177.555 177.555 177.110 0.445 25767 10488 1 12 . 1 1 63 63 ILE CA C 63 61.499 61.499 62.742 -1.243 25767 10489 1 12 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.844 -2.320 25767 10490 1 12 . 1 1 63 63 ILE H H 63 7.732 7.732 7.304 0.428 25767 10491 1 12 . 1 1 64 64 GLY N N 64 107.973 107.973 106.805 1.168 25767 10492 1 12 . 1 1 64 64 GLY C C 64 175.271 175.271 175.384 -0.113 25767 10493 1 12 . 1 1 64 64 GLY CA C 64 45.902 45.902 45.838 0.064 25767 10494 1 12 . 1 1 64 64 GLY H H 64 7.661 7.661 8.127 -0.466 25767 10495 1 12 . 1 1 65 65 GLY N N 65 108.464 108.464 107.498 0.966 25767 10496 1 12 . 1 1 65 65 GLY C C 65 174.800 174.800 175.549 -0.749 25767 10497 1 12 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.384 0.262 25767 10498 1 12 . 1 1 65 65 GLY H H 65 7.808 7.808 8.231 -0.423 25767 10499 1 12 . 1 1 66 66 GLU N N 66 121.162 121.162 120.601 0.561 25767 10500 1 12 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.145 -0.040 25767 10501 1 12 . 1 1 66 66 GLU C C 66 177.230 177.230 178.170 -0.940 25767 10502 1 12 . 1 1 66 66 GLU CA C 66 57.224 57.224 58.347 -1.123 25767 10503 1 12 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.660 0.332 25767 10504 1 12 . 1 1 66 66 GLU H H 66 8.203 8.203 7.732 0.471 25767 10505 1 12 . 1 1 67 67 SER N N 67 116.468 116.468 114.772 1.696 25767 10506 1 12 . 1 1 67 67 SER HA H 67 4.249 4.249 4.176 0.073 25767 10507 1 12 . 1 1 67 67 SER C C 67 174.640 174.640 176.322 -1.682 25767 10508 1 12 . 1 1 67 67 SER CA C 67 58.930 58.930 60.836 -1.906 25767 10509 1 12 . 1 1 67 67 SER CB C 67 63.912 63.912 62.662 1.250 25767 10510 1 12 . 1 1 67 67 SER H H 67 8.206 8.206 8.258 -0.052 25767 10511 1 12 . 1 1 68 68 GLU N N 68 122.400 122.400 121.604 0.796 25767 10512 1 12 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.135 0.018 25767 10513 1 12 . 1 1 68 68 GLU C C 68 176.349 176.349 178.138 -1.789 25767 10514 1 12 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.880 -2.057 25767 10515 1 12 . 1 1 68 68 GLU CB C 68 29.981 29.981 28.894 1.087 25767 10516 1 12 . 1 1 68 68 GLU H H 68 8.168 8.168 7.562 0.606 25767 10517 1 12 . 1 1 69 69 ALA N N 69 124.342 124.342 122.113 2.229 25767 10518 1 12 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.111 0.077 25767 10519 1 12 . 1 1 69 69 ALA C C 69 178.027 178.027 178.174 -0.147 25767 10520 1 12 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.841 -1.283 25767 10521 1 12 . 1 1 69 69 ALA CB C 69 19.492 19.492 18.974 0.517 25767 10522 1 12 . 1 1 69 69 ALA H H 69 7.939 7.939 7.625 0.314 25767 10523 1 12 . 1 1 70 70 GLU N N 70 121.059 121.059 117.272 3.787 25767 10524 1 12 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.547 -0.433 25767 10525 1 12 . 1 1 70 70 GLU C C 70 176.519 176.519 175.912 0.607 25767 10526 1 12 . 1 1 70 70 GLU CA C 70 57.304 57.304 53.906 3.398 25767 10527 1 12 . 1 1 70 70 GLU CB C 70 29.827 29.827 31.030 -1.203 25767 10528 1 12 . 1 1 70 70 GLU H H 70 8.430 8.430 8.073 0.357 25767 10529 1 12 . 1 1 71 71 ASP N N 71 120.274 120.274 120.812 -0.538 25767 10530 1 12 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.337 0.195 25767 10531 1 12 . 1 1 71 71 ASP C C 71 176.369 176.369 178.113 -1.744 25767 10532 1 12 . 1 1 71 71 ASP CA C 71 54.251 54.251 57.014 -2.764 25767 10533 1 12 . 1 1 71 71 ASP CB C 71 40.840 40.840 40.137 0.703 25767 10534 1 12 . 1 1 71 71 ASP H H 71 8.305 8.305 8.905 -0.600 25767 10535 1 12 . 1 1 72 72 SER N N 72 116.165 116.165 115.375 0.790 25767 10536 1 12 . 1 1 72 72 SER HA H 72 4.241 4.241 4.073 0.168 25767 10537 1 12 . 1 1 72 72 SER C C 72 174.567 174.567 176.015 -1.448 25767 10538 1 12 . 1 1 72 72 SER CA C 72 59.031 59.031 61.274 -2.243 25767 10539 1 12 . 1 1 72 72 SER CB C 72 64.040 64.040 62.979 1.061 25767 10540 1 12 . 1 1 72 72 SER H H 72 7.964 7.964 8.137 -0.173 25767 10541 1 12 . 1 1 73 73 ASP N N 73 122.440 122.440 121.201 1.239 25767 10542 1 12 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.332 0.202 25767 10543 1 12 . 1 1 73 73 ASP C C 73 176.882 176.882 178.107 -1.225 25767 10544 1 12 . 1 1 73 73 ASP CA C 73 54.443 54.443 56.854 -2.411 25767 10545 1 12 . 1 1 73 73 ASP CB C 73 41.336 41.336 40.749 0.587 25767 10546 1 12 . 1 1 73 73 ASP H H 73 8.392 8.392 8.488 -0.096 25767 10547 1 12 . 1 1 74 74 LYS N N 74 123.270 123.270 119.624 3.646 25767 10548 1 12 . 1 1 74 74 LYS HA H 74 4.093 4.093 3.943 0.150 25767 10549 1 12 . 1 1 74 74 LYS C C 74 177.608 177.608 178.768 -1.160 25767 10550 1 12 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.680 -2.215 25767 10551 1 12 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.311 -0.165 25767 10552 1 12 . 1 1 74 74 LYS H H 74 8.317 8.317 8.038 0.279 25767 10553 1 12 . 1 1 75 75 SER N N 75 116.557 116.557 116.242 0.315 25767 10554 1 12 . 1 1 75 75 SER HA H 75 4.197 4.197 4.218 -0.021 25767 10555 1 12 . 1 1 75 75 SER C C 75 175.988 175.988 176.752 -0.764 25767 10556 1 12 . 1 1 75 75 SER CA C 75 60.434 60.434 61.800 -1.366 25767 10557 1 12 . 1 1 75 75 SER CB C 75 63.172 63.172 62.471 0.701 25767 10558 1 12 . 1 1 75 75 SER H H 75 8.387 8.387 7.673 0.714 25767 10559 1 12 . 1 1 76 76 LEU N N 76 123.910 123.910 122.620 1.290 25767 10560 1 12 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.997 0.173 25767 10561 1 12 . 1 1 76 76 LEU C C 76 178.083 178.083 178.944 -0.861 25767 10562 1 12 . 1 1 76 76 LEU CA C 76 56.492 56.492 58.189 -1.697 25767 10563 1 12 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.313 0.384 25767 10564 1 12 . 1 1 76 76 LEU H H 76 8.059 8.059 8.269 -0.210 25767 10565 1 12 . 1 1 77 77 HIS N N 77 120.620 120.620 119.038 1.582 25767 10566 1 12 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.219 0.069 25767 10567 1 12 . 1 1 77 77 HIS C C 77 177.667 177.667 177.650 0.017 25767 10568 1 12 . 1 1 77 77 HIS CA C 77 58.422 58.422 60.126 -1.704 25767 10569 1 12 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.789 0.475 25767 10570 1 12 . 1 1 77 77 HIS H H 77 7.936 7.936 7.843 0.093 25767 10571 1 12 . 1 1 78 78 VAL N N 78 121.774 121.774 119.731 2.043 25767 10572 1 12 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.476 0.201 25767 10573 1 12 . 1 1 78 78 VAL CA C 78 65.606 65.606 67.160 -1.554 25767 10574 1 12 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.888 -0.024 25767 10575 1 12 . 1 1 78 78 VAL H H 78 7.916 7.916 7.798 0.118 25767 10576 1 12 . 1 1 79 79 MET N N 79 119.660 119.660 118.539 1.121 25767 10577 1 12 . 1 1 79 79 MET HA H 79 3.925 3.925 3.941 -0.016 25767 10578 1 12 . 1 1 79 79 MET C C 79 177.077 177.077 178.458 -1.381 25767 10579 1 12 . 1 1 79 79 MET CA C 79 58.862 58.862 59.693 -0.831 25767 10580 1 12 . 1 1 79 79 MET CB C 79 32.852 32.852 32.301 0.551 25767 10581 1 12 . 1 1 79 79 MET H H 79 8.149 8.149 8.752 -0.603 25767 10582 1 12 . 1 1 80 80 ASN N N 80 117.337 117.337 118.481 -1.144 25767 10583 1 12 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.782 -0.644 25767 10584 1 12 . 1 1 80 80 ASN C C 80 178.133 178.133 178.454 -0.321 25767 10585 1 12 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.230 0.809 25767 10586 1 12 . 1 1 80 80 ASN CB C 80 38.996 38.996 37.912 1.084 25767 10587 1 12 . 1 1 80 80 ASN H H 80 8.202 8.202 8.902 -0.700 25767 10588 1 12 . 1 1 81 81 THR N N 81 115.517 115.517 118.782 -3.265 25767 10589 1 12 . 1 1 81 81 THR HA H 81 3.896 3.896 4.001 -0.105 25767 10590 1 12 . 1 1 81 81 THR C C 81 175.186 175.186 176.034 -0.848 25767 10591 1 12 . 1 1 81 81 THR CA C 81 66.221 66.221 66.486 -0.265 25767 10592 1 12 . 1 1 81 81 THR CB C 81 69.087 69.087 68.397 0.690 25767 10593 1 12 . 1 1 81 81 THR H H 81 7.944 7.944 7.969 -0.025 25767 10594 1 12 . 1 1 82 82 LEU N N 82 119.074 119.074 120.323 -1.249 25767 10595 1 12 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.050 -0.069 25767 10596 1 12 . 1 1 82 82 LEU C C 82 177.583 177.583 178.165 -0.582 25767 10597 1 12 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.427 -0.887 25767 10598 1 12 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.648 0.145 25767 10599 1 12 . 1 1 82 82 LEU H H 82 7.547 7.547 7.531 0.016 25767 10600 1 12 . 1 1 83 83 ILE N N 83 118.085 118.085 116.017 2.068 25767 10601 1 12 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.509 0.334 25767 10602 1 12 . 1 1 83 83 ILE C C 83 176.413 176.413 177.591 -1.178 25767 10603 1 12 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.699 -0.972 25767 10604 1 12 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.174 -0.476 25767 10605 1 12 . 1 1 83 83 ILE H H 83 7.409 7.409 7.880 -0.471 25767 10606 1 12 . 1 1 84 84 HIS N N 84 116.152 116.152 116.940 -0.788 25767 10607 1 12 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.338 0.257 25767 10608 1 12 . 1 1 84 84 HIS C C 84 175.707 175.707 175.705 0.002 25767 10609 1 12 . 1 1 84 84 HIS CA C 84 58.628 58.628 58.903 -0.275 25767 10610 1 12 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.101 1.302 25767 10611 1 12 . 1 1 84 84 HIS H H 84 7.194 7.194 8.030 -0.836 25767 10612 1 12 . 1 1 85 85 ASP N N 85 122.322 122.322 119.864 2.458 25767 10613 1 12 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.779 -0.245 25767 10614 1 12 . 1 1 85 85 ASP C C 85 175.580 175.580 176.557 -0.977 25767 10615 1 12 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.921 -0.576 25767 10616 1 12 . 1 1 85 85 ASP CB C 85 41.118 41.118 40.858 0.260 25767 10617 1 12 . 1 1 85 85 ASP H H 85 8.505 8.505 7.763 0.742 25767 10618 1 12 . 1 1 86 86 GLN N N 86 122.783 122.783 125.564 -2.781 25767 10619 1 12 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.080 -0.117 25767 10620 1 12 . 1 1 86 86 GLN C C 86 178.581 178.581 177.851 0.730 25767 10621 1 12 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.529 -1.575 25767 10622 1 12 . 1 1 86 86 GLN CB C 86 28.894 28.894 28.858 0.036 25767 10623 1 12 . 1 1 86 86 GLN H H 86 8.803 8.803 8.980 -0.177 25767 10624 1 12 . 1 1 87 87 GLU N N 87 121.794 121.794 118.852 2.942 25767 10625 1 12 . 1 1 87 87 GLU HA H 87 4.013 4.013 3.975 0.038 25767 10626 1 12 . 1 1 87 87 GLU C C 87 178.290 178.290 179.012 -0.722 25767 10627 1 12 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.883 -0.845 25767 10628 1 12 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.014 -0.034 25767 10629 1 12 . 1 1 87 87 GLU H H 87 8.072 8.072 8.906 -0.834 25767 10630 1 12 . 1 1 88 88 LYS N N 88 119.345 119.345 119.107 0.238 25767 10631 1 12 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.143 -0.388 25767 10632 1 12 . 1 1 88 88 LYS C C 88 180.040 180.040 178.933 1.107 25767 10633 1 12 . 1 1 88 88 LYS CA C 88 59.411 59.411 59.284 0.127 25767 10634 1 12 . 1 1 88 88 LYS CB C 88 32.007 32.007 32.029 -0.022 25767 10635 1 12 . 1 1 88 88 LYS H H 88 7.588 7.588 8.251 -0.663 25767 10636 1 12 . 1 1 89 89 ALA N N 89 123.933 123.933 122.443 1.490 25767 10637 1 12 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.200 -0.461 25767 10638 1 12 . 1 1 89 89 ALA C C 89 177.457 177.457 179.363 -1.906 25767 10639 1 12 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.276 0.694 25767 10640 1 12 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.241 0.415 25767 10641 1 12 . 1 1 89 89 ALA H H 89 8.500 8.500 7.873 0.627 25767 10642 1 12 . 1 1 90 90 LYS N N 90 119.244 119.244 119.901 -0.657 25767 10643 1 12 . 1 1 90 90 LYS HA H 90 4.044 4.044 4.022 0.022 25767 10644 1 12 . 1 1 90 90 LYS C C 90 177.774 177.774 178.815 -1.041 25767 10645 1 12 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.523 -0.445 25767 10646 1 12 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.540 -2.299 25767 10647 1 12 . 1 1 90 90 LYS H H 90 6.845 6.845 8.051 -1.206 25767 10648 1 12 . 1 1 91 91 ILE N N 91 117.718 117.718 117.018 0.700 25767 10649 1 12 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.700 -0.302 25767 10650 1 12 . 1 1 91 91 ILE C C 91 177.670 177.670 177.419 0.251 25767 10651 1 12 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.428 -0.430 25767 10652 1 12 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.099 0.702 25767 10653 1 12 . 1 1 91 91 ILE H H 91 7.293 7.293 7.910 -0.617 25767 10654 1 12 . 1 1 92 92 TYR N N 92 121.868 121.868 121.706 0.162 25767 10655 1 12 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.099 0.024 25767 10656 1 12 . 1 1 92 92 TYR C C 92 178.781 178.781 177.510 1.271 25767 10657 1 12 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.578 -0.936 25767 10658 1 12 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.717 0.504 25767 10659 1 12 . 1 1 92 92 TYR H H 92 8.016 8.016 8.063 -0.047 25767 10660 1 12 . 1 1 93 93 MET N N 93 118.984 118.984 117.636 1.348 25767 10661 1 12 . 1 1 93 93 MET HA H 93 3.952 3.952 4.091 -0.139 25767 10662 1 12 . 1 1 93 93 MET C C 93 179.925 179.925 178.475 1.450 25767 10663 1 12 . 1 1 93 93 MET CA C 93 57.589 57.589 59.290 -1.701 25767 10664 1 12 . 1 1 93 93 MET CB C 93 30.752 30.752 32.556 -1.804 25767 10665 1 12 . 1 1 93 93 MET H H 93 8.464 8.464 8.379 0.085 25767 10666 1 12 . 1 1 94 94 LEU N N 94 125.441 125.441 121.001 4.440 25767 10667 1 12 . 1 1 94 94 LEU HA H 94 3.870 3.870 3.802 0.068 25767 10668 1 12 . 1 1 94 94 LEU C C 94 177.937 177.937 178.833 -0.896 25767 10669 1 12 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.348 0.413 25767 10670 1 12 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.508 0.254 25767 10671 1 12 . 1 1 94 94 LEU H H 94 8.927 8.927 8.028 0.899 25767 10672 1 12 . 1 1 95 95 ASN N N 95 119.066 119.066 117.766 1.300 25767 10673 1 12 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.336 -0.074 25767 10674 1 12 . 1 1 95 95 ASN CA C 95 56.273 56.273 55.970 0.303 25767 10675 1 12 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.189 -0.584 25767 10676 1 12 . 1 1 95 95 ASN H H 95 8.691 8.691 8.133 0.558 25767 10677 1 12 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.532 0.133 25767 10678 1 12 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.568 0.503 25767 10679 1 12 . 1 1 96 96 PHE H H 96 8.317 8.317 8.239 0.078 25767 10680 1 12 . 1 1 97 97 THR N N 97 118.178 118.178 116.644 1.534 25767 10681 1 12 . 1 1 97 97 THR HA H 97 3.338 3.338 3.869 -0.531 25767 10682 1 12 . 1 1 97 97 THR C C 97 176.074 176.074 176.384 -0.310 25767 10683 1 12 . 1 1 97 97 THR CA C 97 67.986 67.986 67.290 0.696 25767 10684 1 12 . 1 1 97 97 THR H H 97 8.214 8.214 8.867 -0.653 25767 10685 1 12 . 1 1 98 98 MET N N 98 120.097 120.097 121.237 -1.140 25767 10686 1 12 . 1 1 98 98 MET HA H 98 4.403 4.403 4.272 0.131 25767 10687 1 12 . 1 1 98 98 MET C C 98 178.696 178.696 177.522 1.174 25767 10688 1 12 . 1 1 98 98 MET CA C 98 57.029 57.029 59.636 -2.607 25767 10689 1 12 . 1 1 98 98 MET CB C 98 29.898 29.898 32.361 -2.463 25767 10690 1 12 . 1 1 98 98 MET H H 98 8.885 8.885 7.985 0.900 25767 10691 1 12 . 1 1 99 99 SER N N 99 114.959 114.959 116.445 -1.486 25767 10692 1 12 . 1 1 99 99 SER HA H 99 4.199 4.199 4.144 0.055 25767 10693 1 12 . 1 1 99 99 SER C C 99 176.565 176.565 176.891 -0.326 25767 10694 1 12 . 1 1 99 99 SER CA C 99 61.965 61.965 61.314 0.651 25767 10695 1 12 . 1 1 99 99 SER CB C 99 62.565 62.565 62.826 -0.261 25767 10696 1 12 . 1 1 99 99 SER H H 99 7.515 7.515 7.690 -0.175 25767 10697 1 12 . 1 1 100 100 LEU N N 100 125.380 125.380 123.227 2.153 25767 10698 1 12 . 1 1 100 100 LEU HA H 100 3.776 3.776 4.004 -0.228 25767 10699 1 12 . 1 1 100 100 LEU C C 100 177.689 177.689 178.750 -1.061 25767 10700 1 12 . 1 1 100 100 LEU CA C 100 58.057 58.057 58.062 -0.005 25767 10701 1 12 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.676 -0.126 25767 10702 1 12 . 1 1 100 100 LEU H H 100 7.400 7.400 8.424 -1.024 25767 10703 1 12 . 1 1 101 101 TYR N N 101 120.597 120.597 119.734 0.863 25767 10704 1 12 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.990 0.126 25767 10705 1 12 . 1 1 101 101 TYR C C 101 176.825 176.825 177.579 -0.754 25767 10706 1 12 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.100 -0.212 25767 10707 1 12 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.425 0.568 25767 10708 1 12 . 1 1 101 101 TYR H H 101 8.880 8.880 8.069 0.811 25767 10709 1 12 . 1 1 102 102 ASN N N 102 116.869 116.869 116.789 0.080 25767 10710 1 12 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.236 -0.070 25767 10711 1 12 . 1 1 102 102 ASN C C 102 179.089 179.089 177.515 1.574 25767 10712 1 12 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.100 0.112 25767 10713 1 12 . 1 1 102 102 ASN CB C 102 37.734 37.734 38.093 -0.359 25767 10714 1 12 . 1 1 102 102 ASN H H 102 8.543 8.543 7.961 0.582 25767 10715 1 12 . 1 1 103 103 GLU N N 103 121.259 121.259 120.224 1.035 25767 10716 1 12 . 1 1 103 103 GLU HA H 103 3.986 3.986 4.014 -0.028 25767 10717 1 12 . 1 1 103 103 GLU C C 103 179.968 179.968 178.950 1.018 25767 10718 1 12 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.412 0.105 25767 10719 1 12 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.359 0.191 25767 10720 1 12 . 1 1 103 103 GLU H H 103 7.872 7.872 7.938 -0.066 25767 10721 1 12 . 1 1 104 104 LYS N N 104 120.268 120.268 118.993 1.275 25767 10722 1 12 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.250 -0.204 25767 10723 1 12 . 1 1 104 104 LYS C C 104 178.355 178.355 179.021 -0.666 25767 10724 1 12 . 1 1 104 104 LYS CA C 104 56.735 56.735 58.429 -1.694 25767 10725 1 12 . 1 1 104 104 LYS CB C 104 29.113 29.113 31.888 -2.775 25767 10726 1 12 . 1 1 104 104 LYS H H 104 8.384 8.384 7.541 0.843 25767 10727 1 12 . 1 1 105 105 LEU N N 105 121.622 121.622 119.356 2.266 25767 10728 1 12 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.744 -0.003 25767 10729 1 12 . 1 1 105 105 LEU C C 105 180.552 180.552 178.766 1.786 25767 10730 1 12 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.354 -0.182 25767 10731 1 12 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.110 -0.080 25767 10732 1 12 . 1 1 105 105 LEU H H 105 8.400 8.400 7.607 0.793 25767 10733 1 12 . 1 1 106 106 LYS N N 106 119.498 119.498 118.699 0.799 25767 10734 1 12 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.893 0.021 25767 10735 1 12 . 1 1 106 106 LYS C C 106 178.419 178.419 179.182 -0.763 25767 10736 1 12 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.926 -0.543 25767 10737 1 12 . 1 1 106 106 LYS CB C 106 31.808 31.808 32.053 -0.246 25767 10738 1 12 . 1 1 106 106 LYS H H 106 7.067 7.067 7.706 -0.639 25767 10739 1 12 . 1 1 107 107 GLN N N 107 121.405 121.405 118.799 2.606 25767 10740 1 12 . 1 1 107 107 GLN HA H 107 3.851 3.851 4.049 -0.198 25767 10741 1 12 . 1 1 107 107 GLN C C 107 177.935 177.935 178.991 -1.056 25767 10742 1 12 . 1 1 107 107 GLN CA C 107 58.481 58.481 59.134 -0.653 25767 10743 1 12 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.734 -1.936 25767 10744 1 12 . 1 1 107 107 GLN H H 107 7.460 7.460 7.977 -0.517 25767 10745 1 12 . 1 1 108 108 LEU N N 108 119.561 119.561 120.098 -0.537 25767 10746 1 12 . 1 1 108 108 LEU HA H 108 3.801 3.801 4.319 -0.518 25767 10747 1 12 . 1 1 108 108 LEU C C 108 179.195 179.195 179.194 0.001 25767 10748 1 12 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.942 0.451 25767 10749 1 12 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.707 -0.441 25767 10750 1 12 . 1 1 108 108 LEU H H 108 8.208 8.208 8.381 -0.173 25767 10751 1 12 . 1 1 109 109 LYS N N 109 118.535 118.535 119.705 -1.170 25767 10752 1 12 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.222 0.030 25767 10753 1 12 . 1 1 109 109 LYS C C 109 177.726 177.726 178.337 -0.611 25767 10754 1 12 . 1 1 109 109 LYS CA C 109 58.730 58.730 59.362 -0.632 25767 10755 1 12 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.586 -0.175 25767 10756 1 12 . 1 1 109 109 LYS H H 109 7.168 7.168 7.867 -0.699 25767 10757 1 12 . 1 1 110 110 ASP N N 110 117.463 117.463 116.311 1.152 25767 10758 1 12 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.804 -0.199 25767 10759 1 12 . 1 1 110 110 ASP C C 110 177.360 177.360 176.601 0.759 25767 10760 1 12 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.467 1.429 25767 10761 1 12 . 1 1 110 110 ASP CB C 110 42.577 42.577 42.214 0.363 25767 10762 1 12 . 1 1 110 110 ASP H H 110 7.861 7.861 8.548 -0.687 25767 10763 1 12 . 1 1 111 111 GLY N N 111 113.059 113.059 108.741 4.318 25767 10764 1 12 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.878 -0.826 25767 10765 1 12 . 1 1 111 111 GLY H H 111 8.479 8.479 7.983 0.496 25767 10766 1 12 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.137 0.326 25767 10767 1 12 . 1 1 112 112 PRO C C 112 175.090 175.090 176.234 -1.144 25767 10768 1 12 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.395 -1.031 25767 10769 1 12 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.631 2.219 25767 10770 1 12 . 1 1 113 113 TRP N N 113 123.164 123.164 120.755 2.409 25767 10771 1 12 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.768 -0.058 25767 10772 1 12 . 1 1 113 113 TRP C C 113 174.605 174.605 175.386 -0.781 25767 10773 1 12 . 1 1 113 113 TRP CA C 113 57.905 57.905 55.764 2.141 25767 10774 1 12 . 1 1 113 113 TRP CB C 113 27.293 27.293 29.582 -2.289 25767 10775 1 12 . 1 1 113 113 TRP H H 113 8.687 8.687 7.553 1.134 25767 10776 1 12 . 1 1 114 114 ASP N N 114 121.356 121.356 121.915 -0.559 25767 10777 1 12 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.868 -0.007 25767 10778 1 12 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.235 0.014 25767 10779 1 12 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.433 -1.292 25767 10780 1 12 . 1 1 114 114 ASP H H 114 6.985 6.985 8.207 -1.222 25767 10781 1 12 . 1 1 115 115 VAL N N 115 118.649 118.649 120.405 -1.756 25767 10782 1 12 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.867 -0.025 25767 10783 1 12 . 1 1 115 115 VAL C C 115 177.739 177.739 177.490 0.249 25767 10784 1 12 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.390 0.179 25767 10785 1 12 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.171 -0.494 25767 10786 1 12 . 1 1 115 115 VAL H H 115 8.206 8.206 8.429 -0.223 25767 10787 1 12 . 1 1 116 116 MET N N 116 120.401 120.401 117.568 2.833 25767 10788 1 12 . 1 1 116 116 MET HA H 116 4.303 4.303 4.184 0.119 25767 10789 1 12 . 1 1 116 116 MET C C 116 179.269 179.269 178.234 1.035 25767 10790 1 12 . 1 1 116 116 MET CA C 116 57.634 57.634 59.119 -1.485 25767 10791 1 12 . 1 1 116 116 MET CB C 116 30.414 30.414 31.960 -1.546 25767 10792 1 12 . 1 1 116 116 MET H H 116 7.642 7.642 8.152 -0.510 25767 10793 1 12 . 1 1 117 117 LEU N N 117 125.503 125.503 119.375 6.128 25767 10794 1 12 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.025 0.220 25767 10795 1 12 . 1 1 117 117 LEU C C 117 178.445 178.445 178.993 -0.548 25767 10796 1 12 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.654 0.546 25767 10797 1 12 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.112 -1.023 25767 10798 1 12 . 1 1 117 117 LEU H H 117 8.157 8.157 7.764 0.393 25767 10799 1 12 . 1 1 118 118 LYS N N 118 119.052 119.052 119.524 -0.472 25767 10800 1 12 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.921 -0.116 25767 10801 1 12 . 1 1 118 118 LYS C C 118 178.251 178.251 179.329 -1.078 25767 10802 1 12 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.021 0.505 25767 10803 1 12 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.138 -0.010 25767 10804 1 12 . 1 1 118 118 LYS H H 118 7.400 7.400 7.522 -0.122 25767 10805 1 12 . 1 1 119 119 ARG N N 119 117.999 117.999 119.498 -1.499 25767 10806 1 12 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.305 -0.085 25767 10807 1 12 . 1 1 119 119 ARG C C 119 180.441 180.441 179.077 1.364 25767 10808 1 12 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.610 0.207 25767 10809 1 12 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.261 -0.176 25767 10810 1 12 . 1 1 119 119 ARG H H 119 8.265 8.265 8.036 0.229 25767 10811 1 12 . 1 1 120 120 SER N N 120 118.073 118.073 116.274 1.799 25767 10812 1 12 . 1 1 120 120 SER HA H 120 4.182 4.182 4.276 -0.094 25767 10813 1 12 . 1 1 120 120 SER C C 120 176.215 176.215 176.539 -0.324 25767 10814 1 12 . 1 1 120 120 SER CA C 120 62.817 62.817 62.340 0.477 25767 10815 1 12 . 1 1 120 120 SER CB C 120 63.550 63.550 63.112 0.438 25767 10816 1 12 . 1 1 120 120 SER H H 120 8.633 8.633 7.949 0.684 25767 10817 1 12 . 1 1 121 121 LEU N N 121 125.029 125.029 123.204 1.825 25767 10818 1 12 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.064 0.155 25767 10819 1 12 . 1 1 121 121 LEU C C 121 179.679 179.679 177.439 2.240 25767 10820 1 12 . 1 1 121 121 LEU CA C 121 58.849 58.849 58.232 0.617 25767 10821 1 12 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.621 -0.847 25767 10822 1 12 . 1 1 121 121 LEU H H 121 8.313 8.313 7.954 0.359 25767 10823 1 12 . 1 1 122 122 TRP N N 122 120.217 120.217 119.368 0.849 25767 10824 1 12 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.335 0.005 25767 10825 1 12 . 1 1 122 122 TRP C C 122 177.527 177.527 178.697 -1.170 25767 10826 1 12 . 1 1 122 122 TRP CA C 122 61.758 61.758 61.190 0.568 25767 10827 1 12 . 1 1 122 122 TRP CB C 122 29.648 29.648 28.957 0.691 25767 10828 1 12 . 1 1 122 122 TRP H H 122 7.928 7.928 7.967 -0.039 25767 10829 1 12 . 1 1 123 123 CYS N N 123 119.669 119.669 118.844 0.825 25767 10830 1 12 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.364 -0.157 25767 10831 1 12 . 1 1 123 123 CYS C C 123 177.057 177.057 177.251 -0.194 25767 10832 1 12 . 1 1 123 123 CYS CA C 123 62.600 62.600 62.745 -0.145 25767 10833 1 12 . 1 1 123 123 CYS CB C 123 25.899 25.899 26.274 -0.375 25767 10834 1 12 . 1 1 123 123 CYS H H 123 8.273 8.273 8.189 0.084 25767 10835 1 12 . 1 1 124 124 CYS N N 124 116.898 116.898 119.549 -2.651 25767 10836 1 12 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.166 -0.318 25767 10837 1 12 . 1 1 124 124 CYS C C 124 175.759 175.759 177.045 -1.286 25767 10838 1 12 . 1 1 124 124 CYS CA C 124 65.653 65.653 64.375 1.278 25767 10839 1 12 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.162 0.355 25767 10840 1 12 . 1 1 124 124 CYS H H 124 8.122 8.122 7.938 0.184 25767 10841 1 12 . 1 1 125 125 ILE N N 125 120.498 120.498 121.238 -0.740 25767 10842 1 12 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.821 -0.233 25767 10843 1 12 . 1 1 125 125 ILE C C 125 179.337 179.337 177.493 1.844 25767 10844 1 12 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.797 1.797 25767 10845 1 12 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.378 0.301 25767 10846 1 12 . 1 1 125 125 ILE H H 125 8.092 8.092 8.284 -0.192 25767 10847 1 12 . 1 1 126 126 ASP N N 126 125.084 125.084 120.563 4.521 25767 10848 1 12 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.421 0.196 25767 10849 1 12 . 1 1 126 126 ASP C C 126 178.299 178.299 178.920 -0.621 25767 10850 1 12 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.501 1.503 25767 10851 1 12 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.059 0.237 25767 10852 1 12 . 1 1 126 126 ASP H H 126 9.049 9.049 8.302 0.747 25767 10853 1 12 . 1 1 127 127 LEU N N 127 122.591 122.591 120.056 2.535 25767 10854 1 12 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.871 -0.004 25767 10855 1 12 . 1 1 127 127 LEU C C 127 179.655 179.655 178.890 0.765 25767 10856 1 12 . 1 1 127 127 LEU CA C 127 58.661 58.661 57.960 0.701 25767 10857 1 12 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.572 0.622 25767 10858 1 12 . 1 1 127 127 LEU H H 127 8.888 8.888 7.642 1.246 25767 10859 1 12 . 1 1 128 128 PHE N N 128 117.498 117.498 118.687 -1.189 25767 10860 1 12 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.085 0.237 25767 10861 1 12 . 1 1 128 128 PHE C C 128 178.533 178.533 178.303 0.230 25767 10862 1 12 . 1 1 128 128 PHE CA C 128 60.932 60.932 62.500 -1.568 25767 10863 1 12 . 1 1 128 128 PHE CB C 128 39.053 39.053 38.408 0.645 25767 10864 1 12 . 1 1 128 128 PHE H H 128 8.947 8.947 7.910 1.037 25767 10865 1 12 . 1 1 129 129 SER N N 129 115.398 115.398 115.494 -0.096 25767 10866 1 12 . 1 1 129 129 SER HA H 129 4.046 4.046 4.338 -0.292 25767 10867 1 12 . 1 1 129 129 SER C C 129 175.168 175.168 177.130 -1.962 25767 10868 1 12 . 1 1 129 129 SER CA C 129 63.015 63.015 61.899 1.116 25767 10869 1 12 . 1 1 129 129 SER H H 129 8.578 8.578 8.520 0.058 25767 10870 1 12 . 1 1 130 130 CYS N N 130 125.556 125.556 120.686 4.870 25767 10871 1 12 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.206 -0.097 25767 10872 1 12 . 1 1 130 130 CYS C C 130 175.294 175.294 177.247 -1.953 25767 10873 1 12 . 1 1 130 130 CYS CA C 130 61.438 61.438 64.380 -2.942 25767 10874 1 12 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.877 -0.827 25767 10875 1 12 . 1 1 130 130 CYS H H 130 8.289 8.289 8.078 0.211 25767 10876 1 12 . 1 1 131 131 ILE N N 131 120.232 120.232 121.672 -1.440 25767 10877 1 12 . 1 1 131 131 ILE HA H 131 4.033 4.033 4.003 0.030 25767 10878 1 12 . 1 1 131 131 ILE C C 131 177.297 177.297 178.709 -1.412 25767 10879 1 12 . 1 1 131 131 ILE CA C 131 64.652 64.652 66.083 -1.431 25767 10880 1 12 . 1 1 131 131 ILE CB C 131 39.102 39.102 38.008 1.094 25767 10881 1 12 . 1 1 131 131 ILE H H 131 7.943 7.943 8.428 -0.485 25767 10882 1 12 . 1 1 132 132 LEU N N 132 116.422 116.422 119.228 -2.806 25767 10883 1 12 . 1 1 132 132 LEU HA H 132 3.845 3.845 4.015 -0.170 25767 10884 1 12 . 1 1 132 132 LEU C C 132 177.816 177.816 179.175 -1.359 25767 10885 1 12 . 1 1 132 132 LEU CA C 132 57.078 57.078 58.020 -0.942 25767 10886 1 12 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.584 0.629 25767 10887 1 12 . 1 1 132 132 LEU H H 132 7.846 7.846 8.454 -0.608 25767 10888 1 12 . 1 1 133 133 HIS N N 133 116.929 116.929 119.111 -2.182 25767 10889 1 12 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.275 -0.136 25767 10890 1 12 . 1 1 133 133 HIS C C 133 178.669 178.669 177.339 1.330 25767 10891 1 12 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.867 -0.131 25767 10892 1 12 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.633 2.519 25767 10893 1 12 . 1 1 133 133 HIS H H 133 7.822 7.822 8.283 -0.461 25767 10894 1 12 . 1 1 134 134 LEU N N 134 116.898 116.898 119.878 -2.980 25767 10895 1 12 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.199 -0.466 25767 10896 1 12 . 1 1 134 134 LEU C C 134 179.402 179.402 179.007 0.395 25767 10897 1 12 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.772 -0.545 25767 10898 1 12 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.166 -2.627 25767 10899 1 12 . 1 1 134 134 LEU H H 134 8.688 8.688 8.189 0.499 25767 10900 1 12 . 1 1 135 135 TRP N N 135 115.602 115.602 117.803 -2.201 25767 10901 1 12 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.617 0.391 25767 10902 1 12 . 1 1 135 135 TRP C C 135 175.022 175.022 177.934 -2.912 25767 10903 1 12 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.424 1.002 25767 10904 1 12 . 1 1 135 135 TRP CB C 135 27.085 27.085 28.954 -1.869 25767 10905 1 12 . 1 1 135 135 TRP H H 135 7.638 7.638 8.474 -0.836 25767 10906 1 12 . 1 1 136 136 LYS N N 136 119.721 119.721 122.979 -3.258 25767 10907 1 12 . 1 1 136 136 LYS HA H 136 3.816 3.816 4.029 -0.213 25767 10908 1 12 . 1 1 136 136 LYS C C 136 178.279 178.279 178.437 -0.158 25767 10909 1 12 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.214 0.979 25767 10910 1 12 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.775 1.282 25767 10911 1 12 . 1 1 136 136 LYS H H 136 6.538 6.538 8.236 -1.698 25767 10912 1 12 . 1 1 137 137 GLU N N 137 115.407 115.407 116.263 -0.856 25767 10913 1 12 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.135 0.032 25767 10914 1 12 . 1 1 137 137 GLU C C 137 176.700 176.700 177.290 -0.590 25767 10915 1 12 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.615 -0.765 25767 10916 1 12 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.085 0.075 25767 10917 1 12 . 1 1 137 137 GLU H H 137 8.596 8.596 8.200 0.396 25767 10918 1 12 . 1 1 138 138 ASN N N 138 116.669 116.669 116.487 0.182 25767 10919 1 12 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.853 0.053 25767 10920 1 12 . 1 1 138 138 ASN C C 138 173.481 173.481 174.846 -1.365 25767 10921 1 12 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.876 -1.062 25767 10922 1 12 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.761 1.076 25767 10923 1 12 . 1 1 138 138 ASN H H 138 8.343 8.343 8.264 0.079 25767 10924 1 12 . 1 1 139 139 ILE N N 139 120.703 120.703 120.389 0.314 25767 10925 1 12 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.347 -0.003 25767 10926 1 12 . 1 1 139 139 ILE C C 139 175.241 175.241 175.434 -0.193 25767 10927 1 12 . 1 1 139 139 ILE CA C 139 60.792 60.792 58.436 2.356 25767 10928 1 12 . 1 1 139 139 ILE CB C 139 40.274 40.274 38.452 1.822 25767 10929 1 12 . 1 1 139 139 ILE H H 139 7.167 7.167 7.596 -0.429 25767 10930 1 12 . 1 1 140 140 SER N N 140 123.284 123.284 121.418 1.866 25767 10931 1 12 . 1 1 140 140 SER HA H 140 4.345 4.345 4.529 -0.184 25767 10932 1 12 . 1 1 140 140 SER CA C 140 58.095 58.095 57.412 0.683 25767 10933 1 12 . 1 1 140 140 SER CB C 140 65.370 65.370 64.791 0.579 25767 10934 1 12 . 1 1 140 140 SER H H 140 8.727 8.727 8.467 0.260 25767 10935 1 12 . 1 1 142 142 THR N N 142 113.868 113.868 114.851 -0.983 25767 10936 1 12 . 1 1 142 142 THR HA H 142 3.976 3.976 4.081 -0.105 25767 10937 1 12 . 1 1 142 142 THR C C 142 177.559 177.559 176.877 0.682 25767 10938 1 12 . 1 1 142 142 THR CA C 142 66.007 66.007 65.701 0.306 25767 10939 1 12 . 1 1 142 142 THR CB C 142 68.530 68.530 68.115 0.415 25767 10940 1 12 . 1 1 142 142 THR H H 142 8.243 8.243 8.030 0.213 25767 10941 1 12 . 1 1 143 143 SER N N 143 120.786 120.786 117.760 3.026 25767 10942 1 12 . 1 1 143 143 SER C C 143 175.844 175.844 176.596 -0.752 25767 10943 1 12 . 1 1 143 143 SER CA C 143 62.102 62.102 61.822 0.280 25767 10944 1 12 . 1 1 143 143 SER CB C 143 63.086 63.086 62.680 0.406 25767 10945 1 12 . 1 1 143 143 SER H H 143 7.915 7.915 8.497 -0.582 25767 10946 1 12 . 1 1 144 144 THR N N 144 120.946 120.946 117.923 3.023 25767 10947 1 12 . 1 1 144 144 THR HA H 144 4.299 4.299 4.075 0.224 25767 10948 1 12 . 1 1 144 144 THR C C 144 175.874 175.874 176.271 -0.397 25767 10949 1 12 . 1 1 144 144 THR CA C 144 67.487 67.487 66.640 0.847 25767 10950 1 12 . 1 1 144 144 THR CB C 144 68.485 68.485 68.479 0.006 25767 10951 1 12 . 1 1 144 144 THR H H 144 8.746 8.746 8.568 0.178 25767 10952 1 12 . 1 1 145 145 ASN N N 145 120.069 120.069 119.933 0.136 25767 10953 1 12 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.370 -0.062 25767 10954 1 12 . 1 1 145 145 ASN C C 145 177.917 177.917 177.719 0.198 25767 10955 1 12 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.606 -0.269 25767 10956 1 12 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.574 -0.474 25767 10957 1 12 . 1 1 145 145 ASN H H 145 7.940 7.940 7.878 0.062 25767 10958 1 12 . 1 1 146 146 SER N N 146 116.905 116.905 116.992 -0.087 25767 10959 1 12 . 1 1 146 146 SER HA H 146 3.936 3.936 4.104 -0.168 25767 10960 1 12 . 1 1 146 146 SER C C 146 176.963 176.963 176.449 0.514 25767 10961 1 12 . 1 1 146 146 SER CA C 146 61.997 61.997 62.651 -0.653 25767 10962 1 12 . 1 1 146 146 SER CB C 146 62.879 62.879 63.105 -0.226 25767 10963 1 12 . 1 1 146 146 SER H H 146 7.951 7.951 7.815 0.136 25767 10964 1 12 . 1 1 147 147 LEU N N 147 123.253 123.253 121.532 1.721 25767 10965 1 12 . 1 1 147 147 LEU HA H 147 3.875 3.875 3.910 -0.035 25767 10966 1 12 . 1 1 147 147 LEU C C 147 178.726 178.726 179.072 -0.346 25767 10967 1 12 . 1 1 147 147 LEU CA C 147 58.580 58.580 57.739 0.841 25767 10968 1 12 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.567 -0.707 25767 10969 1 12 . 1 1 147 147 LEU H H 147 8.168 8.168 7.704 0.464 25767 10970 1 12 . 1 1 148 148 GLN N N 148 118.212 118.212 117.773 0.439 25767 10971 1 12 . 1 1 148 148 GLN HA H 148 3.817 3.817 4.023 -0.206 25767 10972 1 12 . 1 1 148 148 GLN C C 148 179.686 179.686 178.239 1.447 25767 10973 1 12 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.226 1.017 25767 10974 1 12 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.694 0.026 25767 10975 1 12 . 1 1 148 148 GLN H H 148 8.295 8.295 8.675 -0.380 25767 10976 1 12 . 1 1 149 149 LYS N N 149 120.770 120.770 120.716 0.054 25767 10977 1 12 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.908 -0.007 25767 10978 1 12 . 1 1 149 149 LYS C C 149 178.006 178.006 178.841 -0.835 25767 10979 1 12 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.550 -0.018 25767 10980 1 12 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.356 -0.464 25767 10981 1 12 . 1 1 149 149 LYS H H 149 7.955 7.955 8.378 -0.423 25767 10982 1 12 . 1 1 150 150 ARG N N 150 119.244 119.244 118.466 0.778 25767 10983 1 12 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.950 -0.110 25767 10984 1 12 . 1 1 150 150 ARG C C 150 178.858 178.858 178.901 -0.043 25767 10985 1 12 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.187 0.184 25767 10986 1 12 . 1 1 150 150 ARG CB C 150 28.804 28.804 30.025 -1.221 25767 10987 1 12 . 1 1 150 150 ARG H H 150 7.020 7.020 7.647 -0.627 25767 10988 1 12 . 1 1 151 151 ILE N N 151 121.183 121.183 120.078 1.105 25767 10989 1 12 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.449 -0.090 25767 10990 1 12 . 1 1 151 151 ILE C C 151 177.327 177.327 177.774 -0.447 25767 10991 1 12 . 1 1 151 151 ILE CA C 151 67.196 67.196 64.901 2.295 25767 10992 1 12 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.507 0.765 25767 10993 1 12 . 1 1 151 151 ILE H H 151 7.574 7.574 7.692 -0.118 25767 10994 1 12 . 1 1 152 152 LYS N N 152 119.521 119.521 120.741 -1.220 25767 10995 1 12 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.848 -0.075 25767 10996 1 12 . 1 1 152 152 LYS C C 152 178.016 178.016 178.465 -0.449 25767 10997 1 12 . 1 1 152 152 LYS CA C 152 59.830 59.830 59.946 -0.116 25767 10998 1 12 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.225 -0.644 25767 10999 1 12 . 1 1 152 152 LYS H H 152 7.629 7.629 8.161 -0.532 25767 11000 1 12 . 1 1 153 153 TYR N N 153 120.178 120.178 120.432 -0.254 25767 11001 1 12 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.105 -0.033 25767 11002 1 12 . 1 1 153 153 TYR C C 153 178.195 178.195 177.842 0.353 25767 11003 1 12 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.792 -0.476 25767 11004 1 12 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.303 -1.030 25767 11005 1 12 . 1 1 153 153 TYR H H 153 8.407 8.407 7.792 0.615 25767 11006 1 12 . 1 1 154 154 CYS N N 154 117.013 117.013 118.396 -1.383 25767 11007 1 12 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.249 -0.177 25767 11008 1 12 . 1 1 154 154 CYS C C 154 176.827 176.827 176.974 -0.147 25767 11009 1 12 . 1 1 154 154 CYS CA C 154 65.780 65.780 62.959 2.821 25767 11010 1 12 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.312 0.848 25767 11011 1 12 . 1 1 154 154 CYS H H 154 8.291 8.291 7.726 0.565 25767 11012 1 12 . 1 1 155 155 LYS N N 155 118.753 118.753 120.582 -1.829 25767 11013 1 12 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.842 -0.171 25767 11014 1 12 . 1 1 155 155 LYS C C 155 179.904 179.904 179.052 0.852 25767 11015 1 12 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.606 0.878 25767 11016 1 12 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.234 -0.291 25767 11017 1 12 . 1 1 155 155 LYS H H 155 7.934 7.934 7.979 -0.045 25767 11018 1 12 . 1 1 156 156 ILE N N 156 123.873 123.873 121.044 2.829 25767 11019 1 12 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.601 -0.017 25767 11020 1 12 . 1 1 156 156 ILE C C 156 179.501 179.501 178.006 1.495 25767 11021 1 12 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.622 -0.382 25767 11022 1 12 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.897 -0.255 25767 11023 1 12 . 1 1 156 156 ILE H H 156 8.314 8.314 8.532 -0.218 25767 11024 1 12 . 1 1 157 157 TYR N N 157 121.132 121.132 119.469 1.663 25767 11025 1 12 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.949 0.216 25767 11026 1 12 . 1 1 157 157 TYR C C 157 178.558 178.558 177.632 0.926 25767 11027 1 12 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.688 0.422 25767 11028 1 12 . 1 1 157 157 TYR H H 157 8.442 8.442 7.777 0.665 25767 11029 1 12 . 1 1 158 158 LEU N N 158 120.964 120.964 119.747 1.217 25767 11030 1 12 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.749 0.163 25767 11031 1 12 . 1 1 158 158 LEU C C 158 180.130 180.130 178.696 1.434 25767 11032 1 12 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.733 0.953 25767 11033 1 12 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.579 0.151 25767 11034 1 12 . 1 1 158 158 LEU H H 158 8.469 8.469 7.970 0.499 25767 11035 1 12 . 1 1 159 159 SER N N 159 116.653 116.653 115.015 1.638 25767 11036 1 12 . 1 1 159 159 SER HA H 159 4.246 4.246 4.049 0.197 25767 11037 1 12 . 1 1 159 159 SER CA C 159 61.460 61.460 62.124 -0.664 25767 11038 1 12 . 1 1 159 159 SER CB C 159 62.849 62.849 62.621 0.228 25767 11039 1 12 . 1 1 159 159 SER H H 159 7.758 7.758 8.381 -0.623 25767 11040 1 12 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.327 -1.954 25767 11041 1 12 . 1 1 160 160 LYS CB C 160 29.832 29.832 31.980 -2.147 25767 11042 1 12 . 1 1 160 160 LYS H H 160 8.425 8.425 7.317 1.108 25767 11043 1 12 . 1 1 161 161 LEU N N 161 121.686 121.686 118.672 3.014 25767 11044 1 12 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.810 0.353 25767 11045 1 12 . 1 1 161 161 LEU C C 161 180.224 180.224 179.083 1.141 25767 11046 1 12 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.569 0.014 25767 11047 1 12 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.395 0.067 25767 11048 1 12 . 1 1 161 161 LEU H H 161 8.323 8.323 7.375 0.948 25767 11049 1 12 . 1 1 162 162 ALA N N 162 123.102 123.102 121.330 1.772 25767 11050 1 12 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.053 0.077 25767 11051 1 12 . 1 1 162 162 ALA C C 162 179.487 179.487 179.248 0.239 25767 11052 1 12 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.749 -0.005 25767 11053 1 12 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.404 -0.001 25767 11054 1 12 . 1 1 162 162 ALA H H 162 7.978 7.978 7.784 0.194 25767 11055 1 12 . 1 1 163 163 LYS N N 163 116.069 116.069 116.246 -0.177 25767 11056 1 12 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.313 -0.090 25767 11057 1 12 . 1 1 163 163 LYS C C 163 176.987 176.987 176.550 0.437 25767 11058 1 12 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.139 0.467 25767 11059 1 12 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.715 0.491 25767 11060 1 12 . 1 1 163 163 LYS H H 163 7.697 7.697 7.825 -0.128 25767 11061 1 12 . 1 1 164 164 GLY N N 164 108.540 108.540 107.365 1.175 25767 11062 1 12 . 1 1 164 164 GLY C C 164 174.721 174.721 174.011 0.710 25767 11063 1 12 . 1 1 164 164 GLY CA C 164 45.791 45.791 45.051 0.740 25767 11064 1 12 . 1 1 164 164 GLY H H 164 7.772 7.772 7.742 0.030 25767 11065 1 12 . 1 1 165 165 GLU N N 165 119.886 119.886 120.349 -0.463 25767 11066 1 12 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.398 -0.348 25767 11067 1 12 . 1 1 165 165 GLU C C 165 176.027 176.027 174.442 1.585 25767 11068 1 12 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.117 1.736 25767 11069 1 12 . 1 1 165 165 GLU CB C 165 30.338 30.338 31.887 -1.549 25767 11070 1 12 . 1 1 165 165 GLU H H 165 8.065 8.065 7.865 0.200 25767 11071 1 12 . 1 1 166 166 ILE N N 166 117.926 117.926 121.272 -3.346 25767 11072 1 12 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.878 0.024 25767 11073 1 12 . 1 1 166 166 ILE C C 166 174.138 174.138 175.134 -0.996 25767 11074 1 12 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.878 1.577 25767 11075 1 12 . 1 1 166 166 ILE CB C 166 40.202 40.202 40.015 0.187 25767 11076 1 12 . 1 1 166 166 ILE H H 166 7.282 7.282 8.112 -0.830 25767 11077 1 13 . 1 1 2 2 ALA N N 2 122.811 122.811 122.388 0.423 25767 11078 1 13 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.097 -0.074 25767 11079 1 13 . 1 1 2 2 ALA C C 2 179.915 179.915 179.497 0.418 25767 11080 1 13 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.541 -0.424 25767 11081 1 13 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.895 -0.356 25767 11082 1 13 . 1 1 2 2 ALA H H 2 8.509 8.509 9.190 -0.681 25767 11083 1 13 . 1 1 3 3 SER N N 3 115.308 115.308 114.343 0.965 25767 11084 1 13 . 1 1 3 3 SER HA H 3 4.097 4.097 3.996 0.101 25767 11085 1 13 . 1 1 3 3 SER C C 3 176.706 176.706 176.348 0.358 25767 11086 1 13 . 1 1 3 3 SER CA C 3 60.665 60.665 62.055 -1.390 25767 11087 1 13 . 1 1 3 3 SER CB C 3 62.710 62.710 62.858 -0.148 25767 11088 1 13 . 1 1 3 3 SER H H 3 7.996 7.996 8.765 -0.769 25767 11089 1 13 . 1 1 4 4 ASN N N 4 122.688 122.688 120.017 2.671 25767 11090 1 13 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.353 -0.049 25767 11091 1 13 . 1 1 4 4 ASN C C 4 176.258 176.258 176.932 -0.674 25767 11092 1 13 . 1 1 4 4 ASN CA C 4 55.701 55.701 56.062 -0.361 25767 11093 1 13 . 1 1 4 4 ASN CB C 4 38.177 38.177 38.100 0.077 25767 11094 1 13 . 1 1 4 4 ASN H H 4 8.075 8.075 8.259 -0.184 25767 11095 1 13 . 1 1 5 5 ALA N N 5 121.900 121.900 122.851 -0.951 25767 11096 1 13 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.026 -0.451 25767 11097 1 13 . 1 1 5 5 ALA C C 5 178.475 178.475 178.978 -0.503 25767 11098 1 13 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.996 0.837 25767 11099 1 13 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.402 -0.787 25767 11100 1 13 . 1 1 5 5 ALA H H 5 8.659 8.659 7.671 0.988 25767 11101 1 13 . 1 1 6 6 ALA N N 6 117.768 117.768 121.639 -3.871 25767 11102 1 13 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.998 -0.211 25767 11103 1 13 . 1 1 6 6 ALA C C 6 180.494 180.494 179.445 1.049 25767 11104 1 13 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.096 0.254 25767 11105 1 13 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.010 -0.108 25767 11106 1 13 . 1 1 6 6 ALA H H 6 7.864 7.864 7.822 0.042 25767 11107 1 13 . 1 1 7 7 ARG N N 7 121.173 121.173 119.238 1.935 25767 11108 1 13 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.103 -0.200 25767 11109 1 13 . 1 1 7 7 ARG C C 7 179.189 179.189 178.711 0.478 25767 11110 1 13 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.862 0.450 25767 11111 1 13 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.964 -0.742 25767 11112 1 13 . 1 1 7 7 ARG H H 7 7.514 7.514 8.003 -0.489 25767 11113 1 13 . 1 1 8 8 VAL N N 8 122.979 122.979 119.854 3.125 25767 11114 1 13 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.863 -0.610 25767 11115 1 13 . 1 1 8 8 VAL C C 8 177.821 177.821 178.396 -0.575 25767 11116 1 13 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.652 1.120 25767 11117 1 13 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.444 -0.003 25767 11118 1 13 . 1 1 8 8 VAL H H 8 8.101 8.101 7.812 0.289 25767 11119 1 13 . 1 1 9 9 VAL N N 9 119.801 119.801 120.713 -0.912 25767 11120 1 13 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.709 -0.443 25767 11121 1 13 . 1 1 9 9 VAL C C 9 177.373 177.373 177.715 -0.342 25767 11122 1 13 . 1 1 9 9 VAL CA C 9 67.484 67.484 65.765 1.719 25767 11123 1 13 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.604 1.021 25767 11124 1 13 . 1 1 9 9 VAL H H 9 8.362 8.362 7.945 0.417 25767 11125 1 13 . 1 1 10 10 ALA N N 10 122.360 122.360 121.393 0.967 25767 11126 1 13 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.047 -0.111 25767 11127 1 13 . 1 1 10 10 ALA C C 10 180.762 180.762 179.552 1.210 25767 11128 1 13 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.624 -0.180 25767 11129 1 13 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.196 -0.459 25767 11130 1 13 . 1 1 10 10 ALA H H 10 7.776 7.776 7.804 -0.028 25767 11131 1 13 . 1 1 11 11 THR N N 11 117.376 117.376 112.438 4.938 25767 11132 1 13 . 1 1 11 11 THR HA H 11 3.816 3.816 3.943 -0.127 25767 11133 1 13 . 1 1 11 11 THR C C 11 175.775 175.775 176.492 -0.717 25767 11134 1 13 . 1 1 11 11 THR CA C 11 66.509 66.509 65.541 0.968 25767 11135 1 13 . 1 1 11 11 THR CB C 11 68.588 68.588 68.772 -0.184 25767 11136 1 13 . 1 1 11 11 THR H H 11 8.180 8.180 7.706 0.474 25767 11137 1 13 . 1 1 12 12 ALA N N 12 125.308 125.308 125.341 -0.033 25767 11138 1 13 . 1 1 12 12 ALA HA H 12 3.997 3.997 4.154 -0.157 25767 11139 1 13 . 1 1 12 12 ALA C C 12 179.399 179.399 179.593 -0.194 25767 11140 1 13 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.696 0.380 25767 11141 1 13 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.395 0.849 25767 11142 1 13 . 1 1 12 12 ALA H H 12 8.671 8.671 8.509 0.162 25767 11143 1 13 . 1 1 13 13 LYS N N 13 116.977 116.977 117.259 -0.282 25767 11144 1 13 . 1 1 13 13 LYS C C 13 179.646 179.646 178.564 1.082 25767 11145 1 13 . 1 1 13 13 LYS CA C 13 58.921 58.921 60.086 -1.165 25767 11146 1 13 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.172 -0.730 25767 11147 1 13 . 1 1 13 13 LYS H H 13 8.061 8.061 7.969 0.092 25767 11148 1 13 . 1 1 14 14 ASP N N 14 121.988 121.988 120.312 1.676 25767 11149 1 13 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.364 -0.011 25767 11150 1 13 . 1 1 14 14 ASP C C 14 179.446 179.446 178.466 0.980 25767 11151 1 13 . 1 1 14 14 ASP CA C 14 57.509 57.509 56.846 0.663 25767 11152 1 13 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.330 -0.328 25767 11153 1 13 . 1 1 14 14 ASP H H 14 7.669 7.669 7.637 0.032 25767 11154 1 13 . 1 1 15 15 PHE N N 15 119.588 119.588 118.230 1.358 25767 11155 1 13 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.190 0.154 25767 11156 1 13 . 1 1 15 15 PHE C C 15 178.373 178.373 177.992 0.381 25767 11157 1 13 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.747 0.490 25767 11158 1 13 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.731 -1.235 25767 11159 1 13 . 1 1 15 15 PHE H H 15 7.913 7.913 8.346 -0.433 25767 11160 1 13 . 1 1 16 16 ASP N N 16 121.705 121.705 119.684 2.021 25767 11161 1 13 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.464 -0.469 25767 11162 1 13 . 1 1 16 16 ASP C C 16 180.071 180.071 179.475 0.596 25767 11163 1 13 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.227 0.922 25767 11164 1 13 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.655 0.832 25767 11165 1 13 . 1 1 16 16 ASP H H 16 8.324 8.324 7.999 0.325 25767 11166 1 13 . 1 1 17 17 LYS N N 17 118.825 118.825 119.910 -1.085 25767 11167 1 13 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.090 -0.053 25767 11168 1 13 . 1 1 17 17 LYS C C 17 178.407 178.407 177.918 0.489 25767 11169 1 13 . 1 1 17 17 LYS CA C 17 59.061 59.061 59.011 0.050 25767 11170 1 13 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.570 0.014 25767 11171 1 13 . 1 1 17 17 LYS H H 17 7.834 7.834 7.760 0.074 25767 11172 1 13 . 1 1 18 18 VAL N N 18 110.562 110.562 116.771 -6.209 25767 11173 1 13 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.103 0.413 25767 11174 1 13 . 1 1 18 18 VAL C C 18 176.144 176.144 176.445 -0.301 25767 11175 1 13 . 1 1 18 18 VAL CA C 18 60.874 60.874 62.897 -2.023 25767 11176 1 13 . 1 1 18 18 VAL CB C 18 31.160 31.160 31.740 -0.580 25767 11177 1 13 . 1 1 18 18 VAL H H 18 7.185 7.185 7.413 -0.228 25767 11178 1 13 . 1 1 19 19 GLY N N 19 109.272 109.272 106.729 2.543 25767 11179 1 13 . 1 1 19 19 GLY C C 19 175.043 175.043 175.102 -0.059 25767 11180 1 13 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.652 0.179 25767 11181 1 13 . 1 1 19 19 GLY H H 19 7.723 7.723 7.724 -0.001 25767 11182 1 13 . 1 1 20 20 LEU N N 20 125.428 125.428 122.902 2.526 25767 11183 1 13 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.709 -0.389 25767 11184 1 13 . 1 1 20 20 LEU C C 20 177.949 177.949 177.204 0.745 25767 11185 1 13 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.225 -0.421 25767 11186 1 13 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.882 0.035 25767 11187 1 13 . 1 1 20 20 LEU H H 20 8.083 8.083 8.245 -0.162 25767 11188 1 13 . 1 1 21 21 GLY N N 21 107.804 107.804 109.897 -2.093 25767 11189 1 13 . 1 1 21 21 GLY C C 21 176.278 176.278 176.278 0.000 25767 11190 1 13 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.655 -0.361 25767 11191 1 13 . 1 1 21 21 GLY H H 21 7.982 7.982 7.887 0.095 25767 11192 1 13 . 1 1 22 22 ILE N N 22 121.319 121.319 122.355 -1.036 25767 11193 1 13 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.854 0.056 25767 11194 1 13 . 1 1 22 22 ILE C C 22 176.604 176.604 177.929 -1.325 25767 11195 1 13 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.478 -2.032 25767 11196 1 13 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.830 -1.264 25767 11197 1 13 . 1 1 22 22 ILE H H 22 8.478 8.478 7.927 0.551 25767 11198 1 13 . 1 1 23 23 ILE N N 23 120.377 120.377 119.741 0.636 25767 11199 1 13 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.678 0.035 25767 11200 1 13 . 1 1 23 23 ILE C C 23 178.581 178.581 178.173 0.408 25767 11201 1 13 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.044 1.202 25767 11202 1 13 . 1 1 23 23 ILE CB C 23 36.199 36.199 35.724 0.476 25767 11203 1 13 . 1 1 23 23 ILE H H 23 6.869 6.869 7.661 -0.792 25767 11204 1 13 . 1 1 24 24 GLY N N 24 103.449 103.449 108.028 -4.579 25767 11205 1 13 . 1 1 24 24 GLY C C 24 175.308 175.308 175.912 -0.604 25767 11206 1 13 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.254 0.689 25767 11207 1 13 . 1 1 24 24 GLY H H 24 7.488 7.488 7.841 -0.353 25767 11208 1 13 . 1 1 25 25 TYR N N 25 124.685 124.685 123.766 0.919 25767 11209 1 13 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.749 -0.083 25767 11210 1 13 . 1 1 25 25 TYR C C 25 176.208 176.208 176.699 -0.491 25767 11211 1 13 . 1 1 25 25 TYR CA C 25 61.371 61.371 61.592 -0.221 25767 11212 1 13 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.211 0.056 25767 11213 1 13 . 1 1 25 25 TYR H H 25 7.931 7.931 8.209 -0.278 25767 11214 1 13 . 1 1 26 26 TYR N N 26 117.001 117.001 119.987 -2.986 25767 11215 1 13 . 1 1 26 26 TYR HA H 26 3.941 3.941 3.966 -0.025 25767 11216 1 13 . 1 1 26 26 TYR C C 26 178.753 178.753 177.466 1.287 25767 11217 1 13 . 1 1 26 26 TYR CA C 26 64.260 64.260 62.010 2.250 25767 11218 1 13 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.731 -1.210 25767 11219 1 13 . 1 1 26 26 TYR H H 26 7.693 7.693 7.949 -0.256 25767 11220 1 13 . 1 1 27 27 LEU N N 27 118.657 118.657 117.175 1.482 25767 11221 1 13 . 1 1 27 27 LEU HA H 27 4.311 4.311 3.989 0.322 25767 11222 1 13 . 1 1 27 27 LEU CA C 27 58.297 58.297 57.907 0.390 25767 11223 1 13 . 1 1 27 27 LEU CB C 27 42.723 42.723 40.885 1.838 25767 11224 1 13 . 1 1 27 27 LEU H H 27 8.339 8.339 7.862 0.477 25767 11225 1 13 . 1 1 28 28 GLN N N 28 118.593 118.593 119.341 -0.748 25767 11226 1 13 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.906 -0.255 25767 11227 1 13 . 1 1 28 28 GLN C C 28 177.282 177.282 178.196 -0.914 25767 11228 1 13 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.870 -0.041 25767 11229 1 13 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.309 1.339 25767 11230 1 13 . 1 1 28 28 GLN H H 28 7.970 7.970 7.871 0.099 25767 11231 1 13 . 1 1 29 29 LEU N N 29 122.111 122.111 119.395 2.716 25767 11232 1 13 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.709 0.235 25767 11233 1 13 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.572 1.094 25767 11234 1 13 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.241 0.767 25767 11235 1 13 . 1 1 29 29 LEU H H 29 7.979 7.979 7.329 0.650 25767 11236 1 13 . 1 1 30 30 TYR N N 30 119.283 119.283 120.154 -0.871 25767 11237 1 13 . 1 1 30 30 TYR C C 30 175.775 175.775 177.234 -1.459 25767 11238 1 13 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.820 -1.726 25767 11239 1 13 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.283 0.790 25767 11240 1 13 . 1 1 30 30 TYR H H 30 8.093 8.093 7.514 0.579 25767 11241 1 13 . 1 1 31 31 ALA N N 31 121.327 121.327 122.090 -0.763 25767 11242 1 13 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.858 -0.490 25767 11243 1 13 . 1 1 31 31 ALA C C 31 178.955 178.955 178.857 0.098 25767 11244 1 13 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.298 0.249 25767 11245 1 13 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.222 -0.259 25767 11246 1 13 . 1 1 31 31 ALA H H 31 8.394 8.394 8.280 0.114 25767 11247 1 13 . 1 1 32 32 VAL N N 32 116.757 116.757 118.443 -1.686 25767 11248 1 13 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.538 -0.278 25767 11249 1 13 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.755 1.907 25767 11250 1 13 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.655 -0.684 25767 11251 1 13 . 1 1 32 32 VAL H H 32 8.020 8.020 7.552 0.468 25767 11252 1 13 . 1 1 33 33 GLU N N 33 118.775 118.775 119.668 -0.893 25767 11253 1 13 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.792 0.197 25767 11254 1 13 . 1 1 33 33 GLU C C 33 179.746 179.746 178.946 0.800 25767 11255 1 13 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.384 0.619 25767 11256 1 13 . 1 1 33 33 GLU H H 33 7.358 7.358 7.583 -0.225 25767 11257 1 13 . 1 1 34 34 LEU N N 34 120.632 120.632 121.671 -1.039 25767 11258 1 13 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.901 -0.252 25767 11259 1 13 . 1 1 34 34 LEU C C 34 180.336 180.336 178.960 1.376 25767 11260 1 13 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.649 0.026 25767 11261 1 13 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.819 -0.231 25767 11262 1 13 . 1 1 34 34 LEU H H 34 8.390 8.390 7.782 0.608 25767 11263 1 13 . 1 1 35 35 ILE N N 35 121.240 121.240 118.598 2.642 25767 11264 1 13 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.672 -0.130 25767 11265 1 13 . 1 1 35 35 ILE C C 35 178.604 178.604 177.452 1.152 25767 11266 1 13 . 1 1 35 35 ILE CA C 35 65.547 65.547 64.831 0.716 25767 11267 1 13 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.923 0.808 25767 11268 1 13 . 1 1 35 35 ILE H H 35 8.129 8.129 7.460 0.669 25767 11269 1 13 . 1 1 36 36 LEU N N 36 115.637 115.637 116.963 -1.326 25767 11270 1 13 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.104 -0.096 25767 11271 1 13 . 1 1 36 36 LEU C C 36 178.001 178.001 178.368 -0.367 25767 11272 1 13 . 1 1 36 36 LEU CA C 36 56.076 56.076 56.700 -0.624 25767 11273 1 13 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.969 -2.035 25767 11274 1 13 . 1 1 36 36 LEU H H 36 8.416 8.416 7.767 0.649 25767 11275 1 13 . 1 1 37 37 SER N N 37 114.106 114.106 111.915 2.191 25767 11276 1 13 . 1 1 37 37 SER HA H 37 3.991 3.991 4.247 -0.256 25767 11277 1 13 . 1 1 37 37 SER C C 37 173.997 173.997 175.190 -1.193 25767 11278 1 13 . 1 1 37 37 SER CA C 37 60.311 60.311 59.417 0.894 25767 11279 1 13 . 1 1 37 37 SER CB C 37 63.746 63.746 63.616 0.130 25767 11280 1 13 . 1 1 37 37 SER H H 37 7.517 7.517 7.770 -0.253 25767 11281 1 13 . 1 1 38 38 GLU N N 38 123.003 123.003 122.637 0.366 25767 11282 1 13 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.305 0.064 25767 11283 1 13 . 1 1 38 38 GLU C C 38 175.780 175.780 175.844 -0.064 25767 11284 1 13 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.656 -0.290 25767 11285 1 13 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.799 -0.506 25767 11286 1 13 . 1 1 38 38 GLU H H 38 7.151 7.151 7.600 -0.449 25767 11287 1 13 . 1 1 39 39 GLU N N 39 126.166 126.166 122.499 3.667 25767 11288 1 13 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.149 -0.140 25767 11289 1 13 . 1 1 39 39 GLU C C 39 176.652 176.652 175.792 0.860 25767 11290 1 13 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.694 1.504 25767 11291 1 13 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.293 -0.258 25767 11292 1 13 . 1 1 39 39 GLU H H 39 8.587 8.587 8.465 0.122 25767 11293 1 13 . 1 1 40 40 ASP N N 40 120.047 120.047 121.259 -1.212 25767 11294 1 13 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.482 0.068 25767 11295 1 13 . 1 1 40 40 ASP C C 40 175.035 175.035 175.855 -0.820 25767 11296 1 13 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.194 -1.825 25767 11297 1 13 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.790 -0.767 25767 11298 1 13 . 1 1 40 40 ASP H H 40 8.504 8.504 8.585 -0.081 25767 11299 1 13 . 1 1 41 41 ARG N N 41 120.671 120.671 122.587 -1.916 25767 11300 1 13 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.638 -0.249 25767 11301 1 13 . 1 1 41 41 ARG C C 41 175.755 175.755 176.233 -0.478 25767 11302 1 13 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.856 0.152 25767 11303 1 13 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.377 -0.828 25767 11304 1 13 . 1 1 41 41 ARG H H 41 7.672 7.672 8.333 -0.661 25767 11305 1 13 . 1 1 42 42 SER N N 42 120.330 120.330 116.688 3.642 25767 11306 1 13 . 1 1 42 42 SER HA H 42 3.837 3.837 4.404 -0.567 25767 11307 1 13 . 1 1 42 42 SER CA C 42 57.326 57.326 58.887 -1.561 25767 11308 1 13 . 1 1 42 42 SER CB C 42 65.762 65.762 64.501 1.261 25767 11309 1 13 . 1 1 42 42 SER H H 42 8.544 8.544 8.329 0.215 25767 11310 1 13 . 1 1 43 43 GLN HA H 43 3.989 3.989 4.025 -0.036 25767 11311 1 13 . 1 1 43 43 GLN C C 43 178.907 178.907 177.935 0.972 25767 11312 1 13 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.797 0.573 25767 11313 1 13 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.512 -0.549 25767 11314 1 13 . 1 1 44 44 GLU N N 44 120.328 120.328 120.001 0.327 25767 11315 1 13 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.955 0.058 25767 11316 1 13 . 1 1 44 44 GLU C C 44 179.824 179.824 178.641 1.183 25767 11317 1 13 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.168 0.877 25767 11318 1 13 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.390 -0.742 25767 11319 1 13 . 1 1 44 44 GLU H H 44 8.938 8.938 7.828 1.110 25767 11320 1 13 . 1 1 45 45 MET N N 45 121.030 121.030 117.876 3.154 25767 11321 1 13 . 1 1 45 45 MET HA H 45 4.412 4.412 4.252 0.160 25767 11322 1 13 . 1 1 45 45 MET C C 45 180.357 180.357 177.654 2.703 25767 11323 1 13 . 1 1 45 45 MET CA C 45 57.209 57.209 58.922 -1.713 25767 11324 1 13 . 1 1 45 45 MET CB C 45 32.436 32.436 32.293 0.143 25767 11325 1 13 . 1 1 45 45 MET H H 45 7.756 7.756 7.778 -0.022 25767 11326 1 13 . 1 1 46 46 THR N N 46 120.008 120.008 115.860 4.148 25767 11327 1 13 . 1 1 46 46 THR HA H 46 4.071 4.071 3.887 0.184 25767 11328 1 13 . 1 1 46 46 THR CA C 46 67.096 67.096 67.458 -0.362 25767 11329 1 13 . 1 1 46 46 THR CB C 46 68.954 68.954 68.121 0.833 25767 11330 1 13 . 1 1 46 46 THR H H 46 8.187 8.187 7.300 0.887 25767 11331 1 13 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.123 -0.014 25767 11332 1 13 . 1 1 47 47 ALA C C 47 180.118 180.118 179.198 0.920 25767 11333 1 13 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.929 0.410 25767 11334 1 13 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.245 -0.413 25767 11335 1 13 . 1 1 47 47 ALA H H 47 8.238 8.238 7.998 0.240 25767 11336 1 13 . 1 1 48 48 LEU N N 48 122.093 122.093 119.189 2.904 25767 11337 1 13 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.011 0.252 25767 11338 1 13 . 1 1 48 48 LEU C C 48 179.103 179.103 179.294 -0.191 25767 11339 1 13 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.471 0.269 25767 11340 1 13 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.514 -0.717 25767 11341 1 13 . 1 1 48 48 LEU H H 48 7.778 7.778 7.663 0.115 25767 11342 1 13 . 1 1 49 49 ALA N N 49 120.130 120.130 121.722 -1.592 25767 11343 1 13 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.951 -0.230 25767 11344 1 13 . 1 1 49 49 ALA C C 49 178.676 178.676 179.522 -0.846 25767 11345 1 13 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.411 0.310 25767 11346 1 13 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.043 -0.216 25767 11347 1 13 . 1 1 49 49 ALA H H 49 8.432 8.432 8.074 0.358 25767 11348 1 13 . 1 1 50 50 THR N N 50 113.333 113.333 114.942 -1.609 25767 11349 1 13 . 1 1 50 50 THR HA H 50 3.895 3.895 3.902 -0.007 25767 11350 1 13 . 1 1 50 50 THR C C 50 174.948 174.948 176.507 -1.559 25767 11351 1 13 . 1 1 50 50 THR CA C 50 67.334 67.334 66.749 0.585 25767 11352 1 13 . 1 1 50 50 THR CB C 50 68.864 68.864 68.207 0.657 25767 11353 1 13 . 1 1 50 50 THR H H 50 7.857 7.857 7.738 0.119 25767 11354 1 13 . 1 1 51 51 GLU N N 51 122.698 122.698 122.274 0.424 25767 11355 1 13 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.047 0.021 25767 11356 1 13 . 1 1 51 51 GLU C C 51 179.997 179.997 178.874 1.123 25767 11357 1 13 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.501 -0.068 25767 11358 1 13 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.495 0.022 25767 11359 1 13 . 1 1 51 51 GLU H H 51 7.817 7.817 7.593 0.224 25767 11360 1 13 . 1 1 52 52 LEU N N 52 121.100 121.100 119.384 1.716 25767 11361 1 13 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.066 0.063 25767 11362 1 13 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.534 0.355 25767 11363 1 13 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.640 0.307 25767 11364 1 13 . 1 1 52 52 LEU H H 52 8.628 8.628 7.848 0.780 25767 11365 1 13 . 1 1 53 53 LEU N N 53 119.935 119.935 120.383 -0.448 25767 11366 1 13 . 1 1 53 53 LEU C C 53 179.671 179.671 178.324 1.347 25767 11367 1 13 . 1 1 53 53 LEU H H 53 8.303 8.303 7.755 0.548 25767 11368 1 13 . 1 1 54 54 ASP N N 54 120.339 120.339 118.492 1.847 25767 11369 1 13 . 1 1 54 54 ASP C C 54 179.106 179.106 178.330 0.776 25767 11370 1 13 . 1 1 54 54 ASP H H 54 7.901 7.901 7.934 -0.033 25767 11371 1 13 . 1 1 55 55 THR N N 55 120.237 120.237 116.918 3.319 25767 11372 1 13 . 1 1 55 55 THR HA H 55 3.696 3.696 4.069 -0.373 25767 11373 1 13 . 1 1 55 55 THR CA C 55 67.340 67.340 66.565 0.775 25767 11374 1 13 . 1 1 55 55 THR CB C 55 68.151 68.151 68.408 -0.257 25767 11375 1 13 . 1 1 55 55 THR H H 55 8.262 8.262 7.690 0.572 25767 11376 1 13 . 1 1 56 56 ILE N N 56 123.953 123.953 121.904 2.049 25767 11377 1 13 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.645 0.198 25767 11378 1 13 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.928 -0.034 25767 11379 1 13 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.527 0.606 25767 11380 1 13 . 1 1 56 56 ILE H H 56 8.930 8.930 7.743 1.187 25767 11381 1 13 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.410 0.171 25767 11382 1 13 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.170 -0.139 25767 11383 1 13 . 1 1 58 58 ALA C C 58 179.875 179.875 179.371 0.504 25767 11384 1 13 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.728 0.538 25767 11385 1 13 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.376 -0.391 25767 11386 1 13 . 1 1 58 58 ALA H H 58 7.764 7.764 8.342 -0.578 25767 11387 1 13 . 1 1 59 59 PHE N N 59 121.988 121.988 120.062 1.926 25767 11388 1 13 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.157 0.069 25767 11389 1 13 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.581 -0.142 25767 11390 1 13 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.401 -0.039 25767 11391 1 13 . 1 1 59 59 PHE H H 59 8.159 8.159 8.591 -0.432 25767 11392 1 13 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.977 -0.436 25767 11393 1 13 . 1 1 60 60 LYS C C 60 179.438 179.438 178.805 0.633 25767 11394 1 13 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.732 0.404 25767 11395 1 13 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.396 -0.338 25767 11396 1 13 . 1 1 61 61 LYS N N 61 119.262 119.262 117.585 1.677 25767 11397 1 13 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.217 -0.272 25767 11398 1 13 . 1 1 61 61 LYS C C 61 178.730 178.730 178.015 0.715 25767 11399 1 13 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.337 1.705 25767 11400 1 13 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.181 0.461 25767 11401 1 13 . 1 1 61 61 LYS H H 61 7.832 7.832 7.827 0.005 25767 11402 1 13 . 1 1 62 62 GLU N N 62 120.790 120.790 119.959 0.831 25767 11403 1 13 . 1 1 62 62 GLU HA H 62 3.935 3.935 3.932 0.003 25767 11404 1 13 . 1 1 62 62 GLU C C 62 178.424 178.424 178.076 0.348 25767 11405 1 13 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.882 -0.168 25767 11406 1 13 . 1 1 62 62 GLU CB C 62 29.230 29.230 28.820 0.410 25767 11407 1 13 . 1 1 62 62 GLU H H 62 7.982 7.982 7.769 0.213 25767 11408 1 13 . 1 1 63 63 ILE N N 63 118.463 118.463 112.528 5.935 25767 11409 1 13 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.911 -0.222 25767 11410 1 13 . 1 1 63 63 ILE C C 63 177.555 177.555 177.381 0.174 25767 11411 1 13 . 1 1 63 63 ILE CA C 63 61.499 61.499 62.537 -1.038 25767 11412 1 13 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.293 -1.769 25767 11413 1 13 . 1 1 63 63 ILE H H 63 7.732 7.732 7.167 0.565 25767 11414 1 13 . 1 1 64 64 GLY N N 64 107.973 107.973 109.648 -1.675 25767 11415 1 13 . 1 1 64 64 GLY C C 64 175.271 175.271 174.908 0.363 25767 11416 1 13 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.260 -0.358 25767 11417 1 13 . 1 1 64 64 GLY H H 64 7.661 7.661 8.171 -0.510 25767 11418 1 13 . 1 1 65 65 GLY N N 65 108.464 108.464 106.967 1.497 25767 11419 1 13 . 1 1 65 65 GLY C C 65 174.800 174.800 175.338 -0.538 25767 11420 1 13 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.370 0.276 25767 11421 1 13 . 1 1 65 65 GLY H H 65 7.808 7.808 7.860 -0.052 25767 11422 1 13 . 1 1 66 66 GLU N N 66 121.162 121.162 121.060 0.102 25767 11423 1 13 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.055 0.050 25767 11424 1 13 . 1 1 66 66 GLU C C 66 177.230 177.230 178.589 -1.359 25767 11425 1 13 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.405 -2.181 25767 11426 1 13 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.720 0.272 25767 11427 1 13 . 1 1 66 66 GLU H H 66 8.203 8.203 7.889 0.314 25767 11428 1 13 . 1 1 67 67 SER N N 67 116.468 116.468 115.370 1.098 25767 11429 1 13 . 1 1 67 67 SER HA H 67 4.249 4.249 4.186 0.063 25767 11430 1 13 . 1 1 67 67 SER C C 67 174.640 174.640 176.547 -1.907 25767 11431 1 13 . 1 1 67 67 SER CA C 67 58.930 58.930 61.760 -2.830 25767 11432 1 13 . 1 1 67 67 SER CB C 67 63.912 63.912 62.785 1.127 25767 11433 1 13 . 1 1 67 67 SER H H 67 8.206 8.206 8.503 -0.297 25767 11434 1 13 . 1 1 68 68 GLU N N 68 122.400 122.400 120.363 2.037 25767 11435 1 13 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.009 0.144 25767 11436 1 13 . 1 1 68 68 GLU C C 68 176.349 176.349 177.656 -1.307 25767 11437 1 13 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.741 -1.918 25767 11438 1 13 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.293 0.688 25767 11439 1 13 . 1 1 68 68 GLU H H 68 8.168 8.168 8.447 -0.279 25767 11440 1 13 . 1 1 69 69 ALA N N 69 124.342 124.342 120.405 3.937 25767 11441 1 13 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.153 0.035 25767 11442 1 13 . 1 1 69 69 ALA C C 69 178.027 178.027 178.058 -0.031 25767 11443 1 13 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.704 -1.146 25767 11444 1 13 . 1 1 69 69 ALA CB C 69 19.492 19.492 19.277 0.215 25767 11445 1 13 . 1 1 69 69 ALA H H 69 7.939 7.939 7.483 0.456 25767 11446 1 13 . 1 1 70 70 GLU N N 70 121.059 121.059 117.510 3.549 25767 11447 1 13 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.423 -0.309 25767 11448 1 13 . 1 1 70 70 GLU C C 70 176.519 176.519 174.843 1.676 25767 11449 1 13 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.561 1.743 25767 11450 1 13 . 1 1 70 70 GLU CB C 70 29.827 29.827 31.951 -2.124 25767 11451 1 13 . 1 1 70 70 GLU H H 70 8.430 8.430 7.758 0.672 25767 11452 1 13 . 1 1 71 71 ASP N N 71 120.274 120.274 121.584 -1.310 25767 11453 1 13 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.359 0.173 25767 11454 1 13 . 1 1 71 71 ASP C C 71 176.369 176.369 177.066 -0.697 25767 11455 1 13 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.312 -1.062 25767 11456 1 13 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.648 1.192 25767 11457 1 13 . 1 1 71 71 ASP H H 71 8.305 8.305 8.868 -0.563 25767 11458 1 13 . 1 1 72 72 SER N N 72 116.165 116.165 112.908 3.257 25767 11459 1 13 . 1 1 72 72 SER HA H 72 4.241 4.241 4.229 0.012 25767 11460 1 13 . 1 1 72 72 SER C C 72 174.567 174.567 175.873 -1.306 25767 11461 1 13 . 1 1 72 72 SER CA C 72 59.031 59.031 61.365 -2.334 25767 11462 1 13 . 1 1 72 72 SER CB C 72 64.040 64.040 63.247 0.793 25767 11463 1 13 . 1 1 72 72 SER H H 72 7.964 7.964 8.627 -0.663 25767 11464 1 13 . 1 1 73 73 ASP N N 73 122.440 122.440 122.399 0.041 25767 11465 1 13 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.425 0.109 25767 11466 1 13 . 1 1 73 73 ASP C C 73 176.882 176.882 178.208 -1.326 25767 11467 1 13 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.457 -3.014 25767 11468 1 13 . 1 1 73 73 ASP CB C 73 41.336 41.336 39.746 1.590 25767 11469 1 13 . 1 1 73 73 ASP H H 73 8.392 8.392 8.618 -0.226 25767 11470 1 13 . 1 1 74 74 LYS N N 74 123.270 123.270 121.016 2.254 25767 11471 1 13 . 1 1 74 74 LYS HA H 74 4.093 4.093 3.997 0.096 25767 11472 1 13 . 1 1 74 74 LYS C C 74 177.608 177.608 178.360 -0.752 25767 11473 1 13 . 1 1 74 74 LYS CA C 74 57.465 57.465 60.061 -2.596 25767 11474 1 13 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.311 -0.165 25767 11475 1 13 . 1 1 74 74 LYS H H 74 8.317 8.317 8.243 0.074 25767 11476 1 13 . 1 1 75 75 SER N N 75 116.557 116.557 115.882 0.675 25767 11477 1 13 . 1 1 75 75 SER HA H 75 4.197 4.197 4.214 -0.017 25767 11478 1 13 . 1 1 75 75 SER C C 75 175.988 175.988 176.855 -0.867 25767 11479 1 13 . 1 1 75 75 SER CA C 75 60.434 60.434 61.747 -1.313 25767 11480 1 13 . 1 1 75 75 SER CB C 75 63.172 63.172 63.042 0.130 25767 11481 1 13 . 1 1 75 75 SER H H 75 8.387 8.387 7.940 0.447 25767 11482 1 13 . 1 1 76 76 LEU N N 76 123.910 123.910 122.825 1.085 25767 11483 1 13 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.983 0.187 25767 11484 1 13 . 1 1 76 76 LEU C C 76 178.083 178.083 179.127 -1.044 25767 11485 1 13 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.851 -1.359 25767 11486 1 13 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.646 0.051 25767 11487 1 13 . 1 1 76 76 LEU H H 76 8.059 8.059 8.105 -0.046 25767 11488 1 13 . 1 1 77 77 HIS N N 77 120.620 120.620 119.609 1.011 25767 11489 1 13 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.253 0.035 25767 11490 1 13 . 1 1 77 77 HIS C C 77 177.667 177.667 177.714 -0.047 25767 11491 1 13 . 1 1 77 77 HIS CA C 77 58.422 58.422 59.878 -1.456 25767 11492 1 13 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.805 0.459 25767 11493 1 13 . 1 1 77 77 HIS H H 77 7.936 7.936 8.417 -0.481 25767 11494 1 13 . 1 1 78 78 VAL N N 78 121.774 121.774 119.735 2.039 25767 11495 1 13 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.591 0.086 25767 11496 1 13 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.249 -0.643 25767 11497 1 13 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.368 0.496 25767 11498 1 13 . 1 1 78 78 VAL H H 78 7.916 7.916 7.944 -0.028 25767 11499 1 13 . 1 1 79 79 MET N N 79 119.660 119.660 118.440 1.220 25767 11500 1 13 . 1 1 79 79 MET HA H 79 3.925 3.925 3.995 -0.070 25767 11501 1 13 . 1 1 79 79 MET C C 79 177.077 177.077 178.551 -1.474 25767 11502 1 13 . 1 1 79 79 MET CA C 79 58.862 58.862 59.731 -0.869 25767 11503 1 13 . 1 1 79 79 MET CB C 79 32.852 32.852 32.159 0.693 25767 11504 1 13 . 1 1 79 79 MET H H 79 8.149 8.149 8.172 -0.023 25767 11505 1 13 . 1 1 80 80 ASN N N 80 117.337 117.337 117.771 -0.434 25767 11506 1 13 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.794 -0.656 25767 11507 1 13 . 1 1 80 80 ASN C C 80 178.133 178.133 178.407 -0.274 25767 11508 1 13 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.415 0.624 25767 11509 1 13 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.420 0.576 25767 11510 1 13 . 1 1 80 80 ASN H H 80 8.202 8.202 8.722 -0.520 25767 11511 1 13 . 1 1 81 81 THR N N 81 115.517 115.517 118.082 -2.565 25767 11512 1 13 . 1 1 81 81 THR HA H 81 3.896 3.896 4.010 -0.114 25767 11513 1 13 . 1 1 81 81 THR C C 81 175.186 175.186 176.280 -1.094 25767 11514 1 13 . 1 1 81 81 THR CA C 81 66.221 66.221 66.681 -0.460 25767 11515 1 13 . 1 1 81 81 THR CB C 81 69.087 69.087 68.590 0.497 25767 11516 1 13 . 1 1 81 81 THR H H 81 7.944 7.944 8.072 -0.128 25767 11517 1 13 . 1 1 82 82 LEU N N 82 119.074 119.074 120.354 -1.280 25767 11518 1 13 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.081 -0.100 25767 11519 1 13 . 1 1 82 82 LEU C C 82 177.583 177.583 178.256 -0.673 25767 11520 1 13 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.254 -0.714 25767 11521 1 13 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.783 0.010 25767 11522 1 13 . 1 1 82 82 LEU H H 82 7.547 7.547 7.820 -0.273 25767 11523 1 13 . 1 1 83 83 ILE N N 83 118.085 118.085 115.973 2.112 25767 11524 1 13 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.532 0.311 25767 11525 1 13 . 1 1 83 83 ILE C C 83 176.413 176.413 177.414 -1.001 25767 11526 1 13 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.916 -1.189 25767 11527 1 13 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.145 -0.447 25767 11528 1 13 . 1 1 83 83 ILE H H 83 7.409 7.409 7.695 -0.286 25767 11529 1 13 . 1 1 84 84 HIS N N 84 116.152 116.152 115.665 0.487 25767 11530 1 13 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.360 0.235 25767 11531 1 13 . 1 1 84 84 HIS C C 84 175.707 175.707 175.544 0.163 25767 11532 1 13 . 1 1 84 84 HIS CA C 84 58.628 58.628 58.380 0.248 25767 11533 1 13 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.488 0.915 25767 11534 1 13 . 1 1 84 84 HIS H H 84 7.194 7.194 7.872 -0.678 25767 11535 1 13 . 1 1 85 85 ASP N N 85 122.322 122.322 119.394 2.928 25767 11536 1 13 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.728 -0.194 25767 11537 1 13 . 1 1 85 85 ASP C C 85 175.580 175.580 176.602 -1.022 25767 11538 1 13 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.179 0.166 25767 11539 1 13 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.538 -0.421 25767 11540 1 13 . 1 1 85 85 ASP H H 85 8.505 8.505 7.747 0.758 25767 11541 1 13 . 1 1 86 86 GLN N N 86 122.783 122.783 127.442 -4.659 25767 11542 1 13 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.106 -0.143 25767 11543 1 13 . 1 1 86 86 GLN C C 86 178.581 178.581 177.856 0.725 25767 11544 1 13 . 1 1 86 86 GLN CA C 86 57.954 57.954 58.648 -0.694 25767 11545 1 13 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.040 -0.146 25767 11546 1 13 . 1 1 86 86 GLN H H 86 8.803 8.803 8.858 -0.055 25767 11547 1 13 . 1 1 87 87 GLU N N 87 121.794 121.794 119.322 2.472 25767 11548 1 13 . 1 1 87 87 GLU HA H 87 4.013 4.013 3.943 0.070 25767 11549 1 13 . 1 1 87 87 GLU C C 87 178.290 178.290 178.798 -0.508 25767 11550 1 13 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.943 -0.905 25767 11551 1 13 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.208 -0.228 25767 11552 1 13 . 1 1 87 87 GLU H H 87 8.072 8.072 8.306 -0.234 25767 11553 1 13 . 1 1 88 88 LYS N N 88 119.345 119.345 118.146 1.199 25767 11554 1 13 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.108 -0.353 25767 11555 1 13 . 1 1 88 88 LYS C C 88 180.040 180.040 178.782 1.258 25767 11556 1 13 . 1 1 88 88 LYS CA C 88 59.411 59.411 58.680 0.731 25767 11557 1 13 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.646 0.361 25767 11558 1 13 . 1 1 88 88 LYS H H 88 7.588 7.588 7.821 -0.233 25767 11559 1 13 . 1 1 89 89 ALA N N 89 123.933 123.933 122.489 1.444 25767 11560 1 13 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.145 -0.406 25767 11561 1 13 . 1 1 89 89 ALA C C 89 177.457 177.457 179.483 -2.026 25767 11562 1 13 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.240 0.730 25767 11563 1 13 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.236 0.420 25767 11564 1 13 . 1 1 89 89 ALA H H 89 8.500 8.500 7.726 0.774 25767 11565 1 13 . 1 1 90 90 LYS N N 90 119.244 119.244 120.083 -0.839 25767 11566 1 13 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.936 0.108 25767 11567 1 13 . 1 1 90 90 LYS C C 90 177.774 177.774 178.246 -0.472 25767 11568 1 13 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.568 -0.490 25767 11569 1 13 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.483 -2.242 25767 11570 1 13 . 1 1 90 90 LYS H H 90 6.845 6.845 8.008 -1.163 25767 11571 1 13 . 1 1 91 91 ILE N N 91 117.718 117.718 119.844 -2.126 25767 11572 1 13 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.684 -0.286 25767 11573 1 13 . 1 1 91 91 ILE C C 91 177.670 177.670 176.976 0.694 25767 11574 1 13 . 1 1 91 91 ILE CA C 91 63.998 63.998 63.947 0.051 25767 11575 1 13 . 1 1 91 91 ILE CB C 91 37.801 37.801 36.904 0.897 25767 11576 1 13 . 1 1 91 91 ILE H H 91 7.293 7.293 7.775 -0.482 25767 11577 1 13 . 1 1 92 92 TYR N N 92 121.868 121.868 122.072 -0.204 25767 11578 1 13 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.073 0.050 25767 11579 1 13 . 1 1 92 92 TYR C C 92 178.781 178.781 177.775 1.006 25767 11580 1 13 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.507 -0.865 25767 11581 1 13 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.605 0.616 25767 11582 1 13 . 1 1 92 92 TYR H H 92 8.016 8.016 7.770 0.246 25767 11583 1 13 . 1 1 93 93 MET N N 93 118.984 118.984 118.297 0.687 25767 11584 1 13 . 1 1 93 93 MET HA H 93 3.952 3.952 4.047 -0.095 25767 11585 1 13 . 1 1 93 93 MET C C 93 179.925 179.925 178.261 1.664 25767 11586 1 13 . 1 1 93 93 MET CA C 93 57.589 57.589 59.338 -1.749 25767 11587 1 13 . 1 1 93 93 MET CB C 93 30.752 30.752 32.730 -1.978 25767 11588 1 13 . 1 1 93 93 MET H H 93 8.464 8.464 8.366 0.098 25767 11589 1 13 . 1 1 94 94 LEU N N 94 125.441 125.441 121.967 3.474 25767 11590 1 13 . 1 1 94 94 LEU HA H 94 3.870 3.870 4.052 -0.182 25767 11591 1 13 . 1 1 94 94 LEU C C 94 177.937 177.937 178.576 -0.639 25767 11592 1 13 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.142 0.619 25767 11593 1 13 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.617 0.145 25767 11594 1 13 . 1 1 94 94 LEU H H 94 8.927 8.927 8.869 0.058 25767 11595 1 13 . 1 1 95 95 ASN N N 95 119.066 119.066 117.556 1.510 25767 11596 1 13 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.374 -0.112 25767 11597 1 13 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.076 0.197 25767 11598 1 13 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.089 -0.484 25767 11599 1 13 . 1 1 95 95 ASN H H 95 8.691 8.691 8.313 0.378 25767 11600 1 13 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.264 0.401 25767 11601 1 13 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.572 0.499 25767 11602 1 13 . 1 1 96 96 PHE H H 96 8.317 8.317 8.015 0.302 25767 11603 1 13 . 1 1 97 97 THR N N 97 118.178 118.178 115.654 2.524 25767 11604 1 13 . 1 1 97 97 THR HA H 97 3.338 3.338 3.928 -0.590 25767 11605 1 13 . 1 1 97 97 THR C C 97 176.074 176.074 176.731 -0.657 25767 11606 1 13 . 1 1 97 97 THR CA C 97 67.986 67.986 66.282 1.704 25767 11607 1 13 . 1 1 97 97 THR H H 97 8.214 8.214 8.894 -0.680 25767 11608 1 13 . 1 1 98 98 MET N N 98 120.097 120.097 121.622 -1.525 25767 11609 1 13 . 1 1 98 98 MET HA H 98 4.403 4.403 4.125 0.278 25767 11610 1 13 . 1 1 98 98 MET C C 98 178.696 178.696 178.014 0.682 25767 11611 1 13 . 1 1 98 98 MET CA C 98 57.029 57.029 59.181 -2.152 25767 11612 1 13 . 1 1 98 98 MET CB C 98 29.898 29.898 32.471 -2.573 25767 11613 1 13 . 1 1 98 98 MET H H 98 8.885 8.885 8.357 0.528 25767 11614 1 13 . 1 1 99 99 SER N N 99 114.959 114.959 115.671 -0.712 25767 11615 1 13 . 1 1 99 99 SER HA H 99 4.199 4.199 4.110 0.089 25767 11616 1 13 . 1 1 99 99 SER C C 99 176.565 176.565 176.699 -0.134 25767 11617 1 13 . 1 1 99 99 SER CA C 99 61.965 61.965 61.266 0.699 25767 11618 1 13 . 1 1 99 99 SER CB C 99 62.565 62.565 63.186 -0.621 25767 11619 1 13 . 1 1 99 99 SER H H 99 7.515 7.515 7.848 -0.333 25767 11620 1 13 . 1 1 100 100 LEU N N 100 125.380 125.380 123.609 1.771 25767 11621 1 13 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.868 -0.092 25767 11622 1 13 . 1 1 100 100 LEU C C 100 177.689 177.689 178.033 -0.344 25767 11623 1 13 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.229 0.828 25767 11624 1 13 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.520 0.030 25767 11625 1 13 . 1 1 100 100 LEU H H 100 7.400 7.400 8.413 -1.013 25767 11626 1 13 . 1 1 101 101 TYR N N 101 120.597 120.597 119.574 1.023 25767 11627 1 13 . 1 1 101 101 TYR HA H 101 4.116 4.116 4.002 0.114 25767 11628 1 13 . 1 1 101 101 TYR C C 101 176.825 176.825 177.420 -0.595 25767 11629 1 13 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.063 -0.175 25767 11630 1 13 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.298 0.695 25767 11631 1 13 . 1 1 101 101 TYR H H 101 8.880 8.880 8.649 0.231 25767 11632 1 13 . 1 1 102 102 ASN N N 102 116.869 116.869 116.887 -0.018 25767 11633 1 13 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.209 -0.043 25767 11634 1 13 . 1 1 102 102 ASN C C 102 179.089 179.089 177.331 1.758 25767 11635 1 13 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.069 0.143 25767 11636 1 13 . 1 1 102 102 ASN CB C 102 37.734 37.734 38.063 -0.329 25767 11637 1 13 . 1 1 102 102 ASN H H 102 8.543 8.543 7.968 0.575 25767 11638 1 13 . 1 1 103 103 GLU N N 103 121.259 121.259 120.148 1.111 25767 11639 1 13 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.887 0.099 25767 11640 1 13 . 1 1 103 103 GLU C C 103 179.968 179.968 178.755 1.213 25767 11641 1 13 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.612 -0.095 25767 11642 1 13 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.539 0.011 25767 11643 1 13 . 1 1 103 103 GLU H H 103 7.872 7.872 7.880 -0.008 25767 11644 1 13 . 1 1 104 104 LYS N N 104 120.268 120.268 118.923 1.345 25767 11645 1 13 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.147 -0.101 25767 11646 1 13 . 1 1 104 104 LYS C C 104 178.355 178.355 179.018 -0.663 25767 11647 1 13 . 1 1 104 104 LYS CA C 104 56.735 56.735 59.197 -2.462 25767 11648 1 13 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.266 -3.153 25767 11649 1 13 . 1 1 104 104 LYS H H 104 8.384 8.384 7.463 0.921 25767 11650 1 13 . 1 1 105 105 LEU N N 105 121.622 121.622 119.240 2.382 25767 11651 1 13 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.700 0.041 25767 11652 1 13 . 1 1 105 105 LEU C C 105 180.552 180.552 178.560 1.992 25767 11653 1 13 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.157 0.015 25767 11654 1 13 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.276 -0.246 25767 11655 1 13 . 1 1 105 105 LEU H H 105 8.400 8.400 7.505 0.895 25767 11656 1 13 . 1 1 106 106 LYS N N 106 119.498 119.498 118.571 0.927 25767 11657 1 13 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.799 0.115 25767 11658 1 13 . 1 1 106 106 LYS C C 106 178.419 178.419 179.031 -0.612 25767 11659 1 13 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.824 -0.441 25767 11660 1 13 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.963 -0.155 25767 11661 1 13 . 1 1 106 106 LYS H H 106 7.067 7.067 7.639 -0.572 25767 11662 1 13 . 1 1 107 107 GLN N N 107 121.405 121.405 118.829 2.576 25767 11663 1 13 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.933 -0.082 25767 11664 1 13 . 1 1 107 107 GLN C C 107 177.935 177.935 178.898 -0.963 25767 11665 1 13 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.671 -0.190 25767 11666 1 13 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.485 -1.687 25767 11667 1 13 . 1 1 107 107 GLN H H 107 7.460 7.460 7.637 -0.177 25767 11668 1 13 . 1 1 108 108 LEU N N 108 119.561 119.561 118.643 0.918 25767 11669 1 13 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.524 0.277 25767 11670 1 13 . 1 1 108 108 LEU C C 108 179.195 179.195 177.962 1.233 25767 11671 1 13 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.149 1.244 25767 11672 1 13 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.597 -0.331 25767 11673 1 13 . 1 1 108 108 LEU H H 108 8.208 8.208 7.567 0.641 25767 11674 1 13 . 1 1 109 109 LYS N N 109 118.535 118.535 116.859 1.676 25767 11675 1 13 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.107 0.145 25767 11676 1 13 . 1 1 109 109 LYS C C 109 177.726 177.726 177.990 -0.264 25767 11677 1 13 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.611 0.119 25767 11678 1 13 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.813 -0.403 25767 11679 1 13 . 1 1 109 109 LYS H H 109 7.168 7.168 7.444 -0.276 25767 11680 1 13 . 1 1 110 110 ASP N N 110 117.463 117.463 116.654 0.809 25767 11681 1 13 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.650 -0.045 25767 11682 1 13 . 1 1 110 110 ASP C C 110 177.360 177.360 176.578 0.782 25767 11683 1 13 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.780 1.116 25767 11684 1 13 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.817 0.760 25767 11685 1 13 . 1 1 110 110 ASP H H 110 7.861 7.861 8.302 -0.441 25767 11686 1 13 . 1 1 111 111 GLY N N 111 113.059 113.059 108.407 4.652 25767 11687 1 13 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.702 -0.650 25767 11688 1 13 . 1 1 111 111 GLY H H 111 8.479 8.479 7.741 0.738 25767 11689 1 13 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.168 0.295 25767 11690 1 13 . 1 1 112 112 PRO C C 112 175.090 175.090 175.687 -0.597 25767 11691 1 13 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.164 -0.800 25767 11692 1 13 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.883 1.966 25767 11693 1 13 . 1 1 113 113 TRP N N 113 123.164 123.164 121.692 1.472 25767 11694 1 13 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.681 0.029 25767 11695 1 13 . 1 1 113 113 TRP C C 113 174.605 174.605 175.216 -0.611 25767 11696 1 13 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.392 0.513 25767 11697 1 13 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.368 -3.075 25767 11698 1 13 . 1 1 113 113 TRP H H 113 8.687 8.687 8.597 0.090 25767 11699 1 13 . 1 1 114 114 ASP N N 114 121.356 121.356 121.768 -0.412 25767 11700 1 13 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.957 -0.096 25767 11701 1 13 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.901 -0.652 25767 11702 1 13 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.220 -1.079 25767 11703 1 13 . 1 1 114 114 ASP H H 114 6.985 6.985 8.279 -1.294 25767 11704 1 13 . 1 1 115 115 VAL N N 115 118.649 118.649 118.683 -0.034 25767 11705 1 13 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.860 -0.018 25767 11706 1 13 . 1 1 115 115 VAL C C 115 177.739 177.739 177.459 0.280 25767 11707 1 13 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.747 -0.178 25767 11708 1 13 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.128 -0.451 25767 11709 1 13 . 1 1 115 115 VAL H H 115 8.206 8.206 8.362 -0.156 25767 11710 1 13 . 1 1 116 116 MET N N 116 120.401 120.401 118.321 2.080 25767 11711 1 13 . 1 1 116 116 MET HA H 116 4.303 4.303 4.192 0.111 25767 11712 1 13 . 1 1 116 116 MET C C 116 179.269 179.269 178.091 1.178 25767 11713 1 13 . 1 1 116 116 MET CA C 116 57.634 57.634 59.152 -1.518 25767 11714 1 13 . 1 1 116 116 MET CB C 116 30.414 30.414 31.792 -1.378 25767 11715 1 13 . 1 1 116 116 MET H H 116 7.642 7.642 8.104 -0.462 25767 11716 1 13 . 1 1 117 117 LEU N N 117 125.503 125.503 119.321 6.182 25767 11717 1 13 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.015 0.230 25767 11718 1 13 . 1 1 117 117 LEU C C 117 178.445 178.445 179.396 -0.951 25767 11719 1 13 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.397 0.803 25767 11720 1 13 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.115 -1.026 25767 11721 1 13 . 1 1 117 117 LEU H H 117 8.157 8.157 7.585 0.572 25767 11722 1 13 . 1 1 118 118 LYS N N 118 119.052 119.052 119.272 -0.220 25767 11723 1 13 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.944 -0.139 25767 11724 1 13 . 1 1 118 118 LYS C C 118 178.251 178.251 179.291 -1.040 25767 11725 1 13 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.308 0.218 25767 11726 1 13 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.236 -0.108 25767 11727 1 13 . 1 1 118 118 LYS H H 118 7.400 7.400 7.553 -0.153 25767 11728 1 13 . 1 1 119 119 ARG N N 119 117.999 117.999 118.979 -0.980 25767 11729 1 13 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.291 -0.071 25767 11730 1 13 . 1 1 119 119 ARG C C 119 180.441 180.441 179.057 1.384 25767 11731 1 13 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.605 0.212 25767 11732 1 13 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.301 -0.216 25767 11733 1 13 . 1 1 119 119 ARG H H 119 8.265 8.265 8.013 0.252 25767 11734 1 13 . 1 1 120 120 SER N N 120 118.073 118.073 115.504 2.569 25767 11735 1 13 . 1 1 120 120 SER HA H 120 4.182 4.182 4.307 -0.125 25767 11736 1 13 . 1 1 120 120 SER C C 120 176.215 176.215 176.670 -0.455 25767 11737 1 13 . 1 1 120 120 SER CA C 120 62.817 62.817 61.696 1.121 25767 11738 1 13 . 1 1 120 120 SER CB C 120 63.550 63.550 63.145 0.405 25767 11739 1 13 . 1 1 120 120 SER H H 120 8.633 8.633 7.922 0.711 25767 11740 1 13 . 1 1 121 121 LEU N N 121 125.029 125.029 123.739 1.290 25767 11741 1 13 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.081 0.138 25767 11742 1 13 . 1 1 121 121 LEU C C 121 179.679 179.679 177.795 1.884 25767 11743 1 13 . 1 1 121 121 LEU CA C 121 58.849 58.849 58.253 0.596 25767 11744 1 13 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.630 -0.856 25767 11745 1 13 . 1 1 121 121 LEU H H 121 8.313 8.313 8.083 0.230 25767 11746 1 13 . 1 1 122 122 TRP N N 122 120.217 120.217 119.418 0.799 25767 11747 1 13 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.349 -0.009 25767 11748 1 13 . 1 1 122 122 TRP C C 122 177.527 177.527 178.695 -1.168 25767 11749 1 13 . 1 1 122 122 TRP CA C 122 61.758 61.758 61.699 0.059 25767 11750 1 13 . 1 1 122 122 TRP CB C 122 29.648 29.648 28.920 0.728 25767 11751 1 13 . 1 1 122 122 TRP H H 122 7.928 7.928 7.870 0.058 25767 11752 1 13 . 1 1 123 123 CYS N N 123 119.669 119.669 118.518 1.151 25767 11753 1 13 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.208 -0.001 25767 11754 1 13 . 1 1 123 123 CYS C C 123 177.057 177.057 177.152 -0.095 25767 11755 1 13 . 1 1 123 123 CYS CA C 123 62.600 62.600 64.185 -1.585 25767 11756 1 13 . 1 1 123 123 CYS CB C 123 25.899 25.899 27.054 -1.155 25767 11757 1 13 . 1 1 123 123 CYS H H 123 8.273 8.273 8.256 0.017 25767 11758 1 13 . 1 1 124 124 CYS N N 124 116.898 116.898 119.831 -2.933 25767 11759 1 13 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.218 -0.370 25767 11760 1 13 . 1 1 124 124 CYS C C 124 175.759 175.759 176.724 -0.965 25767 11761 1 13 . 1 1 124 124 CYS CA C 124 65.653 65.653 63.760 1.893 25767 11762 1 13 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.087 0.430 25767 11763 1 13 . 1 1 124 124 CYS H H 124 8.122 8.122 7.953 0.169 25767 11764 1 13 . 1 1 125 125 ILE N N 125 120.498 120.498 120.676 -0.178 25767 11765 1 13 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.657 -0.069 25767 11766 1 13 . 1 1 125 125 ILE C C 125 179.337 179.337 177.471 1.866 25767 11767 1 13 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.882 1.712 25767 11768 1 13 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.486 0.193 25767 11769 1 13 . 1 1 125 125 ILE H H 125 8.092 8.092 8.190 -0.098 25767 11770 1 13 . 1 1 126 126 ASP N N 126 125.084 125.084 120.823 4.261 25767 11771 1 13 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.425 0.192 25767 11772 1 13 . 1 1 126 126 ASP C C 126 178.299 178.299 179.101 -0.802 25767 11773 1 13 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.600 1.404 25767 11774 1 13 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.178 0.118 25767 11775 1 13 . 1 1 126 126 ASP H H 126 9.049 9.049 8.209 0.840 25767 11776 1 13 . 1 1 127 127 LEU N N 127 122.591 122.591 120.285 2.306 25767 11777 1 13 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.970 -0.103 25767 11778 1 13 . 1 1 127 127 LEU C C 127 179.655 179.655 178.985 0.670 25767 11779 1 13 . 1 1 127 127 LEU CA C 127 58.661 58.661 58.143 0.518 25767 11780 1 13 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.875 0.319 25767 11781 1 13 . 1 1 127 127 LEU H H 127 8.888 8.888 7.780 1.108 25767 11782 1 13 . 1 1 128 128 PHE N N 128 117.498 117.498 119.941 -2.443 25767 11783 1 13 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.140 0.182 25767 11784 1 13 . 1 1 128 128 PHE C C 128 178.533 178.533 177.424 1.109 25767 11785 1 13 . 1 1 128 128 PHE CA C 128 60.932 60.932 61.916 -0.984 25767 11786 1 13 . 1 1 128 128 PHE CB C 128 39.053 39.053 39.545 -0.492 25767 11787 1 13 . 1 1 128 128 PHE H H 128 8.947 8.947 8.134 0.813 25767 11788 1 13 . 1 1 129 129 SER N N 129 115.398 115.398 116.300 -0.902 25767 11789 1 13 . 1 1 129 129 SER HA H 129 4.046 4.046 4.115 -0.069 25767 11790 1 13 . 1 1 129 129 SER C C 129 175.168 175.168 176.509 -1.341 25767 11791 1 13 . 1 1 129 129 SER CA C 129 63.015 63.015 62.391 0.624 25767 11792 1 13 . 1 1 129 129 SER H H 129 8.578 8.578 9.002 -0.424 25767 11793 1 13 . 1 1 130 130 CYS N N 130 125.556 125.556 120.691 4.865 25767 11794 1 13 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.261 -0.152 25767 11795 1 13 . 1 1 130 130 CYS C C 130 175.294 175.294 176.852 -1.558 25767 11796 1 13 . 1 1 130 130 CYS CA C 130 61.438 61.438 64.015 -2.577 25767 11797 1 13 . 1 1 130 130 CYS CB C 130 27.050 27.050 26.643 0.407 25767 11798 1 13 . 1 1 130 130 CYS H H 130 8.289 8.289 8.467 -0.178 25767 11799 1 13 . 1 1 131 131 ILE N N 131 120.232 120.232 121.327 -1.095 25767 11800 1 13 . 1 1 131 131 ILE HA H 131 4.033 4.033 3.974 0.059 25767 11801 1 13 . 1 1 131 131 ILE C C 131 177.297 177.297 178.726 -1.429 25767 11802 1 13 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.564 -0.912 25767 11803 1 13 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.828 1.274 25767 11804 1 13 . 1 1 131 131 ILE H H 131 7.943 7.943 7.786 0.157 25767 11805 1 13 . 1 1 132 132 LEU N N 132 116.422 116.422 120.657 -4.235 25767 11806 1 13 . 1 1 132 132 LEU HA H 132 3.845 3.845 3.870 -0.025 25767 11807 1 13 . 1 1 132 132 LEU C C 132 177.816 177.816 178.489 -0.673 25767 11808 1 13 . 1 1 132 132 LEU CA C 132 57.078 57.078 57.870 -0.792 25767 11809 1 13 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.609 0.604 25767 11810 1 13 . 1 1 132 132 LEU H H 132 7.846 7.846 8.257 -0.411 25767 11811 1 13 . 1 1 133 133 HIS N N 133 116.929 116.929 118.615 -1.686 25767 11812 1 13 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.186 -0.047 25767 11813 1 13 . 1 1 133 133 HIS C C 133 178.669 178.669 177.457 1.212 25767 11814 1 13 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.898 -0.162 25767 11815 1 13 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.213 2.939 25767 11816 1 13 . 1 1 133 133 HIS H H 133 7.822 7.822 8.223 -0.401 25767 11817 1 13 . 1 1 134 134 LEU N N 134 116.898 116.898 119.778 -2.880 25767 11818 1 13 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.019 -0.286 25767 11819 1 13 . 1 1 134 134 LEU C C 134 179.402 179.402 178.631 0.771 25767 11820 1 13 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.759 -0.532 25767 11821 1 13 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.145 -2.606 25767 11822 1 13 . 1 1 134 134 LEU H H 134 8.688 8.688 7.865 0.823 25767 11823 1 13 . 1 1 135 135 TRP N N 135 115.602 115.602 117.625 -2.023 25767 11824 1 13 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.558 0.450 25767 11825 1 13 . 1 1 135 135 TRP C C 135 175.022 175.022 177.925 -2.903 25767 11826 1 13 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.195 1.231 25767 11827 1 13 . 1 1 135 135 TRP CB C 135 27.085 27.085 28.842 -1.757 25767 11828 1 13 . 1 1 135 135 TRP H H 135 7.638 7.638 8.515 -0.877 25767 11829 1 13 . 1 1 136 136 LYS N N 136 119.721 119.721 122.994 -3.273 25767 11830 1 13 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.996 -0.180 25767 11831 1 13 . 1 1 136 136 LYS C C 136 178.279 178.279 178.336 -0.057 25767 11832 1 13 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.200 0.993 25767 11833 1 13 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.669 1.388 25767 11834 1 13 . 1 1 136 136 LYS H H 136 6.538 6.538 8.181 -1.643 25767 11835 1 13 . 1 1 137 137 GLU N N 137 115.407 115.407 115.997 -0.590 25767 11836 1 13 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.143 0.024 25767 11837 1 13 . 1 1 137 137 GLU C C 137 176.700 176.700 177.250 -0.550 25767 11838 1 13 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.509 -0.659 25767 11839 1 13 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.093 0.067 25767 11840 1 13 . 1 1 137 137 GLU H H 137 8.596 8.596 8.158 0.438 25767 11841 1 13 . 1 1 138 138 ASN N N 138 116.669 116.669 116.463 0.206 25767 11842 1 13 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.824 0.082 25767 11843 1 13 . 1 1 138 138 ASN C C 138 173.481 173.481 174.906 -1.425 25767 11844 1 13 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.935 -1.121 25767 11845 1 13 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.760 1.077 25767 11846 1 13 . 1 1 138 138 ASN H H 138 8.343 8.343 8.203 0.140 25767 11847 1 13 . 1 1 139 139 ILE N N 139 120.703 120.703 120.767 -0.064 25767 11848 1 13 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.244 0.100 25767 11849 1 13 . 1 1 139 139 ILE C C 139 175.241 175.241 175.707 -0.466 25767 11850 1 13 . 1 1 139 139 ILE CA C 139 60.792 60.792 58.962 1.830 25767 11851 1 13 . 1 1 139 139 ILE CB C 139 40.274 40.274 38.513 1.761 25767 11852 1 13 . 1 1 139 139 ILE H H 139 7.167 7.167 7.430 -0.263 25767 11853 1 13 . 1 1 140 140 SER N N 140 123.284 123.284 120.148 3.136 25767 11854 1 13 . 1 1 140 140 SER HA H 140 4.345 4.345 4.547 -0.202 25767 11855 1 13 . 1 1 140 140 SER CA C 140 58.095 58.095 57.271 0.824 25767 11856 1 13 . 1 1 140 140 SER CB C 140 65.370 65.370 64.521 0.849 25767 11857 1 13 . 1 1 140 140 SER H H 140 8.727 8.727 8.340 0.387 25767 11858 1 13 . 1 1 142 142 THR N N 142 113.868 113.868 115.384 -1.516 25767 11859 1 13 . 1 1 142 142 THR HA H 142 3.976 3.976 4.282 -0.306 25767 11860 1 13 . 1 1 142 142 THR C C 142 177.559 177.559 176.910 0.649 25767 11861 1 13 . 1 1 142 142 THR CA C 142 66.007 66.007 65.474 0.533 25767 11862 1 13 . 1 1 142 142 THR CB C 142 68.530 68.530 68.287 0.243 25767 11863 1 13 . 1 1 142 142 THR H H 142 8.243 8.243 8.131 0.112 25767 11864 1 13 . 1 1 143 143 SER N N 143 120.786 120.786 118.289 2.497 25767 11865 1 13 . 1 1 143 143 SER C C 143 175.844 175.844 176.657 -0.813 25767 11866 1 13 . 1 1 143 143 SER CA C 143 62.102 62.102 62.342 -0.240 25767 11867 1 13 . 1 1 143 143 SER CB C 143 63.086 63.086 62.693 0.393 25767 11868 1 13 . 1 1 143 143 SER H H 143 7.915 7.915 8.218 -0.303 25767 11869 1 13 . 1 1 144 144 THR N N 144 120.946 120.946 116.888 4.058 25767 11870 1 13 . 1 1 144 144 THR HA H 144 4.299 4.299 4.145 0.154 25767 11871 1 13 . 1 1 144 144 THR C C 144 175.874 175.874 176.125 -0.251 25767 11872 1 13 . 1 1 144 144 THR CA C 144 67.487 67.487 65.860 1.627 25767 11873 1 13 . 1 1 144 144 THR CB C 144 68.485 68.485 68.729 -0.244 25767 11874 1 13 . 1 1 144 144 THR H H 144 8.746 8.746 8.490 0.256 25767 11875 1 13 . 1 1 145 145 ASN N N 145 120.069 120.069 119.714 0.355 25767 11876 1 13 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.378 -0.070 25767 11877 1 13 . 1 1 145 145 ASN C C 145 177.917 177.917 177.702 0.215 25767 11878 1 13 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.721 -0.384 25767 11879 1 13 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.548 -0.448 25767 11880 1 13 . 1 1 145 145 ASN H H 145 7.940 7.940 7.920 0.020 25767 11881 1 13 . 1 1 146 146 SER N N 146 116.905 116.905 116.756 0.149 25767 11882 1 13 . 1 1 146 146 SER HA H 146 3.936 3.936 4.116 -0.180 25767 11883 1 13 . 1 1 146 146 SER C C 146 176.963 176.963 176.498 0.465 25767 11884 1 13 . 1 1 146 146 SER CA C 146 61.997 61.997 62.438 -0.441 25767 11885 1 13 . 1 1 146 146 SER CB C 146 62.879 62.879 63.155 -0.276 25767 11886 1 13 . 1 1 146 146 SER H H 146 7.951 7.951 7.925 0.026 25767 11887 1 13 . 1 1 147 147 LEU N N 147 123.253 123.253 121.992 1.261 25767 11888 1 13 . 1 1 147 147 LEU HA H 147 3.875 3.875 3.892 -0.017 25767 11889 1 13 . 1 1 147 147 LEU C C 147 178.726 178.726 178.892 -0.166 25767 11890 1 13 . 1 1 147 147 LEU CA C 147 58.580 58.580 57.926 0.654 25767 11891 1 13 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.679 -0.819 25767 11892 1 13 . 1 1 147 147 LEU H H 147 8.168 8.168 7.611 0.557 25767 11893 1 13 . 1 1 148 148 GLN N N 148 118.212 118.212 117.759 0.453 25767 11894 1 13 . 1 1 148 148 GLN HA H 148 3.817 3.817 3.920 -0.103 25767 11895 1 13 . 1 1 148 148 GLN C C 148 179.686 179.686 178.219 1.467 25767 11896 1 13 . 1 1 148 148 GLN CA C 148 59.243 59.243 59.166 0.077 25767 11897 1 13 . 1 1 148 148 GLN CB C 148 27.720 27.720 28.480 -0.760 25767 11898 1 13 . 1 1 148 148 GLN H H 148 8.295 8.295 8.927 -0.632 25767 11899 1 13 . 1 1 149 149 LYS N N 149 120.770 120.770 120.290 0.480 25767 11900 1 13 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.958 -0.057 25767 11901 1 13 . 1 1 149 149 LYS C C 149 178.006 178.006 178.536 -0.530 25767 11902 1 13 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.462 0.070 25767 11903 1 13 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.364 -0.472 25767 11904 1 13 . 1 1 149 149 LYS H H 149 7.955 7.955 8.277 -0.322 25767 11905 1 13 . 1 1 150 150 ARG N N 150 119.244 119.244 119.128 0.116 25767 11906 1 13 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.982 -0.142 25767 11907 1 13 . 1 1 150 150 ARG C C 150 178.858 178.858 178.820 0.038 25767 11908 1 13 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.279 0.092 25767 11909 1 13 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.828 -1.024 25767 11910 1 13 . 1 1 150 150 ARG H H 150 7.020 7.020 7.498 -0.478 25767 11911 1 13 . 1 1 151 151 ILE N N 151 121.183 121.183 119.949 1.234 25767 11912 1 13 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.570 -0.210 25767 11913 1 13 . 1 1 151 151 ILE C C 151 177.327 177.327 177.770 -0.443 25767 11914 1 13 . 1 1 151 151 ILE CA C 151 67.196 67.196 64.877 2.319 25767 11915 1 13 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.568 0.704 25767 11916 1 13 . 1 1 151 151 ILE H H 151 7.574 7.574 7.650 -0.076 25767 11917 1 13 . 1 1 152 152 LYS N N 152 119.521 119.521 120.638 -1.117 25767 11918 1 13 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.824 -0.051 25767 11919 1 13 . 1 1 152 152 LYS C C 152 178.016 178.016 178.341 -0.325 25767 11920 1 13 . 1 1 152 152 LYS CA C 152 59.830 59.830 60.094 -0.264 25767 11921 1 13 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.321 -0.740 25767 11922 1 13 . 1 1 152 152 LYS H H 152 7.629 7.629 8.053 -0.424 25767 11923 1 13 . 1 1 153 153 TYR N N 153 120.178 120.178 120.569 -0.391 25767 11924 1 13 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.137 -0.065 25767 11925 1 13 . 1 1 153 153 TYR C C 153 178.195 178.195 177.823 0.372 25767 11926 1 13 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.879 -0.563 25767 11927 1 13 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.400 -1.127 25767 11928 1 13 . 1 1 153 153 TYR H H 153 8.407 8.407 7.856 0.551 25767 11929 1 13 . 1 1 154 154 CYS N N 154 117.013 117.013 118.217 -1.204 25767 11930 1 13 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.166 -0.094 25767 11931 1 13 . 1 1 154 154 CYS C C 154 176.827 176.827 177.020 -0.193 25767 11932 1 13 . 1 1 154 154 CYS CA C 154 65.780 65.780 62.656 3.124 25767 11933 1 13 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.294 0.866 25767 11934 1 13 . 1 1 154 154 CYS H H 154 8.291 8.291 7.871 0.420 25767 11935 1 13 . 1 1 155 155 LYS N N 155 118.753 118.753 120.707 -1.954 25767 11936 1 13 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.826 -0.155 25767 11937 1 13 . 1 1 155 155 LYS C C 155 179.904 179.904 179.047 0.857 25767 11938 1 13 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.514 0.970 25767 11939 1 13 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.153 -0.210 25767 11940 1 13 . 1 1 155 155 LYS H H 155 7.934 7.934 8.077 -0.143 25767 11941 1 13 . 1 1 156 156 ILE N N 156 123.873 123.873 120.991 2.882 25767 11942 1 13 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.591 -0.007 25767 11943 1 13 . 1 1 156 156 ILE C C 156 179.501 179.501 177.702 1.799 25767 11944 1 13 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.709 -0.469 25767 11945 1 13 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.909 -0.267 25767 11946 1 13 . 1 1 156 156 ILE H H 156 8.314 8.314 8.519 -0.205 25767 11947 1 13 . 1 1 157 157 TYR N N 157 121.132 121.132 119.849 1.283 25767 11948 1 13 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.965 0.200 25767 11949 1 13 . 1 1 157 157 TYR C C 157 178.558 178.558 177.488 1.070 25767 11950 1 13 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.969 0.141 25767 11951 1 13 . 1 1 157 157 TYR H H 157 8.442 8.442 7.559 0.883 25767 11952 1 13 . 1 1 158 158 LEU N N 158 120.964 120.964 119.879 1.085 25767 11953 1 13 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.843 0.069 25767 11954 1 13 . 1 1 158 158 LEU C C 158 180.130 180.130 178.619 1.511 25767 11955 1 13 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.676 1.010 25767 11956 1 13 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.669 0.061 25767 11957 1 13 . 1 1 158 158 LEU H H 158 8.469 8.469 7.880 0.589 25767 11958 1 13 . 1 1 159 159 SER N N 159 116.653 116.653 115.155 1.498 25767 11959 1 13 . 1 1 159 159 SER HA H 159 4.246 4.246 4.010 0.236 25767 11960 1 13 . 1 1 159 159 SER CA C 159 61.460 61.460 61.955 -0.495 25767 11961 1 13 . 1 1 159 159 SER CB C 159 62.849 62.849 62.863 -0.014 25767 11962 1 13 . 1 1 159 159 SER H H 159 7.758 7.758 8.414 -0.656 25767 11963 1 13 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.213 -1.840 25767 11964 1 13 . 1 1 160 160 LYS CB C 160 29.832 29.832 31.997 -2.165 25767 11965 1 13 . 1 1 160 160 LYS H H 160 8.425 8.425 7.359 1.066 25767 11966 1 13 . 1 1 161 161 LEU N N 161 121.686 121.686 118.948 2.738 25767 11967 1 13 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.797 0.365 25767 11968 1 13 . 1 1 161 161 LEU C C 161 180.224 180.224 179.139 1.085 25767 11969 1 13 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.343 0.241 25767 11970 1 13 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.539 -0.077 25767 11971 1 13 . 1 1 161 161 LEU H H 161 8.323 8.323 7.483 0.840 25767 11972 1 13 . 1 1 162 162 ALA N N 162 123.102 123.102 120.876 2.226 25767 11973 1 13 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.086 0.044 25767 11974 1 13 . 1 1 162 162 ALA C C 162 179.487 179.487 179.127 0.360 25767 11975 1 13 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.672 0.072 25767 11976 1 13 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.507 -0.104 25767 11977 1 13 . 1 1 162 162 ALA H H 162 7.978 7.978 7.580 0.398 25767 11978 1 13 . 1 1 163 163 LYS N N 163 116.069 116.069 116.402 -0.333 25767 11979 1 13 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.265 -0.042 25767 11980 1 13 . 1 1 163 163 LYS C C 163 176.987 176.987 176.563 0.424 25767 11981 1 13 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.304 0.302 25767 11982 1 13 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.706 0.500 25767 11983 1 13 . 1 1 163 163 LYS H H 163 7.697 7.697 7.729 -0.032 25767 11984 1 13 . 1 1 164 164 GLY N N 164 108.540 108.540 106.610 1.930 25767 11985 1 13 . 1 1 164 164 GLY C C 164 174.721 174.721 174.302 0.419 25767 11986 1 13 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.963 0.828 25767 11987 1 13 . 1 1 164 164 GLY H H 164 7.772 7.772 7.416 0.356 25767 11988 1 13 . 1 1 165 165 GLU N N 165 119.886 119.886 120.081 -0.195 25767 11989 1 13 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.389 -0.339 25767 11990 1 13 . 1 1 165 165 GLU C C 165 176.027 176.027 174.895 1.132 25767 11991 1 13 . 1 1 165 165 GLU CA C 165 56.853 56.853 54.973 1.880 25767 11992 1 13 . 1 1 165 165 GLU CB C 165 30.338 30.338 31.163 -0.825 25767 11993 1 13 . 1 1 165 165 GLU H H 165 8.065 8.065 7.976 0.089 25767 11994 1 13 . 1 1 166 166 ILE N N 166 117.926 117.926 120.286 -2.360 25767 11995 1 13 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.869 0.033 25767 11996 1 13 . 1 1 166 166 ILE C C 166 174.138 174.138 176.705 -2.567 25767 11997 1 13 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.533 1.922 25767 11998 1 13 . 1 1 166 166 ILE CB C 166 40.202 40.202 39.500 0.702 25767 11999 1 13 . 1 1 166 166 ILE H H 166 7.282 7.282 8.106 -0.824 25767 12000 1 14 . 1 1 2 2 ALA N N 2 122.811 122.811 124.181 -1.370 25767 12001 1 14 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.077 -0.054 25767 12002 1 14 . 1 1 2 2 ALA C C 2 179.915 179.915 179.259 0.656 25767 12003 1 14 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.523 -0.406 25767 12004 1 14 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.889 -0.350 25767 12005 1 14 . 1 1 2 2 ALA H H 2 8.509 8.509 8.520 -0.011 25767 12006 1 14 . 1 1 3 3 SER N N 3 115.308 115.308 114.089 1.219 25767 12007 1 14 . 1 1 3 3 SER HA H 3 4.097 4.097 4.137 -0.040 25767 12008 1 14 . 1 1 3 3 SER C C 3 176.706 176.706 176.044 0.662 25767 12009 1 14 . 1 1 3 3 SER CA C 3 60.665 60.665 61.438 -0.773 25767 12010 1 14 . 1 1 3 3 SER CB C 3 62.710 62.710 62.400 0.310 25767 12011 1 14 . 1 1 3 3 SER H H 3 7.996 7.996 8.455 -0.459 25767 12012 1 14 . 1 1 4 4 ASN N N 4 122.688 122.688 120.174 2.514 25767 12013 1 14 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.421 -0.117 25767 12014 1 14 . 1 1 4 4 ASN C C 4 176.258 176.258 177.288 -1.030 25767 12015 1 14 . 1 1 4 4 ASN CA C 4 55.701 55.701 56.101 -0.400 25767 12016 1 14 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.907 0.270 25767 12017 1 14 . 1 1 4 4 ASN H H 4 8.075 8.075 8.285 -0.210 25767 12018 1 14 . 1 1 5 5 ALA N N 5 121.900 121.900 121.843 0.057 25767 12019 1 14 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.137 -0.562 25767 12020 1 14 . 1 1 5 5 ALA C C 5 178.475 178.475 179.403 -0.928 25767 12021 1 14 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.996 0.837 25767 12022 1 14 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.184 -0.569 25767 12023 1 14 . 1 1 5 5 ALA H H 5 8.659 8.659 7.712 0.947 25767 12024 1 14 . 1 1 6 6 ALA N N 6 117.768 117.768 121.727 -3.959 25767 12025 1 14 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.981 -0.194 25767 12026 1 14 . 1 1 6 6 ALA C C 6 180.494 180.494 179.439 1.055 25767 12027 1 14 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.155 0.195 25767 12028 1 14 . 1 1 6 6 ALA CB C 6 17.902 17.902 17.962 -0.060 25767 12029 1 14 . 1 1 6 6 ALA H H 6 7.864 7.864 7.714 0.150 25767 12030 1 14 . 1 1 7 7 ARG N N 7 121.173 121.173 119.118 2.055 25767 12031 1 14 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.088 -0.185 25767 12032 1 14 . 1 1 7 7 ARG C C 7 179.189 179.189 178.636 0.553 25767 12033 1 14 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.930 0.382 25767 12034 1 14 . 1 1 7 7 ARG CB C 7 29.222 29.222 30.123 -0.901 25767 12035 1 14 . 1 1 7 7 ARG H H 7 7.514 7.514 8.031 -0.517 25767 12036 1 14 . 1 1 8 8 VAL N N 8 122.979 122.979 119.996 2.983 25767 12037 1 14 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.718 -0.465 25767 12038 1 14 . 1 1 8 8 VAL C C 8 177.821 177.821 178.052 -0.231 25767 12039 1 14 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.794 0.978 25767 12040 1 14 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.885 -0.444 25767 12041 1 14 . 1 1 8 8 VAL H H 8 8.101 8.101 7.681 0.420 25767 12042 1 14 . 1 1 9 9 VAL N N 9 119.801 119.801 120.118 -0.317 25767 12043 1 14 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.545 -0.279 25767 12044 1 14 . 1 1 9 9 VAL C C 9 177.373 177.373 177.536 -0.163 25767 12045 1 14 . 1 1 9 9 VAL CA C 9 67.484 67.484 67.021 0.463 25767 12046 1 14 . 1 1 9 9 VAL CB C 9 31.625 31.625 31.354 0.271 25767 12047 1 14 . 1 1 9 9 VAL H H 9 8.362 8.362 8.017 0.345 25767 12048 1 14 . 1 1 10 10 ALA N N 10 122.360 122.360 121.587 0.773 25767 12049 1 14 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.024 -0.088 25767 12050 1 14 . 1 1 10 10 ALA C C 10 180.762 180.762 179.516 1.246 25767 12051 1 14 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.425 0.019 25767 12052 1 14 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.126 -0.389 25767 12053 1 14 . 1 1 10 10 ALA H H 10 7.776 7.776 7.758 0.018 25767 12054 1 14 . 1 1 11 11 THR N N 11 117.376 117.376 114.269 3.107 25767 12055 1 14 . 1 1 11 11 THR HA H 11 3.816 3.816 3.991 -0.175 25767 12056 1 14 . 1 1 11 11 THR C C 11 175.775 175.775 176.477 -0.702 25767 12057 1 14 . 1 1 11 11 THR CA C 11 66.509 66.509 66.274 0.235 25767 12058 1 14 . 1 1 11 11 THR CB C 11 68.588 68.588 68.845 -0.257 25767 12059 1 14 . 1 1 11 11 THR H H 11 8.180 8.180 7.898 0.282 25767 12060 1 14 . 1 1 12 12 ALA N N 12 125.308 125.308 124.198 1.110 25767 12061 1 14 . 1 1 12 12 ALA HA H 12 3.997 3.997 4.075 -0.078 25767 12062 1 14 . 1 1 12 12 ALA C C 12 179.399 179.399 179.276 0.123 25767 12063 1 14 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.599 0.477 25767 12064 1 14 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.336 0.908 25767 12065 1 14 . 1 1 12 12 ALA H H 12 8.671 8.671 8.519 0.152 25767 12066 1 14 . 1 1 13 13 LYS N N 13 116.977 116.977 118.527 -1.550 25767 12067 1 14 . 1 1 13 13 LYS C C 13 179.646 179.646 178.638 1.008 25767 12068 1 14 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.757 -0.836 25767 12069 1 14 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.128 -0.685 25767 12070 1 14 . 1 1 13 13 LYS H H 13 8.061 8.061 7.687 0.374 25767 12071 1 14 . 1 1 14 14 ASP N N 14 121.988 121.988 120.049 1.939 25767 12072 1 14 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.352 0.001 25767 12073 1 14 . 1 1 14 14 ASP C C 14 179.446 179.446 178.420 1.026 25767 12074 1 14 . 1 1 14 14 ASP CA C 14 57.509 57.509 56.878 0.631 25767 12075 1 14 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.345 -0.344 25767 12076 1 14 . 1 1 14 14 ASP H H 14 7.669 7.669 7.600 0.069 25767 12077 1 14 . 1 1 15 15 PHE N N 15 119.588 119.588 118.069 1.519 25767 12078 1 14 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.136 0.208 25767 12079 1 14 . 1 1 15 15 PHE C C 15 178.373 178.373 177.974 0.399 25767 12080 1 14 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.803 0.434 25767 12081 1 14 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.753 -1.257 25767 12082 1 14 . 1 1 15 15 PHE H H 15 7.913 7.913 7.771 0.142 25767 12083 1 14 . 1 1 16 16 ASP N N 16 121.705 121.705 119.920 1.785 25767 12084 1 14 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.394 -0.399 25767 12085 1 14 . 1 1 16 16 ASP C C 16 180.071 180.071 179.091 0.980 25767 12086 1 14 . 1 1 16 16 ASP CA C 16 58.149 58.149 56.906 1.243 25767 12087 1 14 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.433 1.054 25767 12088 1 14 . 1 1 16 16 ASP H H 16 8.324 8.324 8.005 0.319 25767 12089 1 14 . 1 1 17 17 LYS N N 17 118.825 118.825 118.981 -0.156 25767 12090 1 14 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.080 -0.043 25767 12091 1 14 . 1 1 17 17 LYS C C 17 178.407 178.407 177.956 0.451 25767 12092 1 14 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.853 0.208 25767 12093 1 14 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.512 0.072 25767 12094 1 14 . 1 1 17 17 LYS H H 17 7.834 7.834 7.771 0.063 25767 12095 1 14 . 1 1 18 18 VAL N N 18 110.562 110.562 117.081 -6.519 25767 12096 1 14 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.069 0.447 25767 12097 1 14 . 1 1 18 18 VAL C C 18 176.144 176.144 176.638 -0.494 25767 12098 1 14 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.114 -2.240 25767 12099 1 14 . 1 1 18 18 VAL CB C 18 31.160 31.160 31.918 -0.758 25767 12100 1 14 . 1 1 18 18 VAL H H 18 7.185 7.185 7.554 -0.369 25767 12101 1 14 . 1 1 19 19 GLY N N 19 109.272 109.272 107.664 1.608 25767 12102 1 14 . 1 1 19 19 GLY C C 19 175.043 175.043 174.814 0.229 25767 12103 1 14 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.378 0.453 25767 12104 1 14 . 1 1 19 19 GLY H H 19 7.723 7.723 7.685 0.038 25767 12105 1 14 . 1 1 20 20 LEU N N 20 125.428 125.428 121.756 3.672 25767 12106 1 14 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.595 -0.275 25767 12107 1 14 . 1 1 20 20 LEU C C 20 177.949 177.949 177.183 0.766 25767 12108 1 14 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.363 -0.559 25767 12109 1 14 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.603 0.314 25767 12110 1 14 . 1 1 20 20 LEU H H 20 8.083 8.083 8.071 0.012 25767 12111 1 14 . 1 1 21 21 GLY N N 21 107.804 107.804 109.979 -2.175 25767 12112 1 14 . 1 1 21 21 GLY C C 21 176.278 176.278 175.590 0.688 25767 12113 1 14 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.077 0.217 25767 12114 1 14 . 1 1 21 21 GLY H H 21 7.982 7.982 7.877 0.105 25767 12115 1 14 . 1 1 22 22 ILE N N 22 121.319 121.319 122.129 -0.810 25767 12116 1 14 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.711 0.199 25767 12117 1 14 . 1 1 22 22 ILE C C 22 176.604 176.604 177.807 -1.203 25767 12118 1 14 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.065 -1.619 25767 12119 1 14 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.656 -1.090 25767 12120 1 14 . 1 1 22 22 ILE H H 22 8.478 8.478 7.741 0.737 25767 12121 1 14 . 1 1 23 23 ILE N N 23 120.377 120.377 119.616 0.761 25767 12122 1 14 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.651 0.062 25767 12123 1 14 . 1 1 23 23 ILE C C 23 178.581 178.581 178.127 0.454 25767 12124 1 14 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.115 1.131 25767 12125 1 14 . 1 1 23 23 ILE CB C 23 36.199 36.199 35.827 0.372 25767 12126 1 14 . 1 1 23 23 ILE H H 23 6.869 6.869 7.546 -0.677 25767 12127 1 14 . 1 1 24 24 GLY N N 24 103.449 103.449 108.155 -4.706 25767 12128 1 14 . 1 1 24 24 GLY C C 24 175.308 175.308 175.744 -0.436 25767 12129 1 14 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.128 0.815 25767 12130 1 14 . 1 1 24 24 GLY H H 24 7.488 7.488 7.692 -0.204 25767 12131 1 14 . 1 1 25 25 TYR N N 25 124.685 124.685 124.269 0.416 25767 12132 1 14 . 1 1 25 25 TYR HA H 25 3.666 3.666 4.306 -0.640 25767 12133 1 14 . 1 1 25 25 TYR C C 25 176.208 176.208 177.378 -1.170 25767 12134 1 14 . 1 1 25 25 TYR CA C 25 61.371 61.371 61.188 0.183 25767 12135 1 14 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.712 -0.445 25767 12136 1 14 . 1 1 25 25 TYR H H 25 7.931 7.931 8.046 -0.115 25767 12137 1 14 . 1 1 26 26 TYR N N 26 117.001 117.001 119.810 -2.809 25767 12138 1 14 . 1 1 26 26 TYR HA H 26 3.941 3.941 4.003 -0.062 25767 12139 1 14 . 1 1 26 26 TYR C C 26 178.753 178.753 177.535 1.218 25767 12140 1 14 . 1 1 26 26 TYR CA C 26 64.260 64.260 62.117 2.143 25767 12141 1 14 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.898 -1.377 25767 12142 1 14 . 1 1 26 26 TYR H H 26 7.693 7.693 7.924 -0.231 25767 12143 1 14 . 1 1 27 27 LEU N N 27 118.657 118.657 117.683 0.974 25767 12144 1 14 . 1 1 27 27 LEU HA H 27 4.311 4.311 4.069 0.242 25767 12145 1 14 . 1 1 27 27 LEU CA C 27 58.297 58.297 58.091 0.206 25767 12146 1 14 . 1 1 27 27 LEU CB C 27 42.723 42.723 41.097 1.625 25767 12147 1 14 . 1 1 27 27 LEU H H 27 8.339 8.339 8.093 0.246 25767 12148 1 14 . 1 1 28 28 GLN N N 28 118.593 118.593 119.242 -0.649 25767 12149 1 14 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.915 -0.264 25767 12150 1 14 . 1 1 28 28 GLN C C 28 177.282 177.282 178.670 -1.388 25767 12151 1 14 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.901 -0.072 25767 12152 1 14 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.420 1.228 25767 12153 1 14 . 1 1 28 28 GLN H H 28 7.970 7.970 7.902 0.068 25767 12154 1 14 . 1 1 29 29 LEU N N 29 122.111 122.111 119.658 2.453 25767 12155 1 14 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.760 0.184 25767 12156 1 14 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.571 1.095 25767 12157 1 14 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.303 0.705 25767 12158 1 14 . 1 1 29 29 LEU H H 29 7.979 7.979 7.358 0.621 25767 12159 1 14 . 1 1 30 30 TYR N N 30 119.283 119.283 120.256 -0.973 25767 12160 1 14 . 1 1 30 30 TYR C C 30 175.775 175.775 177.285 -1.510 25767 12161 1 14 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.846 -1.752 25767 12162 1 14 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.431 0.642 25767 12163 1 14 . 1 1 30 30 TYR H H 30 8.093 8.093 7.583 0.510 25767 12164 1 14 . 1 1 31 31 ALA N N 31 121.327 121.327 122.480 -1.153 25767 12165 1 14 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.857 -0.489 25767 12166 1 14 . 1 1 31 31 ALA C C 31 178.955 178.955 178.728 0.227 25767 12167 1 14 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.373 0.174 25767 12168 1 14 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.187 -0.224 25767 12169 1 14 . 1 1 31 31 ALA H H 31 8.394 8.394 8.434 -0.040 25767 12170 1 14 . 1 1 32 32 VAL N N 32 116.757 116.757 118.448 -1.691 25767 12171 1 14 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.479 -0.219 25767 12172 1 14 . 1 1 32 32 VAL CA C 32 67.662 67.662 66.148 1.514 25767 12173 1 14 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.707 -0.736 25767 12174 1 14 . 1 1 32 32 VAL H H 32 8.020 8.020 7.673 0.347 25767 12175 1 14 . 1 1 33 33 GLU N N 33 118.775 118.775 119.735 -0.960 25767 12176 1 14 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.795 0.194 25767 12177 1 14 . 1 1 33 33 GLU C C 33 179.746 179.746 178.912 0.834 25767 12178 1 14 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.354 0.649 25767 12179 1 14 . 1 1 33 33 GLU H H 33 7.358 7.358 7.563 -0.205 25767 12180 1 14 . 1 1 34 34 LEU N N 34 120.632 120.632 121.760 -1.128 25767 12181 1 14 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.889 -0.240 25767 12182 1 14 . 1 1 34 34 LEU C C 34 180.336 180.336 178.722 1.614 25767 12183 1 14 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.719 -0.044 25767 12184 1 14 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.799 -0.211 25767 12185 1 14 . 1 1 34 34 LEU H H 34 8.390 8.390 7.780 0.610 25767 12186 1 14 . 1 1 35 35 ILE N N 35 121.240 121.240 118.131 3.109 25767 12187 1 14 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.695 -0.153 25767 12188 1 14 . 1 1 35 35 ILE C C 35 178.604 178.604 177.551 1.053 25767 12189 1 14 . 1 1 35 35 ILE CA C 35 65.547 65.547 64.755 0.792 25767 12190 1 14 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.946 0.785 25767 12191 1 14 . 1 1 35 35 ILE H H 35 8.129 8.129 7.435 0.694 25767 12192 1 14 . 1 1 36 36 LEU N N 36 115.637 115.637 117.043 -1.406 25767 12193 1 14 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.078 -0.070 25767 12194 1 14 . 1 1 36 36 LEU C C 36 178.001 178.001 178.042 -0.041 25767 12195 1 14 . 1 1 36 36 LEU CA C 36 56.076 56.076 56.777 -0.701 25767 12196 1 14 . 1 1 36 36 LEU CB C 36 39.934 39.934 42.129 -2.195 25767 12197 1 14 . 1 1 36 36 LEU H H 36 8.416 8.416 7.851 0.565 25767 12198 1 14 . 1 1 37 37 SER N N 37 114.106 114.106 111.461 2.645 25767 12199 1 14 . 1 1 37 37 SER HA H 37 3.991 3.991 4.213 -0.222 25767 12200 1 14 . 1 1 37 37 SER C C 37 173.997 173.997 175.284 -1.287 25767 12201 1 14 . 1 1 37 37 SER CA C 37 60.311 60.311 59.601 0.710 25767 12202 1 14 . 1 1 37 37 SER CB C 37 63.746 63.746 63.604 0.142 25767 12203 1 14 . 1 1 37 37 SER H H 37 7.517 7.517 7.747 -0.230 25767 12204 1 14 . 1 1 38 38 GLU N N 38 123.003 123.003 122.016 0.987 25767 12205 1 14 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.274 0.095 25767 12206 1 14 . 1 1 38 38 GLU C C 38 175.780 175.780 176.084 -0.304 25767 12207 1 14 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.673 -0.308 25767 12208 1 14 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.846 -0.553 25767 12209 1 14 . 1 1 38 38 GLU H H 38 7.151 7.151 7.494 -0.343 25767 12210 1 14 . 1 1 39 39 GLU N N 39 126.166 126.166 122.297 3.869 25767 12211 1 14 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.133 -0.124 25767 12212 1 14 . 1 1 39 39 GLU C C 39 176.652 176.652 175.740 0.912 25767 12213 1 14 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.951 1.247 25767 12214 1 14 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.452 -0.417 25767 12215 1 14 . 1 1 39 39 GLU H H 39 8.587 8.587 8.400 0.187 25767 12216 1 14 . 1 1 40 40 ASP N N 40 120.047 120.047 120.729 -0.682 25767 12217 1 14 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.427 0.123 25767 12218 1 14 . 1 1 40 40 ASP C C 40 175.035 175.035 175.734 -0.699 25767 12219 1 14 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.373 -2.005 25767 12220 1 14 . 1 1 40 40 ASP CB C 40 40.023 40.023 41.032 -1.009 25767 12221 1 14 . 1 1 40 40 ASP H H 40 8.504 8.504 8.499 0.005 25767 12222 1 14 . 1 1 41 41 ARG N N 41 120.671 120.671 123.740 -3.069 25767 12223 1 14 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.691 -0.302 25767 12224 1 14 . 1 1 41 41 ARG C C 41 175.755 175.755 175.824 -0.069 25767 12225 1 14 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.599 0.409 25767 12226 1 14 . 1 1 41 41 ARG CB C 41 31.549 31.549 33.041 -1.492 25767 12227 1 14 . 1 1 41 41 ARG H H 41 7.672 7.672 8.302 -0.630 25767 12228 1 14 . 1 1 42 42 SER N N 42 120.330 120.330 115.815 4.515 25767 12229 1 14 . 1 1 42 42 SER HA H 42 3.837 3.837 4.338 -0.501 25767 12230 1 14 . 1 1 42 42 SER CA C 42 57.326 57.326 58.394 -1.068 25767 12231 1 14 . 1 1 42 42 SER CB C 42 65.762 65.762 64.323 1.439 25767 12232 1 14 . 1 1 42 42 SER H H 42 8.544 8.544 8.544 -0.000 25767 12233 1 14 . 1 1 43 43 GLN HA H 43 3.989 3.989 4.032 -0.043 25767 12234 1 14 . 1 1 43 43 GLN C C 43 178.907 178.907 178.056 0.851 25767 12235 1 14 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.778 0.592 25767 12236 1 14 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.618 -0.655 25767 12237 1 14 . 1 1 44 44 GLU N N 44 120.328 120.328 119.991 0.337 25767 12238 1 14 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.943 0.070 25767 12239 1 14 . 1 1 44 44 GLU C C 44 179.824 179.824 178.945 0.879 25767 12240 1 14 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.088 0.957 25767 12241 1 14 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.269 -0.621 25767 12242 1 14 . 1 1 44 44 GLU H H 44 8.938 8.938 7.732 1.206 25767 12243 1 14 . 1 1 45 45 MET N N 45 121.030 121.030 117.229 3.801 25767 12244 1 14 . 1 1 45 45 MET HA H 45 4.412 4.412 4.261 0.151 25767 12245 1 14 . 1 1 45 45 MET C C 45 180.357 180.357 178.404 1.953 25767 12246 1 14 . 1 1 45 45 MET CA C 45 57.209 57.209 58.474 -1.264 25767 12247 1 14 . 1 1 45 45 MET CB C 45 32.436 32.436 32.261 0.175 25767 12248 1 14 . 1 1 45 45 MET H H 45 7.756 7.756 7.710 0.046 25767 12249 1 14 . 1 1 46 46 THR N N 46 120.008 120.008 116.695 3.313 25767 12250 1 14 . 1 1 46 46 THR HA H 46 4.071 4.071 3.903 0.168 25767 12251 1 14 . 1 1 46 46 THR CA C 46 67.096 67.096 66.544 0.552 25767 12252 1 14 . 1 1 46 46 THR CB C 46 68.954 68.954 68.091 0.863 25767 12253 1 14 . 1 1 46 46 THR H H 46 8.187 8.187 7.503 0.684 25767 12254 1 14 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.140 -0.031 25767 12255 1 14 . 1 1 47 47 ALA C C 47 180.118 180.118 179.371 0.747 25767 12256 1 14 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.979 0.360 25767 12257 1 14 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.239 -0.407 25767 12258 1 14 . 1 1 47 47 ALA H H 47 8.238 8.238 8.222 0.016 25767 12259 1 14 . 1 1 48 48 LEU N N 48 122.093 122.093 119.386 2.707 25767 12260 1 14 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.016 0.247 25767 12261 1 14 . 1 1 48 48 LEU C C 48 179.103 179.103 179.268 -0.165 25767 12262 1 14 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.461 0.279 25767 12263 1 14 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.555 -0.759 25767 12264 1 14 . 1 1 48 48 LEU H H 48 7.778 7.778 7.669 0.109 25767 12265 1 14 . 1 1 49 49 ALA N N 49 120.130 120.130 121.588 -1.458 25767 12266 1 14 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.917 -0.196 25767 12267 1 14 . 1 1 49 49 ALA C C 49 178.676 178.676 179.456 -0.780 25767 12268 1 14 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.371 0.350 25767 12269 1 14 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.031 -0.204 25767 12270 1 14 . 1 1 49 49 ALA H H 49 8.432 8.432 8.501 -0.069 25767 12271 1 14 . 1 1 50 50 THR N N 50 113.333 113.333 115.246 -1.913 25767 12272 1 14 . 1 1 50 50 THR HA H 50 3.895 3.895 3.839 0.056 25767 12273 1 14 . 1 1 50 50 THR C C 50 174.948 174.948 176.470 -1.522 25767 12274 1 14 . 1 1 50 50 THR CA C 50 67.334 67.334 67.280 0.054 25767 12275 1 14 . 1 1 50 50 THR CB C 50 68.864 68.864 68.602 0.262 25767 12276 1 14 . 1 1 50 50 THR H H 50 7.857 7.857 7.709 0.148 25767 12277 1 14 . 1 1 51 51 GLU N N 51 122.698 122.698 122.507 0.191 25767 12278 1 14 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.010 0.058 25767 12279 1 14 . 1 1 51 51 GLU C C 51 179.997 179.997 178.871 1.126 25767 12280 1 14 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.514 -0.081 25767 12281 1 14 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.612 -0.095 25767 12282 1 14 . 1 1 51 51 GLU H H 51 7.817 7.817 7.588 0.229 25767 12283 1 14 . 1 1 52 52 LEU N N 52 121.100 121.100 119.765 1.335 25767 12284 1 14 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.092 0.037 25767 12285 1 14 . 1 1 52 52 LEU CA C 52 57.889 57.889 58.282 -0.393 25767 12286 1 14 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.672 0.275 25767 12287 1 14 . 1 1 52 52 LEU H H 52 8.628 8.628 7.866 0.762 25767 12288 1 14 . 1 1 53 53 LEU N N 53 119.935 119.935 120.411 -0.476 25767 12289 1 14 . 1 1 53 53 LEU C C 53 179.671 179.671 178.430 1.241 25767 12290 1 14 . 1 1 53 53 LEU H H 53 8.303 8.303 7.717 0.586 25767 12291 1 14 . 1 1 54 54 ASP N N 54 120.339 120.339 118.584 1.755 25767 12292 1 14 . 1 1 54 54 ASP C C 54 179.106 179.106 178.403 0.703 25767 12293 1 14 . 1 1 54 54 ASP H H 54 7.901 7.901 8.069 -0.168 25767 12294 1 14 . 1 1 55 55 THR N N 55 120.237 120.237 116.871 3.366 25767 12295 1 14 . 1 1 55 55 THR HA H 55 3.696 3.696 4.043 -0.347 25767 12296 1 14 . 1 1 55 55 THR CA C 55 67.340 67.340 66.802 0.538 25767 12297 1 14 . 1 1 55 55 THR CB C 55 68.151 68.151 68.474 -0.323 25767 12298 1 14 . 1 1 55 55 THR H H 55 8.262 8.262 7.674 0.588 25767 12299 1 14 . 1 1 56 56 ILE N N 56 123.953 123.953 122.302 1.651 25767 12300 1 14 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.982 -0.139 25767 12301 1 14 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.964 -0.070 25767 12302 1 14 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.752 0.382 25767 12303 1 14 . 1 1 56 56 ILE H H 56 8.930 8.930 7.824 1.106 25767 12304 1 14 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.702 -0.121 25767 12305 1 14 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.122 -0.091 25767 12306 1 14 . 1 1 58 58 ALA C C 58 179.875 179.875 179.578 0.297 25767 12307 1 14 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.915 0.351 25767 12308 1 14 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.309 -0.324 25767 12309 1 14 . 1 1 58 58 ALA H H 58 7.764 7.764 8.232 -0.468 25767 12310 1 14 . 1 1 59 59 PHE N N 59 121.988 121.988 120.009 1.979 25767 12311 1 14 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.197 0.029 25767 12312 1 14 . 1 1 59 59 PHE CA C 59 61.439 61.439 59.697 1.742 25767 12313 1 14 . 1 1 59 59 PHE CB C 59 39.363 39.363 38.785 0.578 25767 12314 1 14 . 1 1 59 59 PHE H H 59 8.159 8.159 8.512 -0.353 25767 12315 1 14 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.245 0.296 25767 12316 1 14 . 1 1 60 60 LYS C C 60 179.438 179.438 178.769 0.669 25767 12317 1 14 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.224 0.912 25767 12318 1 14 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.042 0.016 25767 12319 1 14 . 1 1 61 61 LYS N N 61 119.262 119.262 116.772 2.490 25767 12320 1 14 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.164 -0.219 25767 12321 1 14 . 1 1 61 61 LYS C C 61 178.730 178.730 177.736 0.994 25767 12322 1 14 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.334 1.708 25767 12323 1 14 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.012 0.630 25767 12324 1 14 . 1 1 61 61 LYS H H 61 7.832 7.832 7.739 0.093 25767 12325 1 14 . 1 1 62 62 GLU N N 62 120.790 120.790 120.897 -0.107 25767 12326 1 14 . 1 1 62 62 GLU HA H 62 3.935 3.935 4.036 -0.101 25767 12327 1 14 . 1 1 62 62 GLU C C 62 178.424 178.424 178.117 0.307 25767 12328 1 14 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.896 -0.182 25767 12329 1 14 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.537 -0.307 25767 12330 1 14 . 1 1 62 62 GLU H H 62 7.982 7.982 7.695 0.287 25767 12331 1 14 . 1 1 63 63 ILE N N 63 118.463 118.463 117.042 1.421 25767 12332 1 14 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.847 -0.158 25767 12333 1 14 . 1 1 63 63 ILE C C 63 177.555 177.555 177.200 0.355 25767 12334 1 14 . 1 1 63 63 ILE CA C 63 61.499 61.499 62.755 -1.256 25767 12335 1 14 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.468 -1.944 25767 12336 1 14 . 1 1 63 63 ILE H H 63 7.732 7.732 7.428 0.304 25767 12337 1 14 . 1 1 64 64 GLY N N 64 107.973 107.973 107.013 0.960 25767 12338 1 14 . 1 1 64 64 GLY C C 64 175.271 175.271 175.054 0.217 25767 12339 1 14 . 1 1 64 64 GLY CA C 64 45.902 45.902 45.911 -0.009 25767 12340 1 14 . 1 1 64 64 GLY H H 64 7.661 7.661 7.815 -0.154 25767 12341 1 14 . 1 1 65 65 GLY N N 65 108.464 108.464 107.281 1.183 25767 12342 1 14 . 1 1 65 65 GLY C C 65 174.800 174.800 175.783 -0.983 25767 12343 1 14 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.330 0.316 25767 12344 1 14 . 1 1 65 65 GLY H H 65 7.808 7.808 8.261 -0.453 25767 12345 1 14 . 1 1 66 66 GLU N N 66 121.162 121.162 120.927 0.235 25767 12346 1 14 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.001 0.104 25767 12347 1 14 . 1 1 66 66 GLU C C 66 177.230 177.230 178.820 -1.590 25767 12348 1 14 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.007 -1.783 25767 12349 1 14 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.477 0.516 25767 12350 1 14 . 1 1 66 66 GLU H H 66 8.203 8.203 7.736 0.467 25767 12351 1 14 . 1 1 67 67 SER N N 67 116.468 116.468 114.367 2.101 25767 12352 1 14 . 1 1 67 67 SER HA H 67 4.249 4.249 4.208 0.041 25767 12353 1 14 . 1 1 67 67 SER C C 67 174.640 174.640 176.526 -1.886 25767 12354 1 14 . 1 1 67 67 SER CA C 67 58.930 58.930 60.932 -2.002 25767 12355 1 14 . 1 1 67 67 SER CB C 67 63.912 63.912 62.943 0.969 25767 12356 1 14 . 1 1 67 67 SER H H 67 8.206 8.206 8.517 -0.311 25767 12357 1 14 . 1 1 68 68 GLU N N 68 122.400 122.400 120.410 1.990 25767 12358 1 14 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.034 0.119 25767 12359 1 14 . 1 1 68 68 GLU C C 68 176.349 176.349 176.934 -0.585 25767 12360 1 14 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.422 -1.599 25767 12361 1 14 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.517 0.464 25767 12362 1 14 . 1 1 68 68 GLU H H 68 8.168 8.168 8.512 -0.344 25767 12363 1 14 . 1 1 69 69 ALA N N 69 124.342 124.342 119.707 4.635 25767 12364 1 14 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.114 0.074 25767 12365 1 14 . 1 1 69 69 ALA C C 69 178.027 178.027 177.896 0.131 25767 12366 1 14 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.696 -1.138 25767 12367 1 14 . 1 1 69 69 ALA CB C 69 19.492 19.492 19.018 0.474 25767 12368 1 14 . 1 1 69 69 ALA H H 69 7.939 7.939 7.313 0.626 25767 12369 1 14 . 1 1 70 70 GLU N N 70 121.059 121.059 118.686 2.373 25767 12370 1 14 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.447 -0.333 25767 12371 1 14 . 1 1 70 70 GLU C C 70 176.519 176.519 175.320 1.199 25767 12372 1 14 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.336 1.968 25767 12373 1 14 . 1 1 70 70 GLU CB C 70 29.827 29.827 30.907 -1.080 25767 12374 1 14 . 1 1 70 70 GLU H H 70 8.430 8.430 7.642 0.788 25767 12375 1 14 . 1 1 71 71 ASP N N 71 120.274 120.274 122.752 -2.478 25767 12376 1 14 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.315 0.217 25767 12377 1 14 . 1 1 71 71 ASP C C 71 176.369 176.369 176.620 -0.251 25767 12378 1 14 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.197 -0.946 25767 12379 1 14 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.291 1.549 25767 12380 1 14 . 1 1 71 71 ASP H H 71 8.305 8.305 8.859 -0.554 25767 12381 1 14 . 1 1 72 72 SER N N 72 116.165 116.165 113.374 2.791 25767 12382 1 14 . 1 1 72 72 SER HA H 72 4.241 4.241 4.062 0.179 25767 12383 1 14 . 1 1 72 72 SER C C 72 174.567 174.567 175.549 -0.982 25767 12384 1 14 . 1 1 72 72 SER CA C 72 59.031 59.031 61.681 -2.650 25767 12385 1 14 . 1 1 72 72 SER CB C 72 64.040 64.040 63.288 0.752 25767 12386 1 14 . 1 1 72 72 SER H H 72 7.964 7.964 8.643 -0.679 25767 12387 1 14 . 1 1 73 73 ASP N N 73 122.440 122.440 121.083 1.357 25767 12388 1 14 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.230 0.304 25767 12389 1 14 . 1 1 73 73 ASP C C 73 176.882 176.882 178.119 -1.237 25767 12390 1 14 . 1 1 73 73 ASP CA C 73 54.443 54.443 56.734 -2.291 25767 12391 1 14 . 1 1 73 73 ASP CB C 73 41.336 41.336 39.956 1.380 25767 12392 1 14 . 1 1 73 73 ASP H H 73 8.392 8.392 8.690 -0.298 25767 12393 1 14 . 1 1 74 74 LYS N N 74 123.270 123.270 120.570 2.700 25767 12394 1 14 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.217 -0.124 25767 12395 1 14 . 1 1 74 74 LYS C C 74 177.608 177.608 179.227 -1.619 25767 12396 1 14 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.749 -2.284 25767 12397 1 14 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.305 -0.159 25767 12398 1 14 . 1 1 74 74 LYS H H 74 8.317 8.317 7.543 0.774 25767 12399 1 14 . 1 1 75 75 SER N N 75 116.557 116.557 116.339 0.218 25767 12400 1 14 . 1 1 75 75 SER HA H 75 4.197 4.197 4.126 0.071 25767 12401 1 14 . 1 1 75 75 SER C C 75 175.988 175.988 176.386 -0.398 25767 12402 1 14 . 1 1 75 75 SER CA C 75 60.434 60.434 62.387 -1.953 25767 12403 1 14 . 1 1 75 75 SER CB C 75 63.172 63.172 63.002 0.170 25767 12404 1 14 . 1 1 75 75 SER H H 75 8.387 8.387 7.835 0.552 25767 12405 1 14 . 1 1 76 76 LEU N N 76 123.910 123.910 122.253 1.657 25767 12406 1 14 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.929 0.241 25767 12407 1 14 . 1 1 76 76 LEU C C 76 178.083 178.083 178.699 -0.616 25767 12408 1 14 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.687 -1.195 25767 12409 1 14 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.355 0.342 25767 12410 1 14 . 1 1 76 76 LEU H H 76 8.059 8.059 7.720 0.339 25767 12411 1 14 . 1 1 77 77 HIS N N 77 120.620 120.620 118.750 1.870 25767 12412 1 14 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.334 -0.046 25767 12413 1 14 . 1 1 77 77 HIS C C 77 177.667 177.667 178.296 -0.629 25767 12414 1 14 . 1 1 77 77 HIS CA C 77 58.422 58.422 59.326 -0.904 25767 12415 1 14 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.380 0.884 25767 12416 1 14 . 1 1 77 77 HIS H H 77 7.936 7.936 8.020 -0.084 25767 12417 1 14 . 1 1 78 78 VAL N N 78 121.774 121.774 120.204 1.570 25767 12418 1 14 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.739 -0.062 25767 12419 1 14 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.184 -0.578 25767 12420 1 14 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.194 0.670 25767 12421 1 14 . 1 1 78 78 VAL H H 78 7.916 7.916 8.010 -0.094 25767 12422 1 14 . 1 1 79 79 MET N N 79 119.660 119.660 118.856 0.804 25767 12423 1 14 . 1 1 79 79 MET HA H 79 3.925 3.925 3.930 -0.005 25767 12424 1 14 . 1 1 79 79 MET C C 79 177.077 177.077 178.524 -1.447 25767 12425 1 14 . 1 1 79 79 MET CA C 79 58.862 58.862 59.694 -0.832 25767 12426 1 14 . 1 1 79 79 MET CB C 79 32.852 32.852 32.134 0.718 25767 12427 1 14 . 1 1 79 79 MET H H 79 8.149 8.149 8.049 0.100 25767 12428 1 14 . 1 1 80 80 ASN N N 80 117.337 117.337 118.149 -0.812 25767 12429 1 14 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.586 -0.448 25767 12430 1 14 . 1 1 80 80 ASN C C 80 178.133 178.133 178.223 -0.090 25767 12431 1 14 . 1 1 80 80 ASN CA C 80 57.039 57.039 55.948 1.091 25767 12432 1 14 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.294 0.702 25767 12433 1 14 . 1 1 80 80 ASN H H 80 8.202 8.202 8.702 -0.500 25767 12434 1 14 . 1 1 81 81 THR N N 81 115.517 115.517 118.547 -3.030 25767 12435 1 14 . 1 1 81 81 THR HA H 81 3.896 3.896 4.112 -0.216 25767 12436 1 14 . 1 1 81 81 THR C C 81 175.186 175.186 176.722 -1.536 25767 12437 1 14 . 1 1 81 81 THR CA C 81 66.221 66.221 66.871 -0.650 25767 12438 1 14 . 1 1 81 81 THR CB C 81 69.087 69.087 68.970 0.117 25767 12439 1 14 . 1 1 81 81 THR H H 81 7.944 7.944 8.146 -0.202 25767 12440 1 14 . 1 1 82 82 LEU N N 82 119.074 119.074 120.001 -0.927 25767 12441 1 14 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.088 -0.107 25767 12442 1 14 . 1 1 82 82 LEU C C 82 177.583 177.583 177.893 -0.310 25767 12443 1 14 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.186 -0.646 25767 12444 1 14 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.908 -0.115 25767 12445 1 14 . 1 1 82 82 LEU H H 82 7.547 7.547 7.630 -0.083 25767 12446 1 14 . 1 1 83 83 ILE N N 83 118.085 118.085 115.356 2.729 25767 12447 1 14 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.473 0.370 25767 12448 1 14 . 1 1 83 83 ILE C C 83 176.413 176.413 177.341 -0.928 25767 12449 1 14 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.043 -0.316 25767 12450 1 14 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.012 -0.314 25767 12451 1 14 . 1 1 83 83 ILE H H 83 7.409 7.409 7.408 0.001 25767 12452 1 14 . 1 1 84 84 HIS N N 84 116.152 116.152 115.338 0.814 25767 12453 1 14 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.534 0.061 25767 12454 1 14 . 1 1 84 84 HIS C C 84 175.707 175.707 175.260 0.447 25767 12455 1 14 . 1 1 84 84 HIS CA C 84 58.628 58.628 56.990 1.638 25767 12456 1 14 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.887 0.516 25767 12457 1 14 . 1 1 84 84 HIS H H 84 7.194 7.194 7.564 -0.370 25767 12458 1 14 . 1 1 85 85 ASP N N 85 122.322 122.322 120.279 2.043 25767 12459 1 14 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.821 -0.287 25767 12460 1 14 . 1 1 85 85 ASP C C 85 175.580 175.580 176.613 -1.033 25767 12461 1 14 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.021 0.324 25767 12462 1 14 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.554 -0.436 25767 12463 1 14 . 1 1 85 85 ASP H H 85 8.505 8.505 7.732 0.773 25767 12464 1 14 . 1 1 86 86 GLN N N 86 122.783 122.783 126.413 -3.630 25767 12465 1 14 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.157 -0.194 25767 12466 1 14 . 1 1 86 86 GLN C C 86 178.581 178.581 177.687 0.894 25767 12467 1 14 . 1 1 86 86 GLN CA C 86 57.954 57.954 58.954 -1.000 25767 12468 1 14 . 1 1 86 86 GLN CB C 86 28.894 28.894 28.782 0.112 25767 12469 1 14 . 1 1 86 86 GLN H H 86 8.803 8.803 8.802 0.001 25767 12470 1 14 . 1 1 87 87 GLU N N 87 121.794 121.794 120.986 0.808 25767 12471 1 14 . 1 1 87 87 GLU HA H 87 4.013 4.013 3.803 0.210 25767 12472 1 14 . 1 1 87 87 GLU C C 87 178.290 178.290 178.957 -0.667 25767 12473 1 14 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.168 -0.130 25767 12474 1 14 . 1 1 87 87 GLU CB C 87 28.980 28.980 28.892 0.088 25767 12475 1 14 . 1 1 87 87 GLU H H 87 8.072 8.072 8.005 0.067 25767 12476 1 14 . 1 1 88 88 LYS N N 88 119.345 119.345 118.185 1.160 25767 12477 1 14 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.101 -0.346 25767 12478 1 14 . 1 1 88 88 LYS C C 88 180.040 180.040 178.605 1.435 25767 12479 1 14 . 1 1 88 88 LYS CA C 88 59.411 59.411 59.126 0.285 25767 12480 1 14 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.562 0.445 25767 12481 1 14 . 1 1 88 88 LYS H H 88 7.588 7.588 8.715 -1.127 25767 12482 1 14 . 1 1 89 89 ALA N N 89 123.933 123.933 122.308 1.625 25767 12483 1 14 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.220 -0.481 25767 12484 1 14 . 1 1 89 89 ALA C C 89 177.457 177.457 179.571 -2.114 25767 12485 1 14 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.191 0.778 25767 12486 1 14 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.283 0.373 25767 12487 1 14 . 1 1 89 89 ALA H H 89 8.500 8.500 7.451 1.049 25767 12488 1 14 . 1 1 90 90 LYS N N 90 119.244 119.244 119.747 -0.503 25767 12489 1 14 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.941 0.103 25767 12490 1 14 . 1 1 90 90 LYS C C 90 177.774 177.774 178.809 -1.035 25767 12491 1 14 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.911 -0.833 25767 12492 1 14 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.579 -2.338 25767 12493 1 14 . 1 1 90 90 LYS H H 90 6.845 6.845 7.675 -0.830 25767 12494 1 14 . 1 1 91 91 ILE N N 91 117.718 117.718 117.388 0.330 25767 12495 1 14 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.710 -0.312 25767 12496 1 14 . 1 1 91 91 ILE C C 91 177.670 177.670 177.580 0.090 25767 12497 1 14 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.879 -0.881 25767 12498 1 14 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.204 0.597 25767 12499 1 14 . 1 1 91 91 ILE H H 91 7.293 7.293 8.264 -0.971 25767 12500 1 14 . 1 1 92 92 TYR N N 92 121.868 121.868 121.426 0.442 25767 12501 1 14 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.076 0.047 25767 12502 1 14 . 1 1 92 92 TYR C C 92 178.781 178.781 177.572 1.209 25767 12503 1 14 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.448 -0.806 25767 12504 1 14 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.874 0.347 25767 12505 1 14 . 1 1 92 92 TYR H H 92 8.016 8.016 7.898 0.118 25767 12506 1 14 . 1 1 93 93 MET N N 93 118.984 118.984 118.138 0.846 25767 12507 1 14 . 1 1 93 93 MET HA H 93 3.952 3.952 4.067 -0.116 25767 12508 1 14 . 1 1 93 93 MET C C 93 179.925 179.925 178.336 1.589 25767 12509 1 14 . 1 1 93 93 MET CA C 93 57.589 57.589 59.312 -1.722 25767 12510 1 14 . 1 1 93 93 MET CB C 93 30.752 30.752 32.738 -1.986 25767 12511 1 14 . 1 1 93 93 MET H H 93 8.464 8.464 8.585 -0.121 25767 12512 1 14 . 1 1 94 94 LEU N N 94 125.441 125.441 122.052 3.389 25767 12513 1 14 . 1 1 94 94 LEU HA H 94 3.870 3.870 4.096 -0.226 25767 12514 1 14 . 1 1 94 94 LEU C C 94 177.937 177.937 178.939 -1.002 25767 12515 1 14 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.035 0.726 25767 12516 1 14 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.721 0.041 25767 12517 1 14 . 1 1 94 94 LEU H H 94 8.927 8.927 8.952 -0.025 25767 12518 1 14 . 1 1 95 95 ASN N N 95 119.066 119.066 117.533 1.533 25767 12519 1 14 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.360 -0.098 25767 12520 1 14 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.084 0.188 25767 12521 1 14 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.033 -0.428 25767 12522 1 14 . 1 1 95 95 ASN H H 95 8.691 8.691 8.195 0.496 25767 12523 1 14 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.287 0.378 25767 12524 1 14 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.533 0.538 25767 12525 1 14 . 1 1 96 96 PHE H H 96 8.317 8.317 7.929 0.388 25767 12526 1 14 . 1 1 97 97 THR N N 97 118.178 118.178 114.787 3.391 25767 12527 1 14 . 1 1 97 97 THR HA H 97 3.338 3.338 3.876 -0.538 25767 12528 1 14 . 1 1 97 97 THR C C 97 176.074 176.074 176.822 -0.748 25767 12529 1 14 . 1 1 97 97 THR CA C 97 67.986 67.986 66.481 1.505 25767 12530 1 14 . 1 1 97 97 THR H H 97 8.214 8.214 8.909 -0.695 25767 12531 1 14 . 1 1 98 98 MET N N 98 120.097 120.097 121.661 -1.564 25767 12532 1 14 . 1 1 98 98 MET HA H 98 4.403 4.403 4.063 0.340 25767 12533 1 14 . 1 1 98 98 MET C C 98 178.696 178.696 178.159 0.537 25767 12534 1 14 . 1 1 98 98 MET CA C 98 57.029 57.029 59.396 -2.367 25767 12535 1 14 . 1 1 98 98 MET CB C 98 29.898 29.898 32.545 -2.647 25767 12536 1 14 . 1 1 98 98 MET H H 98 8.885 8.885 8.505 0.380 25767 12537 1 14 . 1 1 99 99 SER N N 99 114.959 114.959 116.027 -1.068 25767 12538 1 14 . 1 1 99 99 SER HA H 99 4.199 4.199 4.082 0.117 25767 12539 1 14 . 1 1 99 99 SER C C 99 176.565 176.565 176.594 -0.029 25767 12540 1 14 . 1 1 99 99 SER CA C 99 61.965 61.965 61.725 0.240 25767 12541 1 14 . 1 1 99 99 SER CB C 99 62.565 62.565 63.102 -0.537 25767 12542 1 14 . 1 1 99 99 SER H H 99 7.515 7.515 7.771 -0.256 25767 12543 1 14 . 1 1 100 100 LEU N N 100 125.380 125.380 123.908 1.472 25767 12544 1 14 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.892 -0.116 25767 12545 1 14 . 1 1 100 100 LEU C C 100 177.689 177.689 178.085 -0.396 25767 12546 1 14 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.242 0.815 25767 12547 1 14 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.559 -0.009 25767 12548 1 14 . 1 1 100 100 LEU H H 100 7.400 7.400 8.324 -0.924 25767 12549 1 14 . 1 1 101 101 TYR N N 101 120.597 120.597 119.857 0.740 25767 12550 1 14 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.895 0.221 25767 12551 1 14 . 1 1 101 101 TYR C C 101 176.825 176.825 177.345 -0.520 25767 12552 1 14 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.616 -0.728 25767 12553 1 14 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.154 0.839 25767 12554 1 14 . 1 1 101 101 TYR H H 101 8.880 8.880 8.894 -0.014 25767 12555 1 14 . 1 1 102 102 ASN N N 102 116.869 116.869 116.681 0.188 25767 12556 1 14 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.267 -0.101 25767 12557 1 14 . 1 1 102 102 ASN C C 102 179.089 179.089 177.697 1.392 25767 12558 1 14 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.077 0.135 25767 12559 1 14 . 1 1 102 102 ASN CB C 102 37.734 37.734 38.176 -0.442 25767 12560 1 14 . 1 1 102 102 ASN H H 102 8.543 8.543 7.942 0.601 25767 12561 1 14 . 1 1 103 103 GLU N N 103 121.259 121.259 119.845 1.414 25767 12562 1 14 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.817 0.169 25767 12563 1 14 . 1 1 103 103 GLU C C 103 179.968 179.968 178.731 1.237 25767 12564 1 14 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.312 0.205 25767 12565 1 14 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.366 0.184 25767 12566 1 14 . 1 1 103 103 GLU H H 103 7.872 7.872 8.253 -0.381 25767 12567 1 14 . 1 1 104 104 LYS N N 104 120.268 120.268 121.076 -0.808 25767 12568 1 14 . 1 1 104 104 LYS HA H 104 4.046 4.046 3.995 0.051 25767 12569 1 14 . 1 1 104 104 LYS C C 104 178.355 178.355 178.713 -0.358 25767 12570 1 14 . 1 1 104 104 LYS CA C 104 56.735 56.735 58.868 -2.133 25767 12571 1 14 . 1 1 104 104 LYS CB C 104 29.113 29.113 31.978 -2.865 25767 12572 1 14 . 1 1 104 104 LYS H H 104 8.384 8.384 8.100 0.284 25767 12573 1 14 . 1 1 105 105 LEU N N 105 121.622 121.622 118.986 2.636 25767 12574 1 14 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.628 0.113 25767 12575 1 14 . 1 1 105 105 LEU C C 105 180.552 180.552 178.864 1.688 25767 12576 1 14 . 1 1 105 105 LEU CA C 105 58.172 58.172 57.803 0.369 25767 12577 1 14 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.365 -0.335 25767 12578 1 14 . 1 1 105 105 LEU H H 105 8.400 8.400 7.602 0.798 25767 12579 1 14 . 1 1 106 106 LYS N N 106 119.498 119.498 118.062 1.436 25767 12580 1 14 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.827 0.087 25767 12581 1 14 . 1 1 106 106 LYS C C 106 178.419 178.419 178.707 -0.288 25767 12582 1 14 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.859 -0.476 25767 12583 1 14 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.879 -0.071 25767 12584 1 14 . 1 1 106 106 LYS H H 106 7.067 7.067 7.635 -0.568 25767 12585 1 14 . 1 1 107 107 GLN N N 107 121.405 121.405 119.840 1.565 25767 12586 1 14 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.972 -0.121 25767 12587 1 14 . 1 1 107 107 GLN C C 107 177.935 177.935 178.682 -0.747 25767 12588 1 14 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.939 -0.458 25767 12589 1 14 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.424 -1.626 25767 12590 1 14 . 1 1 107 107 GLN H H 107 7.460 7.460 8.048 -0.588 25767 12591 1 14 . 1 1 108 108 LEU N N 108 119.561 119.561 118.766 0.795 25767 12592 1 14 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.832 -0.031 25767 12593 1 14 . 1 1 108 108 LEU C C 108 179.195 179.195 178.345 0.850 25767 12594 1 14 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.620 0.774 25767 12595 1 14 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.949 -0.683 25767 12596 1 14 . 1 1 108 108 LEU H H 108 8.208 8.208 7.662 0.546 25767 12597 1 14 . 1 1 109 109 LYS N N 109 118.535 118.535 116.487 2.048 25767 12598 1 14 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.183 0.069 25767 12599 1 14 . 1 1 109 109 LYS C C 109 177.726 177.726 178.105 -0.379 25767 12600 1 14 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.575 0.155 25767 12601 1 14 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.846 -0.436 25767 12602 1 14 . 1 1 109 109 LYS H H 109 7.168 7.168 7.449 -0.281 25767 12603 1 14 . 1 1 110 110 ASP N N 110 117.463 117.463 117.096 0.367 25767 12604 1 14 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.561 0.044 25767 12605 1 14 . 1 1 110 110 ASP C C 110 177.360 177.360 176.826 0.534 25767 12606 1 14 . 1 1 110 110 ASP CA C 110 55.896 55.896 55.194 0.702 25767 12607 1 14 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.385 1.192 25767 12608 1 14 . 1 1 110 110 ASP H H 110 7.861 7.861 8.442 -0.581 25767 12609 1 14 . 1 1 111 111 GLY N N 111 113.059 113.059 108.255 4.804 25767 12610 1 14 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.771 -0.719 25767 12611 1 14 . 1 1 111 111 GLY H H 111 8.479 8.479 7.782 0.697 25767 12612 1 14 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.044 0.419 25767 12613 1 14 . 1 1 112 112 PRO C C 112 175.090 175.090 175.647 -0.557 25767 12614 1 14 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.121 -0.757 25767 12615 1 14 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.752 2.098 25767 12616 1 14 . 1 1 113 113 TRP N N 113 123.164 123.164 121.820 1.344 25767 12617 1 14 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.745 -0.035 25767 12618 1 14 . 1 1 113 113 TRP C C 113 174.605 174.605 175.129 -0.524 25767 12619 1 14 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.068 0.837 25767 12620 1 14 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.417 -3.124 25767 12621 1 14 . 1 1 113 113 TRP H H 113 8.687 8.687 8.453 0.234 25767 12622 1 14 . 1 1 114 114 ASP N N 114 121.356 121.356 122.104 -0.748 25767 12623 1 14 . 1 1 114 114 ASP HA H 114 4.861 4.861 5.002 -0.141 25767 12624 1 14 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.769 -0.520 25767 12625 1 14 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.479 -1.338 25767 12626 1 14 . 1 1 114 114 ASP H H 114 6.985 6.985 8.334 -1.349 25767 12627 1 14 . 1 1 115 115 VAL N N 115 118.649 118.649 118.348 0.301 25767 12628 1 14 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.795 0.047 25767 12629 1 14 . 1 1 115 115 VAL C C 115 177.739 177.739 177.415 0.324 25767 12630 1 14 . 1 1 115 115 VAL CA C 115 65.569 65.569 66.099 -0.530 25767 12631 1 14 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.092 -0.415 25767 12632 1 14 . 1 1 115 115 VAL H H 115 8.206 8.206 8.406 -0.200 25767 12633 1 14 . 1 1 116 116 MET N N 116 120.401 120.401 118.778 1.623 25767 12634 1 14 . 1 1 116 116 MET HA H 116 4.303 4.303 4.234 0.069 25767 12635 1 14 . 1 1 116 116 MET C C 116 179.269 179.269 178.432 0.837 25767 12636 1 14 . 1 1 116 116 MET CA C 116 57.634 57.634 58.926 -1.292 25767 12637 1 14 . 1 1 116 116 MET CB C 116 30.414 30.414 31.619 -1.205 25767 12638 1 14 . 1 1 116 116 MET H H 116 7.642 7.642 8.055 -0.413 25767 12639 1 14 . 1 1 117 117 LEU N N 117 125.503 125.503 120.729 4.774 25767 12640 1 14 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.023 0.222 25767 12641 1 14 . 1 1 117 117 LEU C C 117 178.445 178.445 178.608 -0.163 25767 12642 1 14 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.952 0.248 25767 12643 1 14 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.623 -1.534 25767 12644 1 14 . 1 1 117 117 LEU H H 117 8.157 8.157 7.465 0.692 25767 12645 1 14 . 1 1 118 118 LYS N N 118 119.052 119.052 118.890 0.162 25767 12646 1 14 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.958 -0.153 25767 12647 1 14 . 1 1 118 118 LYS C C 118 178.251 178.251 179.263 -1.012 25767 12648 1 14 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.247 0.279 25767 12649 1 14 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.248 -0.120 25767 12650 1 14 . 1 1 118 118 LYS H H 118 7.400 7.400 7.757 -0.357 25767 12651 1 14 . 1 1 119 119 ARG N N 119 117.999 117.999 119.136 -1.137 25767 12652 1 14 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.284 -0.064 25767 12653 1 14 . 1 1 119 119 ARG C C 119 180.441 180.441 179.098 1.343 25767 12654 1 14 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.611 0.206 25767 12655 1 14 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.226 -0.141 25767 12656 1 14 . 1 1 119 119 ARG H H 119 8.265 8.265 7.949 0.316 25767 12657 1 14 . 1 1 120 120 SER N N 120 118.073 118.073 115.417 2.656 25767 12658 1 14 . 1 1 120 120 SER HA H 120 4.182 4.182 4.300 -0.118 25767 12659 1 14 . 1 1 120 120 SER C C 120 176.215 176.215 176.587 -0.372 25767 12660 1 14 . 1 1 120 120 SER CA C 120 62.817 62.817 61.573 1.244 25767 12661 1 14 . 1 1 120 120 SER CB C 120 63.550 63.550 63.269 0.281 25767 12662 1 14 . 1 1 120 120 SER H H 120 8.633 8.633 7.883 0.750 25767 12663 1 14 . 1 1 121 121 LEU N N 121 125.029 125.029 123.859 1.170 25767 12664 1 14 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.120 0.099 25767 12665 1 14 . 1 1 121 121 LEU C C 121 179.679 179.679 178.246 1.433 25767 12666 1 14 . 1 1 121 121 LEU CA C 121 58.849 58.849 57.895 0.954 25767 12667 1 14 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.873 -1.099 25767 12668 1 14 . 1 1 121 121 LEU H H 121 8.313 8.313 7.831 0.482 25767 12669 1 14 . 1 1 122 122 TRP N N 122 120.217 120.217 119.004 1.213 25767 12670 1 14 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.343 -0.003 25767 12671 1 14 . 1 1 122 122 TRP C C 122 177.527 177.527 178.619 -1.092 25767 12672 1 14 . 1 1 122 122 TRP CA C 122 61.758 61.758 61.224 0.534 25767 12673 1 14 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.069 0.579 25767 12674 1 14 . 1 1 122 122 TRP H H 122 7.928 7.928 7.843 0.085 25767 12675 1 14 . 1 1 123 123 CYS N N 123 119.669 119.669 119.094 0.575 25767 12676 1 14 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.409 -0.202 25767 12677 1 14 . 1 1 123 123 CYS C C 123 177.057 177.057 177.393 -0.336 25767 12678 1 14 . 1 1 123 123 CYS CA C 123 62.600 62.600 62.143 0.457 25767 12679 1 14 . 1 1 123 123 CYS CB C 123 25.899 25.899 25.909 -0.010 25767 12680 1 14 . 1 1 123 123 CYS H H 123 8.273 8.273 8.163 0.110 25767 12681 1 14 . 1 1 124 124 CYS N N 124 116.898 116.898 119.564 -2.666 25767 12682 1 14 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.102 -0.254 25767 12683 1 14 . 1 1 124 124 CYS C C 124 175.759 175.759 176.803 -1.044 25767 12684 1 14 . 1 1 124 124 CYS CA C 124 65.653 65.653 64.846 0.807 25767 12685 1 14 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.561 -0.044 25767 12686 1 14 . 1 1 124 124 CYS H H 124 8.122 8.122 7.835 0.287 25767 12687 1 14 . 1 1 125 125 ILE N N 125 120.498 120.498 121.071 -0.573 25767 12688 1 14 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.697 -0.109 25767 12689 1 14 . 1 1 125 125 ILE C C 125 179.337 179.337 177.579 1.758 25767 12690 1 14 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.654 1.940 25767 12691 1 14 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.395 0.284 25767 12692 1 14 . 1 1 125 125 ILE H H 125 8.092 8.092 7.857 0.235 25767 12693 1 14 . 1 1 126 126 ASP N N 126 125.084 125.084 120.760 4.324 25767 12694 1 14 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.438 0.179 25767 12695 1 14 . 1 1 126 126 ASP C C 126 178.299 178.299 179.126 -0.827 25767 12696 1 14 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.524 1.480 25767 12697 1 14 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.079 0.217 25767 12698 1 14 . 1 1 126 126 ASP H H 126 9.049 9.049 8.085 0.964 25767 12699 1 14 . 1 1 127 127 LEU N N 127 122.591 122.591 120.897 1.694 25767 12700 1 14 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.979 -0.112 25767 12701 1 14 . 1 1 127 127 LEU C C 127 179.655 179.655 179.294 0.361 25767 12702 1 14 . 1 1 127 127 LEU CA C 127 58.661 58.661 57.952 0.709 25767 12703 1 14 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.965 0.229 25767 12704 1 14 . 1 1 127 127 LEU H H 127 8.888 8.888 7.839 1.049 25767 12705 1 14 . 1 1 128 128 PHE N N 128 117.498 117.498 119.507 -2.009 25767 12706 1 14 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.142 0.180 25767 12707 1 14 . 1 1 128 128 PHE C C 128 178.533 178.533 177.435 1.098 25767 12708 1 14 . 1 1 128 128 PHE CA C 128 60.932 60.932 61.607 -0.675 25767 12709 1 14 . 1 1 128 128 PHE CB C 128 39.053 39.053 39.565 -0.512 25767 12710 1 14 . 1 1 128 128 PHE H H 128 8.947 8.947 8.071 0.876 25767 12711 1 14 . 1 1 129 129 SER N N 129 115.398 115.398 116.256 -0.858 25767 12712 1 14 . 1 1 129 129 SER HA H 129 4.046 4.046 4.357 -0.311 25767 12713 1 14 . 1 1 129 129 SER C C 129 175.168 175.168 176.783 -1.615 25767 12714 1 14 . 1 1 129 129 SER CA C 129 63.015 63.015 62.267 0.748 25767 12715 1 14 . 1 1 129 129 SER H H 129 8.578 8.578 9.156 -0.578 25767 12716 1 14 . 1 1 130 130 CYS N N 130 125.556 125.556 120.122 5.434 25767 12717 1 14 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.282 -0.173 25767 12718 1 14 . 1 1 130 130 CYS C C 130 175.294 175.294 176.634 -1.340 25767 12719 1 14 . 1 1 130 130 CYS CA C 130 61.438 61.438 62.342 -0.904 25767 12720 1 14 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.148 -0.098 25767 12721 1 14 . 1 1 130 130 CYS H H 130 8.289 8.289 8.641 -0.352 25767 12722 1 14 . 1 1 131 131 ILE N N 131 120.232 120.232 122.524 -2.292 25767 12723 1 14 . 1 1 131 131 ILE HA H 131 4.033 4.033 3.934 0.099 25767 12724 1 14 . 1 1 131 131 ILE C C 131 177.297 177.297 178.517 -1.220 25767 12725 1 14 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.019 -0.367 25767 12726 1 14 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.690 1.412 25767 12727 1 14 . 1 1 131 131 ILE H H 131 7.943 7.943 7.578 0.365 25767 12728 1 14 . 1 1 132 132 LEU N N 132 116.422 116.422 120.354 -3.932 25767 12729 1 14 . 1 1 132 132 LEU HA H 132 3.845 3.845 3.877 -0.032 25767 12730 1 14 . 1 1 132 132 LEU C C 132 177.816 177.816 178.307 -0.491 25767 12731 1 14 . 1 1 132 132 LEU CA C 132 57.078 57.078 57.946 -0.868 25767 12732 1 14 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.595 0.618 25767 12733 1 14 . 1 1 132 132 LEU H H 132 7.846 7.846 8.176 -0.330 25767 12734 1 14 . 1 1 133 133 HIS N N 133 116.929 116.929 118.419 -1.490 25767 12735 1 14 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.246 -0.107 25767 12736 1 14 . 1 1 133 133 HIS C C 133 178.669 178.669 177.881 0.788 25767 12737 1 14 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.848 -0.112 25767 12738 1 14 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.110 3.042 25767 12739 1 14 . 1 1 133 133 HIS H H 133 7.822 7.822 7.940 -0.118 25767 12740 1 14 . 1 1 134 134 LEU N N 134 116.898 116.898 118.182 -1.284 25767 12741 1 14 . 1 1 134 134 LEU HA H 134 3.733 3.733 3.942 -0.209 25767 12742 1 14 . 1 1 134 134 LEU C C 134 179.402 179.402 179.278 0.124 25767 12743 1 14 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.485 -0.258 25767 12744 1 14 . 1 1 134 134 LEU CB C 134 39.539 39.539 41.288 -1.749 25767 12745 1 14 . 1 1 134 134 LEU H H 134 8.688 8.688 7.558 1.130 25767 12746 1 14 . 1 1 135 135 TRP N N 135 115.602 115.602 116.115 -0.513 25767 12747 1 14 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.673 0.335 25767 12748 1 14 . 1 1 135 135 TRP C C 135 175.022 175.022 178.188 -3.166 25767 12749 1 14 . 1 1 135 135 TRP CA C 135 59.426 59.426 56.741 2.685 25767 12750 1 14 . 1 1 135 135 TRP CB C 135 27.085 27.085 28.803 -1.718 25767 12751 1 14 . 1 1 135 135 TRP H H 135 7.638 7.638 7.518 0.120 25767 12752 1 14 . 1 1 136 136 LYS N N 136 119.721 119.721 123.472 -3.751 25767 12753 1 14 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.975 -0.159 25767 12754 1 14 . 1 1 136 136 LYS C C 136 178.279 178.279 178.210 0.069 25767 12755 1 14 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.769 0.424 25767 12756 1 14 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.879 1.178 25767 12757 1 14 . 1 1 136 136 LYS H H 136 6.538 6.538 8.220 -1.682 25767 12758 1 14 . 1 1 137 137 GLU N N 137 115.407 115.407 115.127 0.280 25767 12759 1 14 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.197 -0.030 25767 12760 1 14 . 1 1 137 137 GLU C C 137 176.700 176.700 177.226 -0.526 25767 12761 1 14 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.326 -0.476 25767 12762 1 14 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.027 0.133 25767 12763 1 14 . 1 1 137 137 GLU H H 137 8.596 8.596 8.310 0.286 25767 12764 1 14 . 1 1 138 138 ASN N N 138 116.669 116.669 116.926 -0.257 25767 12765 1 14 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.775 0.131 25767 12766 1 14 . 1 1 138 138 ASN C C 138 173.481 173.481 175.119 -1.638 25767 12767 1 14 . 1 1 138 138 ASN CA C 138 52.814 52.814 54.184 -1.369 25767 12768 1 14 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.718 1.119 25767 12769 1 14 . 1 1 138 138 ASN H H 138 8.343 8.343 8.148 0.195 25767 12770 1 14 . 1 1 139 139 ILE N N 139 120.703 120.703 120.729 -0.026 25767 12771 1 14 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.237 0.107 25767 12772 1 14 . 1 1 139 139 ILE C C 139 175.241 175.241 174.921 0.320 25767 12773 1 14 . 1 1 139 139 ILE CA C 139 60.792 60.792 60.869 -0.077 25767 12774 1 14 . 1 1 139 139 ILE CB C 139 40.274 40.274 40.024 0.250 25767 12775 1 14 . 1 1 139 139 ILE H H 139 7.167 7.167 7.459 -0.292 25767 12776 1 14 . 1 1 140 140 SER N N 140 123.284 123.284 120.323 2.961 25767 12777 1 14 . 1 1 140 140 SER HA H 140 4.345 4.345 4.486 -0.141 25767 12778 1 14 . 1 1 140 140 SER CA C 140 58.095 58.095 57.242 0.853 25767 12779 1 14 . 1 1 140 140 SER CB C 140 65.370 65.370 64.666 0.704 25767 12780 1 14 . 1 1 140 140 SER H H 140 8.727 8.727 8.486 0.241 25767 12781 1 14 . 1 1 142 142 THR N N 142 113.868 113.868 115.388 -1.520 25767 12782 1 14 . 1 1 142 142 THR HA H 142 3.976 3.976 4.052 -0.076 25767 12783 1 14 . 1 1 142 142 THR C C 142 177.559 177.559 176.887 0.672 25767 12784 1 14 . 1 1 142 142 THR CA C 142 66.007 66.007 66.367 -0.360 25767 12785 1 14 . 1 1 142 142 THR CB C 142 68.530 68.530 68.660 -0.130 25767 12786 1 14 . 1 1 142 142 THR H H 142 8.243 8.243 8.096 0.147 25767 12787 1 14 . 1 1 143 143 SER N N 143 120.786 120.786 118.082 2.704 25767 12788 1 14 . 1 1 143 143 SER C C 143 175.844 175.844 176.554 -0.710 25767 12789 1 14 . 1 1 143 143 SER CA C 143 62.102 62.102 61.908 0.194 25767 12790 1 14 . 1 1 143 143 SER CB C 143 63.086 63.086 63.116 -0.030 25767 12791 1 14 . 1 1 143 143 SER H H 143 7.915 7.915 8.159 -0.244 25767 12792 1 14 . 1 1 144 144 THR N N 144 120.946 120.946 117.621 3.325 25767 12793 1 14 . 1 1 144 144 THR HA H 144 4.299 4.299 4.107 0.192 25767 12794 1 14 . 1 1 144 144 THR C C 144 175.874 175.874 176.322 -0.448 25767 12795 1 14 . 1 1 144 144 THR CA C 144 67.487 67.487 65.994 1.493 25767 12796 1 14 . 1 1 144 144 THR CB C 144 68.485 68.485 68.815 -0.330 25767 12797 1 14 . 1 1 144 144 THR H H 144 8.746 8.746 8.534 0.212 25767 12798 1 14 . 1 1 145 145 ASN N N 145 120.069 120.069 119.964 0.105 25767 12799 1 14 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.390 -0.082 25767 12800 1 14 . 1 1 145 145 ASN C C 145 177.917 177.917 177.795 0.122 25767 12801 1 14 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.852 -0.515 25767 12802 1 14 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.482 -0.382 25767 12803 1 14 . 1 1 145 145 ASN H H 145 7.940 7.940 8.647 -0.707 25767 12804 1 14 . 1 1 146 146 SER N N 146 116.905 116.905 116.056 0.849 25767 12805 1 14 . 1 1 146 146 SER HA H 146 3.936 3.936 4.181 -0.245 25767 12806 1 14 . 1 1 146 146 SER C C 146 176.963 176.963 176.752 0.211 25767 12807 1 14 . 1 1 146 146 SER CA C 146 61.997 61.997 61.975 0.022 25767 12808 1 14 . 1 1 146 146 SER CB C 146 62.879 62.879 62.890 -0.011 25767 12809 1 14 . 1 1 146 146 SER H H 146 7.951 7.951 7.724 0.227 25767 12810 1 14 . 1 1 147 147 LEU N N 147 123.253 123.253 122.276 0.977 25767 12811 1 14 . 1 1 147 147 LEU HA H 147 3.875 3.875 4.011 -0.136 25767 12812 1 14 . 1 1 147 147 LEU C C 147 178.726 178.726 178.925 -0.199 25767 12813 1 14 . 1 1 147 147 LEU CA C 147 58.580 58.580 58.456 0.124 25767 12814 1 14 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.772 -0.911 25767 12815 1 14 . 1 1 147 147 LEU H H 147 8.168 8.168 7.617 0.551 25767 12816 1 14 . 1 1 148 148 GLN N N 148 118.212 118.212 117.890 0.322 25767 12817 1 14 . 1 1 148 148 GLN HA H 148 3.817 3.817 3.977 -0.160 25767 12818 1 14 . 1 1 148 148 GLN C C 148 179.686 179.686 178.685 1.001 25767 12819 1 14 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.194 1.049 25767 12820 1 14 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.587 0.133 25767 12821 1 14 . 1 1 148 148 GLN H H 148 8.295 8.295 8.848 -0.553 25767 12822 1 14 . 1 1 149 149 LYS N N 149 120.770 120.770 120.395 0.375 25767 12823 1 14 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.986 -0.085 25767 12824 1 14 . 1 1 149 149 LYS C C 149 178.006 178.006 179.082 -1.076 25767 12825 1 14 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.636 -0.104 25767 12826 1 14 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.129 -0.237 25767 12827 1 14 . 1 1 149 149 LYS H H 149 7.955 7.955 8.011 -0.056 25767 12828 1 14 . 1 1 150 150 ARG N N 150 119.244 119.244 118.731 0.513 25767 12829 1 14 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.922 -0.082 25767 12830 1 14 . 1 1 150 150 ARG C C 150 178.858 178.858 178.740 0.118 25767 12831 1 14 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.547 -0.176 25767 12832 1 14 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.813 -1.009 25767 12833 1 14 . 1 1 150 150 ARG H H 150 7.020 7.020 7.497 -0.477 25767 12834 1 14 . 1 1 151 151 ILE N N 151 121.183 121.183 119.635 1.548 25767 12835 1 14 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.821 -0.462 25767 12836 1 14 . 1 1 151 151 ILE C C 151 177.327 177.327 178.175 -0.848 25767 12837 1 14 . 1 1 151 151 ILE CA C 151 67.196 67.196 62.429 4.767 25767 12838 1 14 . 1 1 151 151 ILE CB C 151 38.272 38.272 36.663 1.609 25767 12839 1 14 . 1 1 151 151 ILE H H 151 7.574 7.574 7.753 -0.179 25767 12840 1 14 . 1 1 152 152 LYS N N 152 119.521 119.521 121.013 -1.492 25767 12841 1 14 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.842 -0.069 25767 12842 1 14 . 1 1 152 152 LYS C C 152 178.016 178.016 178.598 -0.582 25767 12843 1 14 . 1 1 152 152 LYS CA C 152 59.830 59.830 60.217 -0.387 25767 12844 1 14 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.409 -0.828 25767 12845 1 14 . 1 1 152 152 LYS H H 152 7.629 7.629 8.311 -0.682 25767 12846 1 14 . 1 1 153 153 TYR N N 153 120.178 120.178 120.372 -0.194 25767 12847 1 14 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.136 -0.064 25767 12848 1 14 . 1 1 153 153 TYR C C 153 178.195 178.195 177.805 0.390 25767 12849 1 14 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.892 -0.575 25767 12850 1 14 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.486 -1.213 25767 12851 1 14 . 1 1 153 153 TYR H H 153 8.407 8.407 8.144 0.263 25767 12852 1 14 . 1 1 154 154 CYS N N 154 117.013 117.013 118.090 -1.077 25767 12853 1 14 . 1 1 154 154 CYS HA H 154 4.072 4.072 3.970 0.102 25767 12854 1 14 . 1 1 154 154 CYS C C 154 176.827 176.827 176.820 0.007 25767 12855 1 14 . 1 1 154 154 CYS CA C 154 65.780 65.780 64.194 1.586 25767 12856 1 14 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.621 0.539 25767 12857 1 14 . 1 1 154 154 CYS H H 154 8.291 8.291 7.874 0.417 25767 12858 1 14 . 1 1 155 155 LYS N N 155 118.753 118.753 120.429 -1.676 25767 12859 1 14 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.805 -0.134 25767 12860 1 14 . 1 1 155 155 LYS C C 155 179.904 179.904 178.823 1.081 25767 12861 1 14 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.386 1.098 25767 12862 1 14 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.168 -0.225 25767 12863 1 14 . 1 1 155 155 LYS H H 155 7.934 7.934 8.033 -0.099 25767 12864 1 14 . 1 1 156 156 ILE N N 156 123.873 123.873 121.101 2.772 25767 12865 1 14 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.582 0.002 25767 12866 1 14 . 1 1 156 156 ILE C C 156 179.501 179.501 177.615 1.886 25767 12867 1 14 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.698 -0.458 25767 12868 1 14 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.889 -0.247 25767 12869 1 14 . 1 1 156 156 ILE H H 156 8.314 8.314 8.483 -0.169 25767 12870 1 14 . 1 1 157 157 TYR N N 157 121.132 121.132 119.853 1.279 25767 12871 1 14 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.949 0.216 25767 12872 1 14 . 1 1 157 157 TYR C C 157 178.558 178.558 177.449 1.109 25767 12873 1 14 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.997 0.113 25767 12874 1 14 . 1 1 157 157 TYR H H 157 8.442 8.442 7.525 0.917 25767 12875 1 14 . 1 1 158 158 LEU N N 158 120.964 120.964 119.713 1.251 25767 12876 1 14 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.821 0.091 25767 12877 1 14 . 1 1 158 158 LEU C C 158 180.130 180.130 178.639 1.491 25767 12878 1 14 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.595 1.091 25767 12879 1 14 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.648 0.082 25767 12880 1 14 . 1 1 158 158 LEU H H 158 8.469 8.469 7.856 0.613 25767 12881 1 14 . 1 1 159 159 SER N N 159 116.653 116.653 115.224 1.429 25767 12882 1 14 . 1 1 159 159 SER HA H 159 4.246 4.246 4.015 0.231 25767 12883 1 14 . 1 1 159 159 SER CA C 159 61.460 61.460 62.169 -0.709 25767 12884 1 14 . 1 1 159 159 SER CB C 159 62.849 62.849 62.850 -0.001 25767 12885 1 14 . 1 1 159 159 SER H H 159 7.758 7.758 8.481 -0.723 25767 12886 1 14 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.151 -1.778 25767 12887 1 14 . 1 1 160 160 LYS CB C 160 29.832 29.832 32.032 -2.200 25767 12888 1 14 . 1 1 160 160 LYS H H 160 8.425 8.425 7.367 1.058 25767 12889 1 14 . 1 1 161 161 LEU N N 161 121.686 121.686 119.046 2.640 25767 12890 1 14 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.715 0.448 25767 12891 1 14 . 1 1 161 161 LEU C C 161 180.224 180.224 179.096 1.128 25767 12892 1 14 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.355 0.229 25767 12893 1 14 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.439 0.023 25767 12894 1 14 . 1 1 161 161 LEU H H 161 8.323 8.323 7.452 0.871 25767 12895 1 14 . 1 1 162 162 ALA N N 162 123.102 123.102 120.339 2.763 25767 12896 1 14 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.067 0.063 25767 12897 1 14 . 1 1 162 162 ALA C C 162 179.487 179.487 178.829 0.658 25767 12898 1 14 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.606 0.138 25767 12899 1 14 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.421 -0.018 25767 12900 1 14 . 1 1 162 162 ALA H H 162 7.978 7.978 7.520 0.458 25767 12901 1 14 . 1 1 163 163 LYS N N 163 116.069 116.069 117.931 -1.862 25767 12902 1 14 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.203 0.020 25767 12903 1 14 . 1 1 163 163 LYS C C 163 176.987 176.987 177.095 -0.108 25767 12904 1 14 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.245 0.361 25767 12905 1 14 . 1 1 163 163 LYS CB C 163 33.206 33.206 33.039 0.167 25767 12906 1 14 . 1 1 163 163 LYS H H 163 7.697 7.697 7.668 0.029 25767 12907 1 14 . 1 1 164 164 GLY N N 164 108.540 108.540 106.781 1.759 25767 12908 1 14 . 1 1 164 164 GLY C C 164 174.721 174.721 174.089 0.632 25767 12909 1 14 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.927 0.864 25767 12910 1 14 . 1 1 164 164 GLY H H 164 7.772 7.772 7.796 -0.024 25767 12911 1 14 . 1 1 165 165 GLU N N 165 119.886 119.886 120.161 -0.275 25767 12912 1 14 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.327 -0.277 25767 12913 1 14 . 1 1 165 165 GLU C C 165 176.027 176.027 175.051 0.976 25767 12914 1 14 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.089 1.764 25767 12915 1 14 . 1 1 165 165 GLU CB C 165 30.338 30.338 31.002 -0.664 25767 12916 1 14 . 1 1 165 165 GLU H H 165 8.065 8.065 7.874 0.191 25767 12917 1 14 . 1 1 166 166 ILE N N 166 117.926 117.926 120.635 -2.709 25767 12918 1 14 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.929 -0.027 25767 12919 1 14 . 1 1 166 166 ILE C C 166 174.138 174.138 176.832 -2.694 25767 12920 1 14 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.646 1.809 25767 12921 1 14 . 1 1 166 166 ILE CB C 166 40.202 40.202 39.248 0.953 25767 12922 1 14 . 1 1 166 166 ILE H H 166 7.282 7.282 8.122 -0.840 25767 12923 1 15 . 1 1 2 2 ALA N N 2 122.811 122.811 123.828 -1.017 25767 12924 1 15 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.030 -0.007 25767 12925 1 15 . 1 1 2 2 ALA C C 2 179.915 179.915 179.263 0.652 25767 12926 1 15 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.434 -0.317 25767 12927 1 15 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.262 0.277 25767 12928 1 15 . 1 1 2 2 ALA H H 2 8.509 8.509 8.320 0.189 25767 12929 1 15 . 1 1 3 3 SER N N 3 115.308 115.308 114.469 0.839 25767 12930 1 15 . 1 1 3 3 SER HA H 3 4.097 4.097 4.184 -0.087 25767 12931 1 15 . 1 1 3 3 SER C C 3 176.706 176.706 176.118 0.588 25767 12932 1 15 . 1 1 3 3 SER CA C 3 60.665 60.665 61.028 -0.363 25767 12933 1 15 . 1 1 3 3 SER CB C 3 62.710 62.710 62.197 0.513 25767 12934 1 15 . 1 1 3 3 SER H H 3 7.996 7.996 8.459 -0.463 25767 12935 1 15 . 1 1 4 4 ASN N N 4 122.688 122.688 121.095 1.593 25767 12936 1 15 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.463 -0.159 25767 12937 1 15 . 1 1 4 4 ASN C C 4 176.258 176.258 177.654 -1.396 25767 12938 1 15 . 1 1 4 4 ASN CA C 4 55.701 55.701 56.032 -0.331 25767 12939 1 15 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.536 0.640 25767 12940 1 15 . 1 1 4 4 ASN H H 4 8.075 8.075 8.308 -0.233 25767 12941 1 15 . 1 1 5 5 ALA N N 5 121.900 121.900 122.494 -0.594 25767 12942 1 15 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.156 -0.581 25767 12943 1 15 . 1 1 5 5 ALA C C 5 178.475 178.475 179.333 -0.858 25767 12944 1 15 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.966 0.867 25767 12945 1 15 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.175 -0.560 25767 12946 1 15 . 1 1 5 5 ALA H H 5 8.659 8.659 7.765 0.894 25767 12947 1 15 . 1 1 6 6 ALA N N 6 117.768 117.768 121.837 -4.069 25767 12948 1 15 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.968 -0.181 25767 12949 1 15 . 1 1 6 6 ALA C C 6 180.494 180.494 179.438 1.056 25767 12950 1 15 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.122 0.228 25767 12951 1 15 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.205 -0.303 25767 12952 1 15 . 1 1 6 6 ALA H H 6 7.864 7.864 7.900 -0.036 25767 12953 1 15 . 1 1 7 7 ARG N N 7 121.173 121.173 118.961 2.212 25767 12954 1 15 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.080 -0.177 25767 12955 1 15 . 1 1 7 7 ARG C C 7 179.189 179.189 178.503 0.686 25767 12956 1 15 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.286 1.026 25767 12957 1 15 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.739 -0.517 25767 12958 1 15 . 1 1 7 7 ARG H H 7 7.514 7.514 7.941 -0.427 25767 12959 1 15 . 1 1 8 8 VAL N N 8 122.979 122.979 120.337 2.642 25767 12960 1 15 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.599 -0.346 25767 12961 1 15 . 1 1 8 8 VAL C C 8 177.821 177.821 177.993 -0.172 25767 12962 1 15 . 1 1 8 8 VAL CA C 8 67.772 67.772 67.047 0.725 25767 12963 1 15 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.669 -0.228 25767 12964 1 15 . 1 1 8 8 VAL H H 8 8.101 8.101 7.705 0.396 25767 12965 1 15 . 1 1 9 9 VAL N N 9 119.801 119.801 119.984 -0.183 25767 12966 1 15 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.545 -0.279 25767 12967 1 15 . 1 1 9 9 VAL C C 9 177.373 177.373 177.832 -0.459 25767 12968 1 15 . 1 1 9 9 VAL CA C 9 67.484 67.484 66.827 0.657 25767 12969 1 15 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.843 0.781 25767 12970 1 15 . 1 1 9 9 VAL H H 9 8.362 8.362 8.116 0.246 25767 12971 1 15 . 1 1 10 10 ALA N N 10 122.360 122.360 122.015 0.345 25767 12972 1 15 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.061 -0.125 25767 12973 1 15 . 1 1 10 10 ALA C C 10 180.762 180.762 179.662 1.100 25767 12974 1 15 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.477 -0.033 25767 12975 1 15 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.245 -0.508 25767 12976 1 15 . 1 1 10 10 ALA H H 10 7.776 7.776 7.871 -0.095 25767 12977 1 15 . 1 1 11 11 THR N N 11 117.376 117.376 114.603 2.773 25767 12978 1 15 . 1 1 11 11 THR HA H 11 3.816 3.816 4.076 -0.260 25767 12979 1 15 . 1 1 11 11 THR C C 11 175.775 175.775 176.287 -0.512 25767 12980 1 15 . 1 1 11 11 THR CA C 11 66.509 66.509 66.307 0.202 25767 12981 1 15 . 1 1 11 11 THR CB C 11 68.588 68.588 68.738 -0.150 25767 12982 1 15 . 1 1 11 11 THR H H 11 8.180 8.180 8.221 -0.041 25767 12983 1 15 . 1 1 12 12 ALA N N 12 125.308 125.308 124.263 1.045 25767 12984 1 15 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.615 0.382 25767 12985 1 15 . 1 1 12 12 ALA C C 12 179.399 179.399 179.229 0.170 25767 12986 1 15 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.431 0.645 25767 12987 1 15 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.161 1.083 25767 12988 1 15 . 1 1 12 12 ALA H H 12 8.671 8.671 8.558 0.113 25767 12989 1 15 . 1 1 13 13 LYS N N 13 116.977 116.977 118.444 -1.467 25767 12990 1 15 . 1 1 13 13 LYS C C 13 179.646 179.646 178.728 0.918 25767 12991 1 15 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.792 -0.871 25767 12992 1 15 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.164 -0.721 25767 12993 1 15 . 1 1 13 13 LYS H H 13 8.061 8.061 7.742 0.319 25767 12994 1 15 . 1 1 14 14 ASP N N 14 121.988 121.988 119.966 2.022 25767 12995 1 15 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.474 -0.121 25767 12996 1 15 . 1 1 14 14 ASP C C 14 179.446 179.446 178.709 0.737 25767 12997 1 15 . 1 1 14 14 ASP CA C 14 57.509 57.509 57.036 0.473 25767 12998 1 15 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.625 -0.624 25767 12999 1 15 . 1 1 14 14 ASP H H 14 7.669 7.669 7.686 -0.017 25767 13000 1 15 . 1 1 15 15 PHE N N 15 119.588 119.588 118.315 1.273 25767 13001 1 15 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.192 0.152 25767 13002 1 15 . 1 1 15 15 PHE C C 15 178.373 178.373 178.092 0.281 25767 13003 1 15 . 1 1 15 15 PHE CA C 15 62.237 62.237 60.943 1.294 25767 13004 1 15 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.527 -1.031 25767 13005 1 15 . 1 1 15 15 PHE H H 15 7.913 7.913 8.287 -0.374 25767 13006 1 15 . 1 1 16 16 ASP N N 16 121.705 121.705 119.826 1.879 25767 13007 1 15 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.354 -0.359 25767 13008 1 15 . 1 1 16 16 ASP C C 16 180.071 180.071 178.381 1.690 25767 13009 1 15 . 1 1 16 16 ASP CA C 16 58.149 58.149 56.953 1.196 25767 13010 1 15 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.481 1.006 25767 13011 1 15 . 1 1 16 16 ASP H H 16 8.324 8.324 7.939 0.385 25767 13012 1 15 . 1 1 17 17 LYS N N 17 118.825 118.825 118.658 0.167 25767 13013 1 15 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.087 -0.050 25767 13014 1 15 . 1 1 17 17 LYS C C 17 178.407 178.407 178.256 0.151 25767 13015 1 15 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.838 0.223 25767 13016 1 15 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.529 0.055 25767 13017 1 15 . 1 1 17 17 LYS H H 17 7.834 7.834 7.638 0.196 25767 13018 1 15 . 1 1 18 18 VAL N N 18 110.562 110.562 116.878 -6.316 25767 13019 1 15 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.035 0.481 25767 13020 1 15 . 1 1 18 18 VAL C C 18 176.144 176.144 176.362 -0.218 25767 13021 1 15 . 1 1 18 18 VAL CA C 18 60.874 60.874 62.987 -2.113 25767 13022 1 15 . 1 1 18 18 VAL CB C 18 31.160 31.160 31.943 -0.783 25767 13023 1 15 . 1 1 18 18 VAL H H 18 7.185 7.185 7.416 -0.231 25767 13024 1 15 . 1 1 19 19 GLY N N 19 109.272 109.272 107.080 2.192 25767 13025 1 15 . 1 1 19 19 GLY C C 19 175.043 175.043 174.829 0.214 25767 13026 1 15 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.256 0.575 25767 13027 1 15 . 1 1 19 19 GLY H H 19 7.723 7.723 7.549 0.174 25767 13028 1 15 . 1 1 20 20 LEU N N 20 125.428 125.428 121.479 3.949 25767 13029 1 15 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.554 -0.234 25767 13030 1 15 . 1 1 20 20 LEU C C 20 177.949 177.949 177.196 0.753 25767 13031 1 15 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.399 -0.595 25767 13032 1 15 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.450 0.467 25767 13033 1 15 . 1 1 20 20 LEU H H 20 8.083 8.083 8.143 -0.060 25767 13034 1 15 . 1 1 21 21 GLY N N 21 107.804 107.804 109.885 -2.081 25767 13035 1 15 . 1 1 21 21 GLY C C 21 176.278 176.278 175.434 0.844 25767 13036 1 15 . 1 1 21 21 GLY CA C 21 47.294 47.294 46.880 0.414 25767 13037 1 15 . 1 1 21 21 GLY H H 21 7.982 7.982 7.844 0.138 25767 13038 1 15 . 1 1 22 22 ILE N N 22 121.319 121.319 121.497 -0.178 25767 13039 1 15 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.665 0.245 25767 13040 1 15 . 1 1 22 22 ILE C C 22 176.604 176.604 177.868 -1.264 25767 13041 1 15 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.142 -1.696 25767 13042 1 15 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.799 -1.233 25767 13043 1 15 . 1 1 22 22 ILE H H 22 8.478 8.478 7.835 0.643 25767 13044 1 15 . 1 1 23 23 ILE N N 23 120.377 120.377 119.640 0.737 25767 13045 1 15 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.854 -0.141 25767 13046 1 15 . 1 1 23 23 ILE C C 23 178.581 178.581 178.053 0.528 25767 13047 1 15 . 1 1 23 23 ILE CA C 23 64.246 64.246 65.352 -1.106 25767 13048 1 15 . 1 1 23 23 ILE CB C 23 36.199 36.199 37.381 -1.182 25767 13049 1 15 . 1 1 23 23 ILE H H 23 6.869 6.869 7.616 -0.747 25767 13050 1 15 . 1 1 24 24 GLY N N 24 103.449 103.449 108.880 -5.431 25767 13051 1 15 . 1 1 24 24 GLY C C 24 175.308 175.308 175.585 -0.277 25767 13052 1 15 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.332 0.611 25767 13053 1 15 . 1 1 24 24 GLY H H 24 7.488 7.488 7.904 -0.416 25767 13054 1 15 . 1 1 25 25 TYR N N 25 124.685 124.685 124.374 0.311 25767 13055 1 15 . 1 1 25 25 TYR HA H 25 3.666 3.666 4.208 -0.542 25767 13056 1 15 . 1 1 25 25 TYR C C 25 176.208 176.208 177.498 -1.290 25767 13057 1 15 . 1 1 25 25 TYR CA C 25 61.371 61.371 61.425 -0.054 25767 13058 1 15 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.816 -0.549 25767 13059 1 15 . 1 1 25 25 TYR H H 25 7.931 7.931 8.279 -0.348 25767 13060 1 15 . 1 1 26 26 TYR N N 26 117.001 117.001 120.007 -3.006 25767 13061 1 15 . 1 1 26 26 TYR HA H 26 3.941 3.941 4.112 -0.171 25767 13062 1 15 . 1 1 26 26 TYR C C 26 178.753 178.753 177.536 1.217 25767 13063 1 15 . 1 1 26 26 TYR CA C 26 64.260 64.260 61.760 2.501 25767 13064 1 15 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.941 -1.420 25767 13065 1 15 . 1 1 26 26 TYR H H 26 7.693 7.693 7.982 -0.289 25767 13066 1 15 . 1 1 27 27 LEU N N 27 118.657 118.657 118.879 -0.222 25767 13067 1 15 . 1 1 27 27 LEU HA H 27 4.311 4.311 3.978 0.333 25767 13068 1 15 . 1 1 27 27 LEU CA C 27 58.297 58.297 57.925 0.372 25767 13069 1 15 . 1 1 27 27 LEU CB C 27 42.723 42.723 41.202 1.521 25767 13070 1 15 . 1 1 27 27 LEU H H 27 8.339 8.339 8.818 -0.479 25767 13071 1 15 . 1 1 28 28 GLN N N 28 118.593 118.593 118.993 -0.400 25767 13072 1 15 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.904 -0.253 25767 13073 1 15 . 1 1 28 28 GLN C C 28 177.282 177.282 178.641 -1.359 25767 13074 1 15 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.883 -0.054 25767 13075 1 15 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.506 1.141 25767 13076 1 15 . 1 1 28 28 GLN H H 28 7.970 7.970 8.215 -0.245 25767 13077 1 15 . 1 1 29 29 LEU N N 29 122.111 122.111 119.862 2.249 25767 13078 1 15 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.768 0.176 25767 13079 1 15 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.654 1.012 25767 13080 1 15 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.408 0.600 25767 13081 1 15 . 1 1 29 29 LEU H H 29 7.979 7.979 7.521 0.458 25767 13082 1 15 . 1 1 30 30 TYR N N 30 119.283 119.283 120.012 -0.729 25767 13083 1 15 . 1 1 30 30 TYR C C 30 175.775 175.775 177.186 -1.411 25767 13084 1 15 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.776 -1.681 25767 13085 1 15 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.258 0.815 25767 13086 1 15 . 1 1 30 30 TYR H H 30 8.093 8.093 7.565 0.528 25767 13087 1 15 . 1 1 31 31 ALA N N 31 121.327 121.327 121.976 -0.649 25767 13088 1 15 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.884 -0.516 25767 13089 1 15 . 1 1 31 31 ALA C C 31 178.955 178.955 179.145 -0.190 25767 13090 1 15 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.179 0.368 25767 13091 1 15 . 1 1 31 31 ALA CB C 31 17.963 17.963 17.826 0.136 25767 13092 1 15 . 1 1 31 31 ALA H H 31 8.394 8.394 7.965 0.429 25767 13093 1 15 . 1 1 32 32 VAL N N 32 116.757 116.757 118.434 -1.677 25767 13094 1 15 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.553 -0.293 25767 13095 1 15 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.662 2.000 25767 13096 1 15 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.655 -0.684 25767 13097 1 15 . 1 1 32 32 VAL H H 32 8.020 8.020 7.580 0.440 25767 13098 1 15 . 1 1 33 33 GLU N N 33 118.775 118.775 119.780 -1.005 25767 13099 1 15 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.819 0.170 25767 13100 1 15 . 1 1 33 33 GLU C C 33 179.746 179.746 178.881 0.865 25767 13101 1 15 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.492 0.511 25767 13102 1 15 . 1 1 33 33 GLU H H 33 7.358 7.358 7.619 -0.261 25767 13103 1 15 . 1 1 34 34 LEU N N 34 120.632 120.632 120.667 -0.035 25767 13104 1 15 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.840 -0.191 25767 13105 1 15 . 1 1 34 34 LEU C C 34 180.336 180.336 177.910 2.426 25767 13106 1 15 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.628 0.047 25767 13107 1 15 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.716 -0.128 25767 13108 1 15 . 1 1 34 34 LEU H H 34 8.390 8.390 7.727 0.663 25767 13109 1 15 . 1 1 35 35 ILE N N 35 121.240 121.240 118.189 3.051 25767 13110 1 15 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.820 -0.278 25767 13111 1 15 . 1 1 35 35 ILE C C 35 178.604 178.604 178.941 -0.337 25767 13112 1 15 . 1 1 35 35 ILE CA C 35 65.547 65.547 64.884 0.663 25767 13113 1 15 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.979 0.752 25767 13114 1 15 . 1 1 35 35 ILE H H 35 8.129 8.129 7.438 0.691 25767 13115 1 15 . 1 1 36 36 LEU N N 36 115.637 115.637 119.419 -3.782 25767 13116 1 15 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.044 -0.036 25767 13117 1 15 . 1 1 36 36 LEU C C 36 178.001 178.001 178.099 -0.098 25767 13118 1 15 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.188 -1.112 25767 13119 1 15 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.502 -1.568 25767 13120 1 15 . 1 1 36 36 LEU H H 36 8.416 8.416 7.947 0.469 25767 13121 1 15 . 1 1 37 37 SER N N 37 114.106 114.106 110.141 3.965 25767 13122 1 15 . 1 1 37 37 SER HA H 37 3.991 3.991 4.348 -0.357 25767 13123 1 15 . 1 1 37 37 SER C C 37 173.997 173.997 173.804 0.193 25767 13124 1 15 . 1 1 37 37 SER CA C 37 60.311 60.311 59.353 0.958 25767 13125 1 15 . 1 1 37 37 SER CB C 37 63.746 63.746 63.433 0.313 25767 13126 1 15 . 1 1 37 37 SER H H 37 7.517 7.517 7.785 -0.268 25767 13127 1 15 . 1 1 38 38 GLU N N 38 123.003 123.003 121.129 1.874 25767 13128 1 15 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.337 0.032 25767 13129 1 15 . 1 1 38 38 GLU C C 38 175.780 175.780 176.063 -0.283 25767 13130 1 15 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.497 -0.132 25767 13131 1 15 . 1 1 38 38 GLU CB C 38 30.293 30.293 31.252 -0.959 25767 13132 1 15 . 1 1 38 38 GLU H H 38 7.151 7.151 7.428 -0.277 25767 13133 1 15 . 1 1 39 39 GLU N N 39 126.166 126.166 122.503 3.663 25767 13134 1 15 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.156 -0.147 25767 13135 1 15 . 1 1 39 39 GLU C C 39 176.652 176.652 175.891 0.761 25767 13136 1 15 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.662 1.536 25767 13137 1 15 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.268 -0.233 25767 13138 1 15 . 1 1 39 39 GLU H H 39 8.587 8.587 8.494 0.093 25767 13139 1 15 . 1 1 40 40 ASP N N 40 120.047 120.047 121.385 -1.338 25767 13140 1 15 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.484 0.066 25767 13141 1 15 . 1 1 40 40 ASP C C 40 175.035 175.035 175.867 -0.832 25767 13142 1 15 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.195 -1.827 25767 13143 1 15 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.640 -0.617 25767 13144 1 15 . 1 1 40 40 ASP H H 40 8.504 8.504 8.579 -0.075 25767 13145 1 15 . 1 1 41 41 ARG N N 41 120.671 120.671 121.859 -1.188 25767 13146 1 15 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.693 -0.304 25767 13147 1 15 . 1 1 41 41 ARG C C 41 175.755 175.755 175.919 -0.164 25767 13148 1 15 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.578 0.430 25767 13149 1 15 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.720 -1.171 25767 13150 1 15 . 1 1 41 41 ARG H H 41 7.672 7.672 8.189 -0.517 25767 13151 1 15 . 1 1 42 42 SER N N 42 120.330 120.330 115.485 4.845 25767 13152 1 15 . 1 1 42 42 SER HA H 42 3.837 3.837 4.384 -0.547 25767 13153 1 15 . 1 1 42 42 SER CA C 42 57.326 57.326 58.041 -0.715 25767 13154 1 15 . 1 1 42 42 SER CB C 42 65.762 65.762 64.196 1.566 25767 13155 1 15 . 1 1 42 42 SER H H 42 8.544 8.544 8.546 -0.002 25767 13156 1 15 . 1 1 43 43 GLN HA H 43 3.989 3.989 3.995 -0.006 25767 13157 1 15 . 1 1 43 43 GLN C C 43 178.907 178.907 178.067 0.840 25767 13158 1 15 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.615 0.754 25767 13159 1 15 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.635 -0.672 25767 13160 1 15 . 1 1 44 44 GLU N N 44 120.328 120.328 119.966 0.362 25767 13161 1 15 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.941 0.072 25767 13162 1 15 . 1 1 44 44 GLU C C 44 179.824 179.824 178.950 0.874 25767 13163 1 15 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.035 1.010 25767 13164 1 15 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.288 -0.640 25767 13165 1 15 . 1 1 44 44 GLU H H 44 8.938 8.938 7.691 1.247 25767 13166 1 15 . 1 1 45 45 MET N N 45 121.030 121.030 117.350 3.680 25767 13167 1 15 . 1 1 45 45 MET HA H 45 4.412 4.412 4.273 0.139 25767 13168 1 15 . 1 1 45 45 MET C C 45 180.357 180.357 178.201 2.156 25767 13169 1 15 . 1 1 45 45 MET CA C 45 57.209 57.209 58.545 -1.336 25767 13170 1 15 . 1 1 45 45 MET CB C 45 32.436 32.436 32.031 0.405 25767 13171 1 15 . 1 1 45 45 MET H H 45 7.756 7.756 7.889 -0.133 25767 13172 1 15 . 1 1 46 46 THR N N 46 120.008 120.008 116.920 3.088 25767 13173 1 15 . 1 1 46 46 THR HA H 46 4.071 4.071 3.870 0.201 25767 13174 1 15 . 1 1 46 46 THR CA C 46 67.096 67.096 67.016 0.080 25767 13175 1 15 . 1 1 46 46 THR CB C 46 68.954 68.954 68.525 0.429 25767 13176 1 15 . 1 1 46 46 THR H H 46 8.187 8.187 7.349 0.838 25767 13177 1 15 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.120 -0.011 25767 13178 1 15 . 1 1 47 47 ALA C C 47 180.118 180.118 179.235 0.883 25767 13179 1 15 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.916 0.423 25767 13180 1 15 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.372 -0.540 25767 13181 1 15 . 1 1 47 47 ALA H H 47 8.238 8.238 7.991 0.247 25767 13182 1 15 . 1 1 48 48 LEU N N 48 122.093 122.093 120.751 1.342 25767 13183 1 15 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.064 0.200 25767 13184 1 15 . 1 1 48 48 LEU C C 48 179.103 179.103 178.595 0.508 25767 13185 1 15 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.449 0.291 25767 13186 1 15 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.677 -0.881 25767 13187 1 15 . 1 1 48 48 LEU H H 48 7.778 7.778 7.592 0.186 25767 13188 1 15 . 1 1 49 49 ALA N N 49 120.130 120.130 120.602 -0.472 25767 13189 1 15 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.923 -0.202 25767 13190 1 15 . 1 1 49 49 ALA C C 49 178.676 178.676 179.494 -0.818 25767 13191 1 15 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.344 0.377 25767 13192 1 15 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.077 -0.250 25767 13193 1 15 . 1 1 49 49 ALA H H 49 8.432 8.432 8.348 0.084 25767 13194 1 15 . 1 1 50 50 THR N N 50 113.333 113.333 115.397 -2.064 25767 13195 1 15 . 1 1 50 50 THR HA H 50 3.895 3.895 3.824 0.071 25767 13196 1 15 . 1 1 50 50 THR C C 50 174.948 174.948 176.495 -1.547 25767 13197 1 15 . 1 1 50 50 THR CA C 50 67.334 67.334 67.288 0.046 25767 13198 1 15 . 1 1 50 50 THR CB C 50 68.864 68.864 68.597 0.267 25767 13199 1 15 . 1 1 50 50 THR H H 50 7.857 7.857 7.690 0.167 25767 13200 1 15 . 1 1 51 51 GLU N N 51 122.698 122.698 122.325 0.373 25767 13201 1 15 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.031 0.037 25767 13202 1 15 . 1 1 51 51 GLU C C 51 179.997 179.997 178.856 1.141 25767 13203 1 15 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.412 0.021 25767 13204 1 15 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.558 -0.041 25767 13205 1 15 . 1 1 51 51 GLU H H 51 7.817 7.817 7.637 0.180 25767 13206 1 15 . 1 1 52 52 LEU N N 52 121.100 121.100 119.574 1.526 25767 13207 1 15 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.029 0.100 25767 13208 1 15 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.660 0.229 25767 13209 1 15 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.673 0.274 25767 13210 1 15 . 1 1 52 52 LEU H H 52 8.628 8.628 7.734 0.894 25767 13211 1 15 . 1 1 53 53 LEU N N 53 119.935 119.935 120.142 -0.207 25767 13212 1 15 . 1 1 53 53 LEU C C 53 179.671 179.671 178.106 1.565 25767 13213 1 15 . 1 1 53 53 LEU H H 53 8.303 8.303 7.746 0.557 25767 13214 1 15 . 1 1 54 54 ASP N N 54 120.339 120.339 118.543 1.796 25767 13215 1 15 . 1 1 54 54 ASP C C 54 179.106 179.106 178.374 0.732 25767 13216 1 15 . 1 1 54 54 ASP H H 54 7.901 7.901 8.000 -0.099 25767 13217 1 15 . 1 1 55 55 THR N N 55 120.237 120.237 116.688 3.549 25767 13218 1 15 . 1 1 55 55 THR HA H 55 3.696 3.696 4.063 -0.367 25767 13219 1 15 . 1 1 55 55 THR CA C 55 67.340 67.340 66.850 0.490 25767 13220 1 15 . 1 1 55 55 THR CB C 55 68.151 68.151 68.499 -0.348 25767 13221 1 15 . 1 1 55 55 THR H H 55 8.262 8.262 7.909 0.353 25767 13222 1 15 . 1 1 56 56 ILE N N 56 123.953 123.953 122.148 1.805 25767 13223 1 15 . 1 1 56 56 ILE HA H 56 3.843 3.843 4.053 -0.210 25767 13224 1 15 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.643 0.251 25767 13225 1 15 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.735 0.398 25767 13226 1 15 . 1 1 56 56 ILE H H 56 8.930 8.930 7.844 1.086 25767 13227 1 15 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.331 0.250 25767 13228 1 15 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.130 -0.099 25767 13229 1 15 . 1 1 58 58 ALA C C 58 179.875 179.875 179.517 0.358 25767 13230 1 15 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.967 0.299 25767 13231 1 15 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.338 -0.353 25767 13232 1 15 . 1 1 58 58 ALA H H 58 7.764 7.764 8.182 -0.418 25767 13233 1 15 . 1 1 59 59 PHE N N 59 121.988 121.988 119.744 2.244 25767 13234 1 15 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.196 0.030 25767 13235 1 15 . 1 1 59 59 PHE CA C 59 61.439 61.439 59.810 1.629 25767 13236 1 15 . 1 1 59 59 PHE CB C 59 39.363 39.363 38.753 0.610 25767 13237 1 15 . 1 1 59 59 PHE H H 59 8.159 8.159 8.218 -0.059 25767 13238 1 15 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.300 0.241 25767 13239 1 15 . 1 1 60 60 LYS C C 60 179.438 179.438 178.827 0.611 25767 13240 1 15 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.266 0.870 25767 13241 1 15 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.081 -0.023 25767 13242 1 15 . 1 1 61 61 LYS N N 61 119.262 119.262 117.136 2.126 25767 13243 1 15 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.171 -0.226 25767 13244 1 15 . 1 1 61 61 LYS C C 61 178.730 178.730 177.685 1.045 25767 13245 1 15 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.372 1.670 25767 13246 1 15 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.002 0.640 25767 13247 1 15 . 1 1 61 61 LYS H H 61 7.832 7.832 8.209 -0.377 25767 13248 1 15 . 1 1 62 62 GLU N N 62 120.790 120.790 120.816 -0.026 25767 13249 1 15 . 1 1 62 62 GLU HA H 62 3.935 3.935 4.029 -0.094 25767 13250 1 15 . 1 1 62 62 GLU C C 62 178.424 178.424 177.966 0.458 25767 13251 1 15 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.949 -0.235 25767 13252 1 15 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.525 -0.295 25767 13253 1 15 . 1 1 62 62 GLU H H 62 7.982 7.982 7.730 0.252 25767 13254 1 15 . 1 1 63 63 ILE N N 63 118.463 118.463 116.696 1.767 25767 13255 1 15 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.916 -0.227 25767 13256 1 15 . 1 1 63 63 ILE C C 63 177.555 177.555 177.690 -0.135 25767 13257 1 15 . 1 1 63 63 ILE CA C 63 61.499 61.499 61.859 -0.360 25767 13258 1 15 . 1 1 63 63 ILE CB C 63 36.524 36.524 37.484 -0.960 25767 13259 1 15 . 1 1 63 63 ILE H H 63 7.732 7.732 7.381 0.351 25767 13260 1 15 . 1 1 64 64 GLY N N 64 107.973 107.973 107.881 0.092 25767 13261 1 15 . 1 1 64 64 GLY C C 64 175.271 175.271 174.961 0.310 25767 13262 1 15 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.378 -0.476 25767 13263 1 15 . 1 1 64 64 GLY H H 64 7.661 7.661 7.984 -0.323 25767 13264 1 15 . 1 1 65 65 GLY N N 65 108.464 108.464 107.331 1.133 25767 13265 1 15 . 1 1 65 65 GLY C C 65 174.800 174.800 176.043 -1.243 25767 13266 1 15 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.655 -0.009 25767 13267 1 15 . 1 1 65 65 GLY H H 65 7.808 7.808 8.111 -0.303 25767 13268 1 15 . 1 1 66 66 GLU N N 66 121.162 121.162 121.301 -0.139 25767 13269 1 15 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.065 0.040 25767 13270 1 15 . 1 1 66 66 GLU C C 66 177.230 177.230 178.111 -0.881 25767 13271 1 15 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.042 -1.818 25767 13272 1 15 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.299 0.693 25767 13273 1 15 . 1 1 66 66 GLU H H 66 8.203 8.203 7.825 0.378 25767 13274 1 15 . 1 1 67 67 SER N N 67 116.468 116.468 113.654 2.814 25767 13275 1 15 . 1 1 67 67 SER HA H 67 4.249 4.249 4.215 0.034 25767 13276 1 15 . 1 1 67 67 SER C C 67 174.640 174.640 176.218 -1.578 25767 13277 1 15 . 1 1 67 67 SER CA C 67 58.930 58.930 60.787 -1.857 25767 13278 1 15 . 1 1 67 67 SER CB C 67 63.912 63.912 63.118 0.794 25767 13279 1 15 . 1 1 67 67 SER H H 67 8.206 8.206 7.988 0.218 25767 13280 1 15 . 1 1 68 68 GLU N N 68 122.400 122.400 121.907 0.493 25767 13281 1 15 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.047 0.106 25767 13282 1 15 . 1 1 68 68 GLU C C 68 176.349 176.349 177.125 -0.776 25767 13283 1 15 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.511 -1.688 25767 13284 1 15 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.381 0.600 25767 13285 1 15 . 1 1 68 68 GLU H H 68 8.168 8.168 8.417 -0.249 25767 13286 1 15 . 1 1 69 69 ALA N N 69 124.342 124.342 120.455 3.887 25767 13287 1 15 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.126 0.062 25767 13288 1 15 . 1 1 69 69 ALA C C 69 178.027 178.027 177.648 0.379 25767 13289 1 15 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.798 -1.240 25767 13290 1 15 . 1 1 69 69 ALA CB C 69 19.492 19.492 19.090 0.402 25767 13291 1 15 . 1 1 69 69 ALA H H 69 7.939 7.939 7.483 0.456 25767 13292 1 15 . 1 1 70 70 GLU N N 70 121.059 121.059 118.582 2.477 25767 13293 1 15 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.384 -0.270 25767 13294 1 15 . 1 1 70 70 GLU C C 70 176.519 176.519 175.392 1.127 25767 13295 1 15 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.514 1.790 25767 13296 1 15 . 1 1 70 70 GLU CB C 70 29.827 29.827 30.551 -0.724 25767 13297 1 15 . 1 1 70 70 GLU H H 70 8.430 8.430 7.626 0.804 25767 13298 1 15 . 1 1 71 71 ASP N N 71 120.274 120.274 123.797 -3.523 25767 13299 1 15 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.356 0.176 25767 13300 1 15 . 1 1 71 71 ASP C C 71 176.369 176.369 176.532 -0.163 25767 13301 1 15 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.283 -1.032 25767 13302 1 15 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.456 1.384 25767 13303 1 15 . 1 1 71 71 ASP H H 71 8.305 8.305 8.842 -0.537 25767 13304 1 15 . 1 1 72 72 SER N N 72 116.165 116.165 113.415 2.750 25767 13305 1 15 . 1 1 72 72 SER HA H 72 4.241 4.241 4.010 0.231 25767 13306 1 15 . 1 1 72 72 SER C C 72 174.567 174.567 175.534 -0.967 25767 13307 1 15 . 1 1 72 72 SER CA C 72 59.031 59.031 61.604 -2.573 25767 13308 1 15 . 1 1 72 72 SER CB C 72 64.040 64.040 63.277 0.763 25767 13309 1 15 . 1 1 72 72 SER H H 72 7.964 7.964 8.610 -0.646 25767 13310 1 15 . 1 1 73 73 ASP N N 73 122.440 122.440 119.968 2.472 25767 13311 1 15 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.207 0.327 25767 13312 1 15 . 1 1 73 73 ASP C C 73 176.882 176.882 177.805 -0.923 25767 13313 1 15 . 1 1 73 73 ASP CA C 73 54.443 54.443 56.850 -2.407 25767 13314 1 15 . 1 1 73 73 ASP CB C 73 41.336 41.336 39.605 1.731 25767 13315 1 15 . 1 1 73 73 ASP H H 73 8.392 8.392 8.571 -0.179 25767 13316 1 15 . 1 1 74 74 LYS N N 74 123.270 123.270 120.618 2.652 25767 13317 1 15 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.151 -0.057 25767 13318 1 15 . 1 1 74 74 LYS C C 74 177.608 177.608 178.916 -1.308 25767 13319 1 15 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.623 -2.158 25767 13320 1 15 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.470 -0.324 25767 13321 1 15 . 1 1 74 74 LYS H H 74 8.317 8.317 7.726 0.591 25767 13322 1 15 . 1 1 75 75 SER N N 75 116.557 116.557 115.922 0.635 25767 13323 1 15 . 1 1 75 75 SER HA H 75 4.197 4.197 4.261 -0.064 25767 13324 1 15 . 1 1 75 75 SER C C 75 175.988 175.988 176.630 -0.642 25767 13325 1 15 . 1 1 75 75 SER CA C 75 60.434 60.434 61.883 -1.448 25767 13326 1 15 . 1 1 75 75 SER CB C 75 63.172 63.172 62.370 0.802 25767 13327 1 15 . 1 1 75 75 SER H H 75 8.387 8.387 7.825 0.562 25767 13328 1 15 . 1 1 76 76 LEU N N 76 123.910 123.910 123.158 0.752 25767 13329 1 15 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.962 0.208 25767 13330 1 15 . 1 1 76 76 LEU C C 76 178.083 178.083 178.976 -0.893 25767 13331 1 15 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.791 -1.299 25767 13332 1 15 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.279 0.418 25767 13333 1 15 . 1 1 76 76 LEU H H 76 8.059 8.059 7.735 0.324 25767 13334 1 15 . 1 1 77 77 HIS N N 77 120.620 120.620 118.697 1.923 25767 13335 1 15 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.350 -0.062 25767 13336 1 15 . 1 1 77 77 HIS C C 77 177.667 177.667 178.538 -0.871 25767 13337 1 15 . 1 1 77 77 HIS CA C 77 58.422 58.422 59.698 -1.276 25767 13338 1 15 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.430 0.834 25767 13339 1 15 . 1 1 77 77 HIS H H 77 7.936 7.936 8.136 -0.200 25767 13340 1 15 . 1 1 78 78 VAL N N 78 121.774 121.774 120.179 1.595 25767 13341 1 15 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.618 0.059 25767 13342 1 15 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.842 -1.236 25767 13343 1 15 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.789 0.075 25767 13344 1 15 . 1 1 78 78 VAL H H 78 7.916 7.916 8.042 -0.126 25767 13345 1 15 . 1 1 79 79 MET N N 79 119.660 119.660 118.309 1.351 25767 13346 1 15 . 1 1 79 79 MET HA H 79 3.925 3.925 4.029 -0.104 25767 13347 1 15 . 1 1 79 79 MET C C 79 177.077 177.077 178.659 -1.582 25767 13348 1 15 . 1 1 79 79 MET CA C 79 58.862 58.862 59.534 -0.672 25767 13349 1 15 . 1 1 79 79 MET CB C 79 32.852 32.852 32.337 0.515 25767 13350 1 15 . 1 1 79 79 MET H H 79 8.149 8.149 7.896 0.253 25767 13351 1 15 . 1 1 80 80 ASN N N 80 117.337 117.337 118.441 -1.104 25767 13352 1 15 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.938 -0.800 25767 13353 1 15 . 1 1 80 80 ASN C C 80 178.133 178.133 178.557 -0.424 25767 13354 1 15 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.206 0.833 25767 13355 1 15 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.133 0.863 25767 13356 1 15 . 1 1 80 80 ASN H H 80 8.202 8.202 8.796 -0.594 25767 13357 1 15 . 1 1 81 81 THR N N 81 115.517 115.517 119.372 -3.855 25767 13358 1 15 . 1 1 81 81 THR HA H 81 3.896 3.896 4.160 -0.264 25767 13359 1 15 . 1 1 81 81 THR C C 81 175.186 175.186 176.112 -0.926 25767 13360 1 15 . 1 1 81 81 THR CA C 81 66.221 66.221 67.273 -1.052 25767 13361 1 15 . 1 1 81 81 THR CB C 81 69.087 69.087 68.883 0.204 25767 13362 1 15 . 1 1 81 81 THR H H 81 7.944 7.944 8.452 -0.508 25767 13363 1 15 . 1 1 82 82 LEU N N 82 119.074 119.074 120.509 -1.435 25767 13364 1 15 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.105 -0.124 25767 13365 1 15 . 1 1 82 82 LEU C C 82 177.583 177.583 177.899 -0.316 25767 13366 1 15 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.503 -0.963 25767 13367 1 15 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.956 -0.163 25767 13368 1 15 . 1 1 82 82 LEU H H 82 7.547 7.547 7.537 0.010 25767 13369 1 15 . 1 1 83 83 ILE N N 83 118.085 118.085 115.502 2.583 25767 13370 1 15 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.618 0.225 25767 13371 1 15 . 1 1 83 83 ILE C C 83 176.413 176.413 177.054 -0.641 25767 13372 1 15 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.292 -0.565 25767 13373 1 15 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.085 -0.387 25767 13374 1 15 . 1 1 83 83 ILE H H 83 7.409 7.409 7.507 -0.098 25767 13375 1 15 . 1 1 84 84 HIS N N 84 116.152 116.152 115.739 0.413 25767 13376 1 15 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.626 -0.031 25767 13377 1 15 . 1 1 84 84 HIS C C 84 175.707 175.707 175.142 0.565 25767 13378 1 15 . 1 1 84 84 HIS CA C 84 58.628 58.628 57.604 1.024 25767 13379 1 15 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.992 0.411 25767 13380 1 15 . 1 1 84 84 HIS H H 84 7.194 7.194 7.872 -0.678 25767 13381 1 15 . 1 1 85 85 ASP N N 85 122.322 122.322 119.813 2.509 25767 13382 1 15 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.770 -0.236 25767 13383 1 15 . 1 1 85 85 ASP C C 85 175.580 175.580 176.802 -1.222 25767 13384 1 15 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.083 0.262 25767 13385 1 15 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.118 -0.000 25767 13386 1 15 . 1 1 85 85 ASP H H 85 8.505 8.505 7.960 0.545 25767 13387 1 15 . 1 1 86 86 GLN N N 86 122.783 122.783 126.066 -3.283 25767 13388 1 15 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.129 -0.166 25767 13389 1 15 . 1 1 86 86 GLN C C 86 178.581 178.581 178.164 0.417 25767 13390 1 15 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.624 -1.670 25767 13391 1 15 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.324 -0.430 25767 13392 1 15 . 1 1 86 86 GLN H H 86 8.803 8.803 8.807 -0.004 25767 13393 1 15 . 1 1 87 87 GLU N N 87 121.794 121.794 119.801 1.993 25767 13394 1 15 . 1 1 87 87 GLU HA H 87 4.013 4.013 3.914 0.099 25767 13395 1 15 . 1 1 87 87 GLU C C 87 178.290 178.290 178.826 -0.536 25767 13396 1 15 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.671 -0.633 25767 13397 1 15 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.049 -0.070 25767 13398 1 15 . 1 1 87 87 GLU H H 87 8.072 8.072 8.159 -0.087 25767 13399 1 15 . 1 1 88 88 LYS N N 88 119.345 119.345 119.396 -0.051 25767 13400 1 15 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.129 -0.374 25767 13401 1 15 . 1 1 88 88 LYS C C 88 180.040 180.040 178.514 1.526 25767 13402 1 15 . 1 1 88 88 LYS CA C 88 59.411 59.411 58.794 0.617 25767 13403 1 15 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.967 0.040 25767 13404 1 15 . 1 1 88 88 LYS H H 88 7.588 7.588 8.449 -0.861 25767 13405 1 15 . 1 1 89 89 ALA N N 89 123.933 123.933 122.227 1.706 25767 13406 1 15 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.112 -0.373 25767 13407 1 15 . 1 1 89 89 ALA C C 89 177.457 177.457 179.180 -1.723 25767 13408 1 15 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.260 0.710 25767 13409 1 15 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.318 0.338 25767 13410 1 15 . 1 1 89 89 ALA H H 89 8.500 8.500 8.208 0.292 25767 13411 1 15 . 1 1 90 90 LYS N N 90 119.244 119.244 119.500 -0.256 25767 13412 1 15 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.458 0.586 25767 13413 1 15 . 1 1 90 90 LYS C C 90 177.774 177.774 178.525 -0.751 25767 13414 1 15 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.342 -0.264 25767 13415 1 15 . 1 1 90 90 LYS CB C 90 30.241 30.241 31.964 -1.723 25767 13416 1 15 . 1 1 90 90 LYS H H 90 6.845 6.845 8.175 -1.330 25767 13417 1 15 . 1 1 91 91 ILE N N 91 117.718 117.718 116.992 0.726 25767 13418 1 15 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.601 -0.203 25767 13419 1 15 . 1 1 91 91 ILE C C 91 177.670 177.670 177.481 0.189 25767 13420 1 15 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.906 -0.908 25767 13421 1 15 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.163 0.638 25767 13422 1 15 . 1 1 91 91 ILE H H 91 7.293 7.293 7.753 -0.460 25767 13423 1 15 . 1 1 92 92 TYR N N 92 121.868 121.868 121.355 0.513 25767 13424 1 15 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.017 0.106 25767 13425 1 15 . 1 1 92 92 TYR C C 92 178.781 178.781 177.502 1.279 25767 13426 1 15 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.427 -0.785 25767 13427 1 15 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.765 0.456 25767 13428 1 15 . 1 1 92 92 TYR H H 92 8.016 8.016 7.682 0.334 25767 13429 1 15 . 1 1 93 93 MET N N 93 118.984 118.984 118.081 0.903 25767 13430 1 15 . 1 1 93 93 MET HA H 93 3.952 3.952 4.001 -0.049 25767 13431 1 15 . 1 1 93 93 MET C C 93 179.925 179.925 178.271 1.654 25767 13432 1 15 . 1 1 93 93 MET CA C 93 57.589 57.589 59.375 -1.786 25767 13433 1 15 . 1 1 93 93 MET CB C 93 30.752 30.752 32.627 -1.875 25767 13434 1 15 . 1 1 93 93 MET H H 93 8.464 8.464 8.481 -0.017 25767 13435 1 15 . 1 1 94 94 LEU N N 94 125.441 125.441 121.633 3.808 25767 13436 1 15 . 1 1 94 94 LEU HA H 94 3.870 3.870 3.886 -0.016 25767 13437 1 15 . 1 1 94 94 LEU C C 94 177.937 177.937 178.451 -0.514 25767 13438 1 15 . 1 1 94 94 LEU CA C 94 58.761 58.761 57.874 0.887 25767 13439 1 15 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.565 0.197 25767 13440 1 15 . 1 1 94 94 LEU H H 94 8.927 8.927 8.792 0.135 25767 13441 1 15 . 1 1 95 95 ASN N N 95 119.066 119.066 117.710 1.356 25767 13442 1 15 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.316 -0.054 25767 13443 1 15 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.018 0.255 25767 13444 1 15 . 1 1 95 95 ASN CB C 95 37.605 37.605 37.953 -0.348 25767 13445 1 15 . 1 1 95 95 ASN H H 95 8.691 8.691 8.224 0.467 25767 13446 1 15 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.193 0.472 25767 13447 1 15 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.717 0.354 25767 13448 1 15 . 1 1 96 96 PHE H H 96 8.317 8.317 7.975 0.342 25767 13449 1 15 . 1 1 97 97 THR N N 97 118.178 118.178 114.663 3.515 25767 13450 1 15 . 1 1 97 97 THR HA H 97 3.338 3.338 3.877 -0.539 25767 13451 1 15 . 1 1 97 97 THR C C 97 176.074 176.074 177.117 -1.043 25767 13452 1 15 . 1 1 97 97 THR CA C 97 67.986 67.986 66.358 1.628 25767 13453 1 15 . 1 1 97 97 THR H H 97 8.214 8.214 8.375 -0.161 25767 13454 1 15 . 1 1 98 98 MET N N 98 120.097 120.097 121.602 -1.505 25767 13455 1 15 . 1 1 98 98 MET HA H 98 4.403 4.403 4.213 0.190 25767 13456 1 15 . 1 1 98 98 MET C C 98 178.696 178.696 178.661 0.035 25767 13457 1 15 . 1 1 98 98 MET CA C 98 57.029 57.029 59.803 -2.774 25767 13458 1 15 . 1 1 98 98 MET CB C 98 29.898 29.898 32.367 -2.469 25767 13459 1 15 . 1 1 98 98 MET H H 98 8.885 8.885 8.482 0.403 25767 13460 1 15 . 1 1 99 99 SER N N 99 114.959 114.959 116.209 -1.250 25767 13461 1 15 . 1 1 99 99 SER HA H 99 4.199 4.199 4.135 0.064 25767 13462 1 15 . 1 1 99 99 SER C C 99 176.565 176.565 176.654 -0.089 25767 13463 1 15 . 1 1 99 99 SER CA C 99 61.965 61.965 61.649 0.316 25767 13464 1 15 . 1 1 99 99 SER CB C 99 62.565 62.565 63.238 -0.673 25767 13465 1 15 . 1 1 99 99 SER H H 99 7.515 7.515 8.101 -0.586 25767 13466 1 15 . 1 1 100 100 LEU N N 100 125.380 125.380 123.727 1.653 25767 13467 1 15 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.842 -0.066 25767 13468 1 15 . 1 1 100 100 LEU C C 100 177.689 177.689 177.826 -0.137 25767 13469 1 15 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.349 0.708 25767 13470 1 15 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.549 0.001 25767 13471 1 15 . 1 1 100 100 LEU H H 100 7.400 7.400 8.389 -0.989 25767 13472 1 15 . 1 1 101 101 TYR N N 101 120.597 120.597 119.557 1.040 25767 13473 1 15 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.978 0.138 25767 13474 1 15 . 1 1 101 101 TYR C C 101 176.825 176.825 177.337 -0.512 25767 13475 1 15 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.435 -0.548 25767 13476 1 15 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.335 0.658 25767 13477 1 15 . 1 1 101 101 TYR H H 101 8.880 8.880 8.774 0.106 25767 13478 1 15 . 1 1 102 102 ASN N N 102 116.869 116.869 116.626 0.243 25767 13479 1 15 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.274 -0.108 25767 13480 1 15 . 1 1 102 102 ASN C C 102 179.089 179.089 177.854 1.235 25767 13481 1 15 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.103 0.109 25767 13482 1 15 . 1 1 102 102 ASN CB C 102 37.734 37.734 37.664 0.070 25767 13483 1 15 . 1 1 102 102 ASN H H 102 8.543 8.543 8.001 0.542 25767 13484 1 15 . 1 1 103 103 GLU N N 103 121.259 121.259 120.282 0.977 25767 13485 1 15 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.900 0.086 25767 13486 1 15 . 1 1 103 103 GLU C C 103 179.968 179.968 178.862 1.106 25767 13487 1 15 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.441 0.076 25767 13488 1 15 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.370 0.180 25767 13489 1 15 . 1 1 103 103 GLU H H 103 7.872 7.872 7.747 0.125 25767 13490 1 15 . 1 1 104 104 LYS N N 104 120.268 120.268 118.874 1.394 25767 13491 1 15 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.198 -0.152 25767 13492 1 15 . 1 1 104 104 LYS C C 104 178.355 178.355 178.991 -0.636 25767 13493 1 15 . 1 1 104 104 LYS CA C 104 56.735 56.735 58.215 -1.480 25767 13494 1 15 . 1 1 104 104 LYS CB C 104 29.113 29.113 31.906 -2.793 25767 13495 1 15 . 1 1 104 104 LYS H H 104 8.384 8.384 7.468 0.916 25767 13496 1 15 . 1 1 105 105 LEU N N 105 121.622 121.622 119.331 2.291 25767 13497 1 15 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.712 0.029 25767 13498 1 15 . 1 1 105 105 LEU C C 105 180.552 180.552 178.654 1.898 25767 13499 1 15 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.244 -0.072 25767 13500 1 15 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.173 -0.143 25767 13501 1 15 . 1 1 105 105 LEU H H 105 8.400 8.400 7.614 0.786 25767 13502 1 15 . 1 1 106 106 LYS N N 106 119.498 119.498 118.630 0.868 25767 13503 1 15 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.818 0.096 25767 13504 1 15 . 1 1 106 106 LYS C C 106 178.419 178.419 179.063 -0.644 25767 13505 1 15 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.846 -0.463 25767 13506 1 15 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.979 -0.171 25767 13507 1 15 . 1 1 106 106 LYS H H 106 7.067 7.067 7.637 -0.570 25767 13508 1 15 . 1 1 107 107 GLN N N 107 121.405 121.405 118.771 2.634 25767 13509 1 15 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.955 -0.104 25767 13510 1 15 . 1 1 107 107 GLN C C 107 177.935 177.935 179.026 -1.091 25767 13511 1 15 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.635 -0.154 25767 13512 1 15 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.536 -1.738 25767 13513 1 15 . 1 1 107 107 GLN H H 107 7.460 7.460 7.636 -0.176 25767 13514 1 15 . 1 1 108 108 LEU N N 108 119.561 119.561 118.655 0.906 25767 13515 1 15 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.854 -0.053 25767 13516 1 15 . 1 1 108 108 LEU C C 108 179.195 179.195 178.160 1.035 25767 13517 1 15 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.292 1.101 25767 13518 1 15 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.677 -0.411 25767 13519 1 15 . 1 1 108 108 LEU H H 108 8.208 8.208 7.714 0.494 25767 13520 1 15 . 1 1 109 109 LYS N N 109 118.535 118.535 117.279 1.256 25767 13521 1 15 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.241 0.011 25767 13522 1 15 . 1 1 109 109 LYS C C 109 177.726 177.726 177.901 -0.175 25767 13523 1 15 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.452 0.279 25767 13524 1 15 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.906 -0.496 25767 13525 1 15 . 1 1 109 109 LYS H H 109 7.168 7.168 7.605 -0.437 25767 13526 1 15 . 1 1 110 110 ASP N N 110 117.463 117.463 116.316 1.147 25767 13527 1 15 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.688 -0.083 25767 13528 1 15 . 1 1 110 110 ASP C C 110 177.360 177.360 176.494 0.866 25767 13529 1 15 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.456 1.440 25767 13530 1 15 . 1 1 110 110 ASP CB C 110 42.577 42.577 42.116 0.461 25767 13531 1 15 . 1 1 110 110 ASP H H 110 7.861 7.861 8.261 -0.400 25767 13532 1 15 . 1 1 111 111 GLY N N 111 113.059 113.059 108.941 4.118 25767 13533 1 15 . 1 1 111 111 GLY CA C 111 42.052 42.052 43.042 -0.990 25767 13534 1 15 . 1 1 111 111 GLY H H 111 8.479 8.479 7.651 0.828 25767 13535 1 15 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.057 0.406 25767 13536 1 15 . 1 1 112 112 PRO C C 112 175.090 175.090 175.793 -0.703 25767 13537 1 15 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.138 -0.774 25767 13538 1 15 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.691 2.159 25767 13539 1 15 . 1 1 113 113 TRP N N 113 123.164 123.164 122.033 1.131 25767 13540 1 15 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.763 -0.053 25767 13541 1 15 . 1 1 113 113 TRP C C 113 174.605 174.605 175.486 -0.881 25767 13542 1 15 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.148 0.757 25767 13543 1 15 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.009 -2.716 25767 13544 1 15 . 1 1 113 113 TRP H H 113 8.687 8.687 8.374 0.313 25767 13545 1 15 . 1 1 114 114 ASP N N 114 121.356 121.356 122.764 -1.408 25767 13546 1 15 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.895 -0.034 25767 13547 1 15 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.356 -0.107 25767 13548 1 15 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.427 -1.286 25767 13549 1 15 . 1 1 114 114 ASP H H 114 6.985 6.985 8.247 -1.262 25767 13550 1 15 . 1 1 115 115 VAL N N 115 118.649 118.649 120.216 -1.567 25767 13551 1 15 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.880 -0.038 25767 13552 1 15 . 1 1 115 115 VAL C C 115 177.739 177.739 177.509 0.230 25767 13553 1 15 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.426 0.143 25767 13554 1 15 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.181 -0.504 25767 13555 1 15 . 1 1 115 115 VAL H H 115 8.206 8.206 8.422 -0.216 25767 13556 1 15 . 1 1 116 116 MET N N 116 120.401 120.401 117.915 2.486 25767 13557 1 15 . 1 1 116 116 MET HA H 116 4.303 4.303 4.214 0.089 25767 13558 1 15 . 1 1 116 116 MET C C 116 179.269 179.269 178.260 1.009 25767 13559 1 15 . 1 1 116 116 MET CA C 116 57.634 57.634 59.036 -1.402 25767 13560 1 15 . 1 1 116 116 MET CB C 116 30.414 30.414 31.915 -1.501 25767 13561 1 15 . 1 1 116 116 MET H H 116 7.642 7.642 8.147 -0.505 25767 13562 1 15 . 1 1 117 117 LEU N N 117 125.503 125.503 119.585 5.918 25767 13563 1 15 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.062 0.183 25767 13564 1 15 . 1 1 117 117 LEU C C 117 178.445 178.445 179.305 -0.860 25767 13565 1 15 . 1 1 117 117 LEU CA C 117 58.200 58.200 58.010 0.190 25767 13566 1 15 . 1 1 117 117 LEU CB C 117 40.089 40.089 40.682 -0.593 25767 13567 1 15 . 1 1 117 117 LEU H H 117 8.157 8.157 7.731 0.426 25767 13568 1 15 . 1 1 118 118 LYS N N 118 119.052 119.052 119.701 -0.649 25767 13569 1 15 . 1 1 118 118 LYS HA H 118 3.805 3.805 4.088 -0.283 25767 13570 1 15 . 1 1 118 118 LYS C C 118 178.251 178.251 179.314 -1.063 25767 13571 1 15 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.303 0.223 25767 13572 1 15 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.211 -0.083 25767 13573 1 15 . 1 1 118 118 LYS H H 118 7.400 7.400 7.635 -0.235 25767 13574 1 15 . 1 1 119 119 ARG N N 119 117.999 117.999 119.233 -1.234 25767 13575 1 15 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.202 0.018 25767 13576 1 15 . 1 1 119 119 ARG C C 119 180.441 180.441 179.168 1.273 25767 13577 1 15 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.557 0.260 25767 13578 1 15 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.119 -0.034 25767 13579 1 15 . 1 1 119 119 ARG H H 119 8.265 8.265 8.059 0.206 25767 13580 1 15 . 1 1 120 120 SER N N 120 118.073 118.073 115.406 2.667 25767 13581 1 15 . 1 1 120 120 SER HA H 120 4.182 4.182 4.367 -0.185 25767 13582 1 15 . 1 1 120 120 SER C C 120 176.215 176.215 176.517 -0.302 25767 13583 1 15 . 1 1 120 120 SER CA C 120 62.817 62.817 61.722 1.095 25767 13584 1 15 . 1 1 120 120 SER CB C 120 63.550 63.550 63.054 0.496 25767 13585 1 15 . 1 1 120 120 SER H H 120 8.633 8.633 7.908 0.725 25767 13586 1 15 . 1 1 121 121 LEU N N 121 125.029 125.029 123.426 1.603 25767 13587 1 15 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.153 0.066 25767 13588 1 15 . 1 1 121 121 LEU C C 121 179.679 179.679 177.897 1.782 25767 13589 1 15 . 1 1 121 121 LEU CA C 121 58.849 58.849 58.325 0.524 25767 13590 1 15 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.785 -1.011 25767 13591 1 15 . 1 1 121 121 LEU H H 121 8.313 8.313 8.129 0.184 25767 13592 1 15 . 1 1 122 122 TRP N N 122 120.217 120.217 119.651 0.566 25767 13593 1 15 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.342 -0.002 25767 13594 1 15 . 1 1 122 122 TRP C C 122 177.527 177.527 178.659 -1.132 25767 13595 1 15 . 1 1 122 122 TRP CA C 122 61.758 61.758 62.178 -0.420 25767 13596 1 15 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.119 0.529 25767 13597 1 15 . 1 1 122 122 TRP H H 122 7.928 7.928 8.321 -0.393 25767 13598 1 15 . 1 1 123 123 CYS N N 123 119.669 119.669 118.969 0.700 25767 13599 1 15 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.367 -0.160 25767 13600 1 15 . 1 1 123 123 CYS C C 123 177.057 177.057 177.101 -0.044 25767 13601 1 15 . 1 1 123 123 CYS CA C 123 62.600 62.600 63.658 -1.058 25767 13602 1 15 . 1 1 123 123 CYS CB C 123 25.899 25.899 26.960 -1.061 25767 13603 1 15 . 1 1 123 123 CYS H H 123 8.273 8.273 8.453 -0.180 25767 13604 1 15 . 1 1 124 124 CYS N N 124 116.898 116.898 119.763 -2.865 25767 13605 1 15 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.182 -0.334 25767 13606 1 15 . 1 1 124 124 CYS C C 124 175.759 175.759 176.774 -1.015 25767 13607 1 15 . 1 1 124 124 CYS CA C 124 65.653 65.653 65.026 0.627 25767 13608 1 15 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.337 0.180 25767 13609 1 15 . 1 1 124 124 CYS H H 124 8.122 8.122 8.405 -0.283 25767 13610 1 15 . 1 1 125 125 ILE N N 125 120.498 120.498 121.254 -0.756 25767 13611 1 15 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.693 -0.105 25767 13612 1 15 . 1 1 125 125 ILE C C 125 179.337 179.337 177.409 1.928 25767 13613 1 15 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.812 1.782 25767 13614 1 15 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.365 0.314 25767 13615 1 15 . 1 1 125 125 ILE H H 125 8.092 8.092 8.169 -0.077 25767 13616 1 15 . 1 1 126 126 ASP N N 126 125.084 125.084 120.557 4.527 25767 13617 1 15 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.449 0.168 25767 13618 1 15 . 1 1 126 126 ASP C C 126 178.299 178.299 178.974 -0.675 25767 13619 1 15 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.521 1.483 25767 13620 1 15 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.130 0.166 25767 13621 1 15 . 1 1 126 126 ASP H H 126 9.049 9.049 7.959 1.090 25767 13622 1 15 . 1 1 127 127 LEU N N 127 122.591 122.591 120.272 2.319 25767 13623 1 15 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.907 -0.040 25767 13624 1 15 . 1 1 127 127 LEU C C 127 179.655 179.655 178.985 0.670 25767 13625 1 15 . 1 1 127 127 LEU CA C 127 58.661 58.661 58.026 0.635 25767 13626 1 15 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.720 0.474 25767 13627 1 15 . 1 1 127 127 LEU H H 127 8.888 8.888 7.761 1.127 25767 13628 1 15 . 1 1 128 128 PHE N N 128 117.498 117.498 118.940 -1.442 25767 13629 1 15 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.105 0.217 25767 13630 1 15 . 1 1 128 128 PHE C C 128 178.533 178.533 178.274 0.259 25767 13631 1 15 . 1 1 128 128 PHE CA C 128 60.932 60.932 62.447 -1.515 25767 13632 1 15 . 1 1 128 128 PHE CB C 128 39.053 39.053 38.726 0.327 25767 13633 1 15 . 1 1 128 128 PHE H H 128 8.947 8.947 8.080 0.867 25767 13634 1 15 . 1 1 129 129 SER N N 129 115.398 115.398 116.121 -0.723 25767 13635 1 15 . 1 1 129 129 SER HA H 129 4.046 4.046 4.342 -0.296 25767 13636 1 15 . 1 1 129 129 SER C C 129 175.168 175.168 177.148 -1.980 25767 13637 1 15 . 1 1 129 129 SER CA C 129 63.015 63.015 62.481 0.534 25767 13638 1 15 . 1 1 129 129 SER H H 129 8.578 8.578 8.763 -0.185 25767 13639 1 15 . 1 1 130 130 CYS N N 130 125.556 125.556 120.299 5.257 25767 13640 1 15 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.254 -0.145 25767 13641 1 15 . 1 1 130 130 CYS C C 130 175.294 175.294 176.961 -1.667 25767 13642 1 15 . 1 1 130 130 CYS CA C 130 61.438 61.438 64.682 -3.244 25767 13643 1 15 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.758 -0.708 25767 13644 1 15 . 1 1 130 130 CYS H H 130 8.289 8.289 8.443 -0.154 25767 13645 1 15 . 1 1 131 131 ILE N N 131 120.232 120.232 119.598 0.634 25767 13646 1 15 . 1 1 131 131 ILE HA H 131 4.033 4.033 4.449 -0.416 25767 13647 1 15 . 1 1 131 131 ILE C C 131 177.297 177.297 177.843 -0.546 25767 13648 1 15 . 1 1 131 131 ILE CA C 131 64.652 64.652 64.851 -0.199 25767 13649 1 15 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.489 1.613 25767 13650 1 15 . 1 1 131 131 ILE H H 131 7.943 7.943 8.151 -0.208 25767 13651 1 15 . 1 1 132 132 LEU N N 132 116.422 116.422 121.463 -5.041 25767 13652 1 15 . 1 1 132 132 LEU HA H 132 3.845 3.845 4.080 -0.235 25767 13653 1 15 . 1 1 132 132 LEU C C 132 177.816 177.816 178.213 -0.397 25767 13654 1 15 . 1 1 132 132 LEU CA C 132 57.078 57.078 58.405 -1.327 25767 13655 1 15 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.694 0.519 25767 13656 1 15 . 1 1 132 132 LEU H H 132 7.846 7.846 8.545 -0.699 25767 13657 1 15 . 1 1 133 133 HIS N N 133 116.929 116.929 117.751 -0.822 25767 13658 1 15 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.394 -0.256 25767 13659 1 15 . 1 1 133 133 HIS C C 133 178.669 178.669 177.909 0.760 25767 13660 1 15 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.554 0.182 25767 13661 1 15 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.647 2.505 25767 13662 1 15 . 1 1 133 133 HIS H H 133 7.822 7.822 8.073 -0.251 25767 13663 1 15 . 1 1 134 134 LEU N N 134 116.898 116.898 122.319 -5.421 25767 13664 1 15 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.190 -0.457 25767 13665 1 15 . 1 1 134 134 LEU C C 134 179.402 179.402 178.715 0.687 25767 13666 1 15 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.868 -0.641 25767 13667 1 15 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.120 -2.581 25767 13668 1 15 . 1 1 134 134 LEU H H 134 8.688 8.688 7.998 0.690 25767 13669 1 15 . 1 1 135 135 TRP N N 135 115.602 115.602 116.342 -0.740 25767 13670 1 15 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.724 0.284 25767 13671 1 15 . 1 1 135 135 TRP C C 135 175.022 175.022 177.339 -2.317 25767 13672 1 15 . 1 1 135 135 TRP CA C 135 59.426 59.426 57.957 1.469 25767 13673 1 15 . 1 1 135 135 TRP CB C 135 27.085 27.085 29.087 -2.002 25767 13674 1 15 . 1 1 135 135 TRP H H 135 7.638 7.638 8.489 -0.851 25767 13675 1 15 . 1 1 136 136 LYS N N 136 119.721 119.721 122.378 -2.657 25767 13676 1 15 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.993 -0.177 25767 13677 1 15 . 1 1 136 136 LYS C C 136 178.279 178.279 178.448 -0.169 25767 13678 1 15 . 1 1 136 136 LYS CA C 136 60.193 60.193 60.090 0.103 25767 13679 1 15 . 1 1 136 136 LYS CB C 136 33.057 33.057 32.037 1.020 25767 13680 1 15 . 1 1 136 136 LYS H H 136 6.538 6.538 7.691 -1.153 25767 13681 1 15 . 1 1 137 137 GLU N N 137 115.407 115.407 115.963 -0.556 25767 13682 1 15 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.140 0.027 25767 13683 1 15 . 1 1 137 137 GLU C C 137 176.700 176.700 177.390 -0.690 25767 13684 1 15 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.526 -0.676 25767 13685 1 15 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.046 0.114 25767 13686 1 15 . 1 1 137 137 GLU H H 137 8.596 8.596 8.239 0.357 25767 13687 1 15 . 1 1 138 138 ASN N N 138 116.669 116.669 116.478 0.191 25767 13688 1 15 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.807 0.099 25767 13689 1 15 . 1 1 138 138 ASN C C 138 173.481 173.481 174.931 -1.450 25767 13690 1 15 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.848 -1.034 25767 13691 1 15 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.493 1.344 25767 13692 1 15 . 1 1 138 138 ASN H H 138 8.343 8.343 8.317 0.026 25767 13693 1 15 . 1 1 139 139 ILE N N 139 120.703 120.703 120.135 0.568 25767 13694 1 15 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.314 0.030 25767 13695 1 15 . 1 1 139 139 ILE C C 139 175.241 175.241 175.409 -0.168 25767 13696 1 15 . 1 1 139 139 ILE CA C 139 60.792 60.792 58.623 2.169 25767 13697 1 15 . 1 1 139 139 ILE CB C 139 40.274 40.274 38.211 2.063 25767 13698 1 15 . 1 1 139 139 ILE H H 139 7.167 7.167 7.594 -0.427 25767 13699 1 15 . 1 1 140 140 SER N N 140 123.284 123.284 119.848 3.436 25767 13700 1 15 . 1 1 140 140 SER HA H 140 4.345 4.345 4.527 -0.182 25767 13701 1 15 . 1 1 140 140 SER CA C 140 58.095 58.095 56.577 1.518 25767 13702 1 15 . 1 1 140 140 SER CB C 140 65.370 65.370 64.988 0.382 25767 13703 1 15 . 1 1 140 140 SER H H 140 8.727 8.727 8.525 0.202 25767 13704 1 15 . 1 1 142 142 THR N N 142 113.868 113.868 115.103 -1.235 25767 13705 1 15 . 1 1 142 142 THR HA H 142 3.976 3.976 4.112 -0.136 25767 13706 1 15 . 1 1 142 142 THR C C 142 177.559 177.559 176.322 1.237 25767 13707 1 15 . 1 1 142 142 THR CA C 142 66.007 66.007 66.681 -0.674 25767 13708 1 15 . 1 1 142 142 THR CB C 142 68.530 68.530 68.572 -0.042 25767 13709 1 15 . 1 1 142 142 THR H H 142 8.243 8.243 7.777 0.466 25767 13710 1 15 . 1 1 143 143 SER N N 143 120.786 120.786 117.100 3.686 25767 13711 1 15 . 1 1 143 143 SER C C 143 175.844 175.844 176.644 -0.800 25767 13712 1 15 . 1 1 143 143 SER CA C 143 62.102 62.102 60.963 1.139 25767 13713 1 15 . 1 1 143 143 SER CB C 143 63.086 63.086 62.863 0.223 25767 13714 1 15 . 1 1 143 143 SER H H 143 7.915 7.915 8.026 -0.111 25767 13715 1 15 . 1 1 144 144 THR N N 144 120.946 120.946 117.501 3.445 25767 13716 1 15 . 1 1 144 144 THR HA H 144 4.299 4.299 4.043 0.256 25767 13717 1 15 . 1 1 144 144 THR C C 144 175.874 175.874 176.424 -0.550 25767 13718 1 15 . 1 1 144 144 THR CA C 144 67.487 67.487 66.179 1.308 25767 13719 1 15 . 1 1 144 144 THR CB C 144 68.485 68.485 68.607 -0.122 25767 13720 1 15 . 1 1 144 144 THR H H 144 8.746 8.746 8.659 0.087 25767 13721 1 15 . 1 1 145 145 ASN N N 145 120.069 120.069 119.933 0.136 25767 13722 1 15 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.397 -0.089 25767 13723 1 15 . 1 1 145 145 ASN C C 145 177.917 177.917 177.606 0.311 25767 13724 1 15 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.631 -0.294 25767 13725 1 15 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.626 -0.526 25767 13726 1 15 . 1 1 145 145 ASN H H 145 7.940 7.940 7.828 0.112 25767 13727 1 15 . 1 1 146 146 SER N N 146 116.905 116.905 116.907 -0.002 25767 13728 1 15 . 1 1 146 146 SER HA H 146 3.936 3.936 4.079 -0.143 25767 13729 1 15 . 1 1 146 146 SER C C 146 176.963 176.963 176.584 0.379 25767 13730 1 15 . 1 1 146 146 SER CA C 146 61.997 61.997 61.825 0.172 25767 13731 1 15 . 1 1 146 146 SER CB C 146 62.879 62.879 63.208 -0.328 25767 13732 1 15 . 1 1 146 146 SER H H 146 7.951 7.951 7.748 0.203 25767 13733 1 15 . 1 1 147 147 LEU N N 147 123.253 123.253 121.849 1.404 25767 13734 1 15 . 1 1 147 147 LEU HA H 147 3.875 3.875 3.951 -0.076 25767 13735 1 15 . 1 1 147 147 LEU C C 147 178.726 178.726 178.807 -0.081 25767 13736 1 15 . 1 1 147 147 LEU CA C 147 58.580 58.580 58.306 0.274 25767 13737 1 15 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.666 -0.806 25767 13738 1 15 . 1 1 147 147 LEU H H 147 8.168 8.168 7.652 0.516 25767 13739 1 15 . 1 1 148 148 GLN N N 148 118.212 118.212 118.483 -0.271 25767 13740 1 15 . 1 1 148 148 GLN HA H 148 3.817 3.817 3.984 -0.167 25767 13741 1 15 . 1 1 148 148 GLN C C 148 179.686 179.686 178.607 1.079 25767 13742 1 15 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.594 0.649 25767 13743 1 15 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.821 -0.101 25767 13744 1 15 . 1 1 148 148 GLN H H 148 8.295 8.295 8.412 -0.117 25767 13745 1 15 . 1 1 149 149 LYS N N 149 120.770 120.770 120.521 0.249 25767 13746 1 15 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.955 -0.054 25767 13747 1 15 . 1 1 149 149 LYS C C 149 178.006 178.006 179.122 -1.116 25767 13748 1 15 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.691 -0.159 25767 13749 1 15 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.187 -0.295 25767 13750 1 15 . 1 1 149 149 LYS H H 149 7.955 7.955 8.085 -0.130 25767 13751 1 15 . 1 1 150 150 ARG N N 150 119.244 119.244 118.652 0.592 25767 13752 1 15 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.949 -0.109 25767 13753 1 15 . 1 1 150 150 ARG C C 150 178.858 178.858 178.779 0.079 25767 13754 1 15 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.418 -0.047 25767 13755 1 15 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.969 -1.165 25767 13756 1 15 . 1 1 150 150 ARG H H 150 7.020 7.020 7.468 -0.448 25767 13757 1 15 . 1 1 151 151 ILE N N 151 121.183 121.183 120.142 1.041 25767 13758 1 15 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.482 -0.123 25767 13759 1 15 . 1 1 151 151 ILE C C 151 177.327 177.327 177.849 -0.522 25767 13760 1 15 . 1 1 151 151 ILE CA C 151 67.196 67.196 65.061 2.135 25767 13761 1 15 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.583 0.689 25767 13762 1 15 . 1 1 151 151 ILE H H 151 7.574 7.574 8.022 -0.448 25767 13763 1 15 . 1 1 152 152 LYS N N 152 119.521 119.521 120.651 -1.130 25767 13764 1 15 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.860 -0.087 25767 13765 1 15 . 1 1 152 152 LYS C C 152 178.016 178.016 178.576 -0.560 25767 13766 1 15 . 1 1 152 152 LYS CA C 152 59.830 59.830 59.904 -0.073 25767 13767 1 15 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.269 -0.688 25767 13768 1 15 . 1 1 152 152 LYS H H 152 7.629 7.629 8.011 -0.382 25767 13769 1 15 . 1 1 153 153 TYR N N 153 120.178 120.178 120.853 -0.675 25767 13770 1 15 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.119 -0.047 25767 13771 1 15 . 1 1 153 153 TYR C C 153 178.195 178.195 178.001 0.194 25767 13772 1 15 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.734 -0.418 25767 13773 1 15 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.517 -1.244 25767 13774 1 15 . 1 1 153 153 TYR H H 153 8.407 8.407 7.925 0.482 25767 13775 1 15 . 1 1 154 154 CYS N N 154 117.013 117.013 117.981 -0.968 25767 13776 1 15 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.187 -0.115 25767 13777 1 15 . 1 1 154 154 CYS C C 154 176.827 176.827 177.047 -0.220 25767 13778 1 15 . 1 1 154 154 CYS CA C 154 65.780 65.780 62.192 3.588 25767 13779 1 15 . 1 1 154 154 CYS CB C 154 28.160 28.160 26.647 1.513 25767 13780 1 15 . 1 1 154 154 CYS H H 154 8.291 8.291 7.840 0.451 25767 13781 1 15 . 1 1 155 155 LYS N N 155 118.753 118.753 121.247 -2.494 25767 13782 1 15 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.781 -0.110 25767 13783 1 15 . 1 1 155 155 LYS C C 155 179.904 179.904 178.956 0.948 25767 13784 1 15 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.510 0.975 25767 13785 1 15 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.218 -0.275 25767 13786 1 15 . 1 1 155 155 LYS H H 155 7.934 7.934 7.972 -0.038 25767 13787 1 15 . 1 1 156 156 ILE N N 156 123.873 123.873 119.903 3.970 25767 13788 1 15 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.609 -0.025 25767 13789 1 15 . 1 1 156 156 ILE C C 156 179.501 179.501 177.663 1.838 25767 13790 1 15 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.326 -0.086 25767 13791 1 15 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.896 -0.254 25767 13792 1 15 . 1 1 156 156 ILE H H 156 8.314 8.314 8.477 -0.163 25767 13793 1 15 . 1 1 157 157 TYR N N 157 121.132 121.132 120.055 1.077 25767 13794 1 15 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.947 0.218 25767 13795 1 15 . 1 1 157 157 TYR C C 157 178.558 178.558 177.325 1.233 25767 13796 1 15 . 1 1 157 157 TYR CA C 157 62.110 62.110 62.144 -0.034 25767 13797 1 15 . 1 1 157 157 TYR H H 157 8.442 8.442 7.492 0.950 25767 13798 1 15 . 1 1 158 158 LEU N N 158 120.964 120.964 118.713 2.251 25767 13799 1 15 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.767 0.145 25767 13800 1 15 . 1 1 158 158 LEU C C 158 180.130 180.130 179.153 0.977 25767 13801 1 15 . 1 1 158 158 LEU CA C 158 58.686 58.686 58.044 0.642 25767 13802 1 15 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.279 0.451 25767 13803 1 15 . 1 1 158 158 LEU H H 158 8.469 8.469 7.657 0.812 25767 13804 1 15 . 1 1 159 159 SER N N 159 116.653 116.653 115.084 1.569 25767 13805 1 15 . 1 1 159 159 SER HA H 159 4.246 4.246 4.143 0.103 25767 13806 1 15 . 1 1 159 159 SER CA C 159 61.460 61.460 61.734 -0.274 25767 13807 1 15 . 1 1 159 159 SER CB C 159 62.849 62.849 62.389 0.460 25767 13808 1 15 . 1 1 159 159 SER H H 159 7.758 7.758 7.910 -0.152 25767 13809 1 15 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.308 -1.935 25767 13810 1 15 . 1 1 160 160 LYS CB C 160 29.832 29.832 32.044 -2.212 25767 13811 1 15 . 1 1 160 160 LYS H H 160 8.425 8.425 7.374 1.051 25767 13812 1 15 . 1 1 161 161 LEU N N 161 121.686 121.686 118.861 2.825 25767 13813 1 15 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.806 0.357 25767 13814 1 15 . 1 1 161 161 LEU C C 161 180.224 180.224 179.148 1.076 25767 13815 1 15 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.334 0.250 25767 13816 1 15 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.517 -0.055 25767 13817 1 15 . 1 1 161 161 LEU H H 161 8.323 8.323 7.595 0.728 25767 13818 1 15 . 1 1 162 162 ALA N N 162 123.102 123.102 120.912 2.190 25767 13819 1 15 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.074 0.056 25767 13820 1 15 . 1 1 162 162 ALA C C 162 179.487 179.487 179.123 0.364 25767 13821 1 15 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.664 0.080 25767 13822 1 15 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.495 -0.093 25767 13823 1 15 . 1 1 162 162 ALA H H 162 7.978 7.978 7.583 0.395 25767 13824 1 15 . 1 1 163 163 LYS N N 163 116.069 116.069 116.339 -0.270 25767 13825 1 15 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.263 -0.040 25767 13826 1 15 . 1 1 163 163 LYS C C 163 176.987 176.987 176.573 0.414 25767 13827 1 15 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.232 0.374 25767 13828 1 15 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.691 0.515 25767 13829 1 15 . 1 1 163 163 LYS H H 163 7.697 7.697 7.723 -0.026 25767 13830 1 15 . 1 1 164 164 GLY N N 164 108.540 108.540 107.279 1.261 25767 13831 1 15 . 1 1 164 164 GLY C C 164 174.721 174.721 173.879 0.842 25767 13832 1 15 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.887 0.904 25767 13833 1 15 . 1 1 164 164 GLY H H 164 7.772 7.772 7.606 0.166 25767 13834 1 15 . 1 1 165 165 GLU N N 165 119.886 119.886 120.590 -0.704 25767 13835 1 15 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.359 -0.309 25767 13836 1 15 . 1 1 165 165 GLU C C 165 176.027 176.027 175.035 0.992 25767 13837 1 15 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.105 1.748 25767 13838 1 15 . 1 1 165 165 GLU CB C 165 30.338 30.338 30.962 -0.624 25767 13839 1 15 . 1 1 165 165 GLU H H 165 8.065 8.065 7.924 0.141 25767 13840 1 15 . 1 1 166 166 ILE N N 166 117.926 117.926 122.739 -4.813 25767 13841 1 15 . 1 1 166 166 ILE HA H 166 3.902 3.902 4.001 -0.099 25767 13842 1 15 . 1 1 166 166 ILE C C 166 174.138 174.138 176.610 -2.472 25767 13843 1 15 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.594 1.861 25767 13844 1 15 . 1 1 166 166 ILE CB C 166 40.202 40.202 38.680 1.522 25767 13845 1 15 . 1 1 166 166 ILE H H 166 7.282 7.282 8.157 -0.875 25767 13846 1 16 . 1 1 2 2 ALA N N 2 122.811 122.811 124.199 -1.388 25767 13847 1 16 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.037 -0.014 25767 13848 1 16 . 1 1 2 2 ALA C C 2 179.915 179.915 179.120 0.795 25767 13849 1 16 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.649 -0.532 25767 13850 1 16 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.403 0.136 25767 13851 1 16 . 1 1 2 2 ALA H H 2 8.509 8.509 8.966 -0.457 25767 13852 1 16 . 1 1 3 3 SER N N 3 115.308 115.308 114.838 0.470 25767 13853 1 16 . 1 1 3 3 SER HA H 3 4.097 4.097 4.076 0.021 25767 13854 1 16 . 1 1 3 3 SER C C 3 176.706 176.706 176.554 0.152 25767 13855 1 16 . 1 1 3 3 SER CA C 3 60.665 60.665 61.515 -0.850 25767 13856 1 16 . 1 1 3 3 SER CB C 3 62.710 62.710 62.710 -0.000 25767 13857 1 16 . 1 1 3 3 SER H H 3 7.996 7.996 8.773 -0.777 25767 13858 1 16 . 1 1 4 4 ASN N N 4 122.688 122.688 120.427 2.261 25767 13859 1 16 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.380 -0.076 25767 13860 1 16 . 1 1 4 4 ASN C C 4 176.258 176.258 177.063 -0.805 25767 13861 1 16 . 1 1 4 4 ASN CA C 4 55.701 55.701 56.511 -0.810 25767 13862 1 16 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.919 0.258 25767 13863 1 16 . 1 1 4 4 ASN H H 4 8.075 8.075 8.282 -0.207 25767 13864 1 16 . 1 1 5 5 ALA N N 5 121.900 121.900 122.648 -0.748 25767 13865 1 16 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.014 -0.439 25767 13866 1 16 . 1 1 5 5 ALA C C 5 178.475 178.475 178.967 -0.492 25767 13867 1 16 . 1 1 5 5 ALA CA C 5 55.833 55.833 55.016 0.818 25767 13868 1 16 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.399 -0.784 25767 13869 1 16 . 1 1 5 5 ALA H H 5 8.659 8.659 7.641 1.018 25767 13870 1 16 . 1 1 6 6 ALA N N 6 117.768 117.768 121.522 -3.754 25767 13871 1 16 . 1 1 6 6 ALA HA H 6 3.787 3.787 4.004 -0.217 25767 13872 1 16 . 1 1 6 6 ALA C C 6 180.494 180.494 179.449 1.045 25767 13873 1 16 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.057 0.293 25767 13874 1 16 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.017 -0.115 25767 13875 1 16 . 1 1 6 6 ALA H H 6 7.864 7.864 7.685 0.179 25767 13876 1 16 . 1 1 7 7 ARG N N 7 121.173 121.173 119.317 1.856 25767 13877 1 16 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.090 -0.187 25767 13878 1 16 . 1 1 7 7 ARG C C 7 179.189 179.189 178.674 0.515 25767 13879 1 16 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.820 0.492 25767 13880 1 16 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.947 -0.725 25767 13881 1 16 . 1 1 7 7 ARG H H 7 7.514 7.514 8.060 -0.546 25767 13882 1 16 . 1 1 8 8 VAL N N 8 122.979 122.979 119.821 3.158 25767 13883 1 16 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.821 -0.568 25767 13884 1 16 . 1 1 8 8 VAL C C 8 177.821 177.821 178.195 -0.374 25767 13885 1 16 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.488 1.284 25767 13886 1 16 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.753 -0.312 25767 13887 1 16 . 1 1 8 8 VAL H H 8 8.101 8.101 7.807 0.294 25767 13888 1 16 . 1 1 9 9 VAL N N 9 119.801 119.801 119.879 -0.078 25767 13889 1 16 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.667 -0.401 25767 13890 1 16 . 1 1 9 9 VAL C C 9 177.373 177.373 177.345 0.028 25767 13891 1 16 . 1 1 9 9 VAL CA C 9 67.484 67.484 65.874 1.610 25767 13892 1 16 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.551 1.074 25767 13893 1 16 . 1 1 9 9 VAL H H 9 8.362 8.362 7.747 0.615 25767 13894 1 16 . 1 1 10 10 ALA N N 10 122.360 122.360 121.440 0.920 25767 13895 1 16 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.055 -0.119 25767 13896 1 16 . 1 1 10 10 ALA C C 10 180.762 180.762 179.618 1.144 25767 13897 1 16 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.688 -0.244 25767 13898 1 16 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.160 -0.423 25767 13899 1 16 . 1 1 10 10 ALA H H 10 7.776 7.776 7.772 0.004 25767 13900 1 16 . 1 1 11 11 THR N N 11 117.376 117.376 112.515 4.861 25767 13901 1 16 . 1 1 11 11 THR HA H 11 3.816 3.816 3.922 -0.106 25767 13902 1 16 . 1 1 11 11 THR C C 11 175.775 175.775 176.476 -0.701 25767 13903 1 16 . 1 1 11 11 THR CA C 11 66.509 66.509 65.437 1.072 25767 13904 1 16 . 1 1 11 11 THR CB C 11 68.588 68.588 68.689 -0.101 25767 13905 1 16 . 1 1 11 11 THR H H 11 8.180 8.180 7.714 0.466 25767 13906 1 16 . 1 1 12 12 ALA N N 12 125.308 125.308 125.762 -0.454 25767 13907 1 16 . 1 1 12 12 ALA HA H 12 3.997 3.997 4.148 -0.151 25767 13908 1 16 . 1 1 12 12 ALA C C 12 179.399 179.399 179.624 -0.225 25767 13909 1 16 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.722 0.354 25767 13910 1 16 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.346 0.898 25767 13911 1 16 . 1 1 12 12 ALA H H 12 8.671 8.671 8.599 0.072 25767 13912 1 16 . 1 1 13 13 LYS N N 13 116.977 116.977 117.780 -0.803 25767 13913 1 16 . 1 1 13 13 LYS C C 13 179.646 179.646 178.719 0.927 25767 13914 1 16 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.873 -0.952 25767 13915 1 16 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.219 -0.776 25767 13916 1 16 . 1 1 13 13 LYS H H 13 8.061 8.061 7.898 0.163 25767 13917 1 16 . 1 1 14 14 ASP N N 14 121.988 121.988 120.197 1.791 25767 13918 1 16 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.360 -0.007 25767 13919 1 16 . 1 1 14 14 ASP C C 14 179.446 179.446 178.498 0.948 25767 13920 1 16 . 1 1 14 14 ASP CA C 14 57.509 57.509 56.810 0.698 25767 13921 1 16 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.332 -0.331 25767 13922 1 16 . 1 1 14 14 ASP H H 14 7.669 7.669 7.586 0.083 25767 13923 1 16 . 1 1 15 15 PHE N N 15 119.588 119.588 118.074 1.514 25767 13924 1 16 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.199 0.145 25767 13925 1 16 . 1 1 15 15 PHE C C 15 178.373 178.373 178.028 0.345 25767 13926 1 16 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.688 0.549 25767 13927 1 16 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.730 -1.234 25767 13928 1 16 . 1 1 15 15 PHE H H 15 7.913 7.913 8.374 -0.461 25767 13929 1 16 . 1 1 16 16 ASP N N 16 121.705 121.705 119.768 1.937 25767 13930 1 16 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.441 -0.446 25767 13931 1 16 . 1 1 16 16 ASP C C 16 180.071 180.071 178.991 1.080 25767 13932 1 16 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.628 0.521 25767 13933 1 16 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.880 0.607 25767 13934 1 16 . 1 1 16 16 ASP H H 16 8.324 8.324 8.149 0.175 25767 13935 1 16 . 1 1 17 17 LYS N N 17 118.825 118.825 119.745 -0.920 25767 13936 1 16 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.101 -0.064 25767 13937 1 16 . 1 1 17 17 LYS C C 17 178.407 178.407 177.790 0.617 25767 13938 1 16 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.869 0.192 25767 13939 1 16 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.569 0.015 25767 13940 1 16 . 1 1 17 17 LYS H H 17 7.834 7.834 7.752 0.082 25767 13941 1 16 . 1 1 18 18 VAL N N 18 110.562 110.562 117.273 -6.711 25767 13942 1 16 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.104 0.412 25767 13943 1 16 . 1 1 18 18 VAL C C 18 176.144 176.144 176.680 -0.536 25767 13944 1 16 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.101 -2.227 25767 13945 1 16 . 1 1 18 18 VAL CB C 18 31.160 31.160 31.907 -0.747 25767 13946 1 16 . 1 1 18 18 VAL H H 18 7.185 7.185 7.599 -0.414 25767 13947 1 16 . 1 1 19 19 GLY N N 19 109.272 109.272 107.713 1.559 25767 13948 1 16 . 1 1 19 19 GLY C C 19 175.043 175.043 174.946 0.097 25767 13949 1 16 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.501 0.330 25767 13950 1 16 . 1 1 19 19 GLY H H 19 7.723 7.723 7.834 -0.111 25767 13951 1 16 . 1 1 20 20 LEU N N 20 125.428 125.428 121.639 3.789 25767 13952 1 16 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.645 -0.325 25767 13953 1 16 . 1 1 20 20 LEU C C 20 177.949 177.949 177.403 0.546 25767 13954 1 16 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.357 -0.553 25767 13955 1 16 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.627 0.290 25767 13956 1 16 . 1 1 20 20 LEU H H 20 8.083 8.083 8.225 -0.142 25767 13957 1 16 . 1 1 21 21 GLY N N 21 107.804 107.804 110.170 -2.366 25767 13958 1 16 . 1 1 21 21 GLY C C 21 176.278 176.278 176.214 0.064 25767 13959 1 16 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.666 -0.372 25767 13960 1 16 . 1 1 21 21 GLY H H 21 7.982 7.982 7.908 0.074 25767 13961 1 16 . 1 1 22 22 ILE N N 22 121.319 121.319 121.589 -0.270 25767 13962 1 16 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.792 0.118 25767 13963 1 16 . 1 1 22 22 ILE C C 22 176.604 176.604 177.654 -1.050 25767 13964 1 16 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.148 -1.702 25767 13965 1 16 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.570 -1.004 25767 13966 1 16 . 1 1 22 22 ILE H H 22 8.478 8.478 7.907 0.571 25767 13967 1 16 . 1 1 23 23 ILE N N 23 120.377 120.377 119.746 0.631 25767 13968 1 16 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.679 0.034 25767 13969 1 16 . 1 1 23 23 ILE C C 23 178.581 178.581 178.184 0.397 25767 13970 1 16 . 1 1 23 23 ILE CA C 23 64.246 64.246 62.899 1.347 25767 13971 1 16 . 1 1 23 23 ILE CB C 23 36.199 36.199 35.808 0.391 25767 13972 1 16 . 1 1 23 23 ILE H H 23 6.869 6.869 7.587 -0.718 25767 13973 1 16 . 1 1 24 24 GLY N N 24 103.449 103.449 108.247 -4.798 25767 13974 1 16 . 1 1 24 24 GLY C C 24 175.308 175.308 175.680 -0.372 25767 13975 1 16 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.224 0.719 25767 13976 1 16 . 1 1 24 24 GLY H H 24 7.488 7.488 8.094 -0.606 25767 13977 1 16 . 1 1 25 25 TYR N N 25 124.685 124.685 124.147 0.538 25767 13978 1 16 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.770 -0.104 25767 13979 1 16 . 1 1 25 25 TYR C C 25 176.208 176.208 177.072 -0.864 25767 13980 1 16 . 1 1 25 25 TYR CA C 25 61.371 61.371 60.626 0.745 25767 13981 1 16 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.471 -0.204 25767 13982 1 16 . 1 1 25 25 TYR H H 25 7.931 7.931 8.183 -0.252 25767 13983 1 16 . 1 1 26 26 TYR N N 26 117.001 117.001 119.877 -2.876 25767 13984 1 16 . 1 1 26 26 TYR HA H 26 3.941 3.941 3.932 0.009 25767 13985 1 16 . 1 1 26 26 TYR C C 26 178.753 178.753 177.431 1.322 25767 13986 1 16 . 1 1 26 26 TYR CA C 26 64.260 64.260 62.031 2.229 25767 13987 1 16 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.675 -1.154 25767 13988 1 16 . 1 1 26 26 TYR H H 26 7.693 7.693 7.893 -0.200 25767 13989 1 16 . 1 1 27 27 LEU N N 27 118.657 118.657 117.057 1.600 25767 13990 1 16 . 1 1 27 27 LEU HA H 27 4.311 4.311 3.997 0.314 25767 13991 1 16 . 1 1 27 27 LEU CA C 27 58.297 58.297 57.949 0.348 25767 13992 1 16 . 1 1 27 27 LEU CB C 27 42.723 42.723 40.871 1.852 25767 13993 1 16 . 1 1 27 27 LEU H H 27 8.339 8.339 7.923 0.416 25767 13994 1 16 . 1 1 28 28 GLN N N 28 118.593 118.593 118.832 -0.239 25767 13995 1 16 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.804 -0.153 25767 13996 1 16 . 1 1 28 28 GLN C C 28 177.282 177.282 178.493 -1.211 25767 13997 1 16 . 1 1 28 28 GLN CA C 28 58.829 58.829 59.043 -0.214 25767 13998 1 16 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.469 1.179 25767 13999 1 16 . 1 1 28 28 GLN H H 28 7.970 7.970 7.598 0.372 25767 14000 1 16 . 1 1 29 29 LEU N N 29 122.111 122.111 119.523 2.588 25767 14001 1 16 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.710 0.234 25767 14002 1 16 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.563 1.103 25767 14003 1 16 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.231 0.777 25767 14004 1 16 . 1 1 29 29 LEU H H 29 7.979 7.979 7.287 0.692 25767 14005 1 16 . 1 1 30 30 TYR N N 30 119.283 119.283 120.154 -0.871 25767 14006 1 16 . 1 1 30 30 TYR C C 30 175.775 175.775 177.240 -1.465 25767 14007 1 16 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.713 -1.619 25767 14008 1 16 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.300 0.773 25767 14009 1 16 . 1 1 30 30 TYR H H 30 8.093 8.093 7.543 0.550 25767 14010 1 16 . 1 1 31 31 ALA N N 31 121.327 121.327 122.186 -0.859 25767 14011 1 16 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.835 -0.467 25767 14012 1 16 . 1 1 31 31 ALA C C 31 178.955 178.955 178.856 0.099 25767 14013 1 16 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.305 0.242 25767 14014 1 16 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.208 -0.245 25767 14015 1 16 . 1 1 31 31 ALA H H 31 8.394 8.394 8.423 -0.029 25767 14016 1 16 . 1 1 32 32 VAL N N 32 116.757 116.757 118.442 -1.685 25767 14017 1 16 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.549 -0.289 25767 14018 1 16 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.637 2.025 25767 14019 1 16 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.634 -0.663 25767 14020 1 16 . 1 1 32 32 VAL H H 32 8.020 8.020 7.600 0.420 25767 14021 1 16 . 1 1 33 33 GLU N N 33 118.775 118.775 119.702 -0.927 25767 14022 1 16 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.796 0.193 25767 14023 1 16 . 1 1 33 33 GLU C C 33 179.746 179.746 178.955 0.791 25767 14024 1 16 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.399 0.604 25767 14025 1 16 . 1 1 33 33 GLU H H 33 7.358 7.358 7.565 -0.207 25767 14026 1 16 . 1 1 34 34 LEU N N 34 120.632 120.632 121.787 -1.155 25767 14027 1 16 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.881 -0.232 25767 14028 1 16 . 1 1 34 34 LEU C C 34 180.336 180.336 178.691 1.645 25767 14029 1 16 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.672 0.003 25767 14030 1 16 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.783 -0.195 25767 14031 1 16 . 1 1 34 34 LEU H H 34 8.390 8.390 7.875 0.515 25767 14032 1 16 . 1 1 35 35 ILE N N 35 121.240 121.240 118.090 3.150 25767 14033 1 16 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.845 -0.303 25767 14034 1 16 . 1 1 35 35 ILE C C 35 178.604 178.604 177.462 1.142 25767 14035 1 16 . 1 1 35 35 ILE CA C 35 65.547 65.547 64.765 0.782 25767 14036 1 16 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.928 0.803 25767 14037 1 16 . 1 1 35 35 ILE H H 35 8.129 8.129 7.489 0.640 25767 14038 1 16 . 1 1 36 36 LEU N N 36 115.637 115.637 117.085 -1.448 25767 14039 1 16 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.094 -0.086 25767 14040 1 16 . 1 1 36 36 LEU C C 36 178.001 178.001 178.131 -0.130 25767 14041 1 16 . 1 1 36 36 LEU CA C 36 56.076 56.076 56.654 -0.578 25767 14042 1 16 . 1 1 36 36 LEU CB C 36 39.934 39.934 42.060 -2.126 25767 14043 1 16 . 1 1 36 36 LEU H H 36 8.416 8.416 7.773 0.643 25767 14044 1 16 . 1 1 37 37 SER N N 37 114.106 114.106 111.446 2.660 25767 14045 1 16 . 1 1 37 37 SER HA H 37 3.991 3.991 4.255 -0.264 25767 14046 1 16 . 1 1 37 37 SER C C 37 173.997 173.997 175.225 -1.228 25767 14047 1 16 . 1 1 37 37 SER CA C 37 60.311 60.311 59.451 0.860 25767 14048 1 16 . 1 1 37 37 SER CB C 37 63.746 63.746 63.783 -0.037 25767 14049 1 16 . 1 1 37 37 SER H H 37 7.517 7.517 7.755 -0.238 25767 14050 1 16 . 1 1 38 38 GLU N N 38 123.003 123.003 122.596 0.407 25767 14051 1 16 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.185 0.184 25767 14052 1 16 . 1 1 38 38 GLU C C 38 175.780 175.780 176.085 -0.305 25767 14053 1 16 . 1 1 38 38 GLU CA C 38 55.365 55.365 56.075 -0.710 25767 14054 1 16 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.877 -0.584 25767 14055 1 16 . 1 1 38 38 GLU H H 38 7.151 7.151 7.525 -0.374 25767 14056 1 16 . 1 1 39 39 GLU N N 39 126.166 126.166 123.217 2.949 25767 14057 1 16 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.148 -0.139 25767 14058 1 16 . 1 1 39 39 GLU C C 39 176.652 176.652 175.656 0.996 25767 14059 1 16 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.785 1.413 25767 14060 1 16 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.423 -0.388 25767 14061 1 16 . 1 1 39 39 GLU H H 39 8.587 8.587 8.480 0.107 25767 14062 1 16 . 1 1 40 40 ASP N N 40 120.047 120.047 121.482 -1.435 25767 14063 1 16 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.457 0.093 25767 14064 1 16 . 1 1 40 40 ASP C C 40 175.035 175.035 175.924 -0.889 25767 14065 1 16 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.221 -1.853 25767 14066 1 16 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.759 -0.736 25767 14067 1 16 . 1 1 40 40 ASP H H 40 8.504 8.504 8.522 -0.018 25767 14068 1 16 . 1 1 41 41 ARG N N 41 120.671 120.671 122.681 -2.010 25767 14069 1 16 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.600 -0.211 25767 14070 1 16 . 1 1 41 41 ARG C C 41 175.755 175.755 175.980 -0.225 25767 14071 1 16 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.613 0.395 25767 14072 1 16 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.616 -1.067 25767 14073 1 16 . 1 1 41 41 ARG H H 41 7.672 7.672 8.336 -0.664 25767 14074 1 16 . 1 1 42 42 SER N N 42 120.330 120.330 116.029 4.301 25767 14075 1 16 . 1 1 42 42 SER HA H 42 3.837 3.837 4.398 -0.561 25767 14076 1 16 . 1 1 42 42 SER CA C 42 57.326 57.326 58.044 -0.718 25767 14077 1 16 . 1 1 42 42 SER CB C 42 65.762 65.762 64.211 1.551 25767 14078 1 16 . 1 1 42 42 SER H H 42 8.544 8.544 8.271 0.273 25767 14079 1 16 . 1 1 43 43 GLN HA H 43 3.989 3.989 4.004 -0.015 25767 14080 1 16 . 1 1 43 43 GLN C C 43 178.907 178.907 178.004 0.903 25767 14081 1 16 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.509 0.861 25767 14082 1 16 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.608 -0.645 25767 14083 1 16 . 1 1 44 44 GLU N N 44 120.328 120.328 119.593 0.735 25767 14084 1 16 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.990 0.023 25767 14085 1 16 . 1 1 44 44 GLU C C 44 179.824 179.824 178.588 1.236 25767 14086 1 16 . 1 1 44 44 GLU CA C 44 60.045 60.045 58.905 1.140 25767 14087 1 16 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.021 -0.373 25767 14088 1 16 . 1 1 44 44 GLU H H 44 8.938 8.938 7.726 1.212 25767 14089 1 16 . 1 1 45 45 MET N N 45 121.030 121.030 118.382 2.648 25767 14090 1 16 . 1 1 45 45 MET HA H 45 4.412 4.412 4.216 0.196 25767 14091 1 16 . 1 1 45 45 MET C C 45 180.357 180.357 177.632 2.725 25767 14092 1 16 . 1 1 45 45 MET CA C 45 57.209 57.209 59.562 -2.353 25767 14093 1 16 . 1 1 45 45 MET CB C 45 32.436 32.436 32.488 -0.052 25767 14094 1 16 . 1 1 45 45 MET H H 45 7.756 7.756 7.880 -0.124 25767 14095 1 16 . 1 1 46 46 THR N N 46 120.008 120.008 116.337 3.671 25767 14096 1 16 . 1 1 46 46 THR HA H 46 4.071 4.071 3.883 0.188 25767 14097 1 16 . 1 1 46 46 THR CA C 46 67.096 67.096 67.411 -0.315 25767 14098 1 16 . 1 1 46 46 THR CB C 46 68.954 68.954 68.245 0.709 25767 14099 1 16 . 1 1 46 46 THR H H 46 8.187 8.187 7.347 0.840 25767 14100 1 16 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.118 -0.009 25767 14101 1 16 . 1 1 47 47 ALA C C 47 180.118 180.118 179.144 0.974 25767 14102 1 16 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.906 0.433 25767 14103 1 16 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.252 -0.420 25767 14104 1 16 . 1 1 47 47 ALA H H 47 8.238 8.238 7.695 0.543 25767 14105 1 16 . 1 1 48 48 LEU N N 48 122.093 122.093 118.819 3.274 25767 14106 1 16 . 1 1 48 48 LEU HA H 48 4.263 4.263 3.911 0.352 25767 14107 1 16 . 1 1 48 48 LEU C C 48 179.103 179.103 179.048 0.055 25767 14108 1 16 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.510 0.231 25767 14109 1 16 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.462 -0.665 25767 14110 1 16 . 1 1 48 48 LEU H H 48 7.778 7.778 7.657 0.121 25767 14111 1 16 . 1 1 49 49 ALA N N 49 120.130 120.130 121.856 -1.726 25767 14112 1 16 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.959 -0.238 25767 14113 1 16 . 1 1 49 49 ALA C C 49 178.676 178.676 179.459 -0.783 25767 14114 1 16 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.413 0.308 25767 14115 1 16 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.031 -0.204 25767 14116 1 16 . 1 1 49 49 ALA H H 49 8.432 8.432 8.210 0.222 25767 14117 1 16 . 1 1 50 50 THR N N 50 113.333 113.333 115.049 -1.716 25767 14118 1 16 . 1 1 50 50 THR HA H 50 3.895 3.895 3.897 -0.002 25767 14119 1 16 . 1 1 50 50 THR C C 50 174.948 174.948 176.631 -1.683 25767 14120 1 16 . 1 1 50 50 THR CA C 50 67.334 67.334 67.105 0.229 25767 14121 1 16 . 1 1 50 50 THR CB C 50 68.864 68.864 68.477 0.387 25767 14122 1 16 . 1 1 50 50 THR H H 50 7.857 7.857 7.761 0.096 25767 14123 1 16 . 1 1 51 51 GLU N N 51 122.698 122.698 122.053 0.645 25767 14124 1 16 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.089 -0.021 25767 14125 1 16 . 1 1 51 51 GLU C C 51 179.997 179.997 178.557 1.440 25767 14126 1 16 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.074 0.359 25767 14127 1 16 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.302 0.215 25767 14128 1 16 . 1 1 51 51 GLU H H 51 7.817 7.817 7.659 0.158 25767 14129 1 16 . 1 1 52 52 LEU N N 52 121.100 121.100 121.223 -0.123 25767 14130 1 16 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.078 0.051 25767 14131 1 16 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.826 0.063 25767 14132 1 16 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.717 0.230 25767 14133 1 16 . 1 1 52 52 LEU H H 52 8.628 8.628 7.807 0.821 25767 14134 1 16 . 1 1 53 53 LEU N N 53 119.935 119.935 119.883 0.052 25767 14135 1 16 . 1 1 53 53 LEU C C 53 179.671 179.671 178.314 1.357 25767 14136 1 16 . 1 1 53 53 LEU H H 53 8.303 8.303 7.746 0.557 25767 14137 1 16 . 1 1 54 54 ASP N N 54 120.339 120.339 118.753 1.586 25767 14138 1 16 . 1 1 54 54 ASP C C 54 179.106 179.106 178.456 0.650 25767 14139 1 16 . 1 1 54 54 ASP H H 54 7.901 7.901 7.888 0.013 25767 14140 1 16 . 1 1 55 55 THR N N 55 120.237 120.237 116.563 3.674 25767 14141 1 16 . 1 1 55 55 THR HA H 55 3.696 3.696 4.071 -0.375 25767 14142 1 16 . 1 1 55 55 THR CA C 55 67.340 67.340 67.041 0.299 25767 14143 1 16 . 1 1 55 55 THR CB C 55 68.151 68.151 68.604 -0.453 25767 14144 1 16 . 1 1 55 55 THR H H 55 8.262 8.262 7.703 0.559 25767 14145 1 16 . 1 1 56 56 ILE N N 56 123.953 123.953 122.471 1.482 25767 14146 1 16 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.737 0.106 25767 14147 1 16 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.914 -0.020 25767 14148 1 16 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.719 0.413 25767 14149 1 16 . 1 1 56 56 ILE H H 56 8.930 8.930 7.777 1.153 25767 14150 1 16 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.780 -0.199 25767 14151 1 16 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.147 -0.116 25767 14152 1 16 . 1 1 58 58 ALA C C 58 179.875 179.875 179.496 0.379 25767 14153 1 16 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.785 0.481 25767 14154 1 16 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.328 -0.344 25767 14155 1 16 . 1 1 58 58 ALA H H 58 7.764 7.764 8.552 -0.788 25767 14156 1 16 . 1 1 59 59 PHE N N 59 121.988 121.988 120.265 1.723 25767 14157 1 16 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.192 0.034 25767 14158 1 16 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.153 0.286 25767 14159 1 16 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.303 0.060 25767 14160 1 16 . 1 1 59 59 PHE H H 59 8.159 8.159 8.635 -0.476 25767 14161 1 16 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.829 -0.288 25767 14162 1 16 . 1 1 60 60 LYS C C 60 179.438 179.438 178.967 0.471 25767 14163 1 16 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.504 0.632 25767 14164 1 16 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.429 -0.371 25767 14165 1 16 . 1 1 61 61 LYS N N 61 119.262 119.262 118.226 1.036 25767 14166 1 16 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.187 -0.242 25767 14167 1 16 . 1 1 61 61 LYS C C 61 178.730 178.730 178.433 0.297 25767 14168 1 16 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.561 1.481 25767 14169 1 16 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.094 0.548 25767 14170 1 16 . 1 1 61 61 LYS H H 61 7.832 7.832 7.886 -0.054 25767 14171 1 16 . 1 1 62 62 GLU N N 62 120.790 120.790 120.439 0.351 25767 14172 1 16 . 1 1 62 62 GLU HA H 62 3.935 3.935 4.003 -0.068 25767 14173 1 16 . 1 1 62 62 GLU C C 62 178.424 178.424 178.083 0.341 25767 14174 1 16 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.985 -0.271 25767 14175 1 16 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.272 -0.042 25767 14176 1 16 . 1 1 62 62 GLU H H 62 7.982 7.982 8.127 -0.145 25767 14177 1 16 . 1 1 63 63 ILE N N 63 118.463 118.463 116.965 1.498 25767 14178 1 16 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.790 -0.101 25767 14179 1 16 . 1 1 63 63 ILE C C 63 177.555 177.555 177.198 0.357 25767 14180 1 16 . 1 1 63 63 ILE CA C 63 61.499 61.499 62.760 -1.260 25767 14181 1 16 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.464 -1.940 25767 14182 1 16 . 1 1 63 63 ILE H H 63 7.732 7.732 7.337 0.395 25767 14183 1 16 . 1 1 64 64 GLY N N 64 107.973 107.973 106.794 1.179 25767 14184 1 16 . 1 1 64 64 GLY C C 64 175.271 175.271 175.198 0.073 25767 14185 1 16 . 1 1 64 64 GLY CA C 64 45.902 45.902 45.523 0.379 25767 14186 1 16 . 1 1 64 64 GLY H H 64 7.661 7.661 7.742 -0.081 25767 14187 1 16 . 1 1 65 65 GLY N N 65 108.464 108.464 107.518 0.946 25767 14188 1 16 . 1 1 65 65 GLY C C 65 174.800 174.800 175.596 -0.796 25767 14189 1 16 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.183 0.463 25767 14190 1 16 . 1 1 65 65 GLY H H 65 7.808 7.808 8.380 -0.572 25767 14191 1 16 . 1 1 66 66 GLU N N 66 121.162 121.162 120.659 0.503 25767 14192 1 16 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.034 0.071 25767 14193 1 16 . 1 1 66 66 GLU C C 66 177.230 177.230 177.805 -0.575 25767 14194 1 16 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.002 -1.778 25767 14195 1 16 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.363 0.628 25767 14196 1 16 . 1 1 66 66 GLU H H 66 8.203 8.203 7.596 0.607 25767 14197 1 16 . 1 1 67 67 SER N N 67 116.468 116.468 114.294 2.174 25767 14198 1 16 . 1 1 67 67 SER HA H 67 4.249 4.249 4.191 0.058 25767 14199 1 16 . 1 1 67 67 SER C C 67 174.640 174.640 176.994 -2.354 25767 14200 1 16 . 1 1 67 67 SER CA C 67 58.930 58.930 61.325 -2.396 25767 14201 1 16 . 1 1 67 67 SER CB C 67 63.912 63.912 62.831 1.081 25767 14202 1 16 . 1 1 67 67 SER H H 67 8.206 8.206 8.359 -0.153 25767 14203 1 16 . 1 1 68 68 GLU N N 68 122.400 122.400 121.012 1.388 25767 14204 1 16 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.096 0.057 25767 14205 1 16 . 1 1 68 68 GLU C C 68 176.349 176.349 177.253 -0.904 25767 14206 1 16 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.808 -1.985 25767 14207 1 16 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.058 0.923 25767 14208 1 16 . 1 1 68 68 GLU H H 68 8.168 8.168 8.490 -0.322 25767 14209 1 16 . 1 1 69 69 ALA N N 69 124.342 124.342 120.372 3.970 25767 14210 1 16 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.000 0.188 25767 14211 1 16 . 1 1 69 69 ALA C C 69 178.027 178.027 178.251 -0.224 25767 14212 1 16 . 1 1 69 69 ALA CA C 69 52.558 52.558 54.023 -1.465 25767 14213 1 16 . 1 1 69 69 ALA CB C 69 19.492 19.492 18.921 0.571 25767 14214 1 16 . 1 1 69 69 ALA H H 69 7.939 7.939 7.473 0.466 25767 14215 1 16 . 1 1 70 70 GLU N N 70 121.059 121.059 118.100 2.959 25767 14216 1 16 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.471 -0.357 25767 14217 1 16 . 1 1 70 70 GLU C C 70 176.519 176.519 175.300 1.219 25767 14218 1 16 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.108 2.196 25767 14219 1 16 . 1 1 70 70 GLU CB C 70 29.827 29.827 30.732 -0.905 25767 14220 1 16 . 1 1 70 70 GLU H H 70 8.430 8.430 7.532 0.898 25767 14221 1 16 . 1 1 71 71 ASP N N 71 120.274 120.274 123.248 -2.974 25767 14222 1 16 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.314 0.218 25767 14223 1 16 . 1 1 71 71 ASP C C 71 176.369 176.369 176.910 -0.541 25767 14224 1 16 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.278 -1.027 25767 14225 1 16 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.574 1.266 25767 14226 1 16 . 1 1 71 71 ASP H H 71 8.305 8.305 9.109 -0.804 25767 14227 1 16 . 1 1 72 72 SER N N 72 116.165 116.165 113.830 2.335 25767 14228 1 16 . 1 1 72 72 SER HA H 72 4.241 4.241 4.081 0.160 25767 14229 1 16 . 1 1 72 72 SER C C 72 174.567 174.567 175.851 -1.284 25767 14230 1 16 . 1 1 72 72 SER CA C 72 59.031 59.031 61.515 -2.484 25767 14231 1 16 . 1 1 72 72 SER CB C 72 64.040 64.040 63.004 1.036 25767 14232 1 16 . 1 1 72 72 SER H H 72 7.964 7.964 8.211 -0.247 25767 14233 1 16 . 1 1 73 73 ASP N N 73 122.440 122.440 122.499 -0.059 25767 14234 1 16 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.380 0.154 25767 14235 1 16 . 1 1 73 73 ASP C C 73 176.882 176.882 178.575 -1.693 25767 14236 1 16 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.618 -3.175 25767 14237 1 16 . 1 1 73 73 ASP CB C 73 41.336 41.336 40.151 1.185 25767 14238 1 16 . 1 1 73 73 ASP H H 73 8.392 8.392 8.634 -0.242 25767 14239 1 16 . 1 1 74 74 LYS N N 74 123.270 123.270 120.904 2.366 25767 14240 1 16 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.034 0.059 25767 14241 1 16 . 1 1 74 74 LYS C C 74 177.608 177.608 178.663 -1.055 25767 14242 1 16 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.748 -2.283 25767 14243 1 16 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.461 -0.315 25767 14244 1 16 . 1 1 74 74 LYS H H 74 8.317 8.317 7.518 0.799 25767 14245 1 16 . 1 1 75 75 SER N N 75 116.557 116.557 116.433 0.124 25767 14246 1 16 . 1 1 75 75 SER HA H 75 4.197 4.197 4.136 0.061 25767 14247 1 16 . 1 1 75 75 SER C C 75 175.988 175.988 176.654 -0.666 25767 14248 1 16 . 1 1 75 75 SER CA C 75 60.434 60.434 62.053 -1.619 25767 14249 1 16 . 1 1 75 75 SER CB C 75 63.172 63.172 63.188 -0.016 25767 14250 1 16 . 1 1 75 75 SER H H 75 8.387 8.387 8.099 0.288 25767 14251 1 16 . 1 1 76 76 LEU N N 76 123.910 123.910 121.707 2.203 25767 14252 1 16 . 1 1 76 76 LEU HA H 76 4.170 4.170 4.000 0.170 25767 14253 1 16 . 1 1 76 76 LEU C C 76 178.083 178.083 178.722 -0.639 25767 14254 1 16 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.812 -1.319 25767 14255 1 16 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.723 -0.026 25767 14256 1 16 . 1 1 76 76 LEU H H 76 8.059 8.059 8.407 -0.348 25767 14257 1 16 . 1 1 77 77 HIS N N 77 120.620 120.620 119.690 0.930 25767 14258 1 16 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.253 0.035 25767 14259 1 16 . 1 1 77 77 HIS C C 77 177.667 177.667 177.722 -0.055 25767 14260 1 16 . 1 1 77 77 HIS CA C 77 58.422 58.422 59.860 -1.438 25767 14261 1 16 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.710 0.554 25767 14262 1 16 . 1 1 77 77 HIS H H 77 7.936 7.936 8.024 -0.088 25767 14263 1 16 . 1 1 78 78 VAL N N 78 121.774 121.774 119.912 1.862 25767 14264 1 16 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.613 0.064 25767 14265 1 16 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.326 -0.720 25767 14266 1 16 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.303 0.561 25767 14267 1 16 . 1 1 78 78 VAL H H 78 7.916 7.916 7.993 -0.077 25767 14268 1 16 . 1 1 79 79 MET N N 79 119.660 119.660 118.223 1.437 25767 14269 1 16 . 1 1 79 79 MET HA H 79 3.925 3.925 4.106 -0.181 25767 14270 1 16 . 1 1 79 79 MET C C 79 177.077 177.077 178.832 -1.755 25767 14271 1 16 . 1 1 79 79 MET CA C 79 58.862 58.862 57.600 1.262 25767 14272 1 16 . 1 1 79 79 MET CB C 79 32.852 32.852 30.992 1.860 25767 14273 1 16 . 1 1 79 79 MET H H 79 8.149 8.149 8.151 -0.002 25767 14274 1 16 . 1 1 80 80 ASN N N 80 117.337 117.337 118.613 -1.276 25767 14275 1 16 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.719 -0.581 25767 14276 1 16 . 1 1 80 80 ASN C C 80 178.133 178.133 178.233 -0.100 25767 14277 1 16 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.395 0.644 25767 14278 1 16 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.583 0.413 25767 14279 1 16 . 1 1 80 80 ASN H H 80 8.202 8.202 8.780 -0.578 25767 14280 1 16 . 1 1 81 81 THR N N 81 115.517 115.517 118.422 -2.905 25767 14281 1 16 . 1 1 81 81 THR HA H 81 3.896 3.896 3.943 -0.047 25767 14282 1 16 . 1 1 81 81 THR C C 81 175.186 175.186 176.166 -0.980 25767 14283 1 16 . 1 1 81 81 THR CA C 81 66.221 66.221 67.449 -1.228 25767 14284 1 16 . 1 1 81 81 THR CB C 81 69.087 69.087 68.706 0.382 25767 14285 1 16 . 1 1 81 81 THR H H 81 7.944 7.944 8.031 -0.087 25767 14286 1 16 . 1 1 82 82 LEU N N 82 119.074 119.074 120.443 -1.369 25767 14287 1 16 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.019 -0.038 25767 14288 1 16 . 1 1 82 82 LEU C C 82 177.583 177.583 177.843 -0.260 25767 14289 1 16 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.276 -0.736 25767 14290 1 16 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.793 -0.000 25767 14291 1 16 . 1 1 82 82 LEU H H 82 7.547 7.547 7.640 -0.093 25767 14292 1 16 . 1 1 83 83 ILE N N 83 118.085 118.085 115.615 2.470 25767 14293 1 16 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.477 0.366 25767 14294 1 16 . 1 1 83 83 ILE C C 83 176.413 176.413 176.973 -0.560 25767 14295 1 16 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.011 -0.284 25767 14296 1 16 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.212 -0.513 25767 14297 1 16 . 1 1 83 83 ILE H H 83 7.409 7.409 7.475 -0.066 25767 14298 1 16 . 1 1 84 84 HIS N N 84 116.152 116.152 114.715 1.437 25767 14299 1 16 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.470 0.125 25767 14300 1 16 . 1 1 84 84 HIS C C 84 175.707 175.707 175.038 0.669 25767 14301 1 16 . 1 1 84 84 HIS CA C 84 58.628 58.628 57.593 1.035 25767 14302 1 16 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.981 0.422 25767 14303 1 16 . 1 1 84 84 HIS H H 84 7.194 7.194 7.847 -0.653 25767 14304 1 16 . 1 1 85 85 ASP N N 85 122.322 122.322 120.156 2.166 25767 14305 1 16 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.762 -0.228 25767 14306 1 16 . 1 1 85 85 ASP C C 85 175.580 175.580 176.419 -0.839 25767 14307 1 16 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.069 0.277 25767 14308 1 16 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.383 -0.265 25767 14309 1 16 . 1 1 85 85 ASP H H 85 8.505 8.505 8.025 0.480 25767 14310 1 16 . 1 1 86 86 GLN N N 86 122.783 122.783 126.970 -4.187 25767 14311 1 16 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.054 -0.091 25767 14312 1 16 . 1 1 86 86 GLN C C 86 178.581 178.581 177.880 0.701 25767 14313 1 16 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.352 -1.398 25767 14314 1 16 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.185 -0.291 25767 14315 1 16 . 1 1 86 86 GLN H H 86 8.803 8.803 8.736 0.067 25767 14316 1 16 . 1 1 87 87 GLU N N 87 121.794 121.794 118.944 2.850 25767 14317 1 16 . 1 1 87 87 GLU HA H 87 4.013 4.013 4.118 -0.105 25767 14318 1 16 . 1 1 87 87 GLU C C 87 178.290 178.290 178.844 -0.554 25767 14319 1 16 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.473 -0.435 25767 14320 1 16 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.454 -0.475 25767 14321 1 16 . 1 1 87 87 GLU H H 87 8.072 8.072 8.396 -0.324 25767 14322 1 16 . 1 1 88 88 LYS N N 88 119.345 119.345 119.409 -0.064 25767 14323 1 16 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.074 -0.319 25767 14324 1 16 . 1 1 88 88 LYS C C 88 180.040 180.040 178.882 1.158 25767 14325 1 16 . 1 1 88 88 LYS CA C 88 59.411 59.411 59.013 0.398 25767 14326 1 16 . 1 1 88 88 LYS CB C 88 32.007 32.007 32.278 -0.271 25767 14327 1 16 . 1 1 88 88 LYS H H 88 7.588 7.588 7.791 -0.203 25767 14328 1 16 . 1 1 89 89 ALA N N 89 123.933 123.933 122.562 1.371 25767 14329 1 16 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.148 -0.409 25767 14330 1 16 . 1 1 89 89 ALA C C 89 177.457 177.457 179.228 -1.771 25767 14331 1 16 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.294 0.676 25767 14332 1 16 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.213 0.443 25767 14333 1 16 . 1 1 89 89 ALA H H 89 8.500 8.500 7.754 0.746 25767 14334 1 16 . 1 1 90 90 LYS N N 90 119.244 119.244 119.913 -0.669 25767 14335 1 16 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.910 0.134 25767 14336 1 16 . 1 1 90 90 LYS C C 90 177.774 177.774 178.675 -0.901 25767 14337 1 16 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.609 -0.531 25767 14338 1 16 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.422 -2.181 25767 14339 1 16 . 1 1 90 90 LYS H H 90 6.845 6.845 7.920 -1.075 25767 14340 1 16 . 1 1 91 91 ILE N N 91 117.718 117.718 117.255 0.463 25767 14341 1 16 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.650 -0.252 25767 14342 1 16 . 1 1 91 91 ILE C C 91 177.670 177.670 177.636 0.034 25767 14343 1 16 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.671 -0.673 25767 14344 1 16 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.035 0.766 25767 14345 1 16 . 1 1 91 91 ILE H H 91 7.293 7.293 7.759 -0.466 25767 14346 1 16 . 1 1 92 92 TYR N N 92 121.868 121.868 121.442 0.426 25767 14347 1 16 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.064 0.059 25767 14348 1 16 . 1 1 92 92 TYR C C 92 178.781 178.781 177.555 1.226 25767 14349 1 16 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.394 -0.752 25767 14350 1 16 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.903 0.318 25767 14351 1 16 . 1 1 92 92 TYR H H 92 8.016 8.016 7.916 0.100 25767 14352 1 16 . 1 1 93 93 MET N N 93 118.984 118.984 118.216 0.768 25767 14353 1 16 . 1 1 93 93 MET HA H 93 3.952 3.952 4.047 -0.095 25767 14354 1 16 . 1 1 93 93 MET C C 93 179.925 179.925 178.277 1.648 25767 14355 1 16 . 1 1 93 93 MET CA C 93 57.589 57.589 59.279 -1.690 25767 14356 1 16 . 1 1 93 93 MET CB C 93 30.752 30.752 32.697 -1.945 25767 14357 1 16 . 1 1 93 93 MET H H 93 8.464 8.464 8.756 -0.292 25767 14358 1 16 . 1 1 94 94 LEU N N 94 125.441 125.441 121.772 3.669 25767 14359 1 16 . 1 1 94 94 LEU HA H 94 3.870 3.870 4.002 -0.132 25767 14360 1 16 . 1 1 94 94 LEU C C 94 177.937 177.937 178.446 -0.509 25767 14361 1 16 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.199 0.562 25767 14362 1 16 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.572 0.190 25767 14363 1 16 . 1 1 94 94 LEU H H 94 8.927 8.927 8.893 0.034 25767 14364 1 16 . 1 1 95 95 ASN N N 95 119.066 119.066 117.669 1.397 25767 14365 1 16 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.370 -0.108 25767 14366 1 16 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.029 0.244 25767 14367 1 16 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.063 -0.458 25767 14368 1 16 . 1 1 95 95 ASN H H 95 8.691 8.691 8.078 0.613 25767 14369 1 16 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.215 0.450 25767 14370 1 16 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.629 0.442 25767 14371 1 16 . 1 1 96 96 PHE H H 96 8.317 8.317 7.912 0.405 25767 14372 1 16 . 1 1 97 97 THR N N 97 118.178 118.178 114.708 3.470 25767 14373 1 16 . 1 1 97 97 THR HA H 97 3.338 3.338 3.883 -0.545 25767 14374 1 16 . 1 1 97 97 THR C C 97 176.074 176.074 177.135 -1.061 25767 14375 1 16 . 1 1 97 97 THR CA C 97 67.986 67.986 66.418 1.568 25767 14376 1 16 . 1 1 97 97 THR H H 97 8.214 8.214 8.771 -0.557 25767 14377 1 16 . 1 1 98 98 MET N N 98 120.097 120.097 120.836 -0.739 25767 14378 1 16 . 1 1 98 98 MET HA H 98 4.403 4.403 4.074 0.329 25767 14379 1 16 . 1 1 98 98 MET C C 98 178.696 178.696 178.424 0.272 25767 14380 1 16 . 1 1 98 98 MET CA C 98 57.029 57.029 57.045 -0.016 25767 14381 1 16 . 1 1 98 98 MET CB C 98 29.898 29.898 31.108 -1.210 25767 14382 1 16 . 1 1 98 98 MET H H 98 8.885 8.885 8.057 0.828 25767 14383 1 16 . 1 1 99 99 SER N N 99 114.959 114.959 116.432 -1.473 25767 14384 1 16 . 1 1 99 99 SER HA H 99 4.199 4.199 4.119 0.080 25767 14385 1 16 . 1 1 99 99 SER C C 99 176.565 176.565 176.631 -0.066 25767 14386 1 16 . 1 1 99 99 SER CA C 99 61.965 61.965 61.083 0.882 25767 14387 1 16 . 1 1 99 99 SER CB C 99 62.565 62.565 63.035 -0.470 25767 14388 1 16 . 1 1 99 99 SER H H 99 7.515 7.515 7.914 -0.399 25767 14389 1 16 . 1 1 100 100 LEU N N 100 125.380 125.380 124.210 1.170 25767 14390 1 16 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.829 -0.053 25767 14391 1 16 . 1 1 100 100 LEU C C 100 177.689 177.689 178.014 -0.325 25767 14392 1 16 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.481 0.576 25767 14393 1 16 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.587 -0.037 25767 14394 1 16 . 1 1 100 100 LEU H H 100 7.400 7.400 8.362 -0.962 25767 14395 1 16 . 1 1 101 101 TYR N N 101 120.597 120.597 119.363 1.234 25767 14396 1 16 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.943 0.173 25767 14397 1 16 . 1 1 101 101 TYR C C 101 176.825 176.825 177.289 -0.464 25767 14398 1 16 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.340 -0.452 25767 14399 1 16 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.270 0.723 25767 14400 1 16 . 1 1 101 101 TYR H H 101 8.880 8.880 8.414 0.466 25767 14401 1 16 . 1 1 102 102 ASN N N 102 116.869 116.869 117.035 -0.166 25767 14402 1 16 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.179 -0.013 25767 14403 1 16 . 1 1 102 102 ASN C C 102 179.089 179.089 177.435 1.654 25767 14404 1 16 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.125 0.087 25767 14405 1 16 . 1 1 102 102 ASN CB C 102 37.734 37.734 38.086 -0.352 25767 14406 1 16 . 1 1 102 102 ASN H H 102 8.543 8.543 7.916 0.627 25767 14407 1 16 . 1 1 103 103 GLU N N 103 121.259 121.259 119.878 1.381 25767 14408 1 16 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.894 0.091 25767 14409 1 16 . 1 1 103 103 GLU C C 103 179.968 179.968 178.596 1.372 25767 14410 1 16 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.398 0.119 25767 14411 1 16 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.648 -0.098 25767 14412 1 16 . 1 1 103 103 GLU H H 103 7.872 7.872 8.170 -0.298 25767 14413 1 16 . 1 1 104 104 LYS N N 104 120.268 120.268 120.234 0.034 25767 14414 1 16 . 1 1 104 104 LYS HA H 104 4.046 4.046 3.972 0.074 25767 14415 1 16 . 1 1 104 104 LYS C C 104 178.355 178.355 178.844 -0.489 25767 14416 1 16 . 1 1 104 104 LYS CA C 104 56.735 56.735 58.746 -2.011 25767 14417 1 16 . 1 1 104 104 LYS CB C 104 29.113 29.113 31.868 -2.755 25767 14418 1 16 . 1 1 104 104 LYS H H 104 8.384 8.384 7.584 0.800 25767 14419 1 16 . 1 1 105 105 LEU N N 105 121.622 121.622 118.725 2.897 25767 14420 1 16 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.626 0.115 25767 14421 1 16 . 1 1 105 105 LEU C C 105 180.552 180.552 178.594 1.958 25767 14422 1 16 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.037 0.135 25767 14423 1 16 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.130 -0.100 25767 14424 1 16 . 1 1 105 105 LEU H H 105 8.400 8.400 7.744 0.656 25767 14425 1 16 . 1 1 106 106 LYS N N 106 119.498 119.498 118.026 1.472 25767 14426 1 16 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.922 -0.008 25767 14427 1 16 . 1 1 106 106 LYS C C 106 178.419 178.419 179.279 -0.860 25767 14428 1 16 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.022 0.361 25767 14429 1 16 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.463 0.345 25767 14430 1 16 . 1 1 106 106 LYS H H 106 7.067 7.067 7.484 -0.417 25767 14431 1 16 . 1 1 107 107 GLN N N 107 121.405 121.405 118.747 2.658 25767 14432 1 16 . 1 1 107 107 GLN HA H 107 3.851 3.851 4.077 -0.226 25767 14433 1 16 . 1 1 107 107 GLN C C 107 177.935 177.935 179.079 -1.144 25767 14434 1 16 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.411 0.070 25767 14435 1 16 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.238 -1.440 25767 14436 1 16 . 1 1 107 107 GLN H H 107 7.460 7.460 7.774 -0.314 25767 14437 1 16 . 1 1 108 108 LEU N N 108 119.561 119.561 119.904 -0.343 25767 14438 1 16 . 1 1 108 108 LEU HA H 108 3.801 3.801 4.216 -0.415 25767 14439 1 16 . 1 1 108 108 LEU C C 108 179.195 179.195 179.441 -0.246 25767 14440 1 16 . 1 1 108 108 LEU CA C 108 58.393 58.393 58.121 0.272 25767 14441 1 16 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.633 -0.367 25767 14442 1 16 . 1 1 108 108 LEU H H 108 8.208 8.208 7.928 0.280 25767 14443 1 16 . 1 1 109 109 LYS N N 109 118.535 118.535 118.435 0.100 25767 14444 1 16 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.311 -0.059 25767 14445 1 16 . 1 1 109 109 LYS C C 109 177.726 177.726 178.489 -0.763 25767 14446 1 16 . 1 1 109 109 LYS CA C 109 58.730 58.730 59.374 -0.644 25767 14447 1 16 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.623 -0.213 25767 14448 1 16 . 1 1 109 109 LYS H H 109 7.168 7.168 7.691 -0.523 25767 14449 1 16 . 1 1 110 110 ASP N N 110 117.463 117.463 116.968 0.495 25767 14450 1 16 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.693 -0.088 25767 14451 1 16 . 1 1 110 110 ASP C C 110 177.360 177.360 176.670 0.690 25767 14452 1 16 . 1 1 110 110 ASP CA C 110 55.896 55.896 55.062 0.834 25767 14453 1 16 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.771 0.806 25767 14454 1 16 . 1 1 110 110 ASP H H 110 7.861 7.861 8.512 -0.651 25767 14455 1 16 . 1 1 111 111 GLY N N 111 113.059 113.059 108.159 4.900 25767 14456 1 16 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.670 -0.618 25767 14457 1 16 . 1 1 111 111 GLY H H 111 8.479 8.479 7.889 0.590 25767 14458 1 16 . 1 1 112 112 PRO HA H 112 4.463 4.463 3.673 0.790 25767 14459 1 16 . 1 1 112 112 PRO C C 112 175.090 175.090 175.842 -0.752 25767 14460 1 16 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.154 -0.790 25767 14461 1 16 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.468 2.381 25767 14462 1 16 . 1 1 113 113 TRP N N 113 123.164 123.164 120.783 2.381 25767 14463 1 16 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.774 -0.064 25767 14464 1 16 . 1 1 113 113 TRP C C 113 174.605 174.605 174.872 -0.267 25767 14465 1 16 . 1 1 113 113 TRP CA C 113 57.905 57.905 56.360 1.545 25767 14466 1 16 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.117 -2.824 25767 14467 1 16 . 1 1 113 113 TRP H H 113 8.687 8.687 7.509 1.178 25767 14468 1 16 . 1 1 114 114 ASP N N 114 121.356 121.356 121.820 -0.464 25767 14469 1 16 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.928 -0.067 25767 14470 1 16 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.603 -0.354 25767 14471 1 16 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.140 -0.999 25767 14472 1 16 . 1 1 114 114 ASP H H 114 6.985 6.985 8.408 -1.423 25767 14473 1 16 . 1 1 115 115 VAL N N 115 118.649 118.649 119.260 -0.611 25767 14474 1 16 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.915 -0.073 25767 14475 1 16 . 1 1 115 115 VAL C C 115 177.739 177.739 177.455 0.284 25767 14476 1 16 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.758 -0.189 25767 14477 1 16 . 1 1 115 115 VAL CB C 115 31.677 31.677 31.959 -0.282 25767 14478 1 16 . 1 1 115 115 VAL H H 115 8.206 8.206 8.474 -0.268 25767 14479 1 16 . 1 1 116 116 MET N N 116 120.401 120.401 118.436 1.965 25767 14480 1 16 . 1 1 116 116 MET HA H 116 4.303 4.303 4.194 0.109 25767 14481 1 16 . 1 1 116 116 MET C C 116 179.269 179.269 178.455 0.814 25767 14482 1 16 . 1 1 116 116 MET CA C 116 57.634 57.634 59.095 -1.461 25767 14483 1 16 . 1 1 116 116 MET CB C 116 30.414 30.414 31.810 -1.396 25767 14484 1 16 . 1 1 116 116 MET H H 116 7.642 7.642 8.106 -0.464 25767 14485 1 16 . 1 1 117 117 LEU N N 117 125.503 125.503 119.006 6.497 25767 14486 1 16 . 1 1 117 117 LEU HA H 117 4.245 4.245 3.901 0.344 25767 14487 1 16 . 1 1 117 117 LEU C C 117 178.445 178.445 179.009 -0.564 25767 14488 1 16 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.735 0.465 25767 14489 1 16 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.025 -0.936 25767 14490 1 16 . 1 1 117 117 LEU H H 117 8.157 8.157 7.588 0.569 25767 14491 1 16 . 1 1 118 118 LYS N N 118 119.052 119.052 119.401 -0.349 25767 14492 1 16 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.972 -0.167 25767 14493 1 16 . 1 1 118 118 LYS C C 118 178.251 178.251 179.335 -1.084 25767 14494 1 16 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.011 0.515 25767 14495 1 16 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.140 -0.012 25767 14496 1 16 . 1 1 118 118 LYS H H 118 7.400 7.400 7.529 -0.129 25767 14497 1 16 . 1 1 119 119 ARG N N 119 117.999 117.999 119.198 -1.199 25767 14498 1 16 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.315 -0.095 25767 14499 1 16 . 1 1 119 119 ARG C C 119 180.441 180.441 178.981 1.460 25767 14500 1 16 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.559 0.258 25767 14501 1 16 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.134 -0.049 25767 14502 1 16 . 1 1 119 119 ARG H H 119 8.265 8.265 7.931 0.334 25767 14503 1 16 . 1 1 120 120 SER N N 120 118.073 118.073 115.233 2.840 25767 14504 1 16 . 1 1 120 120 SER HA H 120 4.182 4.182 4.354 -0.172 25767 14505 1 16 . 1 1 120 120 SER C C 120 176.215 176.215 176.510 -0.295 25767 14506 1 16 . 1 1 120 120 SER CA C 120 62.817 62.817 61.761 1.056 25767 14507 1 16 . 1 1 120 120 SER CB C 120 63.550 63.550 63.031 0.519 25767 14508 1 16 . 1 1 120 120 SER H H 120 8.633 8.633 7.798 0.835 25767 14509 1 16 . 1 1 121 121 LEU N N 121 125.029 125.029 123.343 1.686 25767 14510 1 16 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.110 0.109 25767 14511 1 16 . 1 1 121 121 LEU C C 121 179.679 179.679 177.702 1.977 25767 14512 1 16 . 1 1 121 121 LEU CA C 121 58.849 58.849 58.465 0.383 25767 14513 1 16 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.723 -0.949 25767 14514 1 16 . 1 1 121 121 LEU H H 121 8.313 8.313 7.750 0.563 25767 14515 1 16 . 1 1 122 122 TRP N N 122 120.217 120.217 119.627 0.590 25767 14516 1 16 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.292 0.048 25767 14517 1 16 . 1 1 122 122 TRP C C 122 177.527 177.527 178.872 -1.345 25767 14518 1 16 . 1 1 122 122 TRP CA C 122 61.758 61.758 61.752 0.006 25767 14519 1 16 . 1 1 122 122 TRP CB C 122 29.648 29.648 28.947 0.701 25767 14520 1 16 . 1 1 122 122 TRP H H 122 7.928 7.928 7.877 0.051 25767 14521 1 16 . 1 1 123 123 CYS N N 123 119.669 119.669 118.726 0.943 25767 14522 1 16 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.310 -0.103 25767 14523 1 16 . 1 1 123 123 CYS C C 123 177.057 177.057 177.199 -0.142 25767 14524 1 16 . 1 1 123 123 CYS CA C 123 62.600 62.600 63.173 -0.573 25767 14525 1 16 . 1 1 123 123 CYS CB C 123 25.899 25.899 27.560 -1.661 25767 14526 1 16 . 1 1 123 123 CYS H H 123 8.273 8.273 8.199 0.074 25767 14527 1 16 . 1 1 124 124 CYS N N 124 116.898 116.898 119.932 -3.034 25767 14528 1 16 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.130 -0.282 25767 14529 1 16 . 1 1 124 124 CYS C C 124 175.759 175.759 176.675 -0.916 25767 14530 1 16 . 1 1 124 124 CYS CA C 124 65.653 65.653 64.166 1.487 25767 14531 1 16 . 1 1 124 124 CYS CB C 124 27.517 27.517 26.732 0.785 25767 14532 1 16 . 1 1 124 124 CYS H H 124 8.122 8.122 8.523 -0.401 25767 14533 1 16 . 1 1 125 125 ILE N N 125 120.498 120.498 121.131 -0.633 25767 14534 1 16 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.639 -0.051 25767 14535 1 16 . 1 1 125 125 ILE C C 125 179.337 179.337 177.405 1.932 25767 14536 1 16 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.811 1.783 25767 14537 1 16 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.331 0.348 25767 14538 1 16 . 1 1 125 125 ILE H H 125 8.092 8.092 8.671 -0.579 25767 14539 1 16 . 1 1 126 126 ASP N N 126 125.084 125.084 120.762 4.322 25767 14540 1 16 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.442 0.175 25767 14541 1 16 . 1 1 126 126 ASP C C 126 178.299 178.299 178.954 -0.655 25767 14542 1 16 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.526 1.478 25767 14543 1 16 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.072 0.224 25767 14544 1 16 . 1 1 126 126 ASP H H 126 9.049 9.049 7.926 1.123 25767 14545 1 16 . 1 1 127 127 LEU N N 127 122.591 122.591 120.263 2.328 25767 14546 1 16 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.958 -0.091 25767 14547 1 16 . 1 1 127 127 LEU C C 127 179.655 179.655 178.927 0.728 25767 14548 1 16 . 1 1 127 127 LEU CA C 127 58.661 58.661 58.160 0.501 25767 14549 1 16 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.754 0.440 25767 14550 1 16 . 1 1 127 127 LEU H H 127 8.888 8.888 7.832 1.056 25767 14551 1 16 . 1 1 128 128 PHE N N 128 117.498 117.498 120.090 -2.592 25767 14552 1 16 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.075 0.247 25767 14553 1 16 . 1 1 128 128 PHE C C 128 178.533 178.533 177.394 1.139 25767 14554 1 16 . 1 1 128 128 PHE CA C 128 60.932 60.932 62.084 -1.152 25767 14555 1 16 . 1 1 128 128 PHE CB C 128 39.053 39.053 39.301 -0.248 25767 14556 1 16 . 1 1 128 128 PHE H H 128 8.947 8.947 8.022 0.925 25767 14557 1 16 . 1 1 129 129 SER N N 129 115.398 115.398 116.445 -1.047 25767 14558 1 16 . 1 1 129 129 SER HA H 129 4.046 4.046 4.346 -0.300 25767 14559 1 16 . 1 1 129 129 SER C C 129 175.168 175.168 176.952 -1.784 25767 14560 1 16 . 1 1 129 129 SER CA C 129 63.015 63.015 62.807 0.208 25767 14561 1 16 . 1 1 129 129 SER H H 129 8.578 8.578 8.852 -0.274 25767 14562 1 16 . 1 1 130 130 CYS N N 130 125.556 125.556 121.406 4.150 25767 14563 1 16 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.163 -0.054 25767 14564 1 16 . 1 1 130 130 CYS C C 130 175.294 175.294 176.765 -1.471 25767 14565 1 16 . 1 1 130 130 CYS CA C 130 61.438 61.438 64.539 -3.101 25767 14566 1 16 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.717 -0.667 25767 14567 1 16 . 1 1 130 130 CYS H H 130 8.289 8.289 8.510 -0.221 25767 14568 1 16 . 1 1 131 131 ILE N N 131 120.232 120.232 120.984 -0.752 25767 14569 1 16 . 1 1 131 131 ILE HA H 131 4.033 4.033 3.962 0.071 25767 14570 1 16 . 1 1 131 131 ILE C C 131 177.297 177.297 178.455 -1.158 25767 14571 1 16 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.531 -0.879 25767 14572 1 16 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.834 1.268 25767 14573 1 16 . 1 1 131 131 ILE H H 131 7.943 7.943 7.968 -0.025 25767 14574 1 16 . 1 1 132 132 LEU N N 132 116.422 116.422 120.591 -4.169 25767 14575 1 16 . 1 1 132 132 LEU HA H 132 3.845 3.845 3.849 -0.004 25767 14576 1 16 . 1 1 132 132 LEU C C 132 177.816 177.816 178.392 -0.576 25767 14577 1 16 . 1 1 132 132 LEU CA C 132 57.078 57.078 57.918 -0.840 25767 14578 1 16 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.433 0.780 25767 14579 1 16 . 1 1 132 132 LEU H H 132 7.846 7.846 8.165 -0.319 25767 14580 1 16 . 1 1 133 133 HIS N N 133 116.929 116.929 119.126 -2.197 25767 14581 1 16 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.233 -0.094 25767 14582 1 16 . 1 1 133 133 HIS C C 133 178.669 178.669 177.486 1.183 25767 14583 1 16 . 1 1 133 133 HIS CA C 133 59.736 59.736 60.057 -0.321 25767 14584 1 16 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.446 2.706 25767 14585 1 16 . 1 1 133 133 HIS H H 133 7.822 7.822 8.285 -0.463 25767 14586 1 16 . 1 1 134 134 LEU N N 134 116.898 116.898 119.968 -3.070 25767 14587 1 16 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.177 -0.444 25767 14588 1 16 . 1 1 134 134 LEU C C 134 179.402 179.402 179.116 0.286 25767 14589 1 16 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.855 -0.627 25767 14590 1 16 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.124 -2.585 25767 14591 1 16 . 1 1 134 134 LEU H H 134 8.688 8.688 7.876 0.812 25767 14592 1 16 . 1 1 135 135 TRP N N 135 115.602 115.602 117.956 -2.354 25767 14593 1 16 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.604 0.404 25767 14594 1 16 . 1 1 135 135 TRP C C 135 175.022 175.022 178.073 -3.051 25767 14595 1 16 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.641 0.785 25767 14596 1 16 . 1 1 135 135 TRP CB C 135 27.085 27.085 29.076 -1.991 25767 14597 1 16 . 1 1 135 135 TRP H H 135 7.638 7.638 8.342 -0.704 25767 14598 1 16 . 1 1 136 136 LYS N N 136 119.721 119.721 122.871 -3.150 25767 14599 1 16 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.938 -0.122 25767 14600 1 16 . 1 1 136 136 LYS C C 136 178.279 178.279 178.268 0.011 25767 14601 1 16 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.739 0.454 25767 14602 1 16 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.813 1.244 25767 14603 1 16 . 1 1 136 136 LYS H H 136 6.538 6.538 8.457 -1.919 25767 14604 1 16 . 1 1 137 137 GLU N N 137 115.407 115.407 116.106 -0.699 25767 14605 1 16 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.120 0.047 25767 14606 1 16 . 1 1 137 137 GLU C C 137 176.700 176.700 177.346 -0.646 25767 14607 1 16 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.520 -0.670 25767 14608 1 16 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.009 0.151 25767 14609 1 16 . 1 1 137 137 GLU H H 137 8.596 8.596 8.109 0.487 25767 14610 1 16 . 1 1 138 138 ASN N N 138 116.669 116.669 116.413 0.256 25767 14611 1 16 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.803 0.103 25767 14612 1 16 . 1 1 138 138 ASN C C 138 173.481 173.481 174.895 -1.414 25767 14613 1 16 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.824 -1.010 25767 14614 1 16 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.544 1.292 25767 14615 1 16 . 1 1 138 138 ASN H H 138 8.343 8.343 8.153 0.190 25767 14616 1 16 . 1 1 139 139 ILE N N 139 120.703 120.703 120.567 0.136 25767 14617 1 16 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.244 0.100 25767 14618 1 16 . 1 1 139 139 ILE C C 139 175.241 175.241 175.729 -0.488 25767 14619 1 16 . 1 1 139 139 ILE CA C 139 60.792 60.792 58.622 2.170 25767 14620 1 16 . 1 1 139 139 ILE CB C 139 40.274 40.274 38.285 1.988 25767 14621 1 16 . 1 1 139 139 ILE H H 139 7.167 7.167 7.657 -0.490 25767 14622 1 16 . 1 1 140 140 SER N N 140 123.284 123.284 121.122 2.162 25767 14623 1 16 . 1 1 140 140 SER HA H 140 4.345 4.345 4.518 -0.173 25767 14624 1 16 . 1 1 140 140 SER CA C 140 58.095 58.095 57.719 0.376 25767 14625 1 16 . 1 1 140 140 SER CB C 140 65.370 65.370 64.743 0.627 25767 14626 1 16 . 1 1 140 140 SER H H 140 8.727 8.727 8.529 0.198 25767 14627 1 16 . 1 1 142 142 THR N N 142 113.868 113.868 115.186 -1.318 25767 14628 1 16 . 1 1 142 142 THR HA H 142 3.976 3.976 4.187 -0.211 25767 14629 1 16 . 1 1 142 142 THR C C 142 177.559 177.559 177.018 0.541 25767 14630 1 16 . 1 1 142 142 THR CA C 142 66.007 66.007 65.736 0.271 25767 14631 1 16 . 1 1 142 142 THR CB C 142 68.530 68.530 68.497 0.033 25767 14632 1 16 . 1 1 142 142 THR H H 142 8.243 8.243 8.103 0.140 25767 14633 1 16 . 1 1 143 143 SER N N 143 120.786 120.786 116.914 3.872 25767 14634 1 16 . 1 1 143 143 SER C C 143 175.844 175.844 176.536 -0.692 25767 14635 1 16 . 1 1 143 143 SER CA C 143 62.102 62.102 61.624 0.478 25767 14636 1 16 . 1 1 143 143 SER CB C 143 63.086 63.086 62.955 0.131 25767 14637 1 16 . 1 1 143 143 SER H H 143 7.915 7.915 8.093 -0.178 25767 14638 1 16 . 1 1 144 144 THR N N 144 120.946 120.946 117.702 3.244 25767 14639 1 16 . 1 1 144 144 THR HA H 144 4.299 4.299 3.991 0.308 25767 14640 1 16 . 1 1 144 144 THR C C 144 175.874 175.874 176.265 -0.391 25767 14641 1 16 . 1 1 144 144 THR CA C 144 67.487 67.487 67.468 0.019 25767 14642 1 16 . 1 1 144 144 THR CB C 144 68.485 68.485 68.699 -0.214 25767 14643 1 16 . 1 1 144 144 THR H H 144 8.746 8.746 8.665 0.081 25767 14644 1 16 . 1 1 145 145 ASN N N 145 120.069 120.069 119.010 1.059 25767 14645 1 16 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.418 -0.110 25767 14646 1 16 . 1 1 145 145 ASN C C 145 177.917 177.917 177.512 0.405 25767 14647 1 16 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.629 -0.292 25767 14648 1 16 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.595 -0.495 25767 14649 1 16 . 1 1 145 145 ASN H H 145 7.940 7.940 7.847 0.093 25767 14650 1 16 . 1 1 146 146 SER N N 146 116.905 116.905 117.413 -0.508 25767 14651 1 16 . 1 1 146 146 SER HA H 146 3.936 3.936 4.200 -0.264 25767 14652 1 16 . 1 1 146 146 SER C C 146 176.963 176.963 176.759 0.204 25767 14653 1 16 . 1 1 146 146 SER CA C 146 61.997 61.997 61.712 0.285 25767 14654 1 16 . 1 1 146 146 SER CB C 146 62.879 62.879 62.566 0.313 25767 14655 1 16 . 1 1 146 146 SER H H 146 7.951 7.951 7.829 0.122 25767 14656 1 16 . 1 1 147 147 LEU N N 147 123.253 123.253 123.310 -0.057 25767 14657 1 16 . 1 1 147 147 LEU HA H 147 3.875 3.875 4.004 -0.129 25767 14658 1 16 . 1 1 147 147 LEU C C 147 178.726 178.726 179.002 -0.276 25767 14659 1 16 . 1 1 147 147 LEU CA C 147 58.580 58.580 58.555 0.025 25767 14660 1 16 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.701 -0.841 25767 14661 1 16 . 1 1 147 147 LEU H H 147 8.168 8.168 7.813 0.355 25767 14662 1 16 . 1 1 148 148 GLN N N 148 118.212 118.212 117.912 0.300 25767 14663 1 16 . 1 1 148 148 GLN HA H 148 3.817 3.817 3.943 -0.126 25767 14664 1 16 . 1 1 148 148 GLN C C 148 179.686 179.686 178.199 1.487 25767 14665 1 16 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.374 0.869 25767 14666 1 16 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.899 -0.179 25767 14667 1 16 . 1 1 148 148 GLN H H 148 8.295 8.295 8.957 -0.662 25767 14668 1 16 . 1 1 149 149 LYS N N 149 120.770 120.770 120.478 0.292 25767 14669 1 16 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.920 -0.019 25767 14670 1 16 . 1 1 149 149 LYS C C 149 178.006 178.006 178.572 -0.566 25767 14671 1 16 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.447 0.085 25767 14672 1 16 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.427 -0.535 25767 14673 1 16 . 1 1 149 149 LYS H H 149 7.955 7.955 8.325 -0.370 25767 14674 1 16 . 1 1 150 150 ARG N N 150 119.244 119.244 119.166 0.078 25767 14675 1 16 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.967 -0.127 25767 14676 1 16 . 1 1 150 150 ARG C C 150 178.858 178.858 178.679 0.179 25767 14677 1 16 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.162 0.209 25767 14678 1 16 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.861 -1.058 25767 14679 1 16 . 1 1 150 150 ARG H H 150 7.020 7.020 7.486 -0.466 25767 14680 1 16 . 1 1 151 151 ILE N N 151 121.183 121.183 119.409 1.774 25767 14681 1 16 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.475 -0.116 25767 14682 1 16 . 1 1 151 151 ILE C C 151 177.327 177.327 177.784 -0.457 25767 14683 1 16 . 1 1 151 151 ILE CA C 151 67.196 67.196 64.754 2.442 25767 14684 1 16 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.521 0.751 25767 14685 1 16 . 1 1 151 151 ILE H H 151 7.574 7.574 7.568 0.006 25767 14686 1 16 . 1 1 152 152 LYS N N 152 119.521 119.521 120.727 -1.206 25767 14687 1 16 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.849 -0.076 25767 14688 1 16 . 1 1 152 152 LYS C C 152 178.016 178.016 178.516 -0.500 25767 14689 1 16 . 1 1 152 152 LYS CA C 152 59.830 59.830 59.926 -0.096 25767 14690 1 16 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.209 -0.628 25767 14691 1 16 . 1 1 152 152 LYS H H 152 7.629 7.629 7.919 -0.290 25767 14692 1 16 . 1 1 153 153 TYR N N 153 120.178 120.178 120.326 -0.148 25767 14693 1 16 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.140 -0.068 25767 14694 1 16 . 1 1 153 153 TYR C C 153 178.195 178.195 177.880 0.315 25767 14695 1 16 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.516 -0.200 25767 14696 1 16 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.385 -1.112 25767 14697 1 16 . 1 1 153 153 TYR H H 153 8.407 8.407 7.769 0.638 25767 14698 1 16 . 1 1 154 154 CYS N N 154 117.013 117.013 118.203 -1.190 25767 14699 1 16 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.197 -0.125 25767 14700 1 16 . 1 1 154 154 CYS C C 154 176.827 176.827 177.306 -0.479 25767 14701 1 16 . 1 1 154 154 CYS CA C 154 65.780 65.780 63.667 2.113 25767 14702 1 16 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.342 0.818 25767 14703 1 16 . 1 1 154 154 CYS H H 154 8.291 8.291 7.738 0.553 25767 14704 1 16 . 1 1 155 155 LYS N N 155 118.753 118.753 120.280 -1.527 25767 14705 1 16 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.809 -0.138 25767 14706 1 16 . 1 1 155 155 LYS C C 155 179.904 179.904 178.725 1.179 25767 14707 1 16 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.529 0.956 25767 14708 1 16 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.228 -0.285 25767 14709 1 16 . 1 1 155 155 LYS H H 155 7.934 7.934 7.912 0.022 25767 14710 1 16 . 1 1 156 156 ILE N N 156 123.873 123.873 120.911 2.962 25767 14711 1 16 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.548 0.036 25767 14712 1 16 . 1 1 156 156 ILE C C 156 179.501 179.501 177.746 1.755 25767 14713 1 16 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.766 -0.526 25767 14714 1 16 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.815 -0.173 25767 14715 1 16 . 1 1 156 156 ILE H H 156 8.314 8.314 8.278 0.036 25767 14716 1 16 . 1 1 157 157 TYR N N 157 121.132 121.132 119.584 1.548 25767 14717 1 16 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.938 0.227 25767 14718 1 16 . 1 1 157 157 TYR C C 157 178.558 178.558 177.625 0.933 25767 14719 1 16 . 1 1 157 157 TYR CA C 157 62.110 62.110 62.324 -0.214 25767 14720 1 16 . 1 1 157 157 TYR H H 157 8.442 8.442 7.837 0.605 25767 14721 1 16 . 1 1 158 158 LEU N N 158 120.964 120.964 120.025 0.939 25767 14722 1 16 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.833 0.079 25767 14723 1 16 . 1 1 158 158 LEU C C 158 180.130 180.130 178.637 1.493 25767 14724 1 16 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.876 0.810 25767 14725 1 16 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.643 0.087 25767 14726 1 16 . 1 1 158 158 LEU H H 158 8.469 8.469 7.908 0.561 25767 14727 1 16 . 1 1 159 159 SER N N 159 116.653 116.653 114.545 2.108 25767 14728 1 16 . 1 1 159 159 SER HA H 159 4.246 4.246 4.021 0.225 25767 14729 1 16 . 1 1 159 159 SER CA C 159 61.460 61.460 61.720 -0.260 25767 14730 1 16 . 1 1 159 159 SER CB C 159 62.849 62.849 62.835 0.014 25767 14731 1 16 . 1 1 159 159 SER H H 159 7.758 7.758 8.348 -0.590 25767 14732 1 16 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.256 -1.883 25767 14733 1 16 . 1 1 160 160 LYS CB C 160 29.832 29.832 31.992 -2.160 25767 14734 1 16 . 1 1 160 160 LYS H H 160 8.425 8.425 7.616 0.809 25767 14735 1 16 . 1 1 161 161 LEU N N 161 121.686 121.686 118.428 3.258 25767 14736 1 16 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.901 0.262 25767 14737 1 16 . 1 1 161 161 LEU C C 161 180.224 180.224 179.797 0.427 25767 14738 1 16 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.335 0.249 25767 14739 1 16 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.658 -0.196 25767 14740 1 16 . 1 1 161 161 LEU H H 161 8.323 8.323 7.883 0.440 25767 14741 1 16 . 1 1 162 162 ALA N N 162 123.102 123.102 122.351 0.751 25767 14742 1 16 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.095 0.035 25767 14743 1 16 . 1 1 162 162 ALA C C 162 179.487 179.487 178.870 0.617 25767 14744 1 16 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.446 0.298 25767 14745 1 16 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.338 0.065 25767 14746 1 16 . 1 1 162 162 ALA H H 162 7.978 7.978 7.587 0.391 25767 14747 1 16 . 1 1 163 163 LYS N N 163 116.069 116.069 116.708 -0.639 25767 14748 1 16 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.194 0.029 25767 14749 1 16 . 1 1 163 163 LYS C C 163 176.987 176.987 177.063 -0.076 25767 14750 1 16 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.349 0.257 25767 14751 1 16 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.723 0.483 25767 14752 1 16 . 1 1 163 163 LYS H H 163 7.697 7.697 7.551 0.146 25767 14753 1 16 . 1 1 164 164 GLY N N 164 108.540 108.540 107.243 1.297 25767 14754 1 16 . 1 1 164 164 GLY C C 164 174.721 174.721 173.747 0.974 25767 14755 1 16 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.806 0.985 25767 14756 1 16 . 1 1 164 164 GLY H H 164 7.772 7.772 7.778 -0.006 25767 14757 1 16 . 1 1 165 165 GLU N N 165 119.886 119.886 120.170 -0.284 25767 14758 1 16 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.318 -0.268 25767 14759 1 16 . 1 1 165 165 GLU C C 165 176.027 176.027 174.069 1.958 25767 14760 1 16 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.253 1.600 25767 14761 1 16 . 1 1 165 165 GLU CB C 165 30.338 30.338 31.508 -1.170 25767 14762 1 16 . 1 1 165 165 GLU H H 165 8.065 8.065 7.476 0.589 25767 14763 1 16 . 1 1 166 166 ILE N N 166 117.926 117.926 123.634 -5.708 25767 14764 1 16 . 1 1 166 166 ILE HA H 166 3.902 3.902 4.008 -0.106 25767 14765 1 16 . 1 1 166 166 ILE C C 166 174.138 174.138 175.713 -1.575 25767 14766 1 16 . 1 1 166 166 ILE CA C 166 60.455 60.455 59.692 0.763 25767 14767 1 16 . 1 1 166 166 ILE CB C 166 40.202 40.202 40.145 0.057 25767 14768 1 16 . 1 1 166 166 ILE H H 166 7.282 7.282 8.021 -0.739 25767 14769 1 17 . 1 1 2 2 ALA N N 2 122.811 122.811 127.010 -4.199 25767 14770 1 17 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.169 -0.146 25767 14771 1 17 . 1 1 2 2 ALA C C 2 179.915 179.915 179.280 0.635 25767 14772 1 17 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.214 -0.097 25767 14773 1 17 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.843 -0.304 25767 14774 1 17 . 1 1 2 2 ALA H H 2 8.509 8.509 8.998 -0.489 25767 14775 1 17 . 1 1 3 3 SER N N 3 115.308 115.308 115.110 0.198 25767 14776 1 17 . 1 1 3 3 SER HA H 3 4.097 4.097 4.064 0.033 25767 14777 1 17 . 1 1 3 3 SER C C 3 176.706 176.706 176.292 0.414 25767 14778 1 17 . 1 1 3 3 SER CA C 3 60.665 60.665 61.382 -0.717 25767 14779 1 17 . 1 1 3 3 SER CB C 3 62.710 62.710 62.573 0.137 25767 14780 1 17 . 1 1 3 3 SER H H 3 7.996 7.996 8.711 -0.715 25767 14781 1 17 . 1 1 4 4 ASN N N 4 122.688 122.688 120.213 2.475 25767 14782 1 17 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.375 -0.071 25767 14783 1 17 . 1 1 4 4 ASN C C 4 176.258 176.258 177.109 -0.851 25767 14784 1 17 . 1 1 4 4 ASN CA C 4 55.701 55.701 55.928 -0.227 25767 14785 1 17 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.193 0.984 25767 14786 1 17 . 1 1 4 4 ASN H H 4 8.075 8.075 8.227 -0.152 25767 14787 1 17 . 1 1 5 5 ALA N N 5 121.900 121.900 122.398 -0.498 25767 14788 1 17 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.140 -0.565 25767 14789 1 17 . 1 1 5 5 ALA C C 5 178.475 178.475 179.366 -0.891 25767 14790 1 17 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.968 0.866 25767 14791 1 17 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.172 -0.557 25767 14792 1 17 . 1 1 5 5 ALA H H 5 8.659 8.659 7.735 0.924 25767 14793 1 17 . 1 1 6 6 ALA N N 6 117.768 117.768 121.777 -4.009 25767 14794 1 17 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.974 -0.187 25767 14795 1 17 . 1 1 6 6 ALA C C 6 180.494 180.494 179.396 1.098 25767 14796 1 17 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.119 0.231 25767 14797 1 17 . 1 1 6 6 ALA CB C 6 17.902 17.902 17.995 -0.093 25767 14798 1 17 . 1 1 6 6 ALA H H 6 7.864 7.864 7.845 0.019 25767 14799 1 17 . 1 1 7 7 ARG N N 7 121.173 121.173 119.323 1.850 25767 14800 1 17 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.082 -0.179 25767 14801 1 17 . 1 1 7 7 ARG C C 7 179.189 179.189 178.672 0.517 25767 14802 1 17 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.874 0.438 25767 14803 1 17 . 1 1 7 7 ARG CB C 7 29.222 29.222 30.015 -0.792 25767 14804 1 17 . 1 1 7 7 ARG H H 7 7.514 7.514 8.237 -0.723 25767 14805 1 17 . 1 1 8 8 VAL N N 8 122.979 122.979 120.124 2.855 25767 14806 1 17 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.700 -0.447 25767 14807 1 17 . 1 1 8 8 VAL C C 8 177.821 177.821 178.204 -0.383 25767 14808 1 17 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.814 0.958 25767 14809 1 17 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.385 0.056 25767 14810 1 17 . 1 1 8 8 VAL H H 8 8.101 8.101 7.843 0.258 25767 14811 1 17 . 1 1 9 9 VAL N N 9 119.801 119.801 120.676 -0.875 25767 14812 1 17 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.669 -0.403 25767 14813 1 17 . 1 1 9 9 VAL C C 9 177.373 177.373 177.895 -0.522 25767 14814 1 17 . 1 1 9 9 VAL CA C 9 67.484 67.484 65.493 1.992 25767 14815 1 17 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.303 1.322 25767 14816 1 17 . 1 1 9 9 VAL H H 9 8.362 8.362 8.133 0.229 25767 14817 1 17 . 1 1 10 10 ALA N N 10 122.360 122.360 121.576 0.784 25767 14818 1 17 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.061 -0.125 25767 14819 1 17 . 1 1 10 10 ALA C C 10 180.762 180.762 179.765 0.997 25767 14820 1 17 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.502 -0.058 25767 14821 1 17 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.162 -0.425 25767 14822 1 17 . 1 1 10 10 ALA H H 10 7.776 7.776 7.787 -0.011 25767 14823 1 17 . 1 1 11 11 THR N N 11 117.376 117.376 114.622 2.754 25767 14824 1 17 . 1 1 11 11 THR HA H 11 3.816 3.816 4.042 -0.226 25767 14825 1 17 . 1 1 11 11 THR C C 11 175.775 175.775 176.094 -0.319 25767 14826 1 17 . 1 1 11 11 THR CA C 11 66.509 66.509 66.135 0.374 25767 14827 1 17 . 1 1 11 11 THR CB C 11 68.588 68.588 68.581 0.007 25767 14828 1 17 . 1 1 11 11 THR H H 11 8.180 8.180 7.676 0.504 25767 14829 1 17 . 1 1 12 12 ALA N N 12 125.308 125.308 124.428 0.880 25767 14830 1 17 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.670 0.327 25767 14831 1 17 . 1 1 12 12 ALA C C 12 179.399 179.399 179.279 0.120 25767 14832 1 17 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.564 0.512 25767 14833 1 17 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.165 1.079 25767 14834 1 17 . 1 1 12 12 ALA H H 12 8.671 8.671 8.465 0.206 25767 14835 1 17 . 1 1 13 13 LYS N N 13 116.977 116.977 118.312 -1.335 25767 14836 1 17 . 1 1 13 13 LYS C C 13 179.646 179.646 178.792 0.854 25767 14837 1 17 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.804 -0.883 25767 14838 1 17 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.207 -0.764 25767 14839 1 17 . 1 1 13 13 LYS H H 13 8.061 8.061 7.715 0.346 25767 14840 1 17 . 1 1 14 14 ASP N N 14 121.988 121.988 120.086 1.902 25767 14841 1 17 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.501 -0.148 25767 14842 1 17 . 1 1 14 14 ASP C C 14 179.446 179.446 178.808 0.638 25767 14843 1 17 . 1 1 14 14 ASP CA C 14 57.509 57.509 57.035 0.474 25767 14844 1 17 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.674 -0.673 25767 14845 1 17 . 1 1 14 14 ASP H H 14 7.669 7.669 7.683 -0.014 25767 14846 1 17 . 1 1 15 15 PHE N N 15 119.588 119.588 118.451 1.137 25767 14847 1 17 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.187 0.157 25767 14848 1 17 . 1 1 15 15 PHE C C 15 178.373 178.373 177.836 0.537 25767 14849 1 17 . 1 1 15 15 PHE CA C 15 62.237 62.237 60.340 1.897 25767 14850 1 17 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.446 -0.950 25767 14851 1 17 . 1 1 15 15 PHE H H 15 7.913 7.913 8.635 -0.722 25767 14852 1 17 . 1 1 16 16 ASP N N 16 121.705 121.705 119.826 1.879 25767 14853 1 17 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.420 -0.425 25767 14854 1 17 . 1 1 16 16 ASP C C 16 180.071 180.071 178.930 1.141 25767 14855 1 17 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.791 0.358 25767 14856 1 17 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.810 0.677 25767 14857 1 17 . 1 1 16 16 ASP H H 16 8.324 8.324 8.185 0.139 25767 14858 1 17 . 1 1 17 17 LYS N N 17 118.825 118.825 119.092 -0.267 25767 14859 1 17 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.095 -0.058 25767 14860 1 17 . 1 1 17 17 LYS C C 17 178.407 178.407 177.860 0.547 25767 14861 1 17 . 1 1 17 17 LYS CA C 17 59.061 59.061 59.068 -0.007 25767 14862 1 17 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.531 0.053 25767 14863 1 17 . 1 1 17 17 LYS H H 17 7.834 7.834 7.745 0.089 25767 14864 1 17 . 1 1 18 18 VAL N N 18 110.562 110.562 117.672 -7.110 25767 14865 1 17 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.060 0.456 25767 14866 1 17 . 1 1 18 18 VAL C C 18 176.144 176.144 176.530 -0.386 25767 14867 1 17 . 1 1 18 18 VAL CA C 18 60.874 60.874 62.679 -1.805 25767 14868 1 17 . 1 1 18 18 VAL CB C 18 31.160 31.160 31.692 -0.532 25767 14869 1 17 . 1 1 18 18 VAL H H 18 7.185 7.185 7.576 -0.391 25767 14870 1 17 . 1 1 19 19 GLY N N 19 109.272 109.272 106.966 2.306 25767 14871 1 17 . 1 1 19 19 GLY C C 19 175.043 175.043 174.626 0.417 25767 14872 1 17 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.712 0.119 25767 14873 1 17 . 1 1 19 19 GLY H H 19 7.723 7.723 7.989 -0.266 25767 14874 1 17 . 1 1 20 20 LEU N N 20 125.428 125.428 120.588 4.840 25767 14875 1 17 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.718 -0.398 25767 14876 1 17 . 1 1 20 20 LEU C C 20 177.949 177.949 177.875 0.074 25767 14877 1 17 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.495 -0.691 25767 14878 1 17 . 1 1 20 20 LEU CB C 20 39.917 39.917 40.269 -0.352 25767 14879 1 17 . 1 1 20 20 LEU H H 20 8.083 8.083 7.900 0.183 25767 14880 1 17 . 1 1 21 21 GLY N N 21 107.804 107.804 110.349 -2.545 25767 14881 1 17 . 1 1 21 21 GLY C C 21 176.278 176.278 176.410 -0.132 25767 14882 1 17 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.572 -0.278 25767 14883 1 17 . 1 1 21 21 GLY H H 21 7.982 7.982 8.788 -0.806 25767 14884 1 17 . 1 1 22 22 ILE N N 22 121.319 121.319 122.358 -1.039 25767 14885 1 17 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.906 0.004 25767 14886 1 17 . 1 1 22 22 ILE C C 22 176.604 176.604 178.034 -1.430 25767 14887 1 17 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.426 -1.980 25767 14888 1 17 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.822 -1.256 25767 14889 1 17 . 1 1 22 22 ILE H H 22 8.478 8.478 7.948 0.530 25767 14890 1 17 . 1 1 23 23 ILE N N 23 120.377 120.377 120.122 0.255 25767 14891 1 17 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.861 -0.148 25767 14892 1 17 . 1 1 23 23 ILE C C 23 178.581 178.581 178.470 0.111 25767 14893 1 17 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.323 0.923 25767 14894 1 17 . 1 1 23 23 ILE CB C 23 36.199 36.199 36.237 -0.038 25767 14895 1 17 . 1 1 23 23 ILE H H 23 6.869 6.869 7.974 -1.105 25767 14896 1 17 . 1 1 24 24 GLY N N 24 103.449 103.449 108.571 -5.122 25767 14897 1 17 . 1 1 24 24 GLY C C 24 175.308 175.308 175.913 -0.605 25767 14898 1 17 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.380 0.563 25767 14899 1 17 . 1 1 24 24 GLY H H 24 7.488 7.488 8.290 -0.802 25767 14900 1 17 . 1 1 25 25 TYR N N 25 124.685 124.685 123.825 0.860 25767 14901 1 17 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.679 -0.013 25767 14902 1 17 . 1 1 25 25 TYR C C 25 176.208 176.208 176.871 -0.663 25767 14903 1 17 . 1 1 25 25 TYR CA C 25 61.371 61.371 61.722 -0.351 25767 14904 1 17 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.114 0.153 25767 14905 1 17 . 1 1 25 25 TYR H H 25 7.931 7.931 8.290 -0.359 25767 14906 1 17 . 1 1 26 26 TYR N N 26 117.001 117.001 119.915 -2.914 25767 14907 1 17 . 1 1 26 26 TYR HA H 26 3.941 3.941 4.043 -0.102 25767 14908 1 17 . 1 1 26 26 TYR C C 26 178.753 178.753 177.512 1.241 25767 14909 1 17 . 1 1 26 26 TYR CA C 26 64.260 64.260 61.979 2.281 25767 14910 1 17 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.949 -1.428 25767 14911 1 17 . 1 1 26 26 TYR H H 26 7.693 7.693 7.994 -0.301 25767 14912 1 17 . 1 1 27 27 LEU N N 27 118.657 118.657 118.316 0.341 25767 14913 1 17 . 1 1 27 27 LEU HA H 27 4.311 4.311 4.049 0.262 25767 14914 1 17 . 1 1 27 27 LEU CA C 27 58.297 58.297 58.016 0.281 25767 14915 1 17 . 1 1 27 27 LEU CB C 27 42.723 42.723 41.120 1.603 25767 14916 1 17 . 1 1 27 27 LEU H H 27 8.339 8.339 8.400 -0.061 25767 14917 1 17 . 1 1 28 28 GLN N N 28 118.593 118.593 119.209 -0.616 25767 14918 1 17 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.872 -0.221 25767 14919 1 17 . 1 1 28 28 GLN C C 28 177.282 177.282 178.166 -0.884 25767 14920 1 17 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.886 -0.057 25767 14921 1 17 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.372 1.276 25767 14922 1 17 . 1 1 28 28 GLN H H 28 7.970 7.970 8.250 -0.280 25767 14923 1 17 . 1 1 29 29 LEU N N 29 122.111 122.111 119.559 2.552 25767 14924 1 17 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.697 0.247 25767 14925 1 17 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.674 0.992 25767 14926 1 17 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.317 0.691 25767 14927 1 17 . 1 1 29 29 LEU H H 29 7.979 7.979 7.394 0.585 25767 14928 1 17 . 1 1 30 30 TYR N N 30 119.283 119.283 119.800 -0.517 25767 14929 1 17 . 1 1 30 30 TYR C C 30 175.775 175.775 177.167 -1.392 25767 14930 1 17 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.920 -1.826 25767 14931 1 17 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.224 0.849 25767 14932 1 17 . 1 1 30 30 TYR H H 30 8.093 8.093 7.510 0.583 25767 14933 1 17 . 1 1 31 31 ALA N N 31 121.327 121.327 121.835 -0.508 25767 14934 1 17 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.852 -0.484 25767 14935 1 17 . 1 1 31 31 ALA C C 31 178.955 178.955 178.801 0.154 25767 14936 1 17 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.437 0.110 25767 14937 1 17 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.283 -0.320 25767 14938 1 17 . 1 1 31 31 ALA H H 31 8.394 8.394 8.289 0.105 25767 14939 1 17 . 1 1 32 32 VAL N N 32 116.757 116.757 116.351 0.406 25767 14940 1 17 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.537 -0.277 25767 14941 1 17 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.571 2.091 25767 14942 1 17 . 1 1 32 32 VAL CB C 32 30.971 30.971 30.549 0.422 25767 14943 1 17 . 1 1 32 32 VAL H H 32 8.020 8.020 7.520 0.500 25767 14944 1 17 . 1 1 33 33 GLU N N 33 118.775 118.775 120.883 -2.108 25767 14945 1 17 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.794 0.195 25767 14946 1 17 . 1 1 33 33 GLU C C 33 179.746 179.746 178.881 0.865 25767 14947 1 17 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.186 0.817 25767 14948 1 17 . 1 1 33 33 GLU H H 33 7.358 7.358 7.465 -0.107 25767 14949 1 17 . 1 1 34 34 LEU N N 34 120.632 120.632 121.678 -1.046 25767 14950 1 17 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.884 -0.235 25767 14951 1 17 . 1 1 34 34 LEU C C 34 180.336 180.336 178.676 1.660 25767 14952 1 17 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.715 -0.040 25767 14953 1 17 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.843 -0.255 25767 14954 1 17 . 1 1 34 34 LEU H H 34 8.390 8.390 7.961 0.429 25767 14955 1 17 . 1 1 35 35 ILE N N 35 121.240 121.240 118.210 3.030 25767 14956 1 17 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.834 -0.292 25767 14957 1 17 . 1 1 35 35 ILE C C 35 178.604 178.604 177.493 1.111 25767 14958 1 17 . 1 1 35 35 ILE CA C 35 65.547 65.547 64.748 0.799 25767 14959 1 17 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.922 0.809 25767 14960 1 17 . 1 1 35 35 ILE H H 35 8.129 8.129 7.369 0.760 25767 14961 1 17 . 1 1 36 36 LEU N N 36 115.637 115.637 117.106 -1.469 25767 14962 1 17 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.079 -0.071 25767 14963 1 17 . 1 1 36 36 LEU C C 36 178.001 178.001 178.163 -0.162 25767 14964 1 17 . 1 1 36 36 LEU CA C 36 56.076 56.076 56.733 -0.657 25767 14965 1 17 . 1 1 36 36 LEU CB C 36 39.934 39.934 42.051 -2.117 25767 14966 1 17 . 1 1 36 36 LEU H H 36 8.416 8.416 7.857 0.559 25767 14967 1 17 . 1 1 37 37 SER N N 37 114.106 114.106 111.569 2.537 25767 14968 1 17 . 1 1 37 37 SER HA H 37 3.991 3.991 4.234 -0.243 25767 14969 1 17 . 1 1 37 37 SER C C 37 173.997 173.997 175.261 -1.264 25767 14970 1 17 . 1 1 37 37 SER CA C 37 60.311 60.311 59.579 0.732 25767 14971 1 17 . 1 1 37 37 SER CB C 37 63.746 63.746 63.666 0.080 25767 14972 1 17 . 1 1 37 37 SER H H 37 7.517 7.517 7.743 -0.226 25767 14973 1 17 . 1 1 38 38 GLU N N 38 123.003 123.003 122.583 0.420 25767 14974 1 17 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.290 0.079 25767 14975 1 17 . 1 1 38 38 GLU C C 38 175.780 175.780 175.761 0.019 25767 14976 1 17 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.724 -0.359 25767 14977 1 17 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.599 -0.306 25767 14978 1 17 . 1 1 38 38 GLU H H 38 7.151 7.151 7.534 -0.383 25767 14979 1 17 . 1 1 39 39 GLU N N 39 126.166 126.166 123.216 2.950 25767 14980 1 17 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.104 -0.095 25767 14981 1 17 . 1 1 39 39 GLU C C 39 176.652 176.652 175.558 1.094 25767 14982 1 17 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.889 1.309 25767 14983 1 17 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.362 -0.327 25767 14984 1 17 . 1 1 39 39 GLU H H 39 8.587 8.587 8.537 0.050 25767 14985 1 17 . 1 1 40 40 ASP N N 40 120.047 120.047 120.842 -0.795 25767 14986 1 17 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.430 0.120 25767 14987 1 17 . 1 1 40 40 ASP C C 40 175.035 175.035 175.713 -0.678 25767 14988 1 17 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.099 -1.731 25767 14989 1 17 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.992 -0.969 25767 14990 1 17 . 1 1 40 40 ASP H H 40 8.504 8.504 8.423 0.081 25767 14991 1 17 . 1 1 41 41 ARG N N 41 120.671 120.671 125.067 -4.396 25767 14992 1 17 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.603 -0.214 25767 14993 1 17 . 1 1 41 41 ARG C C 41 175.755 175.755 175.399 0.356 25767 14994 1 17 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.418 0.590 25767 14995 1 17 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.092 -0.543 25767 14996 1 17 . 1 1 41 41 ARG H H 41 7.672 7.672 8.261 -0.589 25767 14997 1 17 . 1 1 42 42 SER N N 42 120.330 120.330 115.919 4.411 25767 14998 1 17 . 1 1 42 42 SER HA H 42 3.837 3.837 4.319 -0.482 25767 14999 1 17 . 1 1 42 42 SER CA C 42 57.326 57.326 58.441 -1.115 25767 15000 1 17 . 1 1 42 42 SER CB C 42 65.762 65.762 63.955 1.807 25767 15001 1 17 . 1 1 42 42 SER H H 42 8.544 8.544 8.329 0.215 25767 15002 1 17 . 1 1 43 43 GLN HA H 43 3.989 3.989 4.035 -0.046 25767 15003 1 17 . 1 1 43 43 GLN C C 43 178.907 178.907 177.835 1.072 25767 15004 1 17 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.929 0.441 25767 15005 1 17 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.811 -0.848 25767 15006 1 17 . 1 1 44 44 GLU N N 44 120.328 120.328 119.773 0.555 25767 15007 1 17 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.949 0.064 25767 15008 1 17 . 1 1 44 44 GLU C C 44 179.824 179.824 178.824 1.000 25767 15009 1 17 . 1 1 44 44 GLU CA C 44 60.045 60.045 58.895 1.150 25767 15010 1 17 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.143 -0.495 25767 15011 1 17 . 1 1 44 44 GLU H H 44 8.938 8.938 7.914 1.024 25767 15012 1 17 . 1 1 45 45 MET N N 45 121.030 121.030 118.216 2.814 25767 15013 1 17 . 1 1 45 45 MET HA H 45 4.412 4.412 4.254 0.158 25767 15014 1 17 . 1 1 45 45 MET C C 45 180.357 180.357 178.026 2.331 25767 15015 1 17 . 1 1 45 45 MET CA C 45 57.209 57.209 57.674 -0.465 25767 15016 1 17 . 1 1 45 45 MET CB C 45 32.436 32.436 31.905 0.531 25767 15017 1 17 . 1 1 45 45 MET H H 45 7.756 7.756 7.928 -0.172 25767 15018 1 17 . 1 1 46 46 THR N N 46 120.008 120.008 116.035 3.973 25767 15019 1 17 . 1 1 46 46 THR HA H 46 4.071 4.071 3.899 0.172 25767 15020 1 17 . 1 1 46 46 THR CA C 46 67.096 67.096 66.850 0.246 25767 15021 1 17 . 1 1 46 46 THR CB C 46 68.954 68.954 68.566 0.388 25767 15022 1 17 . 1 1 46 46 THR H H 46 8.187 8.187 7.597 0.590 25767 15023 1 17 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.099 0.010 25767 15024 1 17 . 1 1 47 47 ALA C C 47 180.118 180.118 179.417 0.701 25767 15025 1 17 . 1 1 47 47 ALA CA C 47 55.339 55.339 55.063 0.276 25767 15026 1 17 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.277 -0.445 25767 15027 1 17 . 1 1 47 47 ALA H H 47 8.238 8.238 7.660 0.578 25767 15028 1 17 . 1 1 48 48 LEU N N 48 122.093 122.093 119.298 2.795 25767 15029 1 17 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.013 0.250 25767 15030 1 17 . 1 1 48 48 LEU C C 48 179.103 179.103 179.302 -0.199 25767 15031 1 17 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.463 0.277 25767 15032 1 17 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.530 -0.734 25767 15033 1 17 . 1 1 48 48 LEU H H 48 7.778 7.778 7.672 0.106 25767 15034 1 17 . 1 1 49 49 ALA N N 49 120.130 120.130 121.657 -1.527 25767 15035 1 17 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.930 -0.209 25767 15036 1 17 . 1 1 49 49 ALA C C 49 178.676 178.676 179.550 -0.874 25767 15037 1 17 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.364 0.358 25767 15038 1 17 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.035 -0.208 25767 15039 1 17 . 1 1 49 49 ALA H H 49 8.432 8.432 8.425 0.007 25767 15040 1 17 . 1 1 50 50 THR N N 50 113.333 113.333 115.104 -1.771 25767 15041 1 17 . 1 1 50 50 THR HA H 50 3.895 3.895 3.865 0.030 25767 15042 1 17 . 1 1 50 50 THR C C 50 174.948 174.948 176.504 -1.556 25767 15043 1 17 . 1 1 50 50 THR CA C 50 67.334 67.334 67.557 -0.223 25767 15044 1 17 . 1 1 50 50 THR CB C 50 68.864 68.864 68.598 0.266 25767 15045 1 17 . 1 1 50 50 THR H H 50 7.857 7.857 7.743 0.114 25767 15046 1 17 . 1 1 51 51 GLU N N 51 122.698 122.698 122.499 0.199 25767 15047 1 17 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.047 0.021 25767 15048 1 17 . 1 1 51 51 GLU C C 51 179.997 179.997 178.962 1.035 25767 15049 1 17 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.455 -0.022 25767 15050 1 17 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.488 0.029 25767 15051 1 17 . 1 1 51 51 GLU H H 51 7.817 7.817 7.605 0.212 25767 15052 1 17 . 1 1 52 52 LEU N N 52 121.100 121.100 119.410 1.690 25767 15053 1 17 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.054 0.075 25767 15054 1 17 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.510 0.379 25767 15055 1 17 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.656 0.291 25767 15056 1 17 . 1 1 52 52 LEU H H 52 8.628 8.628 7.945 0.683 25767 15057 1 17 . 1 1 53 53 LEU N N 53 119.935 119.935 120.382 -0.447 25767 15058 1 17 . 1 1 53 53 LEU C C 53 179.671 179.671 178.338 1.333 25767 15059 1 17 . 1 1 53 53 LEU H H 53 8.303 8.303 7.809 0.494 25767 15060 1 17 . 1 1 54 54 ASP N N 54 120.339 120.339 118.435 1.904 25767 15061 1 17 . 1 1 54 54 ASP C C 54 179.106 179.106 178.315 0.791 25767 15062 1 17 . 1 1 54 54 ASP H H 54 7.901 7.901 7.941 -0.040 25767 15063 1 17 . 1 1 55 55 THR N N 55 120.237 120.237 116.928 3.309 25767 15064 1 17 . 1 1 55 55 THR HA H 55 3.696 3.696 4.054 -0.358 25767 15065 1 17 . 1 1 55 55 THR CA C 55 67.340 67.340 66.559 0.781 25767 15066 1 17 . 1 1 55 55 THR CB C 55 68.151 68.151 68.388 -0.237 25767 15067 1 17 . 1 1 55 55 THR H H 55 8.262 8.262 7.667 0.595 25767 15068 1 17 . 1 1 56 56 ILE N N 56 123.953 123.953 121.806 2.147 25767 15069 1 17 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.617 0.226 25767 15070 1 17 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.871 0.023 25767 15071 1 17 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.522 0.611 25767 15072 1 17 . 1 1 56 56 ILE H H 56 8.930 8.930 7.713 1.217 25767 15073 1 17 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.371 0.210 25767 15074 1 17 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.135 -0.104 25767 15075 1 17 . 1 1 58 58 ALA C C 58 179.875 179.875 179.454 0.421 25767 15076 1 17 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.861 0.405 25767 15077 1 17 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.316 -0.331 25767 15078 1 17 . 1 1 58 58 ALA H H 58 7.764 7.764 8.306 -0.542 25767 15079 1 17 . 1 1 59 59 PHE N N 59 121.988 121.988 119.760 2.228 25767 15080 1 17 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.139 0.087 25767 15081 1 17 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.663 -0.224 25767 15082 1 17 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.292 0.071 25767 15083 1 17 . 1 1 59 59 PHE H H 59 8.159 8.159 8.385 -0.226 25767 15084 1 17 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.958 -0.417 25767 15085 1 17 . 1 1 60 60 LYS C C 60 179.438 179.438 178.861 0.577 25767 15086 1 17 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.687 0.449 25767 15087 1 17 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.416 -0.358 25767 15088 1 17 . 1 1 61 61 LYS N N 61 119.262 119.262 117.110 2.152 25767 15089 1 17 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.224 -0.279 25767 15090 1 17 . 1 1 61 61 LYS C C 61 178.730 178.730 177.566 1.164 25767 15091 1 17 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.334 1.708 25767 15092 1 17 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.014 0.628 25767 15093 1 17 . 1 1 61 61 LYS H H 61 7.832 7.832 8.289 -0.457 25767 15094 1 17 . 1 1 62 62 GLU N N 62 120.790 120.790 120.842 -0.052 25767 15095 1 17 . 1 1 62 62 GLU HA H 62 3.935 3.935 3.965 -0.030 25767 15096 1 17 . 1 1 62 62 GLU C C 62 178.424 178.424 177.899 0.525 25767 15097 1 17 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.864 -0.150 25767 15098 1 17 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.267 -0.037 25767 15099 1 17 . 1 1 62 62 GLU H H 62 7.982 7.982 7.620 0.362 25767 15100 1 17 . 1 1 63 63 ILE N N 63 118.463 118.463 117.064 1.399 25767 15101 1 17 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.806 -0.117 25767 15102 1 17 . 1 1 63 63 ILE C C 63 177.555 177.555 177.374 0.181 25767 15103 1 17 . 1 1 63 63 ILE CA C 63 61.499 61.499 63.028 -1.529 25767 15104 1 17 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.439 -1.915 25767 15105 1 17 . 1 1 63 63 ILE H H 63 7.732 7.732 7.324 0.408 25767 15106 1 17 . 1 1 64 64 GLY N N 64 107.973 107.973 107.318 0.655 25767 15107 1 17 . 1 1 64 64 GLY C C 64 175.271 175.271 174.929 0.342 25767 15108 1 17 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.262 -0.360 25767 15109 1 17 . 1 1 64 64 GLY H H 64 7.661 7.661 8.010 -0.349 25767 15110 1 17 . 1 1 65 65 GLY N N 65 108.464 108.464 107.144 1.320 25767 15111 1 17 . 1 1 65 65 GLY C C 65 174.800 174.800 175.397 -0.597 25767 15112 1 17 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.517 0.129 25767 15113 1 17 . 1 1 65 65 GLY H H 65 7.808 7.808 7.870 -0.062 25767 15114 1 17 . 1 1 66 66 GLU N N 66 121.162 121.162 121.092 0.070 25767 15115 1 17 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.052 0.053 25767 15116 1 17 . 1 1 66 66 GLU C C 66 177.230 177.230 178.422 -1.192 25767 15117 1 17 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.138 -1.914 25767 15118 1 17 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.609 0.383 25767 15119 1 17 . 1 1 66 66 GLU H H 66 8.203 8.203 7.804 0.399 25767 15120 1 17 . 1 1 67 67 SER N N 67 116.468 116.468 114.942 1.526 25767 15121 1 17 . 1 1 67 67 SER HA H 67 4.249 4.249 4.221 0.028 25767 15122 1 17 . 1 1 67 67 SER C C 67 174.640 174.640 176.843 -2.203 25767 15123 1 17 . 1 1 67 67 SER CA C 67 58.930 58.930 61.330 -2.400 25767 15124 1 17 . 1 1 67 67 SER CB C 67 63.912 63.912 63.069 0.843 25767 15125 1 17 . 1 1 67 67 SER H H 67 8.206 8.206 8.256 -0.050 25767 15126 1 17 . 1 1 68 68 GLU N N 68 122.400 122.400 119.677 2.723 25767 15127 1 17 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.010 0.143 25767 15128 1 17 . 1 1 68 68 GLU C C 68 176.349 176.349 177.178 -0.829 25767 15129 1 17 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.717 -1.894 25767 15130 1 17 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.417 0.564 25767 15131 1 17 . 1 1 68 68 GLU H H 68 8.168 8.168 8.478 -0.310 25767 15132 1 17 . 1 1 69 69 ALA N N 69 124.342 124.342 119.679 4.663 25767 15133 1 17 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.151 0.037 25767 15134 1 17 . 1 1 69 69 ALA C C 69 178.027 178.027 178.086 -0.059 25767 15135 1 17 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.599 -1.041 25767 15136 1 17 . 1 1 69 69 ALA CB C 69 19.492 19.492 19.287 0.205 25767 15137 1 17 . 1 1 69 69 ALA H H 69 7.939 7.939 7.423 0.516 25767 15138 1 17 . 1 1 70 70 GLU N N 70 121.059 121.059 117.437 3.622 25767 15139 1 17 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.420 -0.306 25767 15140 1 17 . 1 1 70 70 GLU C C 70 176.519 176.519 174.821 1.698 25767 15141 1 17 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.545 1.759 25767 15142 1 17 . 1 1 70 70 GLU CB C 70 29.827 29.827 32.025 -2.198 25767 15143 1 17 . 1 1 70 70 GLU H H 70 8.430 8.430 7.678 0.752 25767 15144 1 17 . 1 1 71 71 ASP N N 71 120.274 120.274 121.040 -0.766 25767 15145 1 17 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.350 0.182 25767 15146 1 17 . 1 1 71 71 ASP C C 71 176.369 176.369 177.086 -0.717 25767 15147 1 17 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.392 -1.141 25767 15148 1 17 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.629 1.211 25767 15149 1 17 . 1 1 71 71 ASP H H 71 8.305 8.305 8.870 -0.565 25767 15150 1 17 . 1 1 72 72 SER N N 72 116.165 116.165 112.052 4.113 25767 15151 1 17 . 1 1 72 72 SER HA H 72 4.241 4.241 4.177 0.064 25767 15152 1 17 . 1 1 72 72 SER C C 72 174.567 174.567 175.687 -1.120 25767 15153 1 17 . 1 1 72 72 SER CA C 72 59.031 59.031 60.759 -1.728 25767 15154 1 17 . 1 1 72 72 SER CB C 72 64.040 64.040 63.621 0.419 25767 15155 1 17 . 1 1 72 72 SER H H 72 7.964 7.964 8.527 -0.563 25767 15156 1 17 . 1 1 73 73 ASP N N 73 122.440 122.440 122.544 -0.104 25767 15157 1 17 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.324 0.210 25767 15158 1 17 . 1 1 73 73 ASP C C 73 176.882 176.882 178.345 -1.463 25767 15159 1 17 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.472 -3.029 25767 15160 1 17 . 1 1 73 73 ASP CB C 73 41.336 41.336 40.007 1.329 25767 15161 1 17 . 1 1 73 73 ASP H H 73 8.392 8.392 8.791 -0.399 25767 15162 1 17 . 1 1 74 74 LYS N N 74 123.270 123.270 119.636 3.634 25767 15163 1 17 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.018 0.075 25767 15164 1 17 . 1 1 74 74 LYS C C 74 177.608 177.608 178.672 -1.064 25767 15165 1 17 . 1 1 74 74 LYS CA C 74 57.465 57.465 60.047 -2.582 25767 15166 1 17 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.322 -0.176 25767 15167 1 17 . 1 1 74 74 LYS H H 74 8.317 8.317 8.213 0.104 25767 15168 1 17 . 1 1 75 75 SER N N 75 116.557 116.557 115.844 0.713 25767 15169 1 17 . 1 1 75 75 SER HA H 75 4.197 4.197 4.203 -0.006 25767 15170 1 17 . 1 1 75 75 SER C C 75 175.988 175.988 176.791 -0.803 25767 15171 1 17 . 1 1 75 75 SER CA C 75 60.434 60.434 61.699 -1.265 25767 15172 1 17 . 1 1 75 75 SER CB C 75 63.172 63.172 63.193 -0.021 25767 15173 1 17 . 1 1 75 75 SER H H 75 8.387 8.387 7.901 0.486 25767 15174 1 17 . 1 1 76 76 LEU N N 76 123.910 123.910 123.442 0.468 25767 15175 1 17 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.998 0.172 25767 15176 1 17 . 1 1 76 76 LEU C C 76 178.083 178.083 178.883 -0.800 25767 15177 1 17 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.959 -1.467 25767 15178 1 17 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.652 0.045 25767 15179 1 17 . 1 1 76 76 LEU H H 76 8.059 8.059 8.532 -0.473 25767 15180 1 17 . 1 1 77 77 HIS N N 77 120.620 120.620 119.893 0.727 25767 15181 1 17 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.244 0.044 25767 15182 1 17 . 1 1 77 77 HIS C C 77 177.667 177.667 177.989 -0.322 25767 15183 1 17 . 1 1 77 77 HIS CA C 77 58.422 58.422 60.087 -1.665 25767 15184 1 17 . 1 1 77 77 HIS CB C 77 30.264 30.264 30.335 -0.071 25767 15185 1 17 . 1 1 77 77 HIS H H 77 7.936 7.936 8.313 -0.377 25767 15186 1 17 . 1 1 78 78 VAL N N 78 121.774 121.774 119.416 2.358 25767 15187 1 17 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.640 0.037 25767 15188 1 17 . 1 1 78 78 VAL CA C 78 65.606 65.606 67.132 -1.526 25767 15189 1 17 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.657 0.207 25767 15190 1 17 . 1 1 78 78 VAL H H 78 7.916 7.916 7.905 0.011 25767 15191 1 17 . 1 1 79 79 MET N N 79 119.660 119.660 118.632 1.028 25767 15192 1 17 . 1 1 79 79 MET HA H 79 3.925 3.925 3.981 -0.056 25767 15193 1 17 . 1 1 79 79 MET C C 79 177.077 177.077 178.520 -1.443 25767 15194 1 17 . 1 1 79 79 MET CA C 79 58.862 58.862 59.873 -1.011 25767 15195 1 17 . 1 1 79 79 MET CB C 79 32.852 32.852 32.309 0.543 25767 15196 1 17 . 1 1 79 79 MET H H 79 8.149 8.149 8.051 0.098 25767 15197 1 17 . 1 1 80 80 ASN N N 80 117.337 117.337 118.344 -1.007 25767 15198 1 17 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.809 -0.671 25767 15199 1 17 . 1 1 80 80 ASN C C 80 178.133 178.133 178.549 -0.416 25767 15200 1 17 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.314 0.725 25767 15201 1 17 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.534 0.462 25767 15202 1 17 . 1 1 80 80 ASN H H 80 8.202 8.202 8.731 -0.529 25767 15203 1 17 . 1 1 81 81 THR N N 81 115.517 115.517 118.604 -3.087 25767 15204 1 17 . 1 1 81 81 THR HA H 81 3.896 3.896 3.978 -0.082 25767 15205 1 17 . 1 1 81 81 THR C C 81 175.186 175.186 175.860 -0.674 25767 15206 1 17 . 1 1 81 81 THR CA C 81 66.221 66.221 67.097 -0.876 25767 15207 1 17 . 1 1 81 81 THR CB C 81 69.087 69.087 68.623 0.464 25767 15208 1 17 . 1 1 81 81 THR H H 81 7.944 7.944 8.081 -0.137 25767 15209 1 17 . 1 1 82 82 LEU N N 82 119.074 119.074 120.194 -1.120 25767 15210 1 17 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.103 -0.122 25767 15211 1 17 . 1 1 82 82 LEU C C 82 177.583 177.583 178.162 -0.579 25767 15212 1 17 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.182 -0.642 25767 15213 1 17 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.878 -0.085 25767 15214 1 17 . 1 1 82 82 LEU H H 82 7.547 7.547 7.664 -0.117 25767 15215 1 17 . 1 1 83 83 ILE N N 83 118.085 118.085 115.701 2.384 25767 15216 1 17 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.539 0.304 25767 15217 1 17 . 1 1 83 83 ILE C C 83 176.413 176.413 177.277 -0.864 25767 15218 1 17 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.269 -0.542 25767 15219 1 17 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.194 -0.495 25767 15220 1 17 . 1 1 83 83 ILE H H 83 7.409 7.409 7.602 -0.193 25767 15221 1 17 . 1 1 84 84 HIS N N 84 116.152 116.152 116.246 -0.094 25767 15222 1 17 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.506 0.089 25767 15223 1 17 . 1 1 84 84 HIS C C 84 175.707 175.707 175.456 0.251 25767 15224 1 17 . 1 1 84 84 HIS CA C 84 58.628 58.628 58.283 0.345 25767 15225 1 17 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.461 0.942 25767 15226 1 17 . 1 1 84 84 HIS H H 84 7.194 7.194 7.774 -0.580 25767 15227 1 17 . 1 1 85 85 ASP N N 85 122.322 122.322 121.065 1.257 25767 15228 1 17 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.843 -0.309 25767 15229 1 17 . 1 1 85 85 ASP C C 85 175.580 175.580 176.611 -1.031 25767 15230 1 17 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.792 -0.447 25767 15231 1 17 . 1 1 85 85 ASP CB C 85 41.118 41.118 40.562 0.556 25767 15232 1 17 . 1 1 85 85 ASP H H 85 8.505 8.505 7.901 0.604 25767 15233 1 17 . 1 1 86 86 GLN N N 86 122.783 122.783 124.194 -1.411 25767 15234 1 17 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.120 -0.157 25767 15235 1 17 . 1 1 86 86 GLN C C 86 178.581 178.581 177.544 1.037 25767 15236 1 17 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.750 -1.796 25767 15237 1 17 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.006 -0.112 25767 15238 1 17 . 1 1 86 86 GLN H H 86 8.803 8.803 8.511 0.292 25767 15239 1 17 . 1 1 87 87 GLU N N 87 121.794 121.794 121.523 0.271 25767 15240 1 17 . 1 1 87 87 GLU HA H 87 4.013 4.013 3.994 0.019 25767 15241 1 17 . 1 1 87 87 GLU C C 87 178.290 178.290 178.952 -0.662 25767 15242 1 17 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.238 -0.200 25767 15243 1 17 . 1 1 87 87 GLU CB C 87 28.980 28.980 28.600 0.380 25767 15244 1 17 . 1 1 87 87 GLU H H 87 8.072 8.072 8.747 -0.675 25767 15245 1 17 . 1 1 88 88 LYS N N 88 119.345 119.345 118.934 0.411 25767 15246 1 17 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.085 -0.330 25767 15247 1 17 . 1 1 88 88 LYS C C 88 180.040 180.040 178.822 1.218 25767 15248 1 17 . 1 1 88 88 LYS CA C 88 59.411 59.411 59.195 0.216 25767 15249 1 17 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.970 0.037 25767 15250 1 17 . 1 1 88 88 LYS H H 88 7.588 7.588 8.231 -0.643 25767 15251 1 17 . 1 1 89 89 ALA N N 89 123.933 123.933 122.255 1.678 25767 15252 1 17 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.109 -0.370 25767 15253 1 17 . 1 1 89 89 ALA C C 89 177.457 177.457 179.106 -1.649 25767 15254 1 17 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.210 0.760 25767 15255 1 17 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.219 0.437 25767 15256 1 17 . 1 1 89 89 ALA H H 89 8.500 8.500 7.714 0.786 25767 15257 1 17 . 1 1 90 90 LYS N N 90 119.244 119.244 119.438 -0.194 25767 15258 1 17 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.432 0.612 25767 15259 1 17 . 1 1 90 90 LYS C C 90 177.774 177.774 178.060 -0.286 25767 15260 1 17 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.024 0.054 25767 15261 1 17 . 1 1 90 90 LYS CB C 90 30.241 30.241 31.766 -1.525 25767 15262 1 17 . 1 1 90 90 LYS H H 90 6.845 6.845 7.384 -0.539 25767 15263 1 17 . 1 1 91 91 ILE N N 91 117.718 117.718 119.944 -2.226 25767 15264 1 17 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.625 -0.227 25767 15265 1 17 . 1 1 91 91 ILE C C 91 177.670 177.670 176.924 0.746 25767 15266 1 17 . 1 1 91 91 ILE CA C 91 63.998 63.998 63.924 0.074 25767 15267 1 17 . 1 1 91 91 ILE CB C 91 37.801 37.801 36.883 0.918 25767 15268 1 17 . 1 1 91 91 ILE H H 91 7.293 7.293 7.621 -0.328 25767 15269 1 17 . 1 1 92 92 TYR N N 92 121.868 121.868 121.935 -0.067 25767 15270 1 17 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.043 0.080 25767 15271 1 17 . 1 1 92 92 TYR C C 92 178.781 178.781 177.771 1.010 25767 15272 1 17 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.488 -0.846 25767 15273 1 17 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.608 0.613 25767 15274 1 17 . 1 1 92 92 TYR H H 92 8.016 8.016 7.785 0.231 25767 15275 1 17 . 1 1 93 93 MET N N 93 118.984 118.984 118.148 0.836 25767 15276 1 17 . 1 1 93 93 MET HA H 93 3.952 3.952 4.047 -0.095 25767 15277 1 17 . 1 1 93 93 MET C C 93 179.925 179.925 178.173 1.752 25767 15278 1 17 . 1 1 93 93 MET CA C 93 57.589 57.589 59.230 -1.641 25767 15279 1 17 . 1 1 93 93 MET CB C 93 30.752 30.752 32.688 -1.935 25767 15280 1 17 . 1 1 93 93 MET H H 93 8.464 8.464 8.135 0.329 25767 15281 1 17 . 1 1 94 94 LEU N N 94 125.441 125.441 121.951 3.490 25767 15282 1 17 . 1 1 94 94 LEU HA H 94 3.870 3.870 3.876 -0.006 25767 15283 1 17 . 1 1 94 94 LEU C C 94 177.937 177.937 178.458 -0.521 25767 15284 1 17 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.010 0.751 25767 15285 1 17 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.585 0.177 25767 15286 1 17 . 1 1 94 94 LEU H H 94 8.927 8.927 8.774 0.153 25767 15287 1 17 . 1 1 95 95 ASN N N 95 119.066 119.066 117.467 1.599 25767 15288 1 17 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.339 -0.077 25767 15289 1 17 . 1 1 95 95 ASN CA C 95 56.273 56.273 55.976 0.297 25767 15290 1 17 . 1 1 95 95 ASN CB C 95 37.605 37.605 37.987 -0.382 25767 15291 1 17 . 1 1 95 95 ASN H H 95 8.691 8.691 8.214 0.477 25767 15292 1 17 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.273 0.392 25767 15293 1 17 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.343 0.729 25767 15294 1 17 . 1 1 96 96 PHE H H 96 8.317 8.317 7.847 0.470 25767 15295 1 17 . 1 1 97 97 THR N N 97 118.178 118.178 113.968 4.210 25767 15296 1 17 . 1 1 97 97 THR HA H 97 3.338 3.338 3.872 -0.534 25767 15297 1 17 . 1 1 97 97 THR C C 97 176.074 176.074 176.738 -0.664 25767 15298 1 17 . 1 1 97 97 THR CA C 97 67.986 67.986 66.478 1.508 25767 15299 1 17 . 1 1 97 97 THR H H 97 8.214 8.214 8.473 -0.259 25767 15300 1 17 . 1 1 98 98 MET N N 98 120.097 120.097 122.658 -2.561 25767 15301 1 17 . 1 1 98 98 MET HA H 98 4.403 4.403 4.213 0.190 25767 15302 1 17 . 1 1 98 98 MET C C 98 178.696 178.696 177.966 0.730 25767 15303 1 17 . 1 1 98 98 MET CA C 98 57.029 57.029 59.416 -2.387 25767 15304 1 17 . 1 1 98 98 MET CB C 98 29.898 29.898 32.563 -2.665 25767 15305 1 17 . 1 1 98 98 MET H H 98 8.885 8.885 8.568 0.317 25767 15306 1 17 . 1 1 99 99 SER N N 99 114.959 114.959 115.919 -0.960 25767 15307 1 17 . 1 1 99 99 SER HA H 99 4.199 4.199 4.193 0.006 25767 15308 1 17 . 1 1 99 99 SER C C 99 176.565 176.565 176.561 0.004 25767 15309 1 17 . 1 1 99 99 SER CA C 99 61.965 61.965 61.091 0.874 25767 15310 1 17 . 1 1 99 99 SER CB C 99 62.565 62.565 62.792 -0.227 25767 15311 1 17 . 1 1 99 99 SER H H 99 7.515 7.515 8.349 -0.834 25767 15312 1 17 . 1 1 100 100 LEU N N 100 125.380 125.380 124.799 0.581 25767 15313 1 17 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.905 -0.129 25767 15314 1 17 . 1 1 100 100 LEU C C 100 177.689 177.689 178.119 -0.430 25767 15315 1 17 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.725 0.332 25767 15316 1 17 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.326 0.224 25767 15317 1 17 . 1 1 100 100 LEU H H 100 7.400 7.400 8.351 -0.951 25767 15318 1 17 . 1 1 101 101 TYR N N 101 120.597 120.597 119.794 0.803 25767 15319 1 17 . 1 1 101 101 TYR HA H 101 4.116 4.116 4.086 0.030 25767 15320 1 17 . 1 1 101 101 TYR C C 101 176.825 176.825 177.212 -0.387 25767 15321 1 17 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.363 -0.475 25767 15322 1 17 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.602 0.391 25767 15323 1 17 . 1 1 101 101 TYR H H 101 8.880 8.880 8.849 0.031 25767 15324 1 17 . 1 1 102 102 ASN N N 102 116.869 116.869 116.929 -0.060 25767 15325 1 17 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.285 -0.119 25767 15326 1 17 . 1 1 102 102 ASN C C 102 179.089 179.089 177.606 1.483 25767 15327 1 17 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.254 -0.042 25767 15328 1 17 . 1 1 102 102 ASN CB C 102 37.734 37.734 37.713 0.021 25767 15329 1 17 . 1 1 102 102 ASN H H 102 8.543 8.543 8.201 0.342 25767 15330 1 17 . 1 1 103 103 GLU N N 103 121.259 121.259 120.642 0.617 25767 15331 1 17 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.950 0.036 25767 15332 1 17 . 1 1 103 103 GLU C C 103 179.968 179.968 178.539 1.429 25767 15333 1 17 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.377 0.140 25767 15334 1 17 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.671 -0.121 25767 15335 1 17 . 1 1 103 103 GLU H H 103 7.872 7.872 8.184 -0.312 25767 15336 1 17 . 1 1 104 104 LYS N N 104 120.268 120.268 119.843 0.425 25767 15337 1 17 . 1 1 104 104 LYS HA H 104 4.046 4.046 3.955 0.091 25767 15338 1 17 . 1 1 104 104 LYS C C 104 178.355 178.355 178.816 -0.461 25767 15339 1 17 . 1 1 104 104 LYS CA C 104 56.735 56.735 59.100 -2.365 25767 15340 1 17 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.353 -3.240 25767 15341 1 17 . 1 1 104 104 LYS H H 104 8.384 8.384 7.720 0.664 25767 15342 1 17 . 1 1 105 105 LEU N N 105 121.622 121.622 120.241 1.381 25767 15343 1 17 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.639 0.102 25767 15344 1 17 . 1 1 105 105 LEU C C 105 180.552 180.552 178.230 2.322 25767 15345 1 17 . 1 1 105 105 LEU CA C 105 58.172 58.172 57.964 0.208 25767 15346 1 17 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.558 -0.528 25767 15347 1 17 . 1 1 105 105 LEU H H 105 8.400 8.400 8.159 0.241 25767 15348 1 17 . 1 1 106 106 LYS N N 106 119.498 119.498 118.199 1.299 25767 15349 1 17 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.833 0.081 25767 15350 1 17 . 1 1 106 106 LYS C C 106 178.419 178.419 178.967 -0.548 25767 15351 1 17 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.781 -0.398 25767 15352 1 17 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.933 -0.125 25767 15353 1 17 . 1 1 106 106 LYS H H 106 7.067 7.067 7.651 -0.584 25767 15354 1 17 . 1 1 107 107 GLN N N 107 121.405 121.405 118.456 2.949 25767 15355 1 17 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.998 -0.147 25767 15356 1 17 . 1 1 107 107 GLN C C 107 177.935 177.935 179.005 -1.070 25767 15357 1 17 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.367 0.114 25767 15358 1 17 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.132 -1.334 25767 15359 1 17 . 1 1 107 107 GLN H H 107 7.460 7.460 7.614 -0.154 25767 15360 1 17 . 1 1 108 108 LEU N N 108 119.561 119.561 119.718 -0.157 25767 15361 1 17 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.949 -0.148 25767 15362 1 17 . 1 1 108 108 LEU C C 108 179.195 179.195 179.358 -0.163 25767 15363 1 17 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.794 0.599 25767 15364 1 17 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.701 -0.435 25767 15365 1 17 . 1 1 108 108 LEU H H 108 8.208 8.208 8.026 0.182 25767 15366 1 17 . 1 1 109 109 LYS N N 109 118.535 118.535 118.149 0.386 25767 15367 1 17 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.322 -0.070 25767 15368 1 17 . 1 1 109 109 LYS C C 109 177.726 177.726 178.181 -0.455 25767 15369 1 17 . 1 1 109 109 LYS CA C 109 58.730 58.730 59.179 -0.449 25767 15370 1 17 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.746 -0.336 25767 15371 1 17 . 1 1 109 109 LYS H H 109 7.168 7.168 7.571 -0.403 25767 15372 1 17 . 1 1 110 110 ASP N N 110 117.463 117.463 116.452 1.011 25767 15373 1 17 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.700 -0.095 25767 15374 1 17 . 1 1 110 110 ASP C C 110 177.360 177.360 176.547 0.813 25767 15375 1 17 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.606 1.290 25767 15376 1 17 . 1 1 110 110 ASP CB C 110 42.577 42.577 42.038 0.539 25767 15377 1 17 . 1 1 110 110 ASP H H 110 7.861 7.861 8.413 -0.552 25767 15378 1 17 . 1 1 111 111 GLY N N 111 113.059 113.059 108.814 4.245 25767 15379 1 17 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.927 -0.875 25767 15380 1 17 . 1 1 111 111 GLY H H 111 8.479 8.479 7.755 0.724 25767 15381 1 17 . 1 1 112 112 PRO HA H 112 4.463 4.463 3.895 0.568 25767 15382 1 17 . 1 1 112 112 PRO C C 112 175.090 175.090 175.529 -0.439 25767 15383 1 17 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.187 -0.823 25767 15384 1 17 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.622 2.228 25767 15385 1 17 . 1 1 113 113 TRP N N 113 123.164 123.164 121.618 1.546 25767 15386 1 17 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.729 -0.019 25767 15387 1 17 . 1 1 113 113 TRP C C 113 174.605 174.605 175.123 -0.518 25767 15388 1 17 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.015 0.890 25767 15389 1 17 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.507 -3.214 25767 15390 1 17 . 1 1 113 113 TRP H H 113 8.687 8.687 8.376 0.311 25767 15391 1 17 . 1 1 114 114 ASP N N 114 121.356 121.356 121.737 -0.381 25767 15392 1 17 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.990 -0.129 25767 15393 1 17 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.767 -0.518 25767 15394 1 17 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.402 -1.261 25767 15395 1 17 . 1 1 114 114 ASP H H 114 6.985 6.985 8.344 -1.359 25767 15396 1 17 . 1 1 115 115 VAL N N 115 118.649 118.649 117.898 0.751 25767 15397 1 17 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.849 -0.007 25767 15398 1 17 . 1 1 115 115 VAL C C 115 177.739 177.739 177.411 0.328 25767 15399 1 17 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.740 -0.171 25767 15400 1 17 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.147 -0.470 25767 15401 1 17 . 1 1 115 115 VAL H H 115 8.206 8.206 8.412 -0.206 25767 15402 1 17 . 1 1 116 116 MET N N 116 120.401 120.401 118.368 2.033 25767 15403 1 17 . 1 1 116 116 MET HA H 116 4.303 4.303 4.204 0.099 25767 15404 1 17 . 1 1 116 116 MET C C 116 179.269 179.269 178.280 0.989 25767 15405 1 17 . 1 1 116 116 MET CA C 116 57.634 57.634 58.869 -1.235 25767 15406 1 17 . 1 1 116 116 MET CB C 116 30.414 30.414 32.031 -1.617 25767 15407 1 17 . 1 1 116 116 MET H H 116 7.642 7.642 8.170 -0.528 25767 15408 1 17 . 1 1 117 117 LEU N N 117 125.503 125.503 119.257 6.246 25767 15409 1 17 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.044 0.201 25767 15410 1 17 . 1 1 117 117 LEU C C 117 178.445 178.445 179.197 -0.752 25767 15411 1 17 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.555 0.645 25767 15412 1 17 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.167 -1.078 25767 15413 1 17 . 1 1 117 117 LEU H H 117 8.157 8.157 7.568 0.589 25767 15414 1 17 . 1 1 118 118 LYS N N 118 119.052 119.052 119.411 -0.359 25767 15415 1 17 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.970 -0.165 25767 15416 1 17 . 1 1 118 118 LYS C C 118 178.251 178.251 179.340 -1.089 25767 15417 1 17 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.009 0.517 25767 15418 1 17 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.130 -0.002 25767 15419 1 17 . 1 1 118 118 LYS H H 118 7.400 7.400 7.517 -0.117 25767 15420 1 17 . 1 1 119 119 ARG N N 119 117.999 117.999 119.420 -1.421 25767 15421 1 17 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.308 -0.088 25767 15422 1 17 . 1 1 119 119 ARG C C 119 180.441 180.441 179.061 1.380 25767 15423 1 17 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.575 0.242 25767 15424 1 17 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.209 -0.124 25767 15425 1 17 . 1 1 119 119 ARG H H 119 8.265 8.265 7.905 0.360 25767 15426 1 17 . 1 1 120 120 SER N N 120 118.073 118.073 116.999 1.074 25767 15427 1 17 . 1 1 120 120 SER HA H 120 4.182 4.182 4.298 -0.116 25767 15428 1 17 . 1 1 120 120 SER C C 120 176.215 176.215 176.670 -0.455 25767 15429 1 17 . 1 1 120 120 SER CA C 120 62.817 62.817 62.442 0.375 25767 15430 1 17 . 1 1 120 120 SER CB C 120 63.550 63.550 62.944 0.606 25767 15431 1 17 . 1 1 120 120 SER H H 120 8.633 8.633 7.930 0.703 25767 15432 1 17 . 1 1 121 121 LEU N N 121 125.029 125.029 122.471 2.558 25767 15433 1 17 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.010 0.209 25767 15434 1 17 . 1 1 121 121 LEU C C 121 179.679 179.679 178.447 1.232 25767 15435 1 17 . 1 1 121 121 LEU CA C 121 58.849 58.849 58.215 0.633 25767 15436 1 17 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.596 -0.822 25767 15437 1 17 . 1 1 121 121 LEU H H 121 8.313 8.313 7.846 0.467 25767 15438 1 17 . 1 1 122 122 TRP N N 122 120.217 120.217 119.394 0.823 25767 15439 1 17 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.401 -0.061 25767 15440 1 17 . 1 1 122 122 TRP C C 122 177.527 177.527 178.781 -1.254 25767 15441 1 17 . 1 1 122 122 TRP CA C 122 61.758 61.758 61.280 0.478 25767 15442 1 17 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.090 0.558 25767 15443 1 17 . 1 1 122 122 TRP H H 122 7.928 7.928 7.846 0.082 25767 15444 1 17 . 1 1 123 123 CYS N N 123 119.669 119.669 118.921 0.748 25767 15445 1 17 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.415 -0.208 25767 15446 1 17 . 1 1 123 123 CYS C C 123 177.057 177.057 177.135 -0.078 25767 15447 1 17 . 1 1 123 123 CYS CA C 123 62.600 62.600 63.670 -1.070 25767 15448 1 17 . 1 1 123 123 CYS CB C 123 25.899 25.899 26.985 -1.086 25767 15449 1 17 . 1 1 123 123 CYS H H 123 8.273 8.273 8.413 -0.140 25767 15450 1 17 . 1 1 124 124 CYS N N 124 116.898 116.898 119.744 -2.846 25767 15451 1 17 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.211 -0.363 25767 15452 1 17 . 1 1 124 124 CYS C C 124 175.759 175.759 176.901 -1.142 25767 15453 1 17 . 1 1 124 124 CYS CA C 124 65.653 65.653 64.710 0.943 25767 15454 1 17 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.170 0.347 25767 15455 1 17 . 1 1 124 124 CYS H H 124 8.122 8.122 8.377 -0.255 25767 15456 1 17 . 1 1 125 125 ILE N N 125 120.498 120.498 120.721 -0.223 25767 15457 1 17 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.744 -0.156 25767 15458 1 17 . 1 1 125 125 ILE C C 125 179.337 179.337 177.775 1.562 25767 15459 1 17 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.782 1.812 25767 15460 1 17 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.557 0.122 25767 15461 1 17 . 1 1 125 125 ILE H H 125 8.092 8.092 7.945 0.147 25767 15462 1 17 . 1 1 126 126 ASP N N 126 125.084 125.084 121.174 3.910 25767 15463 1 17 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.466 0.151 25767 15464 1 17 . 1 1 126 126 ASP C C 126 178.299 178.299 179.074 -0.775 25767 15465 1 17 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.383 1.621 25767 15466 1 17 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.186 0.110 25767 15467 1 17 . 1 1 126 126 ASP H H 126 9.049 9.049 7.979 1.070 25767 15468 1 17 . 1 1 127 127 LEU N N 127 122.591 122.591 120.129 2.462 25767 15469 1 17 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.895 -0.028 25767 15470 1 17 . 1 1 127 127 LEU C C 127 179.655 179.655 178.948 0.707 25767 15471 1 17 . 1 1 127 127 LEU CA C 127 58.661 58.661 58.086 0.576 25767 15472 1 17 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.621 0.573 25767 15473 1 17 . 1 1 127 127 LEU H H 127 8.888 8.888 7.757 1.131 25767 15474 1 17 . 1 1 128 128 PHE N N 128 117.498 117.498 118.638 -1.140 25767 15475 1 17 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.173 0.149 25767 15476 1 17 . 1 1 128 128 PHE C C 128 178.533 178.533 177.886 0.647 25767 15477 1 17 . 1 1 128 128 PHE CA C 128 60.932 60.932 62.453 -1.521 25767 15478 1 17 . 1 1 128 128 PHE CB C 128 39.053 39.053 38.722 0.331 25767 15479 1 17 . 1 1 128 128 PHE H H 128 8.947 8.947 8.012 0.935 25767 15480 1 17 . 1 1 129 129 SER N N 129 115.398 115.398 115.918 -0.520 25767 15481 1 17 . 1 1 129 129 SER HA H 129 4.046 4.046 4.308 -0.262 25767 15482 1 17 . 1 1 129 129 SER C C 129 175.168 175.168 177.067 -1.899 25767 15483 1 17 . 1 1 129 129 SER CA C 129 63.015 63.015 62.151 0.864 25767 15484 1 17 . 1 1 129 129 SER H H 129 8.578 8.578 8.798 -0.220 25767 15485 1 17 . 1 1 130 130 CYS N N 130 125.556 125.556 121.571 3.985 25767 15486 1 17 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.180 -0.071 25767 15487 1 17 . 1 1 130 130 CYS C C 130 175.294 175.294 177.081 -1.787 25767 15488 1 17 . 1 1 130 130 CYS CA C 130 61.438 61.438 64.186 -2.748 25767 15489 1 17 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.668 -0.618 25767 15490 1 17 . 1 1 130 130 CYS H H 130 8.289 8.289 8.184 0.105 25767 15491 1 17 . 1 1 131 131 ILE N N 131 120.232 120.232 121.284 -1.052 25767 15492 1 17 . 1 1 131 131 ILE HA H 131 4.033 4.033 4.298 -0.265 25767 15493 1 17 . 1 1 131 131 ILE C C 131 177.297 177.297 178.767 -1.470 25767 15494 1 17 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.609 -0.956 25767 15495 1 17 . 1 1 131 131 ILE CB C 131 39.102 39.102 38.071 1.031 25767 15496 1 17 . 1 1 131 131 ILE H H 131 7.943 7.943 8.440 -0.497 25767 15497 1 17 . 1 1 132 132 LEU N N 132 116.422 116.422 120.864 -4.442 25767 15498 1 17 . 1 1 132 132 LEU HA H 132 3.845 3.845 4.057 -0.212 25767 15499 1 17 . 1 1 132 132 LEU C C 132 177.816 177.816 178.543 -0.727 25767 15500 1 17 . 1 1 132 132 LEU CA C 132 57.078 57.078 58.161 -1.083 25767 15501 1 17 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.837 0.377 25767 15502 1 17 . 1 1 132 132 LEU H H 132 7.846 7.846 8.536 -0.690 25767 15503 1 17 . 1 1 133 133 HIS N N 133 116.929 116.929 118.108 -1.179 25767 15504 1 17 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.348 -0.209 25767 15505 1 17 . 1 1 133 133 HIS C C 133 178.669 178.669 178.074 0.595 25767 15506 1 17 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.769 -0.033 25767 15507 1 17 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.120 3.032 25767 15508 1 17 . 1 1 133 133 HIS H H 133 7.822 7.822 8.050 -0.228 25767 15509 1 17 . 1 1 134 134 LEU N N 134 116.898 116.898 121.598 -4.700 25767 15510 1 17 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.064 -0.331 25767 15511 1 17 . 1 1 134 134 LEU C C 134 179.402 179.402 178.350 1.052 25767 15512 1 17 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.803 -0.576 25767 15513 1 17 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.123 -2.584 25767 15514 1 17 . 1 1 134 134 LEU H H 134 8.688 8.688 7.969 0.719 25767 15515 1 17 . 1 1 135 135 TRP N N 135 115.602 115.602 117.937 -2.335 25767 15516 1 17 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.664 0.344 25767 15517 1 17 . 1 1 135 135 TRP C C 135 175.022 175.022 178.012 -2.990 25767 15518 1 17 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.237 1.189 25767 15519 1 17 . 1 1 135 135 TRP CB C 135 27.085 27.085 28.916 -1.831 25767 15520 1 17 . 1 1 135 135 TRP H H 135 7.638 7.638 8.500 -0.862 25767 15521 1 17 . 1 1 136 136 LYS N N 136 119.721 119.721 122.779 -3.058 25767 15522 1 17 . 1 1 136 136 LYS HA H 136 3.816 3.816 4.015 -0.199 25767 15523 1 17 . 1 1 136 136 LYS C C 136 178.279 178.279 178.467 -0.188 25767 15524 1 17 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.957 0.236 25767 15525 1 17 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.863 1.194 25767 15526 1 17 . 1 1 136 136 LYS H H 136 6.538 6.538 7.911 -1.373 25767 15527 1 17 . 1 1 137 137 GLU N N 137 115.407 115.407 115.079 0.328 25767 15528 1 17 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.192 -0.025 25767 15529 1 17 . 1 1 137 137 GLU C C 137 176.700 176.700 177.224 -0.524 25767 15530 1 17 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.340 -0.490 25767 15531 1 17 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.046 0.114 25767 15532 1 17 . 1 1 137 137 GLU H H 137 8.596 8.596 8.350 0.246 25767 15533 1 17 . 1 1 138 138 ASN N N 138 116.669 116.669 116.942 -0.273 25767 15534 1 17 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.791 0.115 25767 15535 1 17 . 1 1 138 138 ASN C C 138 173.481 173.481 175.038 -1.557 25767 15536 1 17 . 1 1 138 138 ASN CA C 138 52.814 52.814 54.155 -1.341 25767 15537 1 17 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.782 1.055 25767 15538 1 17 . 1 1 138 138 ASN H H 138 8.343 8.343 8.107 0.236 25767 15539 1 17 . 1 1 139 139 ILE N N 139 120.703 120.703 120.681 0.022 25767 15540 1 17 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.221 0.123 25767 15541 1 17 . 1 1 139 139 ILE C C 139 175.241 175.241 174.811 0.430 25767 15542 1 17 . 1 1 139 139 ILE CA C 139 60.792 60.792 60.441 0.351 25767 15543 1 17 . 1 1 139 139 ILE CB C 139 40.274 40.274 40.694 -0.420 25767 15544 1 17 . 1 1 139 139 ILE H H 139 7.167 7.167 7.433 -0.266 25767 15545 1 17 . 1 1 140 140 SER N N 140 123.284 123.284 119.860 3.424 25767 15546 1 17 . 1 1 140 140 SER HA H 140 4.345 4.345 4.533 -0.188 25767 15547 1 17 . 1 1 140 140 SER CA C 140 58.095 58.095 57.777 0.318 25767 15548 1 17 . 1 1 140 140 SER CB C 140 65.370 65.370 64.328 1.042 25767 15549 1 17 . 1 1 140 140 SER H H 140 8.727 8.727 8.475 0.252 25767 15550 1 17 . 1 1 142 142 THR N N 142 113.868 113.868 115.057 -1.189 25767 15551 1 17 . 1 1 142 142 THR HA H 142 3.976 3.976 4.212 -0.236 25767 15552 1 17 . 1 1 142 142 THR C C 142 177.559 177.559 176.655 0.904 25767 15553 1 17 . 1 1 142 142 THR CA C 142 66.007 66.007 65.489 0.518 25767 15554 1 17 . 1 1 142 142 THR CB C 142 68.530 68.530 68.422 0.108 25767 15555 1 17 . 1 1 142 142 THR H H 142 8.243 8.243 7.966 0.277 25767 15556 1 17 . 1 1 143 143 SER N N 143 120.786 120.786 116.552 4.234 25767 15557 1 17 . 1 1 143 143 SER C C 143 175.844 175.844 176.587 -0.743 25767 15558 1 17 . 1 1 143 143 SER CA C 143 62.102 62.102 61.632 0.470 25767 15559 1 17 . 1 1 143 143 SER CB C 143 63.086 63.086 62.862 0.223 25767 15560 1 17 . 1 1 143 143 SER H H 143 7.915 7.915 8.069 -0.154 25767 15561 1 17 . 1 1 144 144 THR N N 144 120.946 120.946 117.080 3.866 25767 15562 1 17 . 1 1 144 144 THR HA H 144 4.299 4.299 4.014 0.285 25767 15563 1 17 . 1 1 144 144 THR C C 144 175.874 175.874 176.306 -0.432 25767 15564 1 17 . 1 1 144 144 THR CA C 144 67.487 67.487 66.473 1.014 25767 15565 1 17 . 1 1 144 144 THR CB C 144 68.485 68.485 68.916 -0.431 25767 15566 1 17 . 1 1 144 144 THR H H 144 8.746 8.746 8.543 0.203 25767 15567 1 17 . 1 1 145 145 ASN N N 145 120.069 120.069 119.271 0.798 25767 15568 1 17 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.396 -0.088 25767 15569 1 17 . 1 1 145 145 ASN C C 145 177.917 177.917 177.513 0.404 25767 15570 1 17 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.610 -0.273 25767 15571 1 17 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.638 -0.538 25767 15572 1 17 . 1 1 145 145 ASN H H 145 7.940 7.940 7.888 0.052 25767 15573 1 17 . 1 1 146 146 SER N N 146 116.905 116.905 116.731 0.174 25767 15574 1 17 . 1 1 146 146 SER HA H 146 3.936 3.936 4.100 -0.164 25767 15575 1 17 . 1 1 146 146 SER C C 146 176.963 176.963 176.520 0.443 25767 15576 1 17 . 1 1 146 146 SER CA C 146 61.997 61.997 61.967 0.030 25767 15577 1 17 . 1 1 146 146 SER CB C 146 62.879 62.879 63.159 -0.280 25767 15578 1 17 . 1 1 146 146 SER H H 146 7.951 7.951 7.739 0.212 25767 15579 1 17 . 1 1 147 147 LEU N N 147 123.253 123.253 121.722 1.531 25767 15580 1 17 . 1 1 147 147 LEU HA H 147 3.875 3.875 3.917 -0.042 25767 15581 1 17 . 1 1 147 147 LEU C C 147 178.726 178.726 178.956 -0.230 25767 15582 1 17 . 1 1 147 147 LEU CA C 147 58.580 58.580 57.707 0.873 25767 15583 1 17 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.517 -0.657 25767 15584 1 17 . 1 1 147 147 LEU H H 147 8.168 8.168 7.540 0.628 25767 15585 1 17 . 1 1 148 148 GLN N N 148 118.212 118.212 117.472 0.740 25767 15586 1 17 . 1 1 148 148 GLN HA H 148 3.817 3.817 3.932 -0.115 25767 15587 1 17 . 1 1 148 148 GLN C C 148 179.686 179.686 178.066 1.620 25767 15588 1 17 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.377 0.866 25767 15589 1 17 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.699 0.021 25767 15590 1 17 . 1 1 148 148 GLN H H 148 8.295 8.295 8.461 -0.166 25767 15591 1 17 . 1 1 149 149 LYS N N 149 120.770 120.770 120.520 0.250 25767 15592 1 17 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.913 -0.012 25767 15593 1 17 . 1 1 149 149 LYS C C 149 178.006 178.006 178.834 -0.828 25767 15594 1 17 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.404 0.128 25767 15595 1 17 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.327 -0.435 25767 15596 1 17 . 1 1 149 149 LYS H H 149 7.955 7.955 7.842 0.113 25767 15597 1 17 . 1 1 150 150 ARG N N 150 119.244 119.244 118.545 0.699 25767 15598 1 17 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.915 -0.075 25767 15599 1 17 . 1 1 150 150 ARG C C 150 178.858 178.858 178.808 0.050 25767 15600 1 17 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.171 0.200 25767 15601 1 17 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.940 -1.136 25767 15602 1 17 . 1 1 150 150 ARG H H 150 7.020 7.020 7.541 -0.521 25767 15603 1 17 . 1 1 151 151 ILE N N 151 121.183 121.183 120.050 1.133 25767 15604 1 17 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.357 0.002 25767 15605 1 17 . 1 1 151 151 ILE C C 151 177.327 177.327 177.476 -0.149 25767 15606 1 17 . 1 1 151 151 ILE CA C 151 67.196 67.196 65.081 2.115 25767 15607 1 17 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.360 0.912 25767 15608 1 17 . 1 1 151 151 ILE H H 151 7.574 7.574 7.633 -0.059 25767 15609 1 17 . 1 1 152 152 LYS N N 152 119.521 119.521 120.128 -0.607 25767 15610 1 17 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.853 -0.080 25767 15611 1 17 . 1 1 152 152 LYS C C 152 178.016 178.016 178.839 -0.823 25767 15612 1 17 . 1 1 152 152 LYS CA C 152 59.830 59.830 59.894 -0.064 25767 15613 1 17 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.071 -0.490 25767 15614 1 17 . 1 1 152 152 LYS H H 152 7.629 7.629 7.832 -0.203 25767 15615 1 17 . 1 1 153 153 TYR N N 153 120.178 120.178 121.218 -1.040 25767 15616 1 17 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.131 -0.059 25767 15617 1 17 . 1 1 153 153 TYR C C 153 178.195 178.195 177.804 0.391 25767 15618 1 17 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.823 -0.507 25767 15619 1 17 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.413 -1.140 25767 15620 1 17 . 1 1 153 153 TYR H H 153 8.407 8.407 7.786 0.621 25767 15621 1 17 . 1 1 154 154 CYS N N 154 117.013 117.013 118.504 -1.491 25767 15622 1 17 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.319 -0.247 25767 15623 1 17 . 1 1 154 154 CYS C C 154 176.827 176.827 177.317 -0.490 25767 15624 1 17 . 1 1 154 154 CYS CA C 154 65.780 65.780 61.313 4.467 25767 15625 1 17 . 1 1 154 154 CYS CB C 154 28.160 28.160 26.346 1.814 25767 15626 1 17 . 1 1 154 154 CYS H H 154 8.291 8.291 7.689 0.602 25767 15627 1 17 . 1 1 155 155 LYS N N 155 118.753 118.753 120.660 -1.907 25767 15628 1 17 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.866 -0.195 25767 15629 1 17 . 1 1 155 155 LYS C C 155 179.904 179.904 179.099 0.805 25767 15630 1 17 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.743 0.741 25767 15631 1 17 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.302 -0.359 25767 15632 1 17 . 1 1 155 155 LYS H H 155 7.934 7.934 8.095 -0.161 25767 15633 1 17 . 1 1 156 156 ILE N N 156 123.873 123.873 120.670 3.203 25767 15634 1 17 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.571 0.013 25767 15635 1 17 . 1 1 156 156 ILE C C 156 179.501 179.501 177.824 1.677 25767 15636 1 17 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.401 -0.161 25767 15637 1 17 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.894 -0.252 25767 15638 1 17 . 1 1 156 156 ILE H H 156 8.314 8.314 8.592 -0.278 25767 15639 1 17 . 1 1 157 157 TYR N N 157 121.132 121.132 119.550 1.582 25767 15640 1 17 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.989 0.176 25767 15641 1 17 . 1 1 157 157 TYR C C 157 178.558 178.558 177.644 0.914 25767 15642 1 17 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.883 0.227 25767 15643 1 17 . 1 1 157 157 TYR H H 157 8.442 8.442 7.995 0.447 25767 15644 1 17 . 1 1 158 158 LEU N N 158 120.964 120.964 119.851 1.113 25767 15645 1 17 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.772 0.140 25767 15646 1 17 . 1 1 158 158 LEU C C 158 180.130 180.130 178.667 1.463 25767 15647 1 17 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.796 0.890 25767 15648 1 17 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.449 0.281 25767 15649 1 17 . 1 1 158 158 LEU H H 158 8.469 8.469 8.100 0.369 25767 15650 1 17 . 1 1 159 159 SER N N 159 116.653 116.653 114.216 2.437 25767 15651 1 17 . 1 1 159 159 SER HA H 159 4.246 4.246 4.071 0.175 25767 15652 1 17 . 1 1 159 159 SER CA C 159 61.460 61.460 61.432 0.028 25767 15653 1 17 . 1 1 159 159 SER CB C 159 62.849 62.849 62.594 0.254 25767 15654 1 17 . 1 1 159 159 SER H H 159 7.758 7.758 8.105 -0.347 25767 15655 1 17 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.275 -1.902 25767 15656 1 17 . 1 1 160 160 LYS CB C 160 29.832 29.832 31.933 -2.101 25767 15657 1 17 . 1 1 160 160 LYS H H 160 8.425 8.425 7.332 1.093 25767 15658 1 17 . 1 1 161 161 LEU N N 161 121.686 121.686 118.566 3.120 25767 15659 1 17 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.896 0.267 25767 15660 1 17 . 1 1 161 161 LEU C C 161 180.224 180.224 179.239 0.985 25767 15661 1 17 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.140 0.444 25767 15662 1 17 . 1 1 161 161 LEU CB C 161 41.462 41.462 40.868 0.594 25767 15663 1 17 . 1 1 161 161 LEU H H 161 8.323 8.323 7.426 0.897 25767 15664 1 17 . 1 1 162 162 ALA N N 162 123.102 123.102 121.247 1.855 25767 15665 1 17 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.082 0.048 25767 15666 1 17 . 1 1 162 162 ALA C C 162 179.487 179.487 179.405 0.082 25767 15667 1 17 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.564 0.180 25767 15668 1 17 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.495 -0.092 25767 15669 1 17 . 1 1 162 162 ALA H H 162 7.978 7.978 7.533 0.445 25767 15670 1 17 . 1 1 163 163 LYS N N 163 116.069 116.069 116.464 -0.395 25767 15671 1 17 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.201 0.022 25767 15672 1 17 . 1 1 163 163 LYS C C 163 176.987 176.987 177.032 -0.045 25767 15673 1 17 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.488 0.118 25767 15674 1 17 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.784 0.422 25767 15675 1 17 . 1 1 163 163 LYS H H 163 7.697 7.697 7.624 0.073 25767 15676 1 17 . 1 1 164 164 GLY N N 164 108.540 108.540 106.919 1.621 25767 15677 1 17 . 1 1 164 164 GLY C C 164 174.721 174.721 173.887 0.834 25767 15678 1 17 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.888 0.903 25767 15679 1 17 . 1 1 164 164 GLY H H 164 7.772 7.772 7.406 0.366 25767 15680 1 17 . 1 1 165 165 GLU N N 165 119.886 119.886 120.359 -0.473 25767 15681 1 17 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.240 -0.190 25767 15682 1 17 . 1 1 165 165 GLU C C 165 176.027 176.027 174.779 1.248 25767 15683 1 17 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.248 1.605 25767 15684 1 17 . 1 1 165 165 GLU CB C 165 30.338 30.338 31.297 -0.959 25767 15685 1 17 . 1 1 165 165 GLU H H 165 8.065 8.065 7.585 0.480 25767 15686 1 17 . 1 1 166 166 ILE N N 166 117.926 117.926 123.313 -5.387 25767 15687 1 17 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.971 -0.069 25767 15688 1 17 . 1 1 166 166 ILE C C 166 174.138 174.138 175.368 -1.230 25767 15689 1 17 . 1 1 166 166 ILE CA C 166 60.455 60.455 59.895 0.560 25767 15690 1 17 . 1 1 166 166 ILE CB C 166 40.202 40.202 40.172 0.030 25767 15691 1 17 . 1 1 166 166 ILE H H 166 7.282 7.282 8.048 -0.766 25767 15692 1 18 . 1 1 2 2 ALA N N 2 122.811 122.811 123.288 -0.477 25767 15693 1 18 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.112 -0.089 25767 15694 1 18 . 1 1 2 2 ALA C C 2 179.915 179.915 179.523 0.392 25767 15695 1 18 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.403 -0.286 25767 15696 1 18 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.756 -0.218 25767 15697 1 18 . 1 1 2 2 ALA H H 2 8.509 8.509 8.729 -0.220 25767 15698 1 18 . 1 1 3 3 SER N N 3 115.308 115.308 114.300 1.008 25767 15699 1 18 . 1 1 3 3 SER HA H 3 4.097 4.097 4.083 0.014 25767 15700 1 18 . 1 1 3 3 SER C C 3 176.706 176.706 175.757 0.949 25767 15701 1 18 . 1 1 3 3 SER CA C 3 60.665 60.665 61.797 -1.132 25767 15702 1 18 . 1 1 3 3 SER CB C 3 62.710 62.710 62.617 0.093 25767 15703 1 18 . 1 1 3 3 SER H H 3 7.996 7.996 8.707 -0.711 25767 15704 1 18 . 1 1 4 4 ASN N N 4 122.688 122.688 119.854 2.834 25767 15705 1 18 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.437 -0.133 25767 15706 1 18 . 1 1 4 4 ASN C C 4 176.258 176.258 177.465 -1.207 25767 15707 1 18 . 1 1 4 4 ASN CA C 4 55.701 55.701 56.005 -0.304 25767 15708 1 18 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.546 0.631 25767 15709 1 18 . 1 1 4 4 ASN H H 4 8.075 8.075 8.270 -0.195 25767 15710 1 18 . 1 1 5 5 ALA N N 5 121.900 121.900 122.979 -1.079 25767 15711 1 18 . 1 1 5 5 ALA HA H 5 3.575 3.575 3.988 -0.413 25767 15712 1 18 . 1 1 5 5 ALA C C 5 178.475 178.475 178.909 -0.434 25767 15713 1 18 . 1 1 5 5 ALA CA C 5 55.833 55.833 55.039 0.794 25767 15714 1 18 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.349 -0.734 25767 15715 1 18 . 1 1 5 5 ALA H H 5 8.659 8.659 7.702 0.957 25767 15716 1 18 . 1 1 6 6 ALA N N 6 117.768 117.768 121.535 -3.767 25767 15717 1 18 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.981 -0.194 25767 15718 1 18 . 1 1 6 6 ALA C C 6 180.494 180.494 179.501 0.993 25767 15719 1 18 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.039 0.311 25767 15720 1 18 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.012 -0.110 25767 15721 1 18 . 1 1 6 6 ALA H H 6 7.864 7.864 7.687 0.177 25767 15722 1 18 . 1 1 7 7 ARG N N 7 121.173 121.173 119.269 1.904 25767 15723 1 18 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.083 -0.180 25767 15724 1 18 . 1 1 7 7 ARG C C 7 179.189 179.189 178.721 0.468 25767 15725 1 18 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.611 0.702 25767 15726 1 18 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.801 -0.579 25767 15727 1 18 . 1 1 7 7 ARG H H 7 7.514 7.514 7.931 -0.417 25767 15728 1 18 . 1 1 8 8 VAL N N 8 122.979 122.979 119.959 3.020 25767 15729 1 18 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.722 -0.469 25767 15730 1 18 . 1 1 8 8 VAL C C 8 177.821 177.821 178.151 -0.330 25767 15731 1 18 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.231 1.541 25767 15732 1 18 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.099 0.342 25767 15733 1 18 . 1 1 8 8 VAL H H 8 8.101 8.101 7.770 0.331 25767 15734 1 18 . 1 1 9 9 VAL N N 9 119.801 119.801 119.836 -0.035 25767 15735 1 18 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.549 -0.283 25767 15736 1 18 . 1 1 9 9 VAL C C 9 177.373 177.373 177.736 -0.363 25767 15737 1 18 . 1 1 9 9 VAL CA C 9 67.484 67.484 66.654 0.830 25767 15738 1 18 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.665 0.960 25767 15739 1 18 . 1 1 9 9 VAL H H 9 8.362 8.362 7.902 0.460 25767 15740 1 18 . 1 1 10 10 ALA N N 10 122.360 122.360 121.563 0.797 25767 15741 1 18 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.016 -0.080 25767 15742 1 18 . 1 1 10 10 ALA C C 10 180.762 180.762 179.415 1.347 25767 15743 1 18 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.534 -0.090 25767 15744 1 18 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.279 -0.542 25767 15745 1 18 . 1 1 10 10 ALA H H 10 7.776 7.776 7.787 -0.011 25767 15746 1 18 . 1 1 11 11 THR N N 11 117.376 117.376 111.438 5.938 25767 15747 1 18 . 1 1 11 11 THR HA H 11 3.816 3.816 4.064 -0.248 25767 15748 1 18 . 1 1 11 11 THR C C 11 175.775 175.775 176.291 -0.516 25767 15749 1 18 . 1 1 11 11 THR CA C 11 66.509 66.509 65.407 1.102 25767 15750 1 18 . 1 1 11 11 THR CB C 11 68.588 68.588 68.859 -0.271 25767 15751 1 18 . 1 1 11 11 THR H H 11 8.180 8.180 7.649 0.531 25767 15752 1 18 . 1 1 12 12 ALA N N 12 125.308 125.308 125.325 -0.017 25767 15753 1 18 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.724 0.273 25767 15754 1 18 . 1 1 12 12 ALA C C 12 179.399 179.399 179.440 -0.041 25767 15755 1 18 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.445 0.631 25767 15756 1 18 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.246 0.998 25767 15757 1 18 . 1 1 12 12 ALA H H 12 8.671 8.671 8.350 0.321 25767 15758 1 18 . 1 1 13 13 LYS N N 13 116.977 116.977 117.808 -0.831 25767 15759 1 18 . 1 1 13 13 LYS C C 13 179.646 179.646 178.782 0.864 25767 15760 1 18 . 1 1 13 13 LYS CA C 13 58.921 58.921 60.097 -1.176 25767 15761 1 18 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.252 -0.809 25767 15762 1 18 . 1 1 13 13 LYS H H 13 8.061 8.061 7.866 0.195 25767 15763 1 18 . 1 1 14 14 ASP N N 14 121.988 121.988 120.007 1.981 25767 15764 1 18 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.504 -0.151 25767 15765 1 18 . 1 1 14 14 ASP C C 14 179.446 179.446 178.806 0.640 25767 15766 1 18 . 1 1 14 14 ASP CA C 14 57.509 57.509 56.968 0.541 25767 15767 1 18 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.685 -0.684 25767 15768 1 18 . 1 1 14 14 ASP H H 14 7.669 7.669 7.779 -0.110 25767 15769 1 18 . 1 1 15 15 PHE N N 15 119.588 119.588 118.598 0.990 25767 15770 1 18 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.233 0.111 25767 15771 1 18 . 1 1 15 15 PHE C C 15 178.373 178.373 178.147 0.226 25767 15772 1 18 . 1 1 15 15 PHE CA C 15 62.237 62.237 60.633 1.604 25767 15773 1 18 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.543 -1.047 25767 15774 1 18 . 1 1 15 15 PHE H H 15 7.913 7.913 8.880 -0.967 25767 15775 1 18 . 1 1 16 16 ASP N N 16 121.705 121.705 119.711 1.994 25767 15776 1 18 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.464 -0.469 25767 15777 1 18 . 1 1 16 16 ASP C C 16 180.071 180.071 179.011 1.060 25767 15778 1 18 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.077 1.072 25767 15779 1 18 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.468 1.019 25767 15780 1 18 . 1 1 16 16 ASP H H 16 8.324 8.324 8.314 0.010 25767 15781 1 18 . 1 1 17 17 LYS N N 17 118.825 118.825 119.611 -0.786 25767 15782 1 18 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.114 -0.077 25767 15783 1 18 . 1 1 17 17 LYS C C 17 178.407 178.407 178.000 0.407 25767 15784 1 18 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.816 0.245 25767 15785 1 18 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.566 0.018 25767 15786 1 18 . 1 1 17 17 LYS H H 17 7.834 7.834 7.740 0.094 25767 15787 1 18 . 1 1 18 18 VAL N N 18 110.562 110.562 117.313 -6.751 25767 15788 1 18 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.054 0.462 25767 15789 1 18 . 1 1 18 18 VAL C C 18 176.144 176.144 176.641 -0.497 25767 15790 1 18 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.115 -2.241 25767 15791 1 18 . 1 1 18 18 VAL CB C 18 31.160 31.160 31.827 -0.667 25767 15792 1 18 . 1 1 18 18 VAL H H 18 7.185 7.185 7.571 -0.386 25767 15793 1 18 . 1 1 19 19 GLY N N 19 109.272 109.272 107.839 1.433 25767 15794 1 18 . 1 1 19 19 GLY C C 19 175.043 175.043 174.895 0.148 25767 15795 1 18 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.423 0.408 25767 15796 1 18 . 1 1 19 19 GLY H H 19 7.723 7.723 7.970 -0.247 25767 15797 1 18 . 1 1 20 20 LEU N N 20 125.428 125.428 121.508 3.920 25767 15798 1 18 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.630 -0.310 25767 15799 1 18 . 1 1 20 20 LEU C C 20 177.949 177.949 177.461 0.488 25767 15800 1 18 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.363 -0.559 25767 15801 1 18 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.513 0.404 25767 15802 1 18 . 1 1 20 20 LEU H H 20 8.083 8.083 7.978 0.105 25767 15803 1 18 . 1 1 21 21 GLY N N 21 107.804 107.804 110.363 -2.559 25767 15804 1 18 . 1 1 21 21 GLY C C 21 176.278 176.278 176.273 0.005 25767 15805 1 18 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.738 -0.444 25767 15806 1 18 . 1 1 21 21 GLY H H 21 7.982 7.982 7.936 0.046 25767 15807 1 18 . 1 1 22 22 ILE N N 22 121.319 121.319 121.654 -0.335 25767 15808 1 18 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.829 0.081 25767 15809 1 18 . 1 1 22 22 ILE C C 22 176.604 176.604 177.881 -1.277 25767 15810 1 18 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.359 -1.913 25767 15811 1 18 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.745 -1.179 25767 15812 1 18 . 1 1 22 22 ILE H H 22 8.478 8.478 8.059 0.419 25767 15813 1 18 . 1 1 23 23 ILE N N 23 120.377 120.377 119.785 0.592 25767 15814 1 18 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.936 -0.223 25767 15815 1 18 . 1 1 23 23 ILE C C 23 178.581 178.581 178.596 -0.015 25767 15816 1 18 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.309 0.937 25767 15817 1 18 . 1 1 23 23 ILE CB C 23 36.199 36.199 36.193 0.007 25767 15818 1 18 . 1 1 23 23 ILE H H 23 6.869 6.869 7.472 -0.603 25767 15819 1 18 . 1 1 24 24 GLY N N 24 103.449 103.449 108.420 -4.971 25767 15820 1 18 . 1 1 24 24 GLY C C 24 175.308 175.308 175.761 -0.453 25767 15821 1 18 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.345 0.598 25767 15822 1 18 . 1 1 24 24 GLY H H 24 7.488 7.488 8.653 -1.165 25767 15823 1 18 . 1 1 25 25 TYR N N 25 124.685 124.685 124.185 0.500 25767 15824 1 18 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.956 -0.290 25767 15825 1 18 . 1 1 25 25 TYR C C 25 176.208 176.208 177.149 -0.941 25767 15826 1 18 . 1 1 25 25 TYR CA C 25 61.371 61.371 60.796 0.575 25767 15827 1 18 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.408 -0.141 25767 15828 1 18 . 1 1 25 25 TYR H H 25 7.931 7.931 8.139 -0.208 25767 15829 1 18 . 1 1 26 26 TYR N N 26 117.001 117.001 119.942 -2.941 25767 15830 1 18 . 1 1 26 26 TYR HA H 26 3.941 3.941 3.994 -0.053 25767 15831 1 18 . 1 1 26 26 TYR C C 26 178.753 178.753 177.483 1.270 25767 15832 1 18 . 1 1 26 26 TYR CA C 26 64.260 64.260 62.094 2.166 25767 15833 1 18 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.747 -1.226 25767 15834 1 18 . 1 1 26 26 TYR H H 26 7.693 7.693 7.939 -0.246 25767 15835 1 18 . 1 1 27 27 LEU N N 27 118.657 118.657 117.099 1.558 25767 15836 1 18 . 1 1 27 27 LEU HA H 27 4.311 4.311 3.985 0.326 25767 15837 1 18 . 1 1 27 27 LEU CA C 27 58.297 58.297 57.958 0.339 25767 15838 1 18 . 1 1 27 27 LEU CB C 27 42.723 42.723 40.757 1.966 25767 15839 1 18 . 1 1 27 27 LEU H H 27 8.339 8.339 8.064 0.275 25767 15840 1 18 . 1 1 28 28 GLN N N 28 118.593 118.593 118.684 -0.091 25767 15841 1 18 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.774 -0.123 25767 15842 1 18 . 1 1 28 28 GLN C C 28 177.282 177.282 178.451 -1.169 25767 15843 1 18 . 1 1 28 28 GLN CA C 28 58.829 58.829 59.023 -0.194 25767 15844 1 18 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.453 1.195 25767 15845 1 18 . 1 1 28 28 GLN H H 28 7.970 7.970 7.513 0.457 25767 15846 1 18 . 1 1 29 29 LEU N N 29 122.111 122.111 119.554 2.557 25767 15847 1 18 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.714 0.230 25767 15848 1 18 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.542 1.124 25767 15849 1 18 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.207 0.801 25767 15850 1 18 . 1 1 29 29 LEU H H 29 7.979 7.979 7.281 0.698 25767 15851 1 18 . 1 1 30 30 TYR N N 30 119.283 119.283 120.237 -0.954 25767 15852 1 18 . 1 1 30 30 TYR C C 30 175.775 175.775 177.249 -1.474 25767 15853 1 18 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.787 -1.693 25767 15854 1 18 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.318 0.755 25767 15855 1 18 . 1 1 30 30 TYR H H 30 8.093 8.093 7.564 0.529 25767 15856 1 18 . 1 1 31 31 ALA N N 31 121.327 121.327 122.410 -1.083 25767 15857 1 18 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.800 -0.432 25767 15858 1 18 . 1 1 31 31 ALA C C 31 178.955 178.955 178.748 0.207 25767 15859 1 18 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.311 0.236 25767 15860 1 18 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.138 -0.175 25767 15861 1 18 . 1 1 31 31 ALA H H 31 8.394 8.394 8.285 0.109 25767 15862 1 18 . 1 1 32 32 VAL N N 32 116.757 116.757 118.493 -1.736 25767 15863 1 18 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.405 -0.145 25767 15864 1 18 . 1 1 32 32 VAL CA C 32 67.662 67.662 66.112 1.550 25767 15865 1 18 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.817 -0.846 25767 15866 1 18 . 1 1 32 32 VAL H H 32 8.020 8.020 7.606 0.414 25767 15867 1 18 . 1 1 33 33 GLU N N 33 118.775 118.775 119.663 -0.888 25767 15868 1 18 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.840 0.149 25767 15869 1 18 . 1 1 33 33 GLU C C 33 179.746 179.746 178.904 0.842 25767 15870 1 18 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.325 0.678 25767 15871 1 18 . 1 1 33 33 GLU H H 33 7.358 7.358 7.623 -0.265 25767 15872 1 18 . 1 1 34 34 LEU N N 34 120.632 120.632 120.694 -0.062 25767 15873 1 18 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.829 -0.180 25767 15874 1 18 . 1 1 34 34 LEU C C 34 180.336 180.336 178.008 2.328 25767 15875 1 18 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.612 0.063 25767 15876 1 18 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.719 -0.131 25767 15877 1 18 . 1 1 34 34 LEU H H 34 8.390 8.390 7.617 0.773 25767 15878 1 18 . 1 1 35 35 ILE N N 35 121.240 121.240 118.627 2.613 25767 15879 1 18 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.816 -0.274 25767 15880 1 18 . 1 1 35 35 ILE C C 35 178.604 178.604 178.983 -0.379 25767 15881 1 18 . 1 1 35 35 ILE CA C 35 65.547 65.547 64.984 0.562 25767 15882 1 18 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.918 0.813 25767 15883 1 18 . 1 1 35 35 ILE H H 35 8.129 8.129 7.497 0.632 25767 15884 1 18 . 1 1 36 36 LEU N N 36 115.637 115.637 119.257 -3.620 25767 15885 1 18 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.045 -0.037 25767 15886 1 18 . 1 1 36 36 LEU C C 36 178.001 178.001 178.157 -0.156 25767 15887 1 18 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.154 -1.078 25767 15888 1 18 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.402 -1.468 25767 15889 1 18 . 1 1 36 36 LEU H H 36 8.416 8.416 7.856 0.560 25767 15890 1 18 . 1 1 37 37 SER N N 37 114.106 114.106 110.053 4.053 25767 15891 1 18 . 1 1 37 37 SER HA H 37 3.991 3.991 4.406 -0.415 25767 15892 1 18 . 1 1 37 37 SER C C 37 173.997 173.997 173.810 0.187 25767 15893 1 18 . 1 1 37 37 SER CA C 37 60.311 60.311 59.114 1.198 25767 15894 1 18 . 1 1 37 37 SER CB C 37 63.746 63.746 63.494 0.252 25767 15895 1 18 . 1 1 37 37 SER H H 37 7.517 7.517 7.636 -0.119 25767 15896 1 18 . 1 1 38 38 GLU N N 38 123.003 123.003 121.662 1.341 25767 15897 1 18 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.365 0.004 25767 15898 1 18 . 1 1 38 38 GLU C C 38 175.780 175.780 175.788 -0.008 25767 15899 1 18 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.516 -0.151 25767 15900 1 18 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.905 -0.612 25767 15901 1 18 . 1 1 38 38 GLU H H 38 7.151 7.151 7.449 -0.298 25767 15902 1 18 . 1 1 39 39 GLU N N 39 126.166 126.166 122.672 3.494 25767 15903 1 18 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.157 -0.148 25767 15904 1 18 . 1 1 39 39 GLU C C 39 176.652 176.652 176.081 0.571 25767 15905 1 18 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.537 1.661 25767 15906 1 18 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.347 -0.312 25767 15907 1 18 . 1 1 39 39 GLU H H 39 8.587 8.587 8.436 0.151 25767 15908 1 18 . 1 1 40 40 ASP N N 40 120.047 120.047 121.082 -1.035 25767 15909 1 18 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.466 0.084 25767 15910 1 18 . 1 1 40 40 ASP C C 40 175.035 175.035 175.988 -0.953 25767 15911 1 18 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.128 -1.760 25767 15912 1 18 . 1 1 40 40 ASP CB C 40 40.023 40.023 41.022 -0.999 25767 15913 1 18 . 1 1 40 40 ASP H H 40 8.504 8.504 8.435 0.069 25767 15914 1 18 . 1 1 41 41 ARG N N 41 120.671 120.671 124.713 -4.042 25767 15915 1 18 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.473 -0.084 25767 15916 1 18 . 1 1 41 41 ARG C C 41 175.755 175.755 175.125 0.630 25767 15917 1 18 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.549 0.459 25767 15918 1 18 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.712 -1.163 25767 15919 1 18 . 1 1 41 41 ARG H H 41 7.672 7.672 8.154 -0.482 25767 15920 1 18 . 1 1 42 42 SER N N 42 120.330 120.330 116.181 4.149 25767 15921 1 18 . 1 1 42 42 SER HA H 42 3.837 3.837 4.364 -0.527 25767 15922 1 18 . 1 1 42 42 SER CA C 42 57.326 57.326 58.931 -1.605 25767 15923 1 18 . 1 1 42 42 SER CB C 42 65.762 65.762 63.997 1.765 25767 15924 1 18 . 1 1 42 42 SER H H 42 8.544 8.544 8.313 0.231 25767 15925 1 18 . 1 1 43 43 GLN HA H 43 3.989 3.989 3.978 0.011 25767 15926 1 18 . 1 1 43 43 GLN C C 43 178.907 178.907 178.073 0.834 25767 15927 1 18 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.830 0.540 25767 15928 1 18 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.505 -0.542 25767 15929 1 18 . 1 1 44 44 GLU N N 44 120.328 120.328 119.994 0.334 25767 15930 1 18 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.977 0.036 25767 15931 1 18 . 1 1 44 44 GLU C C 44 179.824 179.824 178.662 1.162 25767 15932 1 18 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.160 0.885 25767 15933 1 18 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.365 -0.717 25767 15934 1 18 . 1 1 44 44 GLU H H 44 8.938 8.938 7.837 1.101 25767 15935 1 18 . 1 1 45 45 MET N N 45 121.030 121.030 117.511 3.519 25767 15936 1 18 . 1 1 45 45 MET HA H 45 4.412 4.412 4.247 0.165 25767 15937 1 18 . 1 1 45 45 MET C C 45 180.357 180.357 178.255 2.102 25767 15938 1 18 . 1 1 45 45 MET CA C 45 57.209 57.209 57.775 -0.566 25767 15939 1 18 . 1 1 45 45 MET CB C 45 32.436 32.436 31.706 0.730 25767 15940 1 18 . 1 1 45 45 MET H H 45 7.756 7.756 7.866 -0.110 25767 15941 1 18 . 1 1 46 46 THR N N 46 120.008 120.008 115.942 4.066 25767 15942 1 18 . 1 1 46 46 THR HA H 46 4.071 4.071 3.941 0.130 25767 15943 1 18 . 1 1 46 46 THR CA C 46 67.096 67.096 66.550 0.546 25767 15944 1 18 . 1 1 46 46 THR CB C 46 68.954 68.954 68.308 0.646 25767 15945 1 18 . 1 1 46 46 THR H H 46 8.187 8.187 7.922 0.265 25767 15946 1 18 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.101 0.008 25767 15947 1 18 . 1 1 47 47 ALA C C 47 180.118 180.118 179.490 0.628 25767 15948 1 18 . 1 1 47 47 ALA CA C 47 55.339 55.339 55.066 0.273 25767 15949 1 18 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.188 -0.356 25767 15950 1 18 . 1 1 47 47 ALA H H 47 8.238 8.238 7.604 0.634 25767 15951 1 18 . 1 1 48 48 LEU N N 48 122.093 122.093 119.272 2.821 25767 15952 1 18 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.019 0.244 25767 15953 1 18 . 1 1 48 48 LEU C C 48 179.103 179.103 179.328 -0.225 25767 15954 1 18 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.439 0.301 25767 15955 1 18 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.560 -0.764 25767 15956 1 18 . 1 1 48 48 LEU H H 48 7.778 7.778 7.678 0.100 25767 15957 1 18 . 1 1 49 49 ALA N N 49 120.130 120.130 121.860 -1.730 25767 15958 1 18 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.943 -0.222 25767 15959 1 18 . 1 1 49 49 ALA C C 49 178.676 178.676 179.490 -0.814 25767 15960 1 18 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.469 0.252 25767 15961 1 18 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.058 -0.231 25767 15962 1 18 . 1 1 49 49 ALA H H 49 8.432 8.432 8.440 -0.008 25767 15963 1 18 . 1 1 50 50 THR N N 50 113.333 113.333 114.851 -1.518 25767 15964 1 18 . 1 1 50 50 THR HA H 50 3.895 3.895 3.899 -0.004 25767 15965 1 18 . 1 1 50 50 THR C C 50 174.948 174.948 176.530 -1.582 25767 15966 1 18 . 1 1 50 50 THR CA C 50 67.334 67.334 66.724 0.610 25767 15967 1 18 . 1 1 50 50 THR CB C 50 68.864 68.864 68.192 0.672 25767 15968 1 18 . 1 1 50 50 THR H H 50 7.857 7.857 7.827 0.030 25767 15969 1 18 . 1 1 51 51 GLU N N 51 122.698 122.698 122.285 0.413 25767 15970 1 18 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.052 0.016 25767 15971 1 18 . 1 1 51 51 GLU C C 51 179.997 179.997 179.000 0.997 25767 15972 1 18 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.470 -0.037 25767 15973 1 18 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.462 0.055 25767 15974 1 18 . 1 1 51 51 GLU H H 51 7.817 7.817 7.600 0.217 25767 15975 1 18 . 1 1 52 52 LEU N N 52 121.100 121.100 120.126 0.974 25767 15976 1 18 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.021 0.108 25767 15977 1 18 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.660 0.229 25767 15978 1 18 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.702 0.245 25767 15979 1 18 . 1 1 52 52 LEU H H 52 8.628 8.628 7.871 0.757 25767 15980 1 18 . 1 1 53 53 LEU N N 53 119.935 119.935 119.567 0.368 25767 15981 1 18 . 1 1 53 53 LEU C C 53 179.671 179.671 179.244 0.427 25767 15982 1 18 . 1 1 53 53 LEU H H 53 8.303 8.303 7.747 0.556 25767 15983 1 18 . 1 1 54 54 ASP N N 54 120.339 120.339 119.309 1.030 25767 15984 1 18 . 1 1 54 54 ASP C C 54 179.106 179.106 178.596 0.510 25767 15985 1 18 . 1 1 54 54 ASP H H 54 7.901 7.901 8.003 -0.102 25767 15986 1 18 . 1 1 55 55 THR N N 55 120.237 120.237 117.024 3.213 25767 15987 1 18 . 1 1 55 55 THR HA H 55 3.696 3.696 4.052 -0.356 25767 15988 1 18 . 1 1 55 55 THR CA C 55 67.340 67.340 66.534 0.806 25767 15989 1 18 . 1 1 55 55 THR CB C 55 68.151 68.151 68.331 -0.180 25767 15990 1 18 . 1 1 55 55 THR H H 55 8.262 8.262 7.916 0.346 25767 15991 1 18 . 1 1 56 56 ILE N N 56 123.953 123.953 122.405 1.548 25767 15992 1 18 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.714 0.129 25767 15993 1 18 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.963 -0.070 25767 15994 1 18 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.631 0.502 25767 15995 1 18 . 1 1 56 56 ILE H H 56 8.930 8.930 7.729 1.201 25767 15996 1 18 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.749 -0.168 25767 15997 1 18 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.134 -0.103 25767 15998 1 18 . 1 1 58 58 ALA C C 58 179.875 179.875 179.496 0.379 25767 15999 1 18 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.817 0.449 25767 16000 1 18 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.299 -0.314 25767 16001 1 18 . 1 1 58 58 ALA H H 58 7.764 7.764 8.459 -0.695 25767 16002 1 18 . 1 1 59 59 PHE N N 59 121.988 121.988 120.159 1.829 25767 16003 1 18 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.179 0.047 25767 16004 1 18 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.399 0.040 25767 16005 1 18 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.375 -0.012 25767 16006 1 18 . 1 1 59 59 PHE H H 59 8.159 8.159 8.664 -0.505 25767 16007 1 18 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.934 -0.393 25767 16008 1 18 . 1 1 60 60 LYS C C 60 179.438 179.438 178.833 0.605 25767 16009 1 18 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.644 0.492 25767 16010 1 18 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.479 -0.421 25767 16011 1 18 . 1 1 61 61 LYS N N 61 119.262 119.262 118.155 1.107 25767 16012 1 18 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.197 -0.252 25767 16013 1 18 . 1 1 61 61 LYS C C 61 178.730 178.730 178.364 0.366 25767 16014 1 18 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.506 1.536 25767 16015 1 18 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.088 0.554 25767 16016 1 18 . 1 1 61 61 LYS H H 61 7.832 7.832 7.978 -0.146 25767 16017 1 18 . 1 1 62 62 GLU N N 62 120.790 120.790 120.382 0.408 25767 16018 1 18 . 1 1 62 62 GLU HA H 62 3.935 3.935 3.991 -0.056 25767 16019 1 18 . 1 1 62 62 GLU C C 62 178.424 178.424 178.061 0.363 25767 16020 1 18 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.968 -0.254 25767 16021 1 18 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.257 -0.027 25767 16022 1 18 . 1 1 62 62 GLU H H 62 7.982 7.982 8.138 -0.156 25767 16023 1 18 . 1 1 63 63 ILE N N 63 118.463 118.463 117.020 1.443 25767 16024 1 18 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.792 -0.103 25767 16025 1 18 . 1 1 63 63 ILE C C 63 177.555 177.555 177.186 0.369 25767 16026 1 18 . 1 1 63 63 ILE CA C 63 61.499 61.499 62.711 -1.212 25767 16027 1 18 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.465 -1.941 25767 16028 1 18 . 1 1 63 63 ILE H H 63 7.732 7.732 7.390 0.342 25767 16029 1 18 . 1 1 64 64 GLY N N 64 107.973 107.973 106.709 1.264 25767 16030 1 18 . 1 1 64 64 GLY C C 64 175.271 175.271 174.787 0.484 25767 16031 1 18 . 1 1 64 64 GLY CA C 64 45.902 45.902 45.718 0.185 25767 16032 1 18 . 1 1 64 64 GLY H H 64 7.661 7.661 7.831 -0.170 25767 16033 1 18 . 1 1 65 65 GLY N N 65 108.464 108.464 107.516 0.948 25767 16034 1 18 . 1 1 65 65 GLY C C 65 174.800 174.800 175.917 -1.117 25767 16035 1 18 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.413 0.233 25767 16036 1 18 . 1 1 65 65 GLY H H 65 7.808 7.808 8.150 -0.342 25767 16037 1 18 . 1 1 66 66 GLU N N 66 121.162 121.162 120.518 0.644 25767 16038 1 18 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.048 0.057 25767 16039 1 18 . 1 1 66 66 GLU C C 66 177.230 177.230 178.772 -1.542 25767 16040 1 18 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.013 -1.789 25767 16041 1 18 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.405 0.587 25767 16042 1 18 . 1 1 66 66 GLU H H 66 8.203 8.203 7.633 0.570 25767 16043 1 18 . 1 1 67 67 SER N N 67 116.468 116.468 115.215 1.253 25767 16044 1 18 . 1 1 67 67 SER HA H 67 4.249 4.249 4.250 -0.001 25767 16045 1 18 . 1 1 67 67 SER C C 67 174.640 174.640 176.473 -1.833 25767 16046 1 18 . 1 1 67 67 SER CA C 67 58.930 58.930 61.239 -2.309 25767 16047 1 18 . 1 1 67 67 SER CB C 67 63.912 63.912 62.852 1.060 25767 16048 1 18 . 1 1 67 67 SER H H 67 8.206 8.206 8.485 -0.279 25767 16049 1 18 . 1 1 68 68 GLU N N 68 122.400 122.400 120.184 2.216 25767 16050 1 18 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.065 0.088 25767 16051 1 18 . 1 1 68 68 GLU C C 68 176.349 176.349 177.397 -1.048 25767 16052 1 18 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.608 -1.785 25767 16053 1 18 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.011 0.970 25767 16054 1 18 . 1 1 68 68 GLU H H 68 8.168 8.168 8.497 -0.329 25767 16055 1 18 . 1 1 69 69 ALA N N 69 124.342 124.342 120.411 3.931 25767 16056 1 18 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.034 0.154 25767 16057 1 18 . 1 1 69 69 ALA C C 69 178.027 178.027 178.284 -0.257 25767 16058 1 18 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.918 -1.360 25767 16059 1 18 . 1 1 69 69 ALA CB C 69 19.492 19.492 19.002 0.490 25767 16060 1 18 . 1 1 69 69 ALA H H 69 7.939 7.939 7.395 0.544 25767 16061 1 18 . 1 1 70 70 GLU N N 70 121.059 121.059 117.799 3.260 25767 16062 1 18 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.440 -0.326 25767 16063 1 18 . 1 1 70 70 GLU C C 70 176.519 176.519 175.264 1.255 25767 16064 1 18 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.300 2.004 25767 16065 1 18 . 1 1 70 70 GLU CB C 70 29.827 29.827 30.621 -0.794 25767 16066 1 18 . 1 1 70 70 GLU H H 70 8.430 8.430 7.605 0.825 25767 16067 1 18 . 1 1 71 71 ASP N N 71 120.274 120.274 122.902 -2.628 25767 16068 1 18 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.341 0.191 25767 16069 1 18 . 1 1 71 71 ASP C C 71 176.369 176.369 176.996 -0.627 25767 16070 1 18 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.325 -1.074 25767 16071 1 18 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.711 1.129 25767 16072 1 18 . 1 1 71 71 ASP H H 71 8.305 8.305 9.038 -0.733 25767 16073 1 18 . 1 1 72 72 SER N N 72 116.165 116.165 113.042 3.123 25767 16074 1 18 . 1 1 72 72 SER HA H 72 4.241 4.241 4.211 0.030 25767 16075 1 18 . 1 1 72 72 SER C C 72 174.567 174.567 175.716 -1.149 25767 16076 1 18 . 1 1 72 72 SER CA C 72 59.031 59.031 61.369 -2.338 25767 16077 1 18 . 1 1 72 72 SER CB C 72 64.040 64.040 63.535 0.505 25767 16078 1 18 . 1 1 72 72 SER H H 72 7.964 7.964 8.256 -0.292 25767 16079 1 18 . 1 1 73 73 ASP N N 73 122.440 122.440 123.455 -1.015 25767 16080 1 18 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.289 0.245 25767 16081 1 18 . 1 1 73 73 ASP C C 73 176.882 176.882 178.252 -1.370 25767 16082 1 18 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.316 -2.873 25767 16083 1 18 . 1 1 73 73 ASP CB C 73 41.336 41.336 40.098 1.238 25767 16084 1 18 . 1 1 73 73 ASP H H 73 8.392 8.392 8.813 -0.421 25767 16085 1 18 . 1 1 74 74 LYS N N 74 123.270 123.270 120.053 3.217 25767 16086 1 18 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.197 -0.104 25767 16087 1 18 . 1 1 74 74 LYS C C 74 177.608 177.608 179.009 -1.401 25767 16088 1 18 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.667 -2.202 25767 16089 1 18 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.398 -0.251 25767 16090 1 18 . 1 1 74 74 LYS H H 74 8.317 8.317 8.195 0.122 25767 16091 1 18 . 1 1 75 75 SER N N 75 116.557 116.557 116.247 0.310 25767 16092 1 18 . 1 1 75 75 SER HA H 75 4.197 4.197 4.208 -0.011 25767 16093 1 18 . 1 1 75 75 SER C C 75 175.988 175.988 176.644 -0.656 25767 16094 1 18 . 1 1 75 75 SER CA C 75 60.434 60.434 61.922 -1.488 25767 16095 1 18 . 1 1 75 75 SER CB C 75 63.172 63.172 62.782 0.390 25767 16096 1 18 . 1 1 75 75 SER H H 75 8.387 8.387 7.849 0.538 25767 16097 1 18 . 1 1 76 76 LEU N N 76 123.910 123.910 122.159 1.751 25767 16098 1 18 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.924 0.246 25767 16099 1 18 . 1 1 76 76 LEU C C 76 178.083 178.083 179.003 -0.920 25767 16100 1 18 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.834 -1.342 25767 16101 1 18 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.383 0.314 25767 16102 1 18 . 1 1 76 76 LEU H H 76 8.059 8.059 7.936 0.123 25767 16103 1 18 . 1 1 77 77 HIS N N 77 120.620 120.620 118.849 1.771 25767 16104 1 18 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.339 -0.051 25767 16105 1 18 . 1 1 77 77 HIS C C 77 177.667 177.667 178.316 -0.649 25767 16106 1 18 . 1 1 77 77 HIS CA C 77 58.422 58.422 59.206 -0.784 25767 16107 1 18 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.375 0.889 25767 16108 1 18 . 1 1 77 77 HIS H H 77 7.936 7.936 7.946 -0.010 25767 16109 1 18 . 1 1 78 78 VAL N N 78 121.774 121.774 120.262 1.512 25767 16110 1 18 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.757 -0.080 25767 16111 1 18 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.147 -0.541 25767 16112 1 18 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.190 0.674 25767 16113 1 18 . 1 1 78 78 VAL H H 78 7.916 7.916 7.985 -0.069 25767 16114 1 18 . 1 1 79 79 MET N N 79 119.660 119.660 118.510 1.150 25767 16115 1 18 . 1 1 79 79 MET HA H 79 3.925 3.925 4.016 -0.091 25767 16116 1 18 . 1 1 79 79 MET C C 79 177.077 177.077 178.637 -1.560 25767 16117 1 18 . 1 1 79 79 MET CA C 79 58.862 58.862 59.810 -0.948 25767 16118 1 18 . 1 1 79 79 MET CB C 79 32.852 32.852 32.207 0.645 25767 16119 1 18 . 1 1 79 79 MET H H 79 8.149 8.149 8.120 0.029 25767 16120 1 18 . 1 1 80 80 ASN N N 80 117.337 117.337 118.068 -0.731 25767 16121 1 18 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.887 -0.749 25767 16122 1 18 . 1 1 80 80 ASN C C 80 178.133 178.133 178.261 -0.128 25767 16123 1 18 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.685 0.354 25767 16124 1 18 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.707 0.289 25767 16125 1 18 . 1 1 80 80 ASN H H 80 8.202 8.202 8.796 -0.594 25767 16126 1 18 . 1 1 81 81 THR N N 81 115.517 115.517 118.427 -2.910 25767 16127 1 18 . 1 1 81 81 THR HA H 81 3.896 3.896 4.078 -0.182 25767 16128 1 18 . 1 1 81 81 THR C C 81 175.186 175.186 176.088 -0.902 25767 16129 1 18 . 1 1 81 81 THR CA C 81 66.221 66.221 67.654 -1.433 25767 16130 1 18 . 1 1 81 81 THR CB C 81 69.087 69.087 69.049 0.038 25767 16131 1 18 . 1 1 81 81 THR H H 81 7.944 7.944 8.137 -0.193 25767 16132 1 18 . 1 1 82 82 LEU N N 82 119.074 119.074 120.265 -1.191 25767 16133 1 18 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.075 -0.094 25767 16134 1 18 . 1 1 82 82 LEU C C 82 177.583 177.583 177.884 -0.301 25767 16135 1 18 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.321 -0.781 25767 16136 1 18 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.868 -0.075 25767 16137 1 18 . 1 1 82 82 LEU H H 82 7.547 7.547 7.764 -0.217 25767 16138 1 18 . 1 1 83 83 ILE N N 83 118.085 118.085 115.369 2.716 25767 16139 1 18 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.473 0.370 25767 16140 1 18 . 1 1 83 83 ILE C C 83 176.413 176.413 176.912 -0.499 25767 16141 1 18 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.177 -0.450 25767 16142 1 18 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.176 -0.478 25767 16143 1 18 . 1 1 83 83 ILE H H 83 7.409 7.409 7.636 -0.227 25767 16144 1 18 . 1 1 84 84 HIS N N 84 116.152 116.152 114.293 1.859 25767 16145 1 18 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.479 0.116 25767 16146 1 18 . 1 1 84 84 HIS C C 84 175.707 175.707 175.084 0.623 25767 16147 1 18 . 1 1 84 84 HIS CA C 84 58.628 58.628 57.450 1.178 25767 16148 1 18 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.953 0.450 25767 16149 1 18 . 1 1 84 84 HIS H H 84 7.194 7.194 7.747 -0.553 25767 16150 1 18 . 1 1 85 85 ASP N N 85 122.322 122.322 120.309 2.013 25767 16151 1 18 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.780 -0.246 25767 16152 1 18 . 1 1 85 85 ASP C C 85 175.580 175.580 176.431 -0.851 25767 16153 1 18 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.036 0.309 25767 16154 1 18 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.321 -0.203 25767 16155 1 18 . 1 1 85 85 ASP H H 85 8.505 8.505 7.937 0.568 25767 16156 1 18 . 1 1 86 86 GLN N N 86 122.783 122.783 127.032 -4.249 25767 16157 1 18 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.064 -0.101 25767 16158 1 18 . 1 1 86 86 GLN C C 86 178.581 178.581 177.919 0.662 25767 16159 1 18 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.377 -1.423 25767 16160 1 18 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.166 -0.272 25767 16161 1 18 . 1 1 86 86 GLN H H 86 8.803 8.803 8.708 0.095 25767 16162 1 18 . 1 1 87 87 GLU N N 87 121.794 121.794 119.112 2.682 25767 16163 1 18 . 1 1 87 87 GLU HA H 87 4.013 4.013 4.298 -0.285 25767 16164 1 18 . 1 1 87 87 GLU C C 87 178.290 178.290 178.902 -0.612 25767 16165 1 18 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.671 -0.633 25767 16166 1 18 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.457 -0.477 25767 16167 1 18 . 1 1 87 87 GLU H H 87 8.072 8.072 8.506 -0.434 25767 16168 1 18 . 1 1 88 88 LYS N N 88 119.345 119.345 119.576 -0.231 25767 16169 1 18 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.106 -0.351 25767 16170 1 18 . 1 1 88 88 LYS C C 88 180.040 180.040 178.927 1.113 25767 16171 1 18 . 1 1 88 88 LYS CA C 88 59.411 59.411 59.133 0.278 25767 16172 1 18 . 1 1 88 88 LYS CB C 88 32.007 32.007 32.351 -0.344 25767 16173 1 18 . 1 1 88 88 LYS H H 88 7.588 7.588 7.841 -0.253 25767 16174 1 18 . 1 1 89 89 ALA N N 89 123.933 123.933 122.486 1.447 25767 16175 1 18 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.231 -0.492 25767 16176 1 18 . 1 1 89 89 ALA C C 89 177.457 177.457 179.662 -2.205 25767 16177 1 18 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.164 0.806 25767 16178 1 18 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.286 0.370 25767 16179 1 18 . 1 1 89 89 ALA H H 89 8.500 8.500 7.881 0.619 25767 16180 1 18 . 1 1 90 90 LYS N N 90 119.244 119.244 120.320 -1.076 25767 16181 1 18 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.979 0.065 25767 16182 1 18 . 1 1 90 90 LYS C C 90 177.774 177.774 178.782 -1.008 25767 16183 1 18 . 1 1 90 90 LYS CA C 90 59.078 59.078 58.794 0.284 25767 16184 1 18 . 1 1 90 90 LYS CB C 90 30.241 30.241 31.942 -1.701 25767 16185 1 18 . 1 1 90 90 LYS H H 90 6.845 6.845 8.314 -1.469 25767 16186 1 18 . 1 1 91 91 ILE N N 91 117.718 117.718 117.147 0.571 25767 16187 1 18 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.729 -0.331 25767 16188 1 18 . 1 1 91 91 ILE C C 91 177.670 177.670 177.534 0.136 25767 16189 1 18 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.587 -0.589 25767 16190 1 18 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.267 0.534 25767 16191 1 18 . 1 1 91 91 ILE H H 91 7.293 7.293 7.799 -0.506 25767 16192 1 18 . 1 1 92 92 TYR N N 92 121.868 121.868 121.643 0.225 25767 16193 1 18 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.057 0.066 25767 16194 1 18 . 1 1 92 92 TYR C C 92 178.781 178.781 177.573 1.208 25767 16195 1 18 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.459 -0.817 25767 16196 1 18 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.880 0.341 25767 16197 1 18 . 1 1 92 92 TYR H H 92 8.016 8.016 8.263 -0.247 25767 16198 1 18 . 1 1 93 93 MET N N 93 118.984 118.984 117.646 1.338 25767 16199 1 18 . 1 1 93 93 MET HA H 93 3.952 3.952 4.073 -0.121 25767 16200 1 18 . 1 1 93 93 MET C C 93 179.925 179.925 178.202 1.723 25767 16201 1 18 . 1 1 93 93 MET CA C 93 57.589 57.589 59.142 -1.553 25767 16202 1 18 . 1 1 93 93 MET CB C 93 30.752 30.752 32.553 -1.801 25767 16203 1 18 . 1 1 93 93 MET H H 93 8.464 8.464 8.798 -0.334 25767 16204 1 18 . 1 1 94 94 LEU N N 94 125.441 125.441 121.932 3.509 25767 16205 1 18 . 1 1 94 94 LEU HA H 94 3.870 3.870 3.962 -0.092 25767 16206 1 18 . 1 1 94 94 LEU C C 94 177.937 177.937 178.556 -0.619 25767 16207 1 18 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.097 0.664 25767 16208 1 18 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.496 0.266 25767 16209 1 18 . 1 1 94 94 LEU H H 94 8.927 8.927 8.137 0.790 25767 16210 1 18 . 1 1 95 95 ASN N N 95 119.066 119.066 118.102 0.964 25767 16211 1 18 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.329 -0.067 25767 16212 1 18 . 1 1 95 95 ASN CA C 95 56.273 56.273 55.970 0.303 25767 16213 1 18 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.058 -0.453 25767 16214 1 18 . 1 1 95 95 ASN H H 95 8.691 8.691 8.083 0.608 25767 16215 1 18 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.356 0.309 25767 16216 1 18 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.462 0.608 25767 16217 1 18 . 1 1 96 96 PHE H H 96 8.317 8.317 7.961 0.356 25767 16218 1 18 . 1 1 97 97 THR N N 97 118.178 118.178 115.088 3.090 25767 16219 1 18 . 1 1 97 97 THR HA H 97 3.338 3.338 4.043 -0.705 25767 16220 1 18 . 1 1 97 97 THR C C 97 176.074 176.074 177.207 -1.133 25767 16221 1 18 . 1 1 97 97 THR CA C 97 67.986 67.986 66.010 1.976 25767 16222 1 18 . 1 1 97 97 THR H H 97 8.214 8.214 8.698 -0.484 25767 16223 1 18 . 1 1 98 98 MET N N 98 120.097 120.097 121.730 -1.633 25767 16224 1 18 . 1 1 98 98 MET HA H 98 4.403 4.403 4.154 0.249 25767 16225 1 18 . 1 1 98 98 MET C C 98 178.696 178.696 178.482 0.214 25767 16226 1 18 . 1 1 98 98 MET CA C 98 57.029 57.029 57.267 -0.238 25767 16227 1 18 . 1 1 98 98 MET CB C 98 29.898 29.898 31.325 -1.427 25767 16228 1 18 . 1 1 98 98 MET H H 98 8.885 8.885 8.600 0.285 25767 16229 1 18 . 1 1 99 99 SER N N 99 114.959 114.959 116.107 -1.148 25767 16230 1 18 . 1 1 99 99 SER HA H 99 4.199 4.199 4.162 0.037 25767 16231 1 18 . 1 1 99 99 SER C C 99 176.565 176.565 176.765 -0.200 25767 16232 1 18 . 1 1 99 99 SER CA C 99 61.965 61.965 60.960 1.005 25767 16233 1 18 . 1 1 99 99 SER CB C 99 62.565 62.565 63.251 -0.686 25767 16234 1 18 . 1 1 99 99 SER H H 99 7.515 7.515 8.300 -0.785 25767 16235 1 18 . 1 1 100 100 LEU N N 100 125.380 125.380 124.595 0.785 25767 16236 1 18 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.865 -0.089 25767 16237 1 18 . 1 1 100 100 LEU C C 100 177.689 177.689 177.976 -0.287 25767 16238 1 18 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.515 0.542 25767 16239 1 18 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.430 0.120 25767 16240 1 18 . 1 1 100 100 LEU H H 100 7.400 7.400 8.323 -0.923 25767 16241 1 18 . 1 1 101 101 TYR N N 101 120.597 120.597 119.642 0.955 25767 16242 1 18 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.934 0.182 25767 16243 1 18 . 1 1 101 101 TYR C C 101 176.825 176.825 177.324 -0.499 25767 16244 1 18 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.520 -0.632 25767 16245 1 18 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.269 0.724 25767 16246 1 18 . 1 1 101 101 TYR H H 101 8.880 8.880 8.695 0.185 25767 16247 1 18 . 1 1 102 102 ASN N N 102 116.869 116.869 117.176 -0.307 25767 16248 1 18 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.278 -0.112 25767 16249 1 18 . 1 1 102 102 ASN C C 102 179.089 179.089 177.410 1.679 25767 16250 1 18 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.362 -0.150 25767 16251 1 18 . 1 1 102 102 ASN CB C 102 37.734 37.734 38.005 -0.271 25767 16252 1 18 . 1 1 102 102 ASN H H 102 8.543 8.543 7.993 0.550 25767 16253 1 18 . 1 1 103 103 GLU N N 103 121.259 121.259 120.164 1.095 25767 16254 1 18 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.935 0.051 25767 16255 1 18 . 1 1 103 103 GLU C C 103 179.968 179.968 178.901 1.067 25767 16256 1 18 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.626 -0.109 25767 16257 1 18 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.618 -0.068 25767 16258 1 18 . 1 1 103 103 GLU H H 103 7.872 7.872 7.830 0.042 25767 16259 1 18 . 1 1 104 104 LYS N N 104 120.268 120.268 119.275 0.993 25767 16260 1 18 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.119 -0.073 25767 16261 1 18 . 1 1 104 104 LYS C C 104 178.355 178.355 179.044 -0.689 25767 16262 1 18 . 1 1 104 104 LYS CA C 104 56.735 56.735 58.902 -2.167 25767 16263 1 18 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.225 -3.112 25767 16264 1 18 . 1 1 104 104 LYS H H 104 8.384 8.384 7.890 0.494 25767 16265 1 18 . 1 1 105 105 LEU N N 105 121.622 121.622 121.162 0.460 25767 16266 1 18 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.698 0.043 25767 16267 1 18 . 1 1 105 105 LEU C C 105 180.552 180.552 177.802 2.750 25767 16268 1 18 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.271 -0.099 25767 16269 1 18 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.590 -0.560 25767 16270 1 18 . 1 1 105 105 LEU H H 105 8.400 8.400 8.210 0.190 25767 16271 1 18 . 1 1 106 106 LYS N N 106 119.498 119.498 117.929 1.569 25767 16272 1 18 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.825 0.089 25767 16273 1 18 . 1 1 106 106 LYS C C 106 178.419 178.419 178.909 -0.490 25767 16274 1 18 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.930 -0.547 25767 16275 1 18 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.993 -0.185 25767 16276 1 18 . 1 1 106 106 LYS H H 106 7.067 7.067 7.631 -0.564 25767 16277 1 18 . 1 1 107 107 GLN N N 107 121.405 121.405 118.885 2.520 25767 16278 1 18 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.997 -0.146 25767 16279 1 18 . 1 1 107 107 GLN C C 107 177.935 177.935 179.014 -1.079 25767 16280 1 18 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.615 -0.134 25767 16281 1 18 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.425 -1.627 25767 16282 1 18 . 1 1 107 107 GLN H H 107 7.460 7.460 7.544 -0.084 25767 16283 1 18 . 1 1 108 108 LEU N N 108 119.561 119.561 119.384 0.177 25767 16284 1 18 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.361 0.440 25767 16285 1 18 . 1 1 108 108 LEU C C 108 179.195 179.195 178.814 0.381 25767 16286 1 18 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.463 0.930 25767 16287 1 18 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.196 0.070 25767 16288 1 18 . 1 1 108 108 LEU H H 108 8.208 8.208 7.960 0.248 25767 16289 1 18 . 1 1 109 109 LYS N N 109 118.535 118.535 117.926 0.609 25767 16290 1 18 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.283 -0.031 25767 16291 1 18 . 1 1 109 109 LYS C C 109 177.726 177.726 178.179 -0.453 25767 16292 1 18 . 1 1 109 109 LYS CA C 109 58.730 58.730 59.005 -0.275 25767 16293 1 18 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.806 -0.397 25767 16294 1 18 . 1 1 109 109 LYS H H 109 7.168 7.168 7.517 -0.349 25767 16295 1 18 . 1 1 110 110 ASP N N 110 117.463 117.463 116.369 1.094 25767 16296 1 18 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.800 -0.195 25767 16297 1 18 . 1 1 110 110 ASP C C 110 177.360 177.360 176.587 0.773 25767 16298 1 18 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.584 1.312 25767 16299 1 18 . 1 1 110 110 ASP CB C 110 42.577 42.577 42.218 0.359 25767 16300 1 18 . 1 1 110 110 ASP H H 110 7.861 7.861 8.446 -0.585 25767 16301 1 18 . 1 1 111 111 GLY N N 111 113.059 113.059 109.039 4.020 25767 16302 1 18 . 1 1 111 111 GLY CA C 111 42.052 42.052 43.080 -1.028 25767 16303 1 18 . 1 1 111 111 GLY H H 111 8.479 8.479 7.757 0.722 25767 16304 1 18 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.428 0.035 25767 16305 1 18 . 1 1 112 112 PRO C C 112 175.090 175.090 175.728 -0.638 25767 16306 1 18 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.208 -0.844 25767 16307 1 18 . 1 1 112 112 PRO CB C 112 34.850 34.850 33.069 1.781 25767 16308 1 18 . 1 1 113 113 TRP N N 113 123.164 123.164 121.817 1.347 25767 16309 1 18 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.635 0.075 25767 16310 1 18 . 1 1 113 113 TRP C C 113 174.605 174.605 175.787 -1.182 25767 16311 1 18 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.367 0.538 25767 16312 1 18 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.593 -3.300 25767 16313 1 18 . 1 1 113 113 TRP H H 113 8.687 8.687 8.521 0.166 25767 16314 1 18 . 1 1 114 114 ASP N N 114 121.356 121.356 123.341 -1.985 25767 16315 1 18 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.813 0.048 25767 16316 1 18 . 1 1 114 114 ASP CA C 114 52.249 52.249 53.011 -0.762 25767 16317 1 18 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.398 -1.257 25767 16318 1 18 . 1 1 114 114 ASP H H 114 6.985 6.985 8.200 -1.215 25767 16319 1 18 . 1 1 115 115 VAL N N 115 118.649 118.649 118.991 -0.342 25767 16320 1 18 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.710 0.132 25767 16321 1 18 . 1 1 115 115 VAL C C 115 177.739 177.739 177.329 0.410 25767 16322 1 18 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.743 -0.174 25767 16323 1 18 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.074 -0.397 25767 16324 1 18 . 1 1 115 115 VAL H H 115 8.206 8.206 8.344 -0.138 25767 16325 1 18 . 1 1 116 116 MET N N 116 120.401 120.401 118.226 2.175 25767 16326 1 18 . 1 1 116 116 MET HA H 116 4.303 4.303 4.116 0.187 25767 16327 1 18 . 1 1 116 116 MET C C 116 179.269 179.269 178.143 1.126 25767 16328 1 18 . 1 1 116 116 MET CA C 116 57.634 57.634 59.133 -1.499 25767 16329 1 18 . 1 1 116 116 MET CB C 116 30.414 30.414 31.861 -1.447 25767 16330 1 18 . 1 1 116 116 MET H H 116 7.642 7.642 8.021 -0.379 25767 16331 1 18 . 1 1 117 117 LEU N N 117 125.503 125.503 119.344 6.159 25767 16332 1 18 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.022 0.223 25767 16333 1 18 . 1 1 117 117 LEU C C 117 178.445 178.445 179.568 -1.123 25767 16334 1 18 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.327 0.873 25767 16335 1 18 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.229 -1.140 25767 16336 1 18 . 1 1 117 117 LEU H H 117 8.157 8.157 7.515 0.642 25767 16337 1 18 . 1 1 118 118 LYS N N 118 119.052 119.052 119.837 -0.785 25767 16338 1 18 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.955 -0.150 25767 16339 1 18 . 1 1 118 118 LYS C C 118 178.251 178.251 179.223 -0.972 25767 16340 1 18 . 1 1 118 118 LYS CA C 118 60.526 60.526 59.966 0.560 25767 16341 1 18 . 1 1 118 118 LYS CB C 118 32.128 32.128 31.655 0.473 25767 16342 1 18 . 1 1 118 118 LYS H H 118 7.400 7.400 7.773 -0.373 25767 16343 1 18 . 1 1 119 119 ARG N N 119 117.999 117.999 118.487 -0.488 25767 16344 1 18 . 1 1 119 119 ARG HA H 119 4.220 4.220 3.946 0.274 25767 16345 1 18 . 1 1 119 119 ARG C C 119 180.441 180.441 178.881 1.560 25767 16346 1 18 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.763 0.054 25767 16347 1 18 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.263 -0.178 25767 16348 1 18 . 1 1 119 119 ARG H H 119 8.265 8.265 7.913 0.352 25767 16349 1 18 . 1 1 120 120 SER N N 120 118.073 118.073 115.952 2.121 25767 16350 1 18 . 1 1 120 120 SER HA H 120 4.182 4.182 4.350 -0.168 25767 16351 1 18 . 1 1 120 120 SER C C 120 176.215 176.215 176.906 -0.691 25767 16352 1 18 . 1 1 120 120 SER CA C 120 62.817 62.817 61.400 1.417 25767 16353 1 18 . 1 1 120 120 SER CB C 120 63.550 63.550 63.634 -0.084 25767 16354 1 18 . 1 1 120 120 SER H H 120 8.633 8.633 7.918 0.715 25767 16355 1 18 . 1 1 121 121 LEU N N 121 125.029 125.029 124.521 0.508 25767 16356 1 18 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.279 -0.060 25767 16357 1 18 . 1 1 121 121 LEU C C 121 179.679 179.679 178.017 1.662 25767 16358 1 18 . 1 1 121 121 LEU CA C 121 58.849 58.849 57.834 1.015 25767 16359 1 18 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.937 -1.163 25767 16360 1 18 . 1 1 121 121 LEU H H 121 8.313 8.313 8.767 -0.454 25767 16361 1 18 . 1 1 122 122 TRP N N 122 120.217 120.217 119.187 1.030 25767 16362 1 18 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.297 0.043 25767 16363 1 18 . 1 1 122 122 TRP C C 122 177.527 177.527 178.411 -0.884 25767 16364 1 18 . 1 1 122 122 TRP CA C 122 61.758 61.758 60.329 1.429 25767 16365 1 18 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.571 0.077 25767 16366 1 18 . 1 1 122 122 TRP H H 122 7.928 7.928 8.580 -0.652 25767 16367 1 18 . 1 1 123 123 CYS N N 123 119.669 119.669 117.627 2.042 25767 16368 1 18 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.210 -0.003 25767 16369 1 18 . 1 1 123 123 CYS C C 123 177.057 177.057 177.390 -0.333 25767 16370 1 18 . 1 1 123 123 CYS CA C 123 62.600 62.600 62.911 -0.311 25767 16371 1 18 . 1 1 123 123 CYS CB C 123 25.899 25.899 25.860 0.039 25767 16372 1 18 . 1 1 123 123 CYS H H 123 8.273 8.273 8.247 0.026 25767 16373 1 18 . 1 1 124 124 CYS N N 124 116.898 116.898 120.375 -3.477 25767 16374 1 18 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.093 -0.245 25767 16375 1 18 . 1 1 124 124 CYS C C 124 175.759 175.759 176.849 -1.090 25767 16376 1 18 . 1 1 124 124 CYS CA C 124 65.653 65.653 65.084 0.569 25767 16377 1 18 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.544 -0.027 25767 16378 1 18 . 1 1 124 124 CYS H H 124 8.122 8.122 8.135 -0.013 25767 16379 1 18 . 1 1 125 125 ILE N N 125 120.498 120.498 120.916 -0.418 25767 16380 1 18 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.626 -0.038 25767 16381 1 18 . 1 1 125 125 ILE C C 125 179.337 179.337 177.539 1.798 25767 16382 1 18 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.720 1.874 25767 16383 1 18 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.391 0.288 25767 16384 1 18 . 1 1 125 125 ILE H H 125 8.092 8.092 7.762 0.330 25767 16385 1 18 . 1 1 126 126 ASP N N 126 125.084 125.084 120.725 4.359 25767 16386 1 18 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.505 0.112 25767 16387 1 18 . 1 1 126 126 ASP C C 126 178.299 178.299 179.032 -0.733 25767 16388 1 18 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.043 1.961 25767 16389 1 18 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.373 -0.077 25767 16390 1 18 . 1 1 126 126 ASP H H 126 9.049 9.049 7.952 1.097 25767 16391 1 18 . 1 1 127 127 LEU N N 127 122.591 122.591 121.365 1.226 25767 16392 1 18 . 1 1 127 127 LEU HA H 127 3.867 3.867 4.011 -0.144 25767 16393 1 18 . 1 1 127 127 LEU C C 127 179.655 179.655 178.204 1.451 25767 16394 1 18 . 1 1 127 127 LEU CA C 127 58.661 58.661 58.163 0.499 25767 16395 1 18 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.959 0.235 25767 16396 1 18 . 1 1 127 127 LEU H H 127 8.888 8.888 8.381 0.507 25767 16397 1 18 . 1 1 128 128 PHE N N 128 117.498 117.498 119.123 -1.625 25767 16398 1 18 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.125 0.197 25767 16399 1 18 . 1 1 128 128 PHE C C 128 178.533 178.533 176.745 1.788 25767 16400 1 18 . 1 1 128 128 PHE CA C 128 60.932 60.932 61.751 -0.819 25767 16401 1 18 . 1 1 128 128 PHE CB C 128 39.053 39.053 39.192 -0.139 25767 16402 1 18 . 1 1 128 128 PHE H H 128 8.947 8.947 8.398 0.549 25767 16403 1 18 . 1 1 129 129 SER N N 129 115.398 115.398 115.880 -0.482 25767 16404 1 18 . 1 1 129 129 SER HA H 129 4.046 4.046 4.253 -0.207 25767 16405 1 18 . 1 1 129 129 SER C C 129 175.168 175.168 176.597 -1.429 25767 16406 1 18 . 1 1 129 129 SER CA C 129 63.015 63.015 62.192 0.823 25767 16407 1 18 . 1 1 129 129 SER H H 129 8.578 8.578 8.680 -0.102 25767 16408 1 18 . 1 1 130 130 CYS N N 130 125.556 125.556 121.751 3.805 25767 16409 1 18 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.190 -0.081 25767 16410 1 18 . 1 1 130 130 CYS C C 130 175.294 175.294 176.839 -1.545 25767 16411 1 18 . 1 1 130 130 CYS CA C 130 61.438 61.438 64.501 -3.063 25767 16412 1 18 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.675 -0.625 25767 16413 1 18 . 1 1 130 130 CYS H H 130 8.289 8.289 8.043 0.246 25767 16414 1 18 . 1 1 131 131 ILE N N 131 120.232 120.232 121.175 -0.943 25767 16415 1 18 . 1 1 131 131 ILE HA H 131 4.033 4.033 3.782 0.251 25767 16416 1 18 . 1 1 131 131 ILE C C 131 177.297 177.297 178.256 -0.959 25767 16417 1 18 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.703 -1.051 25767 16418 1 18 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.652 1.450 25767 16419 1 18 . 1 1 131 131 ILE H H 131 7.943 7.943 7.658 0.285 25767 16420 1 18 . 1 1 132 132 LEU N N 132 116.422 116.422 119.388 -2.966 25767 16421 1 18 . 1 1 132 132 LEU HA H 132 3.845 3.845 3.850 -0.005 25767 16422 1 18 . 1 1 132 132 LEU C C 132 177.816 177.816 179.013 -1.197 25767 16423 1 18 . 1 1 132 132 LEU CA C 132 57.078 57.078 57.995 -0.917 25767 16424 1 18 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.378 0.835 25767 16425 1 18 . 1 1 132 132 LEU H H 132 7.846 7.846 7.708 0.138 25767 16426 1 18 . 1 1 133 133 HIS N N 133 116.929 116.929 119.163 -2.234 25767 16427 1 18 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.228 -0.089 25767 16428 1 18 . 1 1 133 133 HIS C C 133 178.669 178.669 177.692 0.977 25767 16429 1 18 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.908 -0.172 25767 16430 1 18 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.154 2.998 25767 16431 1 18 . 1 1 133 133 HIS H H 133 7.822 7.822 7.884 -0.062 25767 16432 1 18 . 1 1 134 134 LEU N N 134 116.898 116.898 120.004 -3.106 25767 16433 1 18 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.125 -0.392 25767 16434 1 18 . 1 1 134 134 LEU C C 134 179.402 179.402 178.813 0.589 25767 16435 1 18 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.857 -0.630 25767 16436 1 18 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.245 -2.706 25767 16437 1 18 . 1 1 134 134 LEU H H 134 8.688 8.688 7.885 0.803 25767 16438 1 18 . 1 1 135 135 TRP N N 135 115.602 115.602 117.837 -2.235 25767 16439 1 18 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.616 0.392 25767 16440 1 18 . 1 1 135 135 TRP C C 135 175.022 175.022 178.136 -3.114 25767 16441 1 18 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.634 0.792 25767 16442 1 18 . 1 1 135 135 TRP CB C 135 27.085 27.085 29.032 -1.947 25767 16443 1 18 . 1 1 135 135 TRP H H 135 7.638 7.638 8.237 -0.599 25767 16444 1 18 . 1 1 136 136 LYS N N 136 119.721 119.721 122.957 -3.236 25767 16445 1 18 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.948 -0.132 25767 16446 1 18 . 1 1 136 136 LYS C C 136 178.279 178.279 178.357 -0.078 25767 16447 1 18 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.719 0.474 25767 16448 1 18 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.860 1.197 25767 16449 1 18 . 1 1 136 136 LYS H H 136 6.538 6.538 8.445 -1.907 25767 16450 1 18 . 1 1 137 137 GLU N N 137 115.407 115.407 115.690 -0.283 25767 16451 1 18 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.134 0.033 25767 16452 1 18 . 1 1 137 137 GLU C C 137 176.700 176.700 177.293 -0.593 25767 16453 1 18 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.431 -0.582 25767 16454 1 18 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.045 0.115 25767 16455 1 18 . 1 1 137 137 GLU H H 137 8.596 8.596 8.287 0.309 25767 16456 1 18 . 1 1 138 138 ASN N N 138 116.669 116.669 116.328 0.341 25767 16457 1 18 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.783 0.123 25767 16458 1 18 . 1 1 138 138 ASN C C 138 173.481 173.481 174.930 -1.449 25767 16459 1 18 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.708 -0.894 25767 16460 1 18 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.418 1.419 25767 16461 1 18 . 1 1 138 138 ASN H H 138 8.343 8.343 8.177 0.166 25767 16462 1 18 . 1 1 139 139 ILE N N 139 120.703 120.703 120.129 0.574 25767 16463 1 18 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.250 0.094 25767 16464 1 18 . 1 1 139 139 ILE C C 139 175.241 175.241 175.679 -0.438 25767 16465 1 18 . 1 1 139 139 ILE CA C 139 60.792 60.792 58.872 1.920 25767 16466 1 18 . 1 1 139 139 ILE CB C 139 40.274 40.274 38.201 2.073 25767 16467 1 18 . 1 1 139 139 ILE H H 139 7.167 7.167 7.479 -0.312 25767 16468 1 18 . 1 1 140 140 SER N N 140 123.284 123.284 119.796 3.488 25767 16469 1 18 . 1 1 140 140 SER HA H 140 4.345 4.345 4.493 -0.148 25767 16470 1 18 . 1 1 140 140 SER CA C 140 58.095 58.095 57.020 1.075 25767 16471 1 18 . 1 1 140 140 SER CB C 140 65.370 65.370 64.946 0.424 25767 16472 1 18 . 1 1 140 140 SER H H 140 8.727 8.727 8.496 0.231 25767 16473 1 18 . 1 1 142 142 THR N N 142 113.868 113.868 115.515 -1.647 25767 16474 1 18 . 1 1 142 142 THR HA H 142 3.976 3.976 4.123 -0.147 25767 16475 1 18 . 1 1 142 142 THR C C 142 177.559 177.559 176.490 1.069 25767 16476 1 18 . 1 1 142 142 THR CA C 142 66.007 66.007 66.481 -0.474 25767 16477 1 18 . 1 1 142 142 THR CB C 142 68.530 68.530 68.625 -0.095 25767 16478 1 18 . 1 1 142 142 THR H H 142 8.243 8.243 7.707 0.536 25767 16479 1 18 . 1 1 143 143 SER N N 143 120.786 120.786 116.614 4.172 25767 16480 1 18 . 1 1 143 143 SER C C 143 175.844 175.844 176.561 -0.717 25767 16481 1 18 . 1 1 143 143 SER CA C 143 62.102 62.102 61.426 0.676 25767 16482 1 18 . 1 1 143 143 SER CB C 143 63.086 63.086 62.986 0.100 25767 16483 1 18 . 1 1 143 143 SER H H 143 7.915 7.915 8.121 -0.206 25767 16484 1 18 . 1 1 144 144 THR N N 144 120.946 120.946 116.977 3.969 25767 16485 1 18 . 1 1 144 144 THR HA H 144 4.299 4.299 4.068 0.231 25767 16486 1 18 . 1 1 144 144 THR C C 144 175.874 175.874 176.460 -0.586 25767 16487 1 18 . 1 1 144 144 THR CA C 144 67.487 67.487 66.042 1.445 25767 16488 1 18 . 1 1 144 144 THR CB C 144 68.485 68.485 68.683 -0.198 25767 16489 1 18 . 1 1 144 144 THR H H 144 8.746 8.746 8.593 0.153 25767 16490 1 18 . 1 1 145 145 ASN N N 145 120.069 120.069 119.782 0.287 25767 16491 1 18 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.426 -0.118 25767 16492 1 18 . 1 1 145 145 ASN C C 145 177.917 177.917 177.771 0.146 25767 16493 1 18 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.691 -0.354 25767 16494 1 18 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.610 -0.510 25767 16495 1 18 . 1 1 145 145 ASN H H 145 7.940 7.940 7.979 -0.039 25767 16496 1 18 . 1 1 146 146 SER N N 146 116.905 116.905 116.478 0.427 25767 16497 1 18 . 1 1 146 146 SER HA H 146 3.936 3.936 4.116 -0.180 25767 16498 1 18 . 1 1 146 146 SER C C 146 176.963 176.963 176.688 0.275 25767 16499 1 18 . 1 1 146 146 SER CA C 146 61.997 61.997 62.326 -0.329 25767 16500 1 18 . 1 1 146 146 SER CB C 146 62.879 62.879 63.176 -0.297 25767 16501 1 18 . 1 1 146 146 SER H H 146 7.951 7.951 7.777 0.174 25767 16502 1 18 . 1 1 147 147 LEU N N 147 123.253 123.253 121.656 1.597 25767 16503 1 18 . 1 1 147 147 LEU HA H 147 3.875 3.875 3.904 -0.029 25767 16504 1 18 . 1 1 147 147 LEU C C 147 178.726 178.726 178.774 -0.048 25767 16505 1 18 . 1 1 147 147 LEU CA C 147 58.580 58.580 58.009 0.571 25767 16506 1 18 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.457 -0.597 25767 16507 1 18 . 1 1 147 147 LEU H H 147 8.168 8.168 7.638 0.530 25767 16508 1 18 . 1 1 148 148 GLN N N 148 118.212 118.212 117.928 0.284 25767 16509 1 18 . 1 1 148 148 GLN HA H 148 3.817 3.817 3.988 -0.171 25767 16510 1 18 . 1 1 148 148 GLN C C 148 179.686 179.686 178.437 1.249 25767 16511 1 18 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.518 0.725 25767 16512 1 18 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.788 -0.068 25767 16513 1 18 . 1 1 148 148 GLN H H 148 8.295 8.295 8.585 -0.290 25767 16514 1 18 . 1 1 149 149 LYS N N 149 120.770 120.770 120.582 0.188 25767 16515 1 18 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.941 -0.040 25767 16516 1 18 . 1 1 149 149 LYS C C 149 178.006 178.006 178.775 -0.769 25767 16517 1 18 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.651 -0.119 25767 16518 1 18 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.130 -0.238 25767 16519 1 18 . 1 1 149 149 LYS H H 149 7.955 7.955 8.031 -0.076 25767 16520 1 18 . 1 1 150 150 ARG N N 150 119.244 119.244 119.945 -0.701 25767 16521 1 18 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.967 -0.127 25767 16522 1 18 . 1 1 150 150 ARG C C 150 178.858 178.858 178.646 0.212 25767 16523 1 18 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.267 0.104 25767 16524 1 18 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.932 -1.128 25767 16525 1 18 . 1 1 150 150 ARG H H 150 7.020 7.020 7.535 -0.515 25767 16526 1 18 . 1 1 151 151 ILE N N 151 121.183 121.183 119.118 2.065 25767 16527 1 18 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.713 -0.354 25767 16528 1 18 . 1 1 151 151 ILE C C 151 177.327 177.327 177.691 -0.364 25767 16529 1 18 . 1 1 151 151 ILE CA C 151 67.196 67.196 62.680 4.516 25767 16530 1 18 . 1 1 151 151 ILE CB C 151 38.272 38.272 36.551 1.721 25767 16531 1 18 . 1 1 151 151 ILE H H 151 7.574 7.574 7.643 -0.069 25767 16532 1 18 . 1 1 152 152 LYS N N 152 119.521 119.521 121.373 -1.852 25767 16533 1 18 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.884 -0.111 25767 16534 1 18 . 1 1 152 152 LYS C C 152 178.016 178.016 178.922 -0.906 25767 16535 1 18 . 1 1 152 152 LYS CA C 152 59.830 59.830 60.096 -0.266 25767 16536 1 18 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.252 -0.671 25767 16537 1 18 . 1 1 152 152 LYS H H 152 7.629 7.629 8.118 -0.489 25767 16538 1 18 . 1 1 153 153 TYR N N 153 120.178 120.178 120.386 -0.208 25767 16539 1 18 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.133 -0.061 25767 16540 1 18 . 1 1 153 153 TYR C C 153 178.195 178.195 178.085 0.110 25767 16541 1 18 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.736 -0.420 25767 16542 1 18 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.541 -1.268 25767 16543 1 18 . 1 1 153 153 TYR H H 153 8.407 8.407 7.951 0.456 25767 16544 1 18 . 1 1 154 154 CYS N N 154 117.013 117.013 118.045 -1.032 25767 16545 1 18 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.226 -0.154 25767 16546 1 18 . 1 1 154 154 CYS C C 154 176.827 176.827 177.094 -0.267 25767 16547 1 18 . 1 1 154 154 CYS CA C 154 65.780 65.780 63.195 2.585 25767 16548 1 18 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.988 0.172 25767 16549 1 18 . 1 1 154 154 CYS H H 154 8.291 8.291 7.844 0.447 25767 16550 1 18 . 1 1 155 155 LYS N N 155 118.753 118.753 121.009 -2.256 25767 16551 1 18 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.930 -0.259 25767 16552 1 18 . 1 1 155 155 LYS C C 155 179.904 179.904 178.646 1.258 25767 16553 1 18 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.426 1.058 25767 16554 1 18 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.279 -0.336 25767 16555 1 18 . 1 1 155 155 LYS H H 155 7.934 7.934 8.466 -0.532 25767 16556 1 18 . 1 1 156 156 ILE N N 156 123.873 123.873 119.823 4.050 25767 16557 1 18 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.603 -0.019 25767 16558 1 18 . 1 1 156 156 ILE C C 156 179.501 179.501 177.372 2.129 25767 16559 1 18 . 1 1 156 156 ILE CA C 156 65.240 65.240 64.930 0.310 25767 16560 1 18 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.839 -0.197 25767 16561 1 18 . 1 1 156 156 ILE H H 156 8.314 8.314 8.593 -0.279 25767 16562 1 18 . 1 1 157 157 TYR N N 157 121.132 121.132 119.668 1.464 25767 16563 1 18 . 1 1 157 157 TYR HA H 157 4.165 4.165 4.091 0.074 25767 16564 1 18 . 1 1 157 157 TYR C C 157 178.558 178.558 177.773 0.785 25767 16565 1 18 . 1 1 157 157 TYR CA C 157 62.110 62.110 60.735 1.375 25767 16566 1 18 . 1 1 157 157 TYR H H 157 8.442 8.442 7.462 0.980 25767 16567 1 18 . 1 1 158 158 LEU N N 158 120.964 120.964 119.449 1.515 25767 16568 1 18 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.918 -0.006 25767 16569 1 18 . 1 1 158 158 LEU C C 158 180.130 180.130 179.212 0.918 25767 16570 1 18 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.910 0.776 25767 16571 1 18 . 1 1 158 158 LEU CB C 158 41.730 41.730 40.645 1.085 25767 16572 1 18 . 1 1 158 158 LEU H H 158 8.469 8.469 7.657 0.812 25767 16573 1 18 . 1 1 159 159 SER N N 159 116.653 116.653 114.880 1.773 25767 16574 1 18 . 1 1 159 159 SER HA H 159 4.246 4.246 4.053 0.193 25767 16575 1 18 . 1 1 159 159 SER CA C 159 61.460 61.460 61.827 -0.367 25767 16576 1 18 . 1 1 159 159 SER CB C 159 62.849 62.849 62.785 0.064 25767 16577 1 18 . 1 1 159 159 SER H H 159 7.758 7.758 8.133 -0.375 25767 16578 1 18 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.376 -2.003 25767 16579 1 18 . 1 1 160 160 LYS CB C 160 29.832 29.832 32.384 -2.552 25767 16580 1 18 . 1 1 160 160 LYS H H 160 8.425 8.425 7.542 0.883 25767 16581 1 18 . 1 1 161 161 LEU N N 161 121.686 121.686 119.010 2.676 25767 16582 1 18 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.912 0.251 25767 16583 1 18 . 1 1 161 161 LEU C C 161 180.224 180.224 179.217 1.007 25767 16584 1 18 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.455 0.129 25767 16585 1 18 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.571 -0.109 25767 16586 1 18 . 1 1 161 161 LEU H H 161 8.323 8.323 7.762 0.561 25767 16587 1 18 . 1 1 162 162 ALA N N 162 123.102 123.102 120.651 2.451 25767 16588 1 18 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.098 0.032 25767 16589 1 18 . 1 1 162 162 ALA C C 162 179.487 179.487 178.886 0.601 25767 16590 1 18 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.656 0.088 25767 16591 1 18 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.439 -0.036 25767 16592 1 18 . 1 1 162 162 ALA H H 162 7.978 7.978 7.648 0.330 25767 16593 1 18 . 1 1 163 163 LYS N N 163 116.069 116.069 117.672 -1.603 25767 16594 1 18 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.252 -0.029 25767 16595 1 18 . 1 1 163 163 LYS C C 163 176.987 176.987 176.525 0.462 25767 16596 1 18 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.410 0.196 25767 16597 1 18 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.987 0.219 25767 16598 1 18 . 1 1 163 163 LYS H H 163 7.697 7.697 7.781 -0.084 25767 16599 1 18 . 1 1 164 164 GLY N N 164 108.540 108.540 106.210 2.330 25767 16600 1 18 . 1 1 164 164 GLY C C 164 174.721 174.721 174.315 0.406 25767 16601 1 18 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.959 0.833 25767 16602 1 18 . 1 1 164 164 GLY H H 164 7.772 7.772 7.421 0.351 25767 16603 1 18 . 1 1 165 165 GLU N N 165 119.886 119.886 120.304 -0.418 25767 16604 1 18 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.498 -0.448 25767 16605 1 18 . 1 1 165 165 GLU C C 165 176.027 176.027 175.239 0.788 25767 16606 1 18 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.109 1.744 25767 16607 1 18 . 1 1 165 165 GLU CB C 165 30.338 30.338 31.143 -0.805 25767 16608 1 18 . 1 1 165 165 GLU H H 165 8.065 8.065 7.922 0.143 25767 16609 1 18 . 1 1 166 166 ILE N N 166 117.926 117.926 120.589 -2.663 25767 16610 1 18 . 1 1 166 166 ILE HA H 166 3.902 3.902 4.340 -0.438 25767 16611 1 18 . 1 1 166 166 ILE C C 166 174.138 174.138 176.882 -2.744 25767 16612 1 18 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.760 1.695 25767 16613 1 18 . 1 1 166 166 ILE CB C 166 40.202 40.202 39.004 1.198 25767 16614 1 18 . 1 1 166 166 ILE H H 166 7.282 7.282 8.320 -1.038 25767 16615 1 19 . 1 1 2 2 ALA N N 2 122.811 122.811 123.834 -1.023 25767 16616 1 19 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.054 -0.031 25767 16617 1 19 . 1 1 2 2 ALA C C 2 179.915 179.915 179.398 0.517 25767 16618 1 19 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.585 -0.468 25767 16619 1 19 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.843 -0.304 25767 16620 1 19 . 1 1 2 2 ALA H H 2 8.509 8.509 8.806 -0.297 25767 16621 1 19 . 1 1 3 3 SER N N 3 115.308 115.308 114.038 1.270 25767 16622 1 19 . 1 1 3 3 SER HA H 3 4.097 4.097 4.110 -0.013 25767 16623 1 19 . 1 1 3 3 SER C C 3 176.706 176.706 176.202 0.504 25767 16624 1 19 . 1 1 3 3 SER CA C 3 60.665 60.665 61.581 -0.916 25767 16625 1 19 . 1 1 3 3 SER CB C 3 62.710 62.710 62.371 0.339 25767 16626 1 19 . 1 1 3 3 SER H H 3 7.996 7.996 8.612 -0.616 25767 16627 1 19 . 1 1 4 4 ASN N N 4 122.688 122.688 122.087 0.601 25767 16628 1 19 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.488 -0.184 25767 16629 1 19 . 1 1 4 4 ASN C C 4 176.258 176.258 177.021 -0.763 25767 16630 1 19 . 1 1 4 4 ASN CA C 4 55.701 55.701 55.613 0.088 25767 16631 1 19 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.878 0.299 25767 16632 1 19 . 1 1 4 4 ASN H H 4 8.075 8.075 7.894 0.181 25767 16633 1 19 . 1 1 5 5 ALA N N 5 121.900 121.900 122.258 -0.358 25767 16634 1 19 . 1 1 5 5 ALA HA H 5 3.575 3.575 3.984 -0.409 25767 16635 1 19 . 1 1 5 5 ALA C C 5 178.475 178.475 179.052 -0.577 25767 16636 1 19 . 1 1 5 5 ALA CA C 5 55.833 55.833 55.124 0.709 25767 16637 1 19 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.439 -0.824 25767 16638 1 19 . 1 1 5 5 ALA H H 5 8.659 8.659 7.650 1.009 25767 16639 1 19 . 1 1 6 6 ALA N N 6 117.768 117.768 121.547 -3.779 25767 16640 1 19 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.991 -0.204 25767 16641 1 19 . 1 1 6 6 ALA C C 6 180.494 180.494 179.441 1.053 25767 16642 1 19 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.098 0.252 25767 16643 1 19 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.001 -0.099 25767 16644 1 19 . 1 1 6 6 ALA H H 6 7.864 7.864 7.697 0.167 25767 16645 1 19 . 1 1 7 7 ARG N N 7 121.173 121.173 119.180 1.993 25767 16646 1 19 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.102 -0.199 25767 16647 1 19 . 1 1 7 7 ARG C C 7 179.189 179.189 178.681 0.508 25767 16648 1 19 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.836 0.476 25767 16649 1 19 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.951 -0.729 25767 16650 1 19 . 1 1 7 7 ARG H H 7 7.514 7.514 7.909 -0.395 25767 16651 1 19 . 1 1 8 8 VAL N N 8 122.979 122.979 119.659 3.320 25767 16652 1 19 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.839 -0.586 25767 16653 1 19 . 1 1 8 8 VAL C C 8 177.821 177.821 178.373 -0.552 25767 16654 1 19 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.692 1.080 25767 16655 1 19 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.576 -0.135 25767 16656 1 19 . 1 1 8 8 VAL H H 8 8.101 8.101 7.708 0.393 25767 16657 1 19 . 1 1 9 9 VAL N N 9 119.801 119.801 120.131 -0.330 25767 16658 1 19 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.555 -0.289 25767 16659 1 19 . 1 1 9 9 VAL C C 9 177.373 177.373 177.441 -0.068 25767 16660 1 19 . 1 1 9 9 VAL CA C 9 67.484 67.484 67.267 0.217 25767 16661 1 19 . 1 1 9 9 VAL CB C 9 31.625 31.625 31.304 0.321 25767 16662 1 19 . 1 1 9 9 VAL H H 9 8.362 8.362 7.921 0.441 25767 16663 1 19 . 1 1 10 10 ALA N N 10 122.360 122.360 121.332 1.028 25767 16664 1 19 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.032 -0.096 25767 16665 1 19 . 1 1 10 10 ALA C C 10 180.762 180.762 179.415 1.347 25767 16666 1 19 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.610 -0.166 25767 16667 1 19 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.192 -0.455 25767 16668 1 19 . 1 1 10 10 ALA H H 10 7.776 7.776 7.756 0.020 25767 16669 1 19 . 1 1 11 11 THR N N 11 117.376 117.376 112.447 4.929 25767 16670 1 19 . 1 1 11 11 THR HA H 11 3.816 3.816 3.946 -0.130 25767 16671 1 19 . 1 1 11 11 THR C C 11 175.775 175.775 176.504 -0.729 25767 16672 1 19 . 1 1 11 11 THR CA C 11 66.509 66.509 65.605 0.904 25767 16673 1 19 . 1 1 11 11 THR CB C 11 68.588 68.588 68.780 -0.192 25767 16674 1 19 . 1 1 11 11 THR H H 11 8.180 8.180 7.724 0.456 25767 16675 1 19 . 1 1 12 12 ALA N N 12 125.308 125.308 125.218 0.090 25767 16676 1 19 . 1 1 12 12 ALA HA H 12 3.997 3.997 4.134 -0.137 25767 16677 1 19 . 1 1 12 12 ALA C C 12 179.399 179.399 179.589 -0.190 25767 16678 1 19 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.666 0.410 25767 16679 1 19 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.367 0.877 25767 16680 1 19 . 1 1 12 12 ALA H H 12 8.671 8.671 8.509 0.162 25767 16681 1 19 . 1 1 13 13 LYS N N 13 116.977 116.977 117.680 -0.703 25767 16682 1 19 . 1 1 13 13 LYS C C 13 179.646 179.646 178.693 0.953 25767 16683 1 19 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.890 -0.969 25767 16684 1 19 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.193 -0.750 25767 16685 1 19 . 1 1 13 13 LYS H H 13 8.061 8.061 7.958 0.103 25767 16686 1 19 . 1 1 14 14 ASP N N 14 121.988 121.988 120.310 1.678 25767 16687 1 19 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.370 -0.017 25767 16688 1 19 . 1 1 14 14 ASP C C 14 179.446 179.446 178.475 0.971 25767 16689 1 19 . 1 1 14 14 ASP CA C 14 57.509 57.509 56.852 0.657 25767 16690 1 19 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.340 -0.339 25767 16691 1 19 . 1 1 14 14 ASP H H 14 7.669 7.669 7.609 0.060 25767 16692 1 19 . 1 1 15 15 PHE N N 15 119.588 119.588 118.082 1.506 25767 16693 1 19 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.178 0.166 25767 16694 1 19 . 1 1 15 15 PHE C C 15 178.373 178.373 177.963 0.410 25767 16695 1 19 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.875 0.362 25767 16696 1 19 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.799 -1.303 25767 16697 1 19 . 1 1 15 15 PHE H H 15 7.913 7.913 8.272 -0.359 25767 16698 1 19 . 1 1 16 16 ASP N N 16 121.705 121.705 119.732 1.973 25767 16699 1 19 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.437 -0.442 25767 16700 1 19 . 1 1 16 16 ASP C C 16 180.071 180.071 179.017 1.054 25767 16701 1 19 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.647 0.502 25767 16702 1 19 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.868 0.619 25767 16703 1 19 . 1 1 16 16 ASP H H 16 8.324 8.324 8.106 0.218 25767 16704 1 19 . 1 1 17 17 LYS N N 17 118.825 118.825 119.647 -0.822 25767 16705 1 19 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.094 -0.057 25767 16706 1 19 . 1 1 17 17 LYS C C 17 178.407 178.407 177.878 0.529 25767 16707 1 19 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.961 0.101 25767 16708 1 19 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.608 -0.024 25767 16709 1 19 . 1 1 17 17 LYS H H 17 7.834 7.834 7.789 0.045 25767 16710 1 19 . 1 1 18 18 VAL N N 18 110.562 110.562 117.023 -6.461 25767 16711 1 19 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.081 0.435 25767 16712 1 19 . 1 1 18 18 VAL C C 18 176.144 176.144 176.469 -0.325 25767 16713 1 19 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.286 -2.412 25767 16714 1 19 . 1 1 18 18 VAL CB C 18 31.160 31.160 32.160 -1.000 25767 16715 1 19 . 1 1 18 18 VAL H H 18 7.185 7.185 7.514 -0.330 25767 16716 1 19 . 1 1 19 19 GLY N N 19 109.272 109.272 107.179 2.093 25767 16717 1 19 . 1 1 19 19 GLY C C 19 175.043 175.043 175.085 -0.042 25767 16718 1 19 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.538 0.293 25767 16719 1 19 . 1 1 19 19 GLY H H 19 7.723 7.723 7.800 -0.077 25767 16720 1 19 . 1 1 20 20 LEU N N 20 125.428 125.428 122.718 2.710 25767 16721 1 19 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.689 -0.369 25767 16722 1 19 . 1 1 20 20 LEU C C 20 177.949 177.949 177.203 0.746 25767 16723 1 19 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.299 -0.495 25767 16724 1 19 . 1 1 20 20 LEU CB C 20 39.917 39.917 38.954 0.963 25767 16725 1 19 . 1 1 20 20 LEU H H 20 8.083 8.083 8.308 -0.225 25767 16726 1 19 . 1 1 21 21 GLY N N 21 107.804 107.804 110.067 -2.263 25767 16727 1 19 . 1 1 21 21 GLY C C 21 176.278 176.278 176.219 0.059 25767 16728 1 19 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.798 -0.504 25767 16729 1 19 . 1 1 21 21 GLY H H 21 7.982 7.982 7.857 0.125 25767 16730 1 19 . 1 1 22 22 ILE N N 22 121.319 121.319 122.158 -0.839 25767 16731 1 19 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.820 0.090 25767 16732 1 19 . 1 1 22 22 ILE C C 22 176.604 176.604 177.660 -1.056 25767 16733 1 19 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.957 -2.511 25767 16734 1 19 . 1 1 22 22 ILE CB C 22 35.566 35.566 37.551 -1.985 25767 16735 1 19 . 1 1 22 22 ILE H H 22 8.478 8.478 8.017 0.461 25767 16736 1 19 . 1 1 23 23 ILE N N 23 120.377 120.377 119.501 0.876 25767 16737 1 19 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.616 0.097 25767 16738 1 19 . 1 1 23 23 ILE C C 23 178.581 178.581 178.015 0.566 25767 16739 1 19 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.320 0.926 25767 16740 1 19 . 1 1 23 23 ILE CB C 23 36.199 36.199 35.898 0.301 25767 16741 1 19 . 1 1 23 23 ILE H H 23 6.869 6.869 7.462 -0.593 25767 16742 1 19 . 1 1 24 24 GLY N N 24 103.449 103.449 108.045 -4.596 25767 16743 1 19 . 1 1 24 24 GLY C C 24 175.308 175.308 175.671 -0.363 25767 16744 1 19 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.126 0.817 25767 16745 1 19 . 1 1 24 24 GLY H H 24 7.488 7.488 7.805 -0.317 25767 16746 1 19 . 1 1 25 25 TYR N N 25 124.685 124.685 124.183 0.502 25767 16747 1 19 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.779 -0.113 25767 16748 1 19 . 1 1 25 25 TYR C C 25 176.208 176.208 177.098 -0.890 25767 16749 1 19 . 1 1 25 25 TYR CA C 25 61.371 61.371 60.620 0.751 25767 16750 1 19 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.389 -0.122 25767 16751 1 19 . 1 1 25 25 TYR H H 25 7.931 7.931 8.050 -0.119 25767 16752 1 19 . 1 1 26 26 TYR N N 26 117.001 117.001 119.901 -2.900 25767 16753 1 19 . 1 1 26 26 TYR HA H 26 3.941 3.941 3.948 -0.007 25767 16754 1 19 . 1 1 26 26 TYR C C 26 178.753 178.753 177.430 1.323 25767 16755 1 19 . 1 1 26 26 TYR CA C 26 64.260 64.260 62.005 2.255 25767 16756 1 19 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.678 -1.157 25767 16757 1 19 . 1 1 26 26 TYR H H 26 7.693 7.693 7.940 -0.247 25767 16758 1 19 . 1 1 27 27 LEU N N 27 118.657 118.657 117.109 1.548 25767 16759 1 19 . 1 1 27 27 LEU HA H 27 4.311 4.311 3.957 0.354 25767 16760 1 19 . 1 1 27 27 LEU CA C 27 58.297 58.297 57.939 0.358 25767 16761 1 19 . 1 1 27 27 LEU CB C 27 42.723 42.723 40.816 1.907 25767 16762 1 19 . 1 1 27 27 LEU H H 27 8.339 8.339 7.846 0.493 25767 16763 1 19 . 1 1 28 28 GLN N N 28 118.593 118.593 118.739 -0.146 25767 16764 1 19 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.808 -0.157 25767 16765 1 19 . 1 1 28 28 GLN C C 28 177.282 177.282 178.492 -1.210 25767 16766 1 19 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.999 -0.170 25767 16767 1 19 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.462 1.186 25767 16768 1 19 . 1 1 28 28 GLN H H 28 7.970 7.970 7.500 0.470 25767 16769 1 19 . 1 1 29 29 LEU N N 29 122.111 122.111 119.519 2.592 25767 16770 1 19 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.713 0.231 25767 16771 1 19 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.521 1.145 25767 16772 1 19 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.221 0.787 25767 16773 1 19 . 1 1 29 29 LEU H H 29 7.979 7.979 7.279 0.700 25767 16774 1 19 . 1 1 30 30 TYR N N 30 119.283 119.283 120.195 -0.912 25767 16775 1 19 . 1 1 30 30 TYR C C 30 175.775 175.775 177.222 -1.447 25767 16776 1 19 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.687 -1.593 25767 16777 1 19 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.273 0.800 25767 16778 1 19 . 1 1 30 30 TYR H H 30 8.093 8.093 7.572 0.521 25767 16779 1 19 . 1 1 31 31 ALA N N 31 121.327 121.327 122.604 -1.277 25767 16780 1 19 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.812 -0.444 25767 16781 1 19 . 1 1 31 31 ALA C C 31 178.955 178.955 178.756 0.199 25767 16782 1 19 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.356 0.191 25767 16783 1 19 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.120 -0.157 25767 16784 1 19 . 1 1 31 31 ALA H H 31 8.394 8.394 8.283 0.111 25767 16785 1 19 . 1 1 32 32 VAL N N 32 116.757 116.757 118.377 -1.620 25767 16786 1 19 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.473 -0.213 25767 16787 1 19 . 1 1 32 32 VAL CA C 32 67.662 67.662 66.076 1.586 25767 16788 1 19 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.682 -0.711 25767 16789 1 19 . 1 1 32 32 VAL H H 32 8.020 8.020 7.594 0.426 25767 16790 1 19 . 1 1 33 33 GLU N N 33 118.775 118.775 119.780 -1.005 25767 16791 1 19 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.827 0.162 25767 16792 1 19 . 1 1 33 33 GLU C C 33 179.746 179.746 178.881 0.865 25767 16793 1 19 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.334 0.668 25767 16794 1 19 . 1 1 33 33 GLU H H 33 7.358 7.358 7.614 -0.256 25767 16795 1 19 . 1 1 34 34 LEU N N 34 120.632 120.632 120.801 -0.169 25767 16796 1 19 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.798 -0.149 25767 16797 1 19 . 1 1 34 34 LEU C C 34 180.336 180.336 178.012 2.324 25767 16798 1 19 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.733 -0.058 25767 16799 1 19 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.728 -0.140 25767 16800 1 19 . 1 1 34 34 LEU H H 34 8.390 8.390 7.732 0.658 25767 16801 1 19 . 1 1 35 35 ILE N N 35 121.240 121.240 118.550 2.690 25767 16802 1 19 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.794 -0.252 25767 16803 1 19 . 1 1 35 35 ILE C C 35 178.604 178.604 178.957 -0.353 25767 16804 1 19 . 1 1 35 35 ILE CA C 35 65.547 65.547 64.981 0.565 25767 16805 1 19 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.916 0.815 25767 16806 1 19 . 1 1 35 35 ILE H H 35 8.129 8.129 7.480 0.649 25767 16807 1 19 . 1 1 36 36 LEU N N 36 115.637 115.637 118.930 -3.293 25767 16808 1 19 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.028 -0.020 25767 16809 1 19 . 1 1 36 36 LEU C C 36 178.001 178.001 178.064 -0.063 25767 16810 1 19 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.253 -1.177 25767 16811 1 19 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.364 -1.430 25767 16812 1 19 . 1 1 36 36 LEU H H 36 8.416 8.416 7.824 0.592 25767 16813 1 19 . 1 1 37 37 SER N N 37 114.106 114.106 110.722 3.384 25767 16814 1 19 . 1 1 37 37 SER HA H 37 3.991 3.991 4.363 -0.372 25767 16815 1 19 . 1 1 37 37 SER C C 37 173.997 173.997 174.019 -0.022 25767 16816 1 19 . 1 1 37 37 SER CA C 37 60.311 60.311 58.872 1.439 25767 16817 1 19 . 1 1 37 37 SER CB C 37 63.746 63.746 63.597 0.149 25767 16818 1 19 . 1 1 37 37 SER H H 37 7.517 7.517 7.803 -0.286 25767 16819 1 19 . 1 1 38 38 GLU N N 38 123.003 123.003 121.738 1.265 25767 16820 1 19 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.337 0.032 25767 16821 1 19 . 1 1 38 38 GLU C C 38 175.780 175.780 175.603 0.177 25767 16822 1 19 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.434 -0.069 25767 16823 1 19 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.953 -0.660 25767 16824 1 19 . 1 1 38 38 GLU H H 38 7.151 7.151 7.395 -0.244 25767 16825 1 19 . 1 1 39 39 GLU N N 39 126.166 126.166 122.897 3.269 25767 16826 1 19 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.155 -0.146 25767 16827 1 19 . 1 1 39 39 GLU C C 39 176.652 176.652 175.780 0.872 25767 16828 1 19 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.528 1.670 25767 16829 1 19 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.293 -0.258 25767 16830 1 19 . 1 1 39 39 GLU H H 39 8.587 8.587 8.475 0.112 25767 16831 1 19 . 1 1 40 40 ASP N N 40 120.047 120.047 121.767 -1.720 25767 16832 1 19 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.459 0.091 25767 16833 1 19 . 1 1 40 40 ASP C C 40 175.035 175.035 175.925 -0.890 25767 16834 1 19 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.130 -1.762 25767 16835 1 19 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.669 -0.646 25767 16836 1 19 . 1 1 40 40 ASP H H 40 8.504 8.504 8.535 -0.031 25767 16837 1 19 . 1 1 41 41 ARG N N 41 120.671 120.671 122.623 -1.952 25767 16838 1 19 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.603 -0.214 25767 16839 1 19 . 1 1 41 41 ARG C C 41 175.755 175.755 175.892 -0.137 25767 16840 1 19 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.641 0.367 25767 16841 1 19 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.593 -1.044 25767 16842 1 19 . 1 1 41 41 ARG H H 41 7.672 7.672 8.369 -0.697 25767 16843 1 19 . 1 1 42 42 SER N N 42 120.330 120.330 115.926 4.404 25767 16844 1 19 . 1 1 42 42 SER HA H 42 3.837 3.837 4.399 -0.562 25767 16845 1 19 . 1 1 42 42 SER CA C 42 57.326 57.326 57.948 -0.622 25767 16846 1 19 . 1 1 42 42 SER CB C 42 65.762 65.762 64.188 1.574 25767 16847 1 19 . 1 1 42 42 SER H H 42 8.544 8.544 8.257 0.287 25767 16848 1 19 . 1 1 43 43 GLN HA H 43 3.989 3.989 3.972 0.017 25767 16849 1 19 . 1 1 43 43 GLN C C 43 178.907 178.907 177.860 1.047 25767 16850 1 19 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.585 0.785 25767 16851 1 19 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.489 -0.527 25767 16852 1 19 . 1 1 44 44 GLU N N 44 120.328 120.328 120.145 0.183 25767 16853 1 19 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.922 0.091 25767 16854 1 19 . 1 1 44 44 GLU C C 44 179.824 179.824 178.231 1.593 25767 16855 1 19 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.267 0.778 25767 16856 1 19 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.440 -0.792 25767 16857 1 19 . 1 1 44 44 GLU H H 44 8.938 8.938 7.713 1.225 25767 16858 1 19 . 1 1 45 45 MET N N 45 121.030 121.030 117.563 3.467 25767 16859 1 19 . 1 1 45 45 MET HA H 45 4.412 4.412 4.187 0.225 25767 16860 1 19 . 1 1 45 45 MET C C 45 180.357 180.357 177.852 2.505 25767 16861 1 19 . 1 1 45 45 MET CA C 45 57.209 57.209 59.048 -1.839 25767 16862 1 19 . 1 1 45 45 MET CB C 45 32.436 32.436 32.688 -0.252 25767 16863 1 19 . 1 1 45 45 MET H H 45 7.756 7.756 7.833 -0.077 25767 16864 1 19 . 1 1 46 46 THR N N 46 120.008 120.008 113.408 6.600 25767 16865 1 19 . 1 1 46 46 THR HA H 46 4.071 4.071 3.963 0.108 25767 16866 1 19 . 1 1 46 46 THR CA C 46 67.096 67.096 65.615 1.481 25767 16867 1 19 . 1 1 46 46 THR CB C 46 68.954 68.954 68.570 0.383 25767 16868 1 19 . 1 1 46 46 THR H H 46 8.187 8.187 7.739 0.448 25767 16869 1 19 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.108 0.001 25767 16870 1 19 . 1 1 47 47 ALA C C 47 180.118 180.118 179.352 0.766 25767 16871 1 19 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.836 0.503 25767 16872 1 19 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.381 -0.549 25767 16873 1 19 . 1 1 47 47 ALA H H 47 8.238 8.238 7.741 0.497 25767 16874 1 19 . 1 1 48 48 LEU N N 48 122.093 122.093 119.240 2.853 25767 16875 1 19 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.022 0.241 25767 16876 1 19 . 1 1 48 48 LEU C C 48 179.103 179.103 179.319 -0.216 25767 16877 1 19 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.466 0.274 25767 16878 1 19 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.466 -0.670 25767 16879 1 19 . 1 1 48 48 LEU H H 48 7.778 7.778 7.683 0.095 25767 16880 1 19 . 1 1 49 49 ALA N N 49 120.130 120.130 121.764 -1.634 25767 16881 1 19 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.945 -0.224 25767 16882 1 19 . 1 1 49 49 ALA C C 49 178.676 178.676 179.400 -0.724 25767 16883 1 19 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.391 0.330 25767 16884 1 19 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.019 -0.192 25767 16885 1 19 . 1 1 49 49 ALA H H 49 8.432 8.432 8.060 0.372 25767 16886 1 19 . 1 1 50 50 THR N N 50 113.333 113.333 115.514 -2.181 25767 16887 1 19 . 1 1 50 50 THR HA H 50 3.895 3.895 3.821 0.074 25767 16888 1 19 . 1 1 50 50 THR C C 50 174.948 174.948 176.498 -1.550 25767 16889 1 19 . 1 1 50 50 THR CA C 50 67.334 67.334 67.923 -0.589 25767 16890 1 19 . 1 1 50 50 THR CB C 50 68.864 68.864 68.648 0.216 25767 16891 1 19 . 1 1 50 50 THR H H 50 7.857 7.857 7.765 0.092 25767 16892 1 19 . 1 1 51 51 GLU N N 51 122.698 122.698 122.148 0.550 25767 16893 1 19 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.020 0.048 25767 16894 1 19 . 1 1 51 51 GLU C C 51 179.997 179.997 178.620 1.377 25767 16895 1 19 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.266 0.167 25767 16896 1 19 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.752 -0.235 25767 16897 1 19 . 1 1 51 51 GLU H H 51 7.817 7.817 7.587 0.230 25767 16898 1 19 . 1 1 52 52 LEU N N 52 121.100 121.100 121.322 -0.222 25767 16899 1 19 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.064 0.065 25767 16900 1 19 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.741 0.148 25767 16901 1 19 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.755 0.191 25767 16902 1 19 . 1 1 52 52 LEU H H 52 8.628 8.628 7.961 0.667 25767 16903 1 19 . 1 1 53 53 LEU N N 53 119.935 119.935 119.967 -0.032 25767 16904 1 19 . 1 1 53 53 LEU C C 53 179.671 179.671 178.353 1.318 25767 16905 1 19 . 1 1 53 53 LEU H H 53 8.303 8.303 7.978 0.325 25767 16906 1 19 . 1 1 54 54 ASP N N 54 120.339 120.339 118.664 1.675 25767 16907 1 19 . 1 1 54 54 ASP C C 54 179.106 179.106 178.494 0.612 25767 16908 1 19 . 1 1 54 54 ASP H H 54 7.901 7.901 7.842 0.059 25767 16909 1 19 . 1 1 55 55 THR N N 55 120.237 120.237 116.833 3.404 25767 16910 1 19 . 1 1 55 55 THR HA H 55 3.696 3.696 4.008 -0.312 25767 16911 1 19 . 1 1 55 55 THR CA C 55 67.340 67.340 67.272 0.068 25767 16912 1 19 . 1 1 55 55 THR CB C 55 68.151 68.151 68.737 -0.586 25767 16913 1 19 . 1 1 55 55 THR H H 55 8.262 8.262 7.667 0.595 25767 16914 1 19 . 1 1 56 56 ILE N N 56 123.953 123.953 122.248 1.705 25767 16915 1 19 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.727 0.116 25767 16916 1 19 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.773 0.121 25767 16917 1 19 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.696 0.437 25767 16918 1 19 . 1 1 56 56 ILE H H 56 8.930 8.930 7.771 1.159 25767 16919 1 19 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.420 0.161 25767 16920 1 19 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.154 -0.123 25767 16921 1 19 . 1 1 58 58 ALA C C 58 179.875 179.875 179.462 0.413 25767 16922 1 19 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.835 0.431 25767 16923 1 19 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.378 -0.393 25767 16924 1 19 . 1 1 58 58 ALA H H 58 7.764 7.764 8.386 -0.622 25767 16925 1 19 . 1 1 59 59 PHE N N 59 121.988 121.988 120.146 1.842 25767 16926 1 19 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.197 0.029 25767 16927 1 19 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.201 0.238 25767 16928 1 19 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.326 0.037 25767 16929 1 19 . 1 1 59 59 PHE H H 59 8.159 8.159 8.658 -0.499 25767 16930 1 19 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.813 -0.272 25767 16931 1 19 . 1 1 60 60 LYS C C 60 179.438 179.438 178.979 0.459 25767 16932 1 19 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.525 0.611 25767 16933 1 19 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.416 -0.358 25767 16934 1 19 . 1 1 61 61 LYS N N 61 119.262 119.262 118.174 1.088 25767 16935 1 19 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.187 -0.242 25767 16936 1 19 . 1 1 61 61 LYS C C 61 178.730 178.730 178.475 0.255 25767 16937 1 19 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.580 1.462 25767 16938 1 19 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.089 0.553 25767 16939 1 19 . 1 1 61 61 LYS H H 61 7.832 7.832 8.033 -0.201 25767 16940 1 19 . 1 1 62 62 GLU N N 62 120.790 120.790 120.589 0.201 25767 16941 1 19 . 1 1 62 62 GLU HA H 62 3.935 3.935 3.999 -0.064 25767 16942 1 19 . 1 1 62 62 GLU C C 62 178.424 178.424 178.117 0.307 25767 16943 1 19 . 1 1 62 62 GLU CA C 62 58.714 58.714 59.017 -0.303 25767 16944 1 19 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.263 -0.033 25767 16945 1 19 . 1 1 62 62 GLU H H 62 7.982 7.982 8.129 -0.147 25767 16946 1 19 . 1 1 63 63 ILE N N 63 118.463 118.463 116.582 1.881 25767 16947 1 19 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.784 -0.095 25767 16948 1 19 . 1 1 63 63 ILE C C 63 177.555 177.555 177.243 0.312 25767 16949 1 19 . 1 1 63 63 ILE CA C 63 61.499 61.499 63.047 -1.548 25767 16950 1 19 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.553 -2.029 25767 16951 1 19 . 1 1 63 63 ILE H H 63 7.732 7.732 7.319 0.413 25767 16952 1 19 . 1 1 64 64 GLY N N 64 107.973 107.973 107.187 0.786 25767 16953 1 19 . 1 1 64 64 GLY C C 64 175.271 175.271 175.064 0.207 25767 16954 1 19 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.154 -0.252 25767 16955 1 19 . 1 1 64 64 GLY H H 64 7.661 7.661 7.864 -0.203 25767 16956 1 19 . 1 1 65 65 GLY N N 65 108.464 108.464 107.203 1.261 25767 16957 1 19 . 1 1 65 65 GLY C C 65 174.800 174.800 175.439 -0.639 25767 16958 1 19 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.280 0.366 25767 16959 1 19 . 1 1 65 65 GLY H H 65 7.808 7.808 7.982 -0.174 25767 16960 1 19 . 1 1 66 66 GLU N N 66 121.162 121.162 121.485 -0.323 25767 16961 1 19 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.063 0.042 25767 16962 1 19 . 1 1 66 66 GLU C C 66 177.230 177.230 178.754 -1.524 25767 16963 1 19 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.313 -2.089 25767 16964 1 19 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.652 0.340 25767 16965 1 19 . 1 1 66 66 GLU H H 66 8.203 8.203 7.754 0.449 25767 16966 1 19 . 1 1 67 67 SER N N 67 116.468 116.468 115.971 0.497 25767 16967 1 19 . 1 1 67 67 SER HA H 67 4.249 4.249 4.256 -0.007 25767 16968 1 19 . 1 1 67 67 SER C C 67 174.640 174.640 176.741 -2.101 25767 16969 1 19 . 1 1 67 67 SER CA C 67 58.930 58.930 61.484 -2.554 25767 16970 1 19 . 1 1 67 67 SER CB C 67 63.912 63.912 62.676 1.236 25767 16971 1 19 . 1 1 67 67 SER H H 67 8.206 8.206 8.342 -0.136 25767 16972 1 19 . 1 1 68 68 GLU N N 68 122.400 122.400 120.631 1.769 25767 16973 1 19 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.056 0.097 25767 16974 1 19 . 1 1 68 68 GLU C C 68 176.349 176.349 177.258 -0.909 25767 16975 1 19 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.409 -1.586 25767 16976 1 19 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.190 0.791 25767 16977 1 19 . 1 1 68 68 GLU H H 68 8.168 8.168 8.515 -0.347 25767 16978 1 19 . 1 1 69 69 ALA N N 69 124.342 124.342 120.220 4.122 25767 16979 1 19 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.022 0.166 25767 16980 1 19 . 1 1 69 69 ALA C C 69 178.027 178.027 178.201 -0.174 25767 16981 1 19 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.873 -1.315 25767 16982 1 19 . 1 1 69 69 ALA CB C 69 19.492 19.492 18.924 0.568 25767 16983 1 19 . 1 1 69 69 ALA H H 69 7.939 7.939 7.402 0.537 25767 16984 1 19 . 1 1 70 70 GLU N N 70 121.059 121.059 117.919 3.140 25767 16985 1 19 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.456 -0.342 25767 16986 1 19 . 1 1 70 70 GLU C C 70 176.519 176.519 175.318 1.201 25767 16987 1 19 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.247 2.057 25767 16988 1 19 . 1 1 70 70 GLU CB C 70 29.827 29.827 30.648 -0.821 25767 16989 1 19 . 1 1 70 70 GLU H H 70 8.430 8.430 7.563 0.867 25767 16990 1 19 . 1 1 71 71 ASP N N 71 120.274 120.274 123.017 -2.743 25767 16991 1 19 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.340 0.192 25767 16992 1 19 . 1 1 71 71 ASP C C 71 176.369 176.369 176.965 -0.596 25767 16993 1 19 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.261 -1.010 25767 16994 1 19 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.628 1.212 25767 16995 1 19 . 1 1 71 71 ASP H H 71 8.305 8.305 9.038 -0.733 25767 16996 1 19 . 1 1 72 72 SER N N 72 116.165 116.165 114.028 2.137 25767 16997 1 19 . 1 1 72 72 SER HA H 72 4.241 4.241 4.071 0.170 25767 16998 1 19 . 1 1 72 72 SER C C 72 174.567 174.567 175.954 -1.387 25767 16999 1 19 . 1 1 72 72 SER CA C 72 59.031 59.031 61.621 -2.590 25767 17000 1 19 . 1 1 72 72 SER CB C 72 64.040 64.040 62.999 1.041 25767 17001 1 19 . 1 1 72 72 SER H H 72 7.964 7.964 8.195 -0.231 25767 17002 1 19 . 1 1 73 73 ASP N N 73 122.440 122.440 122.148 0.292 25767 17003 1 19 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.365 0.169 25767 17004 1 19 . 1 1 73 73 ASP C C 73 176.882 176.882 178.496 -1.614 25767 17005 1 19 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.029 -2.586 25767 17006 1 19 . 1 1 73 73 ASP CB C 73 41.336 41.336 40.436 0.900 25767 17007 1 19 . 1 1 73 73 ASP H H 73 8.392 8.392 8.631 -0.239 25767 17008 1 19 . 1 1 74 74 LYS N N 74 123.270 123.270 119.399 3.871 25767 17009 1 19 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.042 0.051 25767 17010 1 19 . 1 1 74 74 LYS C C 74 177.608 177.608 178.763 -1.155 25767 17011 1 19 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.556 -2.091 25767 17012 1 19 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.450 -0.304 25767 17013 1 19 . 1 1 74 74 LYS H H 74 8.317 8.317 7.669 0.648 25767 17014 1 19 . 1 1 75 75 SER N N 75 116.557 116.557 116.296 0.261 25767 17015 1 19 . 1 1 75 75 SER HA H 75 4.197 4.197 4.192 0.005 25767 17016 1 19 . 1 1 75 75 SER C C 75 175.988 175.988 176.935 -0.947 25767 17017 1 19 . 1 1 75 75 SER CA C 75 60.434 60.434 62.441 -2.007 25767 17018 1 19 . 1 1 75 75 SER CB C 75 63.172 63.172 63.065 0.107 25767 17019 1 19 . 1 1 75 75 SER H H 75 8.387 8.387 8.100 0.287 25767 17020 1 19 . 1 1 76 76 LEU N N 76 123.910 123.910 121.894 2.016 25767 17021 1 19 . 1 1 76 76 LEU HA H 76 4.170 4.170 4.032 0.138 25767 17022 1 19 . 1 1 76 76 LEU C C 76 178.083 178.083 178.986 -0.903 25767 17023 1 19 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.921 -1.429 25767 17024 1 19 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.764 -0.067 25767 17025 1 19 . 1 1 76 76 LEU H H 76 8.059 8.059 8.418 -0.359 25767 17026 1 19 . 1 1 77 77 HIS N N 77 120.620 120.620 119.396 1.224 25767 17027 1 19 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.393 -0.105 25767 17028 1 19 . 1 1 77 77 HIS C C 77 177.667 177.667 177.948 -0.281 25767 17029 1 19 . 1 1 77 77 HIS CA C 77 58.422 58.422 59.672 -1.250 25767 17030 1 19 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.873 0.391 25767 17031 1 19 . 1 1 77 77 HIS H H 77 7.936 7.936 8.210 -0.274 25767 17032 1 19 . 1 1 78 78 VAL N N 78 121.774 121.774 119.639 2.135 25767 17033 1 19 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.560 0.117 25767 17034 1 19 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.971 -1.365 25767 17035 1 19 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.611 0.253 25767 17036 1 19 . 1 1 78 78 VAL H H 78 7.916 7.916 8.290 -0.374 25767 17037 1 19 . 1 1 79 79 MET N N 79 119.660 119.660 118.063 1.597 25767 17038 1 19 . 1 1 79 79 MET HA H 79 3.925 3.925 4.093 -0.168 25767 17039 1 19 . 1 1 79 79 MET C C 79 177.077 177.077 178.516 -1.439 25767 17040 1 19 . 1 1 79 79 MET CA C 79 58.862 58.862 57.813 1.048 25767 17041 1 19 . 1 1 79 79 MET CB C 79 32.852 32.852 31.193 1.659 25767 17042 1 19 . 1 1 79 79 MET H H 79 8.149 8.149 8.467 -0.318 25767 17043 1 19 . 1 1 80 80 ASN N N 80 117.337 117.337 118.266 -0.929 25767 17044 1 19 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.800 -0.662 25767 17045 1 19 . 1 1 80 80 ASN C C 80 178.133 178.133 178.525 -0.392 25767 17046 1 19 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.249 0.790 25767 17047 1 19 . 1 1 80 80 ASN CB C 80 38.996 38.996 37.797 1.200 25767 17048 1 19 . 1 1 80 80 ASN H H 80 8.202 8.202 8.629 -0.427 25767 17049 1 19 . 1 1 81 81 THR N N 81 115.517 115.517 118.836 -3.319 25767 17050 1 19 . 1 1 81 81 THR HA H 81 3.896 3.896 4.047 -0.151 25767 17051 1 19 . 1 1 81 81 THR C C 81 175.186 175.186 176.150 -0.964 25767 17052 1 19 . 1 1 81 81 THR CA C 81 66.221 66.221 66.265 -0.044 25767 17053 1 19 . 1 1 81 81 THR CB C 81 69.087 69.087 68.325 0.762 25767 17054 1 19 . 1 1 81 81 THR H H 81 7.944 7.944 7.906 0.038 25767 17055 1 19 . 1 1 82 82 LEU N N 82 119.074 119.074 120.085 -1.011 25767 17056 1 19 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.043 -0.062 25767 17057 1 19 . 1 1 82 82 LEU C C 82 177.583 177.583 178.113 -0.530 25767 17058 1 19 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.214 -0.674 25767 17059 1 19 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.667 0.126 25767 17060 1 19 . 1 1 82 82 LEU H H 82 7.547 7.547 7.522 0.025 25767 17061 1 19 . 1 1 83 83 ILE N N 83 118.085 118.085 116.028 2.057 25767 17062 1 19 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.469 0.374 25767 17063 1 19 . 1 1 83 83 ILE C C 83 176.413 176.413 177.274 -0.861 25767 17064 1 19 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.656 -0.929 25767 17065 1 19 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.144 -0.446 25767 17066 1 19 . 1 1 83 83 ILE H H 83 7.409 7.409 7.520 -0.111 25767 17067 1 19 . 1 1 84 84 HIS N N 84 116.152 116.152 115.746 0.406 25767 17068 1 19 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.309 0.286 25767 17069 1 19 . 1 1 84 84 HIS C C 84 175.707 175.707 175.580 0.127 25767 17070 1 19 . 1 1 84 84 HIS CA C 84 58.628 58.628 58.624 0.004 25767 17071 1 19 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.497 0.906 25767 17072 1 19 . 1 1 84 84 HIS H H 84 7.194 7.194 7.978 -0.784 25767 17073 1 19 . 1 1 85 85 ASP N N 85 122.322 122.322 119.105 3.217 25767 17074 1 19 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.744 -0.210 25767 17075 1 19 . 1 1 85 85 ASP C C 85 175.580 175.580 176.494 -0.914 25767 17076 1 19 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.205 0.140 25767 17077 1 19 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.411 -0.293 25767 17078 1 19 . 1 1 85 85 ASP H H 85 8.505 8.505 7.754 0.751 25767 17079 1 19 . 1 1 86 86 GLN N N 86 122.783 122.783 127.243 -4.460 25767 17080 1 19 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.064 -0.101 25767 17081 1 19 . 1 1 86 86 GLN C C 86 178.581 178.581 177.866 0.715 25767 17082 1 19 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.221 -1.267 25767 17083 1 19 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.228 -0.334 25767 17084 1 19 . 1 1 86 86 GLN H H 86 8.803 8.803 8.798 0.005 25767 17085 1 19 . 1 1 87 87 GLU N N 87 121.794 121.794 119.570 2.224 25767 17086 1 19 . 1 1 87 87 GLU HA H 87 4.013 4.013 3.958 0.055 25767 17087 1 19 . 1 1 87 87 GLU C C 87 178.290 178.290 178.856 -0.566 25767 17088 1 19 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.814 -0.776 25767 17089 1 19 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.216 -0.236 25767 17090 1 19 . 1 1 87 87 GLU H H 87 8.072 8.072 8.313 -0.241 25767 17091 1 19 . 1 1 88 88 LYS N N 88 119.345 119.345 118.268 1.077 25767 17092 1 19 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.081 -0.326 25767 17093 1 19 . 1 1 88 88 LYS C C 88 180.040 180.040 178.789 1.251 25767 17094 1 19 . 1 1 88 88 LYS CA C 88 59.411 59.411 58.785 0.626 25767 17095 1 19 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.713 0.294 25767 17096 1 19 . 1 1 88 88 LYS H H 88 7.588 7.588 7.736 -0.148 25767 17097 1 19 . 1 1 89 89 ALA N N 89 123.933 123.933 122.220 1.713 25767 17098 1 19 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.176 -0.437 25767 17099 1 19 . 1 1 89 89 ALA C C 89 177.457 177.457 179.578 -2.121 25767 17100 1 19 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.143 0.827 25767 17101 1 19 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.188 0.468 25767 17102 1 19 . 1 1 89 89 ALA H H 89 8.500 8.500 7.630 0.870 25767 17103 1 19 . 1 1 90 90 LYS N N 90 119.244 119.244 120.085 -0.841 25767 17104 1 19 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.905 0.139 25767 17105 1 19 . 1 1 90 90 LYS C C 90 177.774 177.774 178.504 -0.730 25767 17106 1 19 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.526 -0.448 25767 17107 1 19 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.317 -2.076 25767 17108 1 19 . 1 1 90 90 LYS H H 90 6.845 6.845 8.130 -1.285 25767 17109 1 19 . 1 1 91 91 ILE N N 91 117.718 117.718 118.475 -0.757 25767 17110 1 19 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.766 -0.368 25767 17111 1 19 . 1 1 91 91 ILE C C 91 177.670 177.670 176.987 0.683 25767 17112 1 19 . 1 1 91 91 ILE CA C 91 63.998 63.998 63.223 0.775 25767 17113 1 19 . 1 1 91 91 ILE CB C 91 37.801 37.801 36.714 1.087 25767 17114 1 19 . 1 1 91 91 ILE H H 91 7.293 7.293 7.659 -0.366 25767 17115 1 19 . 1 1 92 92 TYR N N 92 121.868 121.868 122.880 -1.012 25767 17116 1 19 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.045 0.078 25767 17117 1 19 . 1 1 92 92 TYR C C 92 178.781 178.781 177.743 1.038 25767 17118 1 19 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.710 -1.068 25767 17119 1 19 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.560 0.661 25767 17120 1 19 . 1 1 92 92 TYR H H 92 8.016 8.016 7.989 0.027 25767 17121 1 19 . 1 1 93 93 MET N N 93 118.984 118.984 117.531 1.453 25767 17122 1 19 . 1 1 93 93 MET HA H 93 3.952 3.952 4.021 -0.069 25767 17123 1 19 . 1 1 93 93 MET C C 93 179.925 179.925 178.218 1.707 25767 17124 1 19 . 1 1 93 93 MET CA C 93 57.589 57.589 59.160 -1.571 25767 17125 1 19 . 1 1 93 93 MET CB C 93 30.752 30.752 32.533 -1.781 25767 17126 1 19 . 1 1 93 93 MET H H 93 8.464 8.464 8.763 -0.299 25767 17127 1 19 . 1 1 94 94 LEU N N 94 125.441 125.441 121.927 3.514 25767 17128 1 19 . 1 1 94 94 LEU HA H 94 3.870 3.870 4.022 -0.152 25767 17129 1 19 . 1 1 94 94 LEU C C 94 177.937 177.937 178.664 -0.727 25767 17130 1 19 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.075 0.686 25767 17131 1 19 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.553 0.208 25767 17132 1 19 . 1 1 94 94 LEU H H 94 8.927 8.927 7.955 0.972 25767 17133 1 19 . 1 1 95 95 ASN N N 95 119.066 119.066 117.619 1.447 25767 17134 1 19 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.376 -0.114 25767 17135 1 19 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.029 0.244 25767 17136 1 19 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.091 -0.486 25767 17137 1 19 . 1 1 95 95 ASN H H 95 8.691 8.691 8.317 0.374 25767 17138 1 19 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.358 0.307 25767 17139 1 19 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.324 0.747 25767 17140 1 19 . 1 1 96 96 PHE H H 96 8.317 8.317 8.110 0.207 25767 17141 1 19 . 1 1 97 97 THR N N 97 118.178 118.178 115.092 3.086 25767 17142 1 19 . 1 1 97 97 THR HA H 97 3.338 3.338 3.961 -0.623 25767 17143 1 19 . 1 1 97 97 THR C C 97 176.074 176.074 176.758 -0.684 25767 17144 1 19 . 1 1 97 97 THR CA C 97 67.986 67.986 66.313 1.673 25767 17145 1 19 . 1 1 97 97 THR H H 97 8.214 8.214 8.721 -0.507 25767 17146 1 19 . 1 1 98 98 MET N N 98 120.097 120.097 122.920 -2.823 25767 17147 1 19 . 1 1 98 98 MET HA H 98 4.403 4.403 4.005 0.398 25767 17148 1 19 . 1 1 98 98 MET C C 98 178.696 178.696 177.727 0.969 25767 17149 1 19 . 1 1 98 98 MET CA C 98 57.029 57.029 59.672 -2.643 25767 17150 1 19 . 1 1 98 98 MET CB C 98 29.898 29.898 32.525 -2.627 25767 17151 1 19 . 1 1 98 98 MET H H 98 8.885 8.885 8.277 0.608 25767 17152 1 19 . 1 1 99 99 SER N N 99 114.959 114.959 115.762 -0.803 25767 17153 1 19 . 1 1 99 99 SER HA H 99 4.199 4.199 4.125 0.074 25767 17154 1 19 . 1 1 99 99 SER C C 99 176.565 176.565 176.716 -0.151 25767 17155 1 19 . 1 1 99 99 SER CA C 99 61.965 61.965 61.021 0.944 25767 17156 1 19 . 1 1 99 99 SER CB C 99 62.565 62.565 63.363 -0.798 25767 17157 1 19 . 1 1 99 99 SER H H 99 7.515 7.515 8.134 -0.619 25767 17158 1 19 . 1 1 100 100 LEU N N 100 125.380 125.380 123.767 1.613 25767 17159 1 19 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.810 -0.034 25767 17160 1 19 . 1 1 100 100 LEU C C 100 177.689 177.689 177.933 -0.244 25767 17161 1 19 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.592 0.465 25767 17162 1 19 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.392 0.158 25767 17163 1 19 . 1 1 100 100 LEU H H 100 7.400 7.400 8.385 -0.985 25767 17164 1 19 . 1 1 101 101 TYR N N 101 120.597 120.597 119.614 0.983 25767 17165 1 19 . 1 1 101 101 TYR HA H 101 4.116 4.116 4.015 0.101 25767 17166 1 19 . 1 1 101 101 TYR C C 101 176.825 176.825 177.358 -0.533 25767 17167 1 19 . 1 1 101 101 TYR CA C 101 61.888 61.888 61.873 0.015 25767 17168 1 19 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.273 0.720 25767 17169 1 19 . 1 1 101 101 TYR H H 101 8.880 8.880 8.655 0.225 25767 17170 1 19 . 1 1 102 102 ASN N N 102 116.869 116.869 116.753 0.116 25767 17171 1 19 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.206 -0.040 25767 17172 1 19 . 1 1 102 102 ASN C C 102 179.089 179.089 177.510 1.579 25767 17173 1 19 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.068 0.144 25767 17174 1 19 . 1 1 102 102 ASN CB C 102 37.734 37.734 38.016 -0.282 25767 17175 1 19 . 1 1 102 102 ASN H H 102 8.543 8.543 7.832 0.711 25767 17176 1 19 . 1 1 103 103 GLU N N 103 121.259 121.259 120.218 1.041 25767 17177 1 19 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.948 0.038 25767 17178 1 19 . 1 1 103 103 GLU C C 103 179.968 179.968 178.848 1.120 25767 17179 1 19 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.263 0.254 25767 17180 1 19 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.400 0.150 25767 17181 1 19 . 1 1 103 103 GLU H H 103 7.872 7.872 7.814 0.058 25767 17182 1 19 . 1 1 104 104 LYS N N 104 120.268 120.268 119.430 0.838 25767 17183 1 19 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.138 -0.092 25767 17184 1 19 . 1 1 104 104 LYS C C 104 178.355 178.355 178.889 -0.534 25767 17185 1 19 . 1 1 104 104 LYS CA C 104 56.735 56.735 59.171 -2.436 25767 17186 1 19 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.220 -3.107 25767 17187 1 19 . 1 1 104 104 LYS H H 104 8.384 8.384 7.410 0.974 25767 17188 1 19 . 1 1 105 105 LEU N N 105 121.622 121.622 119.237 2.385 25767 17189 1 19 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.675 0.066 25767 17190 1 19 . 1 1 105 105 LEU C C 105 180.552 180.552 178.566 1.986 25767 17191 1 19 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.152 0.020 25767 17192 1 19 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.254 -0.224 25767 17193 1 19 . 1 1 105 105 LEU H H 105 8.400 8.400 7.559 0.841 25767 17194 1 19 . 1 1 106 106 LYS N N 106 119.498 119.498 118.487 1.011 25767 17195 1 19 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.809 0.105 25767 17196 1 19 . 1 1 106 106 LYS C C 106 178.419 178.419 179.033 -0.614 25767 17197 1 19 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.816 -0.433 25767 17198 1 19 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.964 -0.156 25767 17199 1 19 . 1 1 106 106 LYS H H 106 7.067 7.067 7.616 -0.549 25767 17200 1 19 . 1 1 107 107 GLN N N 107 121.405 121.405 118.410 2.995 25767 17201 1 19 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.892 -0.041 25767 17202 1 19 . 1 1 107 107 GLN C C 107 177.935 177.935 178.720 -0.785 25767 17203 1 19 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.814 -0.333 25767 17204 1 19 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.537 -1.739 25767 17205 1 19 . 1 1 107 107 GLN H H 107 7.460 7.460 7.592 -0.132 25767 17206 1 19 . 1 1 108 108 LEU N N 108 119.561 119.561 119.201 0.360 25767 17207 1 19 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.875 -0.074 25767 17208 1 19 . 1 1 108 108 LEU C C 108 179.195 179.195 178.569 0.626 25767 17209 1 19 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.503 0.890 25767 17210 1 19 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.561 -0.295 25767 17211 1 19 . 1 1 108 108 LEU H H 108 8.208 8.208 7.778 0.430 25767 17212 1 19 . 1 1 109 109 LYS N N 109 118.535 118.535 117.444 1.091 25767 17213 1 19 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.262 -0.010 25767 17214 1 19 . 1 1 109 109 LYS C C 109 177.726 177.726 177.943 -0.217 25767 17215 1 19 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.862 -0.132 25767 17216 1 19 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.912 -0.502 25767 17217 1 19 . 1 1 109 109 LYS H H 109 7.168 7.168 7.502 -0.334 25767 17218 1 19 . 1 1 110 110 ASP N N 110 117.463 117.463 116.286 1.177 25767 17219 1 19 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.692 -0.087 25767 17220 1 19 . 1 1 110 110 ASP C C 110 177.360 177.360 176.491 0.869 25767 17221 1 19 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.432 1.464 25767 17222 1 19 . 1 1 110 110 ASP CB C 110 42.577 42.577 42.124 0.452 25767 17223 1 19 . 1 1 110 110 ASP H H 110 7.861 7.861 8.262 -0.401 25767 17224 1 19 . 1 1 111 111 GLY N N 111 113.059 113.059 108.956 4.103 25767 17225 1 19 . 1 1 111 111 GLY CA C 111 42.052 42.052 43.050 -0.998 25767 17226 1 19 . 1 1 111 111 GLY H H 111 8.479 8.479 7.657 0.822 25767 17227 1 19 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.047 0.416 25767 17228 1 19 . 1 1 112 112 PRO C C 112 175.090 175.090 175.627 -0.537 25767 17229 1 19 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.169 -0.805 25767 17230 1 19 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.701 2.149 25767 17231 1 19 . 1 1 113 113 TRP N N 113 123.164 123.164 121.587 1.577 25767 17232 1 19 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.761 -0.051 25767 17233 1 19 . 1 1 113 113 TRP C C 113 174.605 174.605 175.367 -0.762 25767 17234 1 19 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.117 0.787 25767 17235 1 19 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.406 -3.113 25767 17236 1 19 . 1 1 113 113 TRP H H 113 8.687 8.687 8.380 0.307 25767 17237 1 19 . 1 1 114 114 ASP N N 114 121.356 121.356 122.561 -1.205 25767 17238 1 19 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.924 -0.063 25767 17239 1 19 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.163 0.086 25767 17240 1 19 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.251 -1.110 25767 17241 1 19 . 1 1 114 114 ASP H H 114 6.985 6.985 8.259 -1.274 25767 17242 1 19 . 1 1 115 115 VAL N N 115 118.649 118.649 119.248 -0.599 25767 17243 1 19 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.838 0.004 25767 17244 1 19 . 1 1 115 115 VAL C C 115 177.739 177.739 177.405 0.334 25767 17245 1 19 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.521 0.048 25767 17246 1 19 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.150 -0.473 25767 17247 1 19 . 1 1 115 115 VAL H H 115 8.206 8.206 8.426 -0.220 25767 17248 1 19 . 1 1 116 116 MET N N 116 120.401 120.401 118.172 2.229 25767 17249 1 19 . 1 1 116 116 MET HA H 116 4.303 4.303 4.186 0.117 25767 17250 1 19 . 1 1 116 116 MET C C 116 179.269 179.269 178.280 0.989 25767 17251 1 19 . 1 1 116 116 MET CA C 116 57.634 57.634 58.885 -1.251 25767 17252 1 19 . 1 1 116 116 MET CB C 116 30.414 30.414 32.027 -1.613 25767 17253 1 19 . 1 1 116 116 MET H H 116 7.642 7.642 8.157 -0.515 25767 17254 1 19 . 1 1 117 117 LEU N N 117 125.503 125.503 119.500 6.003 25767 17255 1 19 . 1 1 117 117 LEU HA H 117 4.245 4.245 3.935 0.310 25767 17256 1 19 . 1 1 117 117 LEU C C 117 178.445 178.445 179.055 -0.610 25767 17257 1 19 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.676 0.524 25767 17258 1 19 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.087 -0.998 25767 17259 1 19 . 1 1 117 117 LEU H H 117 8.157 8.157 7.630 0.527 25767 17260 1 19 . 1 1 118 118 LYS N N 118 119.052 119.052 119.425 -0.373 25767 17261 1 19 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.972 -0.167 25767 17262 1 19 . 1 1 118 118 LYS C C 118 178.251 178.251 179.329 -1.078 25767 17263 1 19 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.007 0.519 25767 17264 1 19 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.106 0.022 25767 17265 1 19 . 1 1 118 118 LYS H H 118 7.400 7.400 7.515 -0.115 25767 17266 1 19 . 1 1 119 119 ARG N N 119 117.999 117.999 119.044 -1.045 25767 17267 1 19 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.314 -0.094 25767 17268 1 19 . 1 1 119 119 ARG C C 119 180.441 180.441 178.781 1.660 25767 17269 1 19 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.523 0.294 25767 17270 1 19 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.077 0.008 25767 17271 1 19 . 1 1 119 119 ARG H H 119 8.265 8.265 7.875 0.390 25767 17272 1 19 . 1 1 120 120 SER N N 120 118.073 118.073 115.956 2.117 25767 17273 1 19 . 1 1 120 120 SER HA H 120 4.182 4.182 4.297 -0.115 25767 17274 1 19 . 1 1 120 120 SER C C 120 176.215 176.215 176.721 -0.506 25767 17275 1 19 . 1 1 120 120 SER CA C 120 62.817 62.817 61.674 1.143 25767 17276 1 19 . 1 1 120 120 SER CB C 120 63.550 63.550 62.942 0.608 25767 17277 1 19 . 1 1 120 120 SER H H 120 8.633 8.633 7.803 0.830 25767 17278 1 19 . 1 1 121 121 LEU N N 121 125.029 125.029 121.829 3.200 25767 17279 1 19 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.033 0.186 25767 17280 1 19 . 1 1 121 121 LEU C C 121 179.679 179.679 178.715 0.964 25767 17281 1 19 . 1 1 121 121 LEU CA C 121 58.849 58.849 58.140 0.709 25767 17282 1 19 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.422 -0.648 25767 17283 1 19 . 1 1 121 121 LEU H H 121 8.313 8.313 7.921 0.392 25767 17284 1 19 . 1 1 122 122 TRP N N 122 120.217 120.217 119.370 0.847 25767 17285 1 19 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.342 -0.002 25767 17286 1 19 . 1 1 122 122 TRP C C 122 177.527 177.527 179.122 -1.595 25767 17287 1 19 . 1 1 122 122 TRP CA C 122 61.758 61.758 60.422 1.336 25767 17288 1 19 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.375 0.273 25767 17289 1 19 . 1 1 122 122 TRP H H 122 7.928 7.928 7.991 -0.063 25767 17290 1 19 . 1 1 123 123 CYS N N 123 119.669 119.669 118.785 0.884 25767 17291 1 19 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.106 0.101 25767 17292 1 19 . 1 1 123 123 CYS C C 123 177.057 177.057 176.784 0.273 25767 17293 1 19 . 1 1 123 123 CYS CA C 123 62.600 62.600 61.845 0.755 25767 17294 1 19 . 1 1 123 123 CYS CB C 123 25.899 25.899 26.634 -0.736 25767 17295 1 19 . 1 1 123 123 CYS H H 123 8.273 8.273 8.447 -0.174 25767 17296 1 19 . 1 1 124 124 CYS N N 124 116.898 116.898 121.588 -4.690 25767 17297 1 19 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.139 -0.291 25767 17298 1 19 . 1 1 124 124 CYS C C 124 175.759 175.759 177.318 -1.559 25767 17299 1 19 . 1 1 124 124 CYS CA C 124 65.653 65.653 65.239 0.414 25767 17300 1 19 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.679 -0.162 25767 17301 1 19 . 1 1 124 124 CYS H H 124 8.122 8.122 8.596 -0.474 25767 17302 1 19 . 1 1 125 125 ILE N N 125 120.498 120.498 120.215 0.283 25767 17303 1 19 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.680 -0.092 25767 17304 1 19 . 1 1 125 125 ILE C C 125 179.337 179.337 177.590 1.747 25767 17305 1 19 . 1 1 125 125 ILE CA C 125 67.594 67.594 66.019 1.575 25767 17306 1 19 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.501 0.178 25767 17307 1 19 . 1 1 125 125 ILE H H 125 8.092 8.092 8.596 -0.504 25767 17308 1 19 . 1 1 126 126 ASP N N 126 125.084 125.084 120.112 4.972 25767 17309 1 19 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.442 0.175 25767 17310 1 19 . 1 1 126 126 ASP C C 126 178.299 178.299 178.492 -0.193 25767 17311 1 19 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.071 1.933 25767 17312 1 19 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.794 -0.498 25767 17313 1 19 . 1 1 126 126 ASP H H 126 9.049 9.049 8.022 1.027 25767 17314 1 19 . 1 1 127 127 LEU N N 127 122.591 122.591 120.648 1.943 25767 17315 1 19 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.992 -0.125 25767 17316 1 19 . 1 1 127 127 LEU C C 127 179.655 179.655 177.808 1.847 25767 17317 1 19 . 1 1 127 127 LEU CA C 127 58.661 58.661 57.965 0.696 25767 17318 1 19 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.718 0.476 25767 17319 1 19 . 1 1 127 127 LEU H H 127 8.888 8.888 8.175 0.713 25767 17320 1 19 . 1 1 128 128 PHE N N 128 117.498 117.498 119.243 -1.745 25767 17321 1 19 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.093 0.229 25767 17322 1 19 . 1 1 128 128 PHE C C 128 178.533 178.533 177.157 1.376 25767 17323 1 19 . 1 1 128 128 PHE CA C 128 60.932 60.932 61.875 -0.943 25767 17324 1 19 . 1 1 128 128 PHE CB C 128 39.053 39.053 39.252 -0.199 25767 17325 1 19 . 1 1 128 128 PHE H H 128 8.947 8.947 8.436 0.511 25767 17326 1 19 . 1 1 129 129 SER N N 129 115.398 115.398 115.675 -0.277 25767 17327 1 19 . 1 1 129 129 SER HA H 129 4.046 4.046 4.255 -0.209 25767 17328 1 19 . 1 1 129 129 SER C C 129 175.168 175.168 176.977 -1.809 25767 17329 1 19 . 1 1 129 129 SER CA C 129 63.015 63.015 61.738 1.277 25767 17330 1 19 . 1 1 129 129 SER H H 129 8.578 8.578 8.696 -0.118 25767 17331 1 19 . 1 1 130 130 CYS N N 130 125.556 125.556 120.954 4.602 25767 17332 1 19 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.235 -0.126 25767 17333 1 19 . 1 1 130 130 CYS C C 130 175.294 175.294 177.221 -1.927 25767 17334 1 19 . 1 1 130 130 CYS CA C 130 61.438 61.438 64.597 -3.159 25767 17335 1 19 . 1 1 130 130 CYS CB C 130 27.050 27.050 26.919 0.131 25767 17336 1 19 . 1 1 130 130 CYS H H 130 8.289 8.289 8.662 -0.373 25767 17337 1 19 . 1 1 131 131 ILE N N 131 120.232 120.232 120.747 -0.515 25767 17338 1 19 . 1 1 131 131 ILE HA H 131 4.033 4.033 3.845 0.188 25767 17339 1 19 . 1 1 131 131 ILE C C 131 177.297 177.297 178.623 -1.326 25767 17340 1 19 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.775 -1.123 25767 17341 1 19 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.820 1.282 25767 17342 1 19 . 1 1 131 131 ILE H H 131 7.943 7.943 7.710 0.233 25767 17343 1 19 . 1 1 132 132 LEU N N 132 116.422 116.422 119.234 -2.812 25767 17344 1 19 . 1 1 132 132 LEU HA H 132 3.845 3.845 3.853 -0.008 25767 17345 1 19 . 1 1 132 132 LEU C C 132 177.816 177.816 179.132 -1.316 25767 17346 1 19 . 1 1 132 132 LEU CA C 132 57.078 57.078 57.796 -0.718 25767 17347 1 19 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.322 0.891 25767 17348 1 19 . 1 1 132 132 LEU H H 132 7.846 7.846 7.607 0.239 25767 17349 1 19 . 1 1 133 133 HIS N N 133 116.929 116.929 119.038 -2.109 25767 17350 1 19 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.290 -0.151 25767 17351 1 19 . 1 1 133 133 HIS C C 133 178.669 178.669 178.159 0.510 25767 17352 1 19 . 1 1 133 133 HIS CA C 133 59.736 59.736 60.088 -0.352 25767 17353 1 19 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.400 2.752 25767 17354 1 19 . 1 1 133 133 HIS H H 133 7.822 7.822 8.618 -0.796 25767 17355 1 19 . 1 1 134 134 LEU N N 134 116.898 116.898 121.472 -4.574 25767 17356 1 19 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.191 -0.458 25767 17357 1 19 . 1 1 134 134 LEU C C 134 179.402 179.402 178.595 0.807 25767 17358 1 19 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.926 -0.699 25767 17359 1 19 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.215 -2.676 25767 17360 1 19 . 1 1 134 134 LEU H H 134 8.688 8.688 8.120 0.568 25767 17361 1 19 . 1 1 135 135 TRP N N 135 115.602 115.602 117.969 -2.367 25767 17362 1 19 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.612 0.396 25767 17363 1 19 . 1 1 135 135 TRP C C 135 175.022 175.022 177.977 -2.955 25767 17364 1 19 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.320 1.106 25767 17365 1 19 . 1 1 135 135 TRP CB C 135 27.085 27.085 29.005 -1.920 25767 17366 1 19 . 1 1 135 135 TRP H H 135 7.638 7.638 8.381 -0.743 25767 17367 1 19 . 1 1 136 136 LYS N N 136 119.721 119.721 123.166 -3.445 25767 17368 1 19 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.951 -0.135 25767 17369 1 19 . 1 1 136 136 LYS C C 136 178.279 178.279 178.302 -0.023 25767 17370 1 19 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.607 0.586 25767 17371 1 19 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.799 1.258 25767 17372 1 19 . 1 1 136 136 LYS H H 136 6.538 6.538 8.300 -1.762 25767 17373 1 19 . 1 1 137 137 GLU N N 137 115.407 115.407 115.853 -0.446 25767 17374 1 19 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.137 0.030 25767 17375 1 19 . 1 1 137 137 GLU C C 137 176.700 176.700 177.359 -0.659 25767 17376 1 19 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.495 -0.645 25767 17377 1 19 . 1 1 137 137 GLU CB C 137 29.160 29.160 28.983 0.176 25767 17378 1 19 . 1 1 137 137 GLU H H 137 8.596 8.596 8.173 0.423 25767 17379 1 19 . 1 1 138 138 ASN N N 138 116.669 116.669 116.913 -0.244 25767 17380 1 19 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.804 0.102 25767 17381 1 19 . 1 1 138 138 ASN C C 138 173.481 173.481 175.087 -1.606 25767 17382 1 19 . 1 1 138 138 ASN CA C 138 52.814 52.814 54.171 -1.357 25767 17383 1 19 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.803 1.034 25767 17384 1 19 . 1 1 138 138 ASN H H 138 8.343 8.343 8.140 0.203 25767 17385 1 19 . 1 1 139 139 ILE N N 139 120.703 120.703 119.767 0.936 25767 17386 1 19 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.197 0.147 25767 17387 1 19 . 1 1 139 139 ILE C C 139 175.241 175.241 174.702 0.539 25767 17388 1 19 . 1 1 139 139 ILE CA C 139 60.792 60.792 60.492 0.300 25767 17389 1 19 . 1 1 139 139 ILE CB C 139 40.274 40.274 40.159 0.115 25767 17390 1 19 . 1 1 139 139 ILE H H 139 7.167 7.167 7.552 -0.385 25767 17391 1 19 . 1 1 140 140 SER N N 140 123.284 123.284 118.889 4.395 25767 17392 1 19 . 1 1 140 140 SER HA H 140 4.345 4.345 4.462 -0.117 25767 17393 1 19 . 1 1 140 140 SER CA C 140 58.095 58.095 57.891 0.204 25767 17394 1 19 . 1 1 140 140 SER CB C 140 65.370 65.370 64.473 0.897 25767 17395 1 19 . 1 1 140 140 SER H H 140 8.727 8.727 8.509 0.218 25767 17396 1 19 . 1 1 142 142 THR N N 142 113.868 113.868 116.620 -2.752 25767 17397 1 19 . 1 1 142 142 THR HA H 142 3.976 3.976 4.146 -0.170 25767 17398 1 19 . 1 1 142 142 THR C C 142 177.559 177.559 176.809 0.750 25767 17399 1 19 . 1 1 142 142 THR CA C 142 66.007 66.007 66.571 -0.564 25767 17400 1 19 . 1 1 142 142 THR CB C 142 68.530 68.530 68.603 -0.073 25767 17401 1 19 . 1 1 142 142 THR H H 142 8.243 8.243 7.729 0.514 25767 17402 1 19 . 1 1 143 143 SER N N 143 120.786 120.786 117.846 2.940 25767 17403 1 19 . 1 1 143 143 SER C C 143 175.844 175.844 176.452 -0.608 25767 17404 1 19 . 1 1 143 143 SER CA C 143 62.102 62.102 62.116 -0.014 25767 17405 1 19 . 1 1 143 143 SER CB C 143 63.086 63.086 62.955 0.131 25767 17406 1 19 . 1 1 143 143 SER H H 143 7.915 7.915 8.083 -0.168 25767 17407 1 19 . 1 1 144 144 THR N N 144 120.946 120.946 117.349 3.597 25767 17408 1 19 . 1 1 144 144 THR HA H 144 4.299 4.299 4.036 0.263 25767 17409 1 19 . 1 1 144 144 THR C C 144 175.874 175.874 175.963 -0.089 25767 17410 1 19 . 1 1 144 144 THR CA C 144 67.487 67.487 66.425 1.062 25767 17411 1 19 . 1 1 144 144 THR CB C 144 68.485 68.485 68.916 -0.431 25767 17412 1 19 . 1 1 144 144 THR H H 144 8.746 8.746 8.526 0.220 25767 17413 1 19 . 1 1 145 145 ASN N N 145 120.069 120.069 119.142 0.927 25767 17414 1 19 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.393 -0.085 25767 17415 1 19 . 1 1 145 145 ASN C C 145 177.917 177.917 177.687 0.230 25767 17416 1 19 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.606 -0.269 25767 17417 1 19 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.617 -0.517 25767 17418 1 19 . 1 1 145 145 ASN H H 145 7.940 7.940 8.133 -0.193 25767 17419 1 19 . 1 1 146 146 SER N N 146 116.905 116.905 116.383 0.522 25767 17420 1 19 . 1 1 146 146 SER HA H 146 3.936 3.936 4.188 -0.252 25767 17421 1 19 . 1 1 146 146 SER C C 146 176.963 176.963 176.706 0.257 25767 17422 1 19 . 1 1 146 146 SER CA C 146 61.997 61.997 61.986 0.011 25767 17423 1 19 . 1 1 146 146 SER CB C 146 62.879 62.879 62.790 0.089 25767 17424 1 19 . 1 1 146 146 SER H H 146 7.951 7.951 7.827 0.124 25767 17425 1 19 . 1 1 147 147 LEU N N 147 123.253 123.253 122.130 1.123 25767 17426 1 19 . 1 1 147 147 LEU HA H 147 3.875 3.875 4.002 -0.127 25767 17427 1 19 . 1 1 147 147 LEU C C 147 178.726 178.726 179.187 -0.461 25767 17428 1 19 . 1 1 147 147 LEU CA C 147 58.580 58.580 58.047 0.533 25767 17429 1 19 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.606 -0.746 25767 17430 1 19 . 1 1 147 147 LEU H H 147 8.168 8.168 7.634 0.534 25767 17431 1 19 . 1 1 148 148 GLN N N 148 118.212 118.212 117.332 0.880 25767 17432 1 19 . 1 1 148 148 GLN HA H 148 3.817 3.817 4.053 -0.236 25767 17433 1 19 . 1 1 148 148 GLN C C 148 179.686 179.686 178.158 1.528 25767 17434 1 19 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.239 1.004 25767 17435 1 19 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.721 -0.001 25767 17436 1 19 . 1 1 148 148 GLN H H 148 8.295 8.295 8.740 -0.445 25767 17437 1 19 . 1 1 149 149 LYS N N 149 120.770 120.770 120.736 0.034 25767 17438 1 19 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.947 -0.046 25767 17439 1 19 . 1 1 149 149 LYS C C 149 178.006 178.006 178.901 -0.895 25767 17440 1 19 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.507 0.025 25767 17441 1 19 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.362 -0.470 25767 17442 1 19 . 1 1 149 149 LYS H H 149 7.955 7.955 8.185 -0.230 25767 17443 1 19 . 1 1 150 150 ARG N N 150 119.244 119.244 118.572 0.672 25767 17444 1 19 . 1 1 150 150 ARG HA H 150 3.840 3.840 4.000 -0.160 25767 17445 1 19 . 1 1 150 150 ARG C C 150 178.858 178.858 178.928 -0.070 25767 17446 1 19 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.254 0.117 25767 17447 1 19 . 1 1 150 150 ARG CB C 150 28.804 28.804 30.001 -1.197 25767 17448 1 19 . 1 1 150 150 ARG H H 150 7.020 7.020 7.636 -0.616 25767 17449 1 19 . 1 1 151 151 ILE N N 151 121.183 121.183 120.084 1.099 25767 17450 1 19 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.594 -0.235 25767 17451 1 19 . 1 1 151 151 ILE C C 151 177.327 177.327 177.886 -0.559 25767 17452 1 19 . 1 1 151 151 ILE CA C 151 67.196 67.196 65.017 2.179 25767 17453 1 19 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.594 0.678 25767 17454 1 19 . 1 1 151 151 ILE H H 151 7.574 7.574 7.727 -0.153 25767 17455 1 19 . 1 1 152 152 LYS N N 152 119.521 119.521 120.668 -1.147 25767 17456 1 19 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.832 -0.059 25767 17457 1 19 . 1 1 152 152 LYS C C 152 178.016 178.016 178.345 -0.329 25767 17458 1 19 . 1 1 152 152 LYS CA C 152 59.830 59.830 60.090 -0.260 25767 17459 1 19 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.329 -0.748 25767 17460 1 19 . 1 1 152 152 LYS H H 152 7.629 7.629 8.231 -0.602 25767 17461 1 19 . 1 1 153 153 TYR N N 153 120.178 120.178 120.524 -0.346 25767 17462 1 19 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.135 -0.063 25767 17463 1 19 . 1 1 153 153 TYR C C 153 178.195 178.195 177.874 0.321 25767 17464 1 19 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.862 -0.546 25767 17465 1 19 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.395 -1.122 25767 17466 1 19 . 1 1 153 153 TYR H H 153 8.407 8.407 7.813 0.594 25767 17467 1 19 . 1 1 154 154 CYS N N 154 117.013 117.013 118.338 -1.325 25767 17468 1 19 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.194 -0.122 25767 17469 1 19 . 1 1 154 154 CYS C C 154 176.827 176.827 176.843 -0.016 25767 17470 1 19 . 1 1 154 154 CYS CA C 154 65.780 65.780 63.119 2.661 25767 17471 1 19 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.545 0.615 25767 17472 1 19 . 1 1 154 154 CYS H H 154 8.291 8.291 7.867 0.424 25767 17473 1 19 . 1 1 155 155 LYS N N 155 118.753 118.753 121.107 -2.354 25767 17474 1 19 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.842 -0.171 25767 17475 1 19 . 1 1 155 155 LYS C C 155 179.904 179.904 178.850 1.054 25767 17476 1 19 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.472 1.012 25767 17477 1 19 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.203 -0.260 25767 17478 1 19 . 1 1 155 155 LYS H H 155 7.934 7.934 8.103 -0.169 25767 17479 1 19 . 1 1 156 156 ILE N N 156 123.873 123.873 120.231 3.642 25767 17480 1 19 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.577 0.007 25767 17481 1 19 . 1 1 156 156 ILE C C 156 179.501 179.501 177.646 1.855 25767 17482 1 19 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.596 -0.355 25767 17483 1 19 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.920 -0.278 25767 17484 1 19 . 1 1 156 156 ILE H H 156 8.314 8.314 8.511 -0.197 25767 17485 1 19 . 1 1 157 157 TYR N N 157 121.132 121.132 119.893 1.239 25767 17486 1 19 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.968 0.197 25767 17487 1 19 . 1 1 157 157 TYR C C 157 178.558 178.558 177.393 1.165 25767 17488 1 19 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.864 0.246 25767 17489 1 19 . 1 1 157 157 TYR H H 157 8.442 8.442 7.545 0.897 25767 17490 1 19 . 1 1 158 158 LEU N N 158 120.964 120.964 119.809 1.155 25767 17491 1 19 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.791 0.121 25767 17492 1 19 . 1 1 158 158 LEU C C 158 180.130 180.130 178.657 1.473 25767 17493 1 19 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.675 1.011 25767 17494 1 19 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.641 0.089 25767 17495 1 19 . 1 1 158 158 LEU H H 158 8.469 8.469 7.764 0.705 25767 17496 1 19 . 1 1 159 159 SER N N 159 116.653 116.653 115.096 1.557 25767 17497 1 19 . 1 1 159 159 SER HA H 159 4.246 4.246 4.027 0.219 25767 17498 1 19 . 1 1 159 159 SER CA C 159 61.460 61.460 62.219 -0.759 25767 17499 1 19 . 1 1 159 159 SER CB C 159 62.849 62.849 62.842 0.007 25767 17500 1 19 . 1 1 159 159 SER H H 159 7.758 7.758 8.318 -0.560 25767 17501 1 19 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.315 -1.942 25767 17502 1 19 . 1 1 160 160 LYS CB C 160 29.832 29.832 32.031 -2.199 25767 17503 1 19 . 1 1 160 160 LYS H H 160 8.425 8.425 7.413 1.012 25767 17504 1 19 . 1 1 161 161 LEU N N 161 121.686 121.686 118.894 2.792 25767 17505 1 19 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.834 0.329 25767 17506 1 19 . 1 1 161 161 LEU C C 161 180.224 180.224 178.968 1.256 25767 17507 1 19 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.675 -0.091 25767 17508 1 19 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.414 0.048 25767 17509 1 19 . 1 1 161 161 LEU H H 161 8.323 8.323 7.347 0.976 25767 17510 1 19 . 1 1 162 162 ALA N N 162 123.102 123.102 120.877 2.225 25767 17511 1 19 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.029 0.101 25767 17512 1 19 . 1 1 162 162 ALA C C 162 179.487 179.487 179.054 0.433 25767 17513 1 19 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.716 0.028 25767 17514 1 19 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.359 0.044 25767 17515 1 19 . 1 1 162 162 ALA H H 162 7.978 7.978 7.514 0.464 25767 17516 1 19 . 1 1 163 163 LYS N N 163 116.069 116.069 117.509 -1.440 25767 17517 1 19 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.234 -0.011 25767 17518 1 19 . 1 1 163 163 LYS C C 163 176.987 176.987 176.532 0.455 25767 17519 1 19 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.344 0.262 25767 17520 1 19 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.976 0.230 25767 17521 1 19 . 1 1 163 163 LYS H H 163 7.697 7.697 7.741 -0.044 25767 17522 1 19 . 1 1 164 164 GLY N N 164 108.540 108.540 106.343 2.197 25767 17523 1 19 . 1 1 164 164 GLY C C 164 174.721 174.721 174.272 0.449 25767 17524 1 19 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.956 0.835 25767 17525 1 19 . 1 1 164 164 GLY H H 164 7.772 7.772 7.419 0.353 25767 17526 1 19 . 1 1 165 165 GLU N N 165 119.886 119.886 120.342 -0.456 25767 17527 1 19 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.364 -0.314 25767 17528 1 19 . 1 1 165 165 GLU C C 165 176.027 176.027 175.115 0.912 25767 17529 1 19 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.148 1.705 25767 17530 1 19 . 1 1 165 165 GLU CB C 165 30.338 30.338 30.977 -0.640 25767 17531 1 19 . 1 1 165 165 GLU H H 165 8.065 8.065 7.778 0.287 25767 17532 1 19 . 1 1 166 166 ILE N N 166 117.926 117.926 121.281 -3.355 25767 17533 1 19 . 1 1 166 166 ILE HA H 166 3.902 3.902 4.021 -0.119 25767 17534 1 19 . 1 1 166 166 ILE C C 166 174.138 174.138 176.605 -2.467 25767 17535 1 19 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.624 1.831 25767 17536 1 19 . 1 1 166 166 ILE CB C 166 40.202 40.202 39.299 0.903 25767 17537 1 19 . 1 1 166 166 ILE H H 166 7.282 7.282 8.146 -0.864 25767 17538 1 20 . 1 1 2 2 ALA N N 2 122.811 122.811 123.657 -0.846 25767 17539 1 20 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.045 -0.022 25767 17540 1 20 . 1 1 2 2 ALA C C 2 179.915 179.915 178.967 0.948 25767 17541 1 20 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.631 -0.514 25767 17542 1 20 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.591 -0.052 25767 17543 1 20 . 1 1 2 2 ALA H H 2 8.509 8.509 8.922 -0.413 25767 17544 1 20 . 1 1 3 3 SER N N 3 115.308 115.308 114.160 1.148 25767 17545 1 20 . 1 1 3 3 SER HA H 3 4.097 4.097 4.056 0.041 25767 17546 1 20 . 1 1 3 3 SER C C 3 176.706 176.706 175.850 0.856 25767 17547 1 20 . 1 1 3 3 SER CA C 3 60.665 60.665 62.313 -1.648 25767 17548 1 20 . 1 1 3 3 SER CB C 3 62.710 62.710 62.706 0.004 25767 17549 1 20 . 1 1 3 3 SER H H 3 7.996 7.996 8.577 -0.581 25767 17550 1 20 . 1 1 4 4 ASN N N 4 122.688 122.688 119.597 3.091 25767 17551 1 20 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.439 -0.135 25767 17552 1 20 . 1 1 4 4 ASN C C 4 176.258 176.258 177.286 -1.028 25767 17553 1 20 . 1 1 4 4 ASN CA C 4 55.701 55.701 56.028 -0.327 25767 17554 1 20 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.929 0.248 25767 17555 1 20 . 1 1 4 4 ASN H H 4 8.075 8.075 8.255 -0.180 25767 17556 1 20 . 1 1 5 5 ALA N N 5 121.900 121.900 121.927 -0.027 25767 17557 1 20 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.116 -0.541 25767 17558 1 20 . 1 1 5 5 ALA C C 5 178.475 178.475 179.380 -0.905 25767 17559 1 20 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.944 0.889 25767 17560 1 20 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.188 -0.573 25767 17561 1 20 . 1 1 5 5 ALA H H 5 8.659 8.659 7.703 0.956 25767 17562 1 20 . 1 1 6 6 ALA N N 6 117.768 117.768 121.852 -4.084 25767 17563 1 20 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.970 -0.183 25767 17564 1 20 . 1 1 6 6 ALA C C 6 180.494 180.494 179.452 1.042 25767 17565 1 20 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.116 0.234 25767 17566 1 20 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.212 -0.310 25767 17567 1 20 . 1 1 6 6 ALA H H 6 7.864 7.864 8.093 -0.229 25767 17568 1 20 . 1 1 7 7 ARG N N 7 121.173 121.173 119.074 2.099 25767 17569 1 20 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.101 -0.198 25767 17570 1 20 . 1 1 7 7 ARG C C 7 179.189 179.189 178.598 0.591 25767 17571 1 20 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.348 0.964 25767 17572 1 20 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.611 -0.389 25767 17573 1 20 . 1 1 7 7 ARG H H 7 7.514 7.514 7.933 -0.419 25767 17574 1 20 . 1 1 8 8 VAL N N 8 122.979 122.979 119.610 3.369 25767 17575 1 20 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.723 -0.470 25767 17576 1 20 . 1 1 8 8 VAL C C 8 177.821 177.821 178.113 -0.292 25767 17577 1 20 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.874 0.898 25767 17578 1 20 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.395 0.046 25767 17579 1 20 . 1 1 8 8 VAL H H 8 8.101 8.101 7.700 0.401 25767 17580 1 20 . 1 1 9 9 VAL N N 9 119.801 119.801 120.123 -0.322 25767 17581 1 20 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.531 -0.265 25767 17582 1 20 . 1 1 9 9 VAL C C 9 177.373 177.373 177.362 0.011 25767 17583 1 20 . 1 1 9 9 VAL CA C 9 67.484 67.484 67.114 0.370 25767 17584 1 20 . 1 1 9 9 VAL CB C 9 31.625 31.625 31.272 0.353 25767 17585 1 20 . 1 1 9 9 VAL H H 9 8.362 8.362 8.266 0.096 25767 17586 1 20 . 1 1 10 10 ALA N N 10 122.360 122.360 121.451 0.909 25767 17587 1 20 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.004 -0.068 25767 17588 1 20 . 1 1 10 10 ALA C C 10 180.762 180.762 179.440 1.322 25767 17589 1 20 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.624 -0.180 25767 17590 1 20 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.070 -0.334 25767 17591 1 20 . 1 1 10 10 ALA H H 10 7.776 7.776 7.802 -0.026 25767 17592 1 20 . 1 1 11 11 THR N N 11 117.376 117.376 111.656 5.720 25767 17593 1 20 . 1 1 11 11 THR HA H 11 3.816 3.816 4.079 -0.263 25767 17594 1 20 . 1 1 11 11 THR C C 11 175.775 175.775 176.509 -0.734 25767 17595 1 20 . 1 1 11 11 THR CA C 11 66.509 66.509 65.732 0.777 25767 17596 1 20 . 1 1 11 11 THR CB C 11 68.588 68.588 69.034 -0.447 25767 17597 1 20 . 1 1 11 11 THR H H 11 8.180 8.180 7.740 0.440 25767 17598 1 20 . 1 1 12 12 ALA N N 12 125.308 125.308 125.115 0.193 25767 17599 1 20 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.792 0.205 25767 17600 1 20 . 1 1 12 12 ALA C C 12 179.399 179.399 179.435 -0.036 25767 17601 1 20 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.361 0.715 25767 17602 1 20 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.289 0.955 25767 17603 1 20 . 1 1 12 12 ALA H H 12 8.671 8.671 8.399 0.272 25767 17604 1 20 . 1 1 13 13 LYS N N 13 116.977 116.977 118.478 -1.501 25767 17605 1 20 . 1 1 13 13 LYS C C 13 179.646 179.646 178.744 0.902 25767 17606 1 20 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.854 -0.933 25767 17607 1 20 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.200 -0.757 25767 17608 1 20 . 1 1 13 13 LYS H H 13 8.061 8.061 8.100 -0.039 25767 17609 1 20 . 1 1 14 14 ASP N N 14 121.988 121.988 120.098 1.890 25767 17610 1 20 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.461 -0.108 25767 17611 1 20 . 1 1 14 14 ASP C C 14 179.446 179.446 178.684 0.762 25767 17612 1 20 . 1 1 14 14 ASP CA C 14 57.509 57.509 56.967 0.542 25767 17613 1 20 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.627 -0.626 25767 17614 1 20 . 1 1 14 14 ASP H H 14 7.669 7.669 7.703 -0.034 25767 17615 1 20 . 1 1 15 15 PHE N N 15 119.588 119.588 118.482 1.106 25767 17616 1 20 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.208 0.136 25767 17617 1 20 . 1 1 15 15 PHE C C 15 178.373 178.373 178.049 0.324 25767 17618 1 20 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.515 0.722 25767 17619 1 20 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.752 -1.256 25767 17620 1 20 . 1 1 15 15 PHE H H 15 7.913 7.913 8.536 -0.623 25767 17621 1 20 . 1 1 16 16 ASP N N 16 121.705 121.705 120.083 1.622 25767 17622 1 20 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.385 -0.390 25767 17623 1 20 . 1 1 16 16 ASP C C 16 180.071 180.071 179.105 0.966 25767 17624 1 20 . 1 1 16 16 ASP CA C 16 58.149 58.149 56.947 1.202 25767 17625 1 20 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.477 1.010 25767 17626 1 20 . 1 1 16 16 ASP H H 16 8.324 8.324 8.226 0.098 25767 17627 1 20 . 1 1 17 17 LYS N N 17 118.825 118.825 118.808 0.017 25767 17628 1 20 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.095 -0.058 25767 17629 1 20 . 1 1 17 17 LYS C C 17 178.407 178.407 177.931 0.476 25767 17630 1 20 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.813 0.248 25767 17631 1 20 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.509 0.075 25767 17632 1 20 . 1 1 17 17 LYS H H 17 7.834 7.834 7.754 0.080 25767 17633 1 20 . 1 1 18 18 VAL N N 18 110.562 110.562 117.175 -6.613 25767 17634 1 20 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.030 0.486 25767 17635 1 20 . 1 1 18 18 VAL C C 18 176.144 176.144 176.571 -0.427 25767 17636 1 20 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.134 -2.260 25767 17637 1 20 . 1 1 18 18 VAL CB C 18 31.160 31.160 31.881 -0.722 25767 17638 1 20 . 1 1 18 18 VAL H H 18 7.185 7.185 7.537 -0.352 25767 17639 1 20 . 1 1 19 19 GLY N N 19 109.272 109.272 107.744 1.528 25767 17640 1 20 . 1 1 19 19 GLY C C 19 175.043 175.043 174.760 0.283 25767 17641 1 20 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.281 0.550 25767 17642 1 20 . 1 1 19 19 GLY H H 19 7.723 7.723 7.684 0.039 25767 17643 1 20 . 1 1 20 20 LEU N N 20 125.428 125.428 121.638 3.790 25767 17644 1 20 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.521 -0.201 25767 17645 1 20 . 1 1 20 20 LEU C C 20 177.949 177.949 177.240 0.709 25767 17646 1 20 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.294 -0.490 25767 17647 1 20 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.542 0.375 25767 17648 1 20 . 1 1 20 20 LEU H H 20 8.083 8.083 8.026 0.057 25767 17649 1 20 . 1 1 21 21 GLY N N 21 107.804 107.804 110.005 -2.201 25767 17650 1 20 . 1 1 21 21 GLY C C 21 176.278 176.278 175.697 0.581 25767 17651 1 20 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.075 0.219 25767 17652 1 20 . 1 1 21 21 GLY H H 21 7.982 7.982 7.864 0.118 25767 17653 1 20 . 1 1 22 22 ILE N N 22 121.319 121.319 122.139 -0.820 25767 17654 1 20 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.708 0.202 25767 17655 1 20 . 1 1 22 22 ILE C C 22 176.604 176.604 177.871 -1.267 25767 17656 1 20 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.227 -1.780 25767 17657 1 20 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.546 -0.980 25767 17658 1 20 . 1 1 22 22 ILE H H 22 8.478 8.478 7.745 0.733 25767 17659 1 20 . 1 1 23 23 ILE N N 23 120.377 120.377 119.771 0.606 25767 17660 1 20 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.799 -0.086 25767 17661 1 20 . 1 1 23 23 ILE C C 23 178.581 178.581 178.358 0.223 25767 17662 1 20 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.099 1.147 25767 17663 1 20 . 1 1 23 23 ILE CB C 23 36.199 36.199 36.229 -0.030 25767 17664 1 20 . 1 1 23 23 ILE H H 23 6.869 6.869 7.521 -0.652 25767 17665 1 20 . 1 1 24 24 GLY N N 24 103.449 103.449 108.479 -5.030 25767 17666 1 20 . 1 1 24 24 GLY C C 24 175.308 175.308 175.820 -0.512 25767 17667 1 20 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.217 0.726 25767 17668 1 20 . 1 1 24 24 GLY H H 24 7.488 7.488 7.966 -0.478 25767 17669 1 20 . 1 1 25 25 TYR N N 25 124.685 124.685 123.891 0.794 25767 17670 1 20 . 1 1 25 25 TYR HA H 25 3.666 3.666 4.067 -0.401 25767 17671 1 20 . 1 1 25 25 TYR C C 25 176.208 176.208 177.039 -0.831 25767 17672 1 20 . 1 1 25 25 TYR CA C 25 61.371 61.371 62.074 -0.703 25767 17673 1 20 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.711 -0.444 25767 17674 1 20 . 1 1 25 25 TYR H H 25 7.931 7.931 8.217 -0.286 25767 17675 1 20 . 1 1 26 26 TYR N N 26 117.001 117.001 119.893 -2.892 25767 17676 1 20 . 1 1 26 26 TYR HA H 26 3.941 3.941 4.132 -0.191 25767 17677 1 20 . 1 1 26 26 TYR C C 26 178.753 178.753 177.521 1.232 25767 17678 1 20 . 1 1 26 26 TYR CA C 26 64.260 64.260 61.851 2.409 25767 17679 1 20 . 1 1 26 26 TYR CB C 26 37.521 37.521 39.001 -1.480 25767 17680 1 20 . 1 1 26 26 TYR H H 26 7.693 7.693 8.016 -0.323 25767 17681 1 20 . 1 1 27 27 LEU N N 27 118.657 118.657 118.792 -0.135 25767 17682 1 20 . 1 1 27 27 LEU HA H 27 4.311 4.311 4.086 0.225 25767 17683 1 20 . 1 1 27 27 LEU CA C 27 58.297 58.297 58.053 0.244 25767 17684 1 20 . 1 1 27 27 LEU CB C 27 42.723 42.723 41.363 1.360 25767 17685 1 20 . 1 1 27 27 LEU H H 27 8.339 8.339 8.657 -0.318 25767 17686 1 20 . 1 1 28 28 GLN N N 28 118.593 118.593 118.694 -0.101 25767 17687 1 20 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.946 -0.295 25767 17688 1 20 . 1 1 28 28 GLN C C 28 177.282 177.282 178.791 -1.509 25767 17689 1 20 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.630 0.199 25767 17690 1 20 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.215 1.433 25767 17691 1 20 . 1 1 28 28 GLN H H 28 7.970 7.970 8.286 -0.316 25767 17692 1 20 . 1 1 29 29 LEU N N 29 122.111 122.111 119.931 2.180 25767 17693 1 20 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.756 0.188 25767 17694 1 20 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.689 0.977 25767 17695 1 20 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.361 0.647 25767 17696 1 20 . 1 1 29 29 LEU H H 29 7.979 7.979 7.521 0.458 25767 17697 1 20 . 1 1 30 30 TYR N N 30 119.283 119.283 120.159 -0.876 25767 17698 1 20 . 1 1 30 30 TYR C C 30 175.775 175.775 177.449 -1.674 25767 17699 1 20 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.758 -1.664 25767 17700 1 20 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.334 0.739 25767 17701 1 20 . 1 1 30 30 TYR H H 30 8.093 8.093 7.625 0.468 25767 17702 1 20 . 1 1 31 31 ALA N N 31 121.327 121.327 122.024 -0.697 25767 17703 1 20 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.860 -0.492 25767 17704 1 20 . 1 1 31 31 ALA C C 31 178.955 178.955 178.987 -0.032 25767 17705 1 20 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.354 0.193 25767 17706 1 20 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.323 -0.360 25767 17707 1 20 . 1 1 31 31 ALA H H 31 8.394 8.394 8.199 0.195 25767 17708 1 20 . 1 1 32 32 VAL N N 32 116.757 116.757 117.011 -0.254 25767 17709 1 20 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.552 -0.292 25767 17710 1 20 . 1 1 32 32 VAL CA C 32 67.662 67.662 66.359 1.303 25767 17711 1 20 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.417 -0.446 25767 17712 1 20 . 1 1 32 32 VAL H H 32 8.020 8.020 7.560 0.460 25767 17713 1 20 . 1 1 33 33 GLU N N 33 118.775 118.775 120.356 -1.581 25767 17714 1 20 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.825 0.164 25767 17715 1 20 . 1 1 33 33 GLU C C 33 179.746 179.746 178.547 1.199 25767 17716 1 20 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.183 0.820 25767 17717 1 20 . 1 1 33 33 GLU H H 33 7.358 7.358 7.484 -0.126 25767 17718 1 20 . 1 1 34 34 LEU N N 34 120.632 120.632 121.052 -0.420 25767 17719 1 20 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.877 -0.228 25767 17720 1 20 . 1 1 34 34 LEU C C 34 180.336 180.336 178.740 1.596 25767 17721 1 20 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.630 0.044 25767 17722 1 20 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.810 -0.222 25767 17723 1 20 . 1 1 34 34 LEU H H 34 8.390 8.390 7.889 0.501 25767 17724 1 20 . 1 1 35 35 ILE N N 35 121.240 121.240 118.276 2.964 25767 17725 1 20 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.835 -0.293 25767 17726 1 20 . 1 1 35 35 ILE C C 35 178.604 178.604 177.519 1.085 25767 17727 1 20 . 1 1 35 35 ILE CA C 35 65.547 65.547 64.761 0.786 25767 17728 1 20 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.920 0.811 25767 17729 1 20 . 1 1 35 35 ILE H H 35 8.129 8.129 7.378 0.751 25767 17730 1 20 . 1 1 36 36 LEU N N 36 115.637 115.637 116.967 -1.330 25767 17731 1 20 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.050 -0.042 25767 17732 1 20 . 1 1 36 36 LEU C C 36 178.001 178.001 178.010 -0.009 25767 17733 1 20 . 1 1 36 36 LEU CA C 36 56.076 56.076 56.885 -0.809 25767 17734 1 20 . 1 1 36 36 LEU CB C 36 39.934 39.934 42.090 -2.156 25767 17735 1 20 . 1 1 36 36 LEU H H 36 8.416 8.416 7.771 0.645 25767 17736 1 20 . 1 1 37 37 SER N N 37 114.106 114.106 111.504 2.602 25767 17737 1 20 . 1 1 37 37 SER HA H 37 3.991 3.991 4.217 -0.226 25767 17738 1 20 . 1 1 37 37 SER C C 37 173.997 173.997 175.303 -1.306 25767 17739 1 20 . 1 1 37 37 SER CA C 37 60.311 60.311 59.197 1.114 25767 17740 1 20 . 1 1 37 37 SER CB C 37 63.746 63.746 63.603 0.143 25767 17741 1 20 . 1 1 37 37 SER H H 37 7.517 7.517 7.640 -0.123 25767 17742 1 20 . 1 1 38 38 GLU N N 38 123.003 123.003 122.310 0.693 25767 17743 1 20 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.239 0.130 25767 17744 1 20 . 1 1 38 38 GLU C C 38 175.780 175.780 176.029 -0.249 25767 17745 1 20 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.770 -0.405 25767 17746 1 20 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.815 -0.522 25767 17747 1 20 . 1 1 38 38 GLU H H 38 7.151 7.151 7.530 -0.379 25767 17748 1 20 . 1 1 39 39 GLU N N 39 126.166 126.166 122.292 3.874 25767 17749 1 20 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.139 -0.130 25767 17750 1 20 . 1 1 39 39 GLU C C 39 176.652 176.652 175.746 0.906 25767 17751 1 20 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.822 1.376 25767 17752 1 20 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.350 -0.315 25767 17753 1 20 . 1 1 39 39 GLU H H 39 8.587 8.587 8.443 0.144 25767 17754 1 20 . 1 1 40 40 ASP N N 40 120.047 120.047 120.939 -0.892 25767 17755 1 20 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.466 0.084 25767 17756 1 20 . 1 1 40 40 ASP C C 40 175.035 175.035 175.932 -0.897 25767 17757 1 20 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.221 -1.853 25767 17758 1 20 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.859 -0.836 25767 17759 1 20 . 1 1 40 40 ASP H H 40 8.504 8.504 8.541 -0.037 25767 17760 1 20 . 1 1 41 41 ARG N N 41 120.671 120.671 122.449 -1.778 25767 17761 1 20 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.600 -0.211 25767 17762 1 20 . 1 1 41 41 ARG C C 41 175.755 175.755 175.767 -0.012 25767 17763 1 20 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.596 0.412 25767 17764 1 20 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.413 -0.865 25767 17765 1 20 . 1 1 41 41 ARG H H 41 7.672 7.672 8.119 -0.447 25767 17766 1 20 . 1 1 42 42 SER N N 42 120.330 120.330 116.263 4.067 25767 17767 1 20 . 1 1 42 42 SER HA H 42 3.837 3.837 4.350 -0.513 25767 17768 1 20 . 1 1 42 42 SER CA C 42 57.326 57.326 58.766 -1.440 25767 17769 1 20 . 1 1 42 42 SER CB C 42 65.762 65.762 63.963 1.799 25767 17770 1 20 . 1 1 42 42 SER H H 42 8.544 8.544 8.245 0.299 25767 17771 1 20 . 1 1 43 43 GLN HA H 43 3.989 3.989 3.996 -0.007 25767 17772 1 20 . 1 1 43 43 GLN C C 43 178.907 178.907 178.109 0.798 25767 17773 1 20 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.875 0.495 25767 17774 1 20 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.622 -0.659 25767 17775 1 20 . 1 1 44 44 GLU N N 44 120.328 120.328 119.322 1.006 25767 17776 1 20 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.925 0.088 25767 17777 1 20 . 1 1 44 44 GLU C C 44 179.824 179.824 178.531 1.293 25767 17778 1 20 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.197 0.848 25767 17779 1 20 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.325 -0.677 25767 17780 1 20 . 1 1 44 44 GLU H H 44 8.938 8.938 7.815 1.123 25767 17781 1 20 . 1 1 45 45 MET N N 45 121.030 121.030 118.170 2.860 25767 17782 1 20 . 1 1 45 45 MET HA H 45 4.412 4.412 4.222 0.190 25767 17783 1 20 . 1 1 45 45 MET C C 45 180.357 180.357 177.927 2.430 25767 17784 1 20 . 1 1 45 45 MET CA C 45 57.209 57.209 58.297 -1.088 25767 17785 1 20 . 1 1 45 45 MET CB C 45 32.436 32.436 32.524 -0.088 25767 17786 1 20 . 1 1 45 45 MET H H 45 7.756 7.756 7.820 -0.064 25767 17787 1 20 . 1 1 46 46 THR N N 46 120.008 120.008 114.221 5.787 25767 17788 1 20 . 1 1 46 46 THR HA H 46 4.071 4.071 3.958 0.113 25767 17789 1 20 . 1 1 46 46 THR CA C 46 67.096 67.096 65.988 1.108 25767 17790 1 20 . 1 1 46 46 THR CB C 46 68.954 68.954 68.358 0.596 25767 17791 1 20 . 1 1 46 46 THR H H 46 8.187 8.187 7.494 0.693 25767 17792 1 20 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.088 0.021 25767 17793 1 20 . 1 1 47 47 ALA C C 47 180.118 180.118 179.511 0.607 25767 17794 1 20 . 1 1 47 47 ALA CA C 47 55.339 55.339 55.002 0.337 25767 17795 1 20 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.187 -0.355 25767 17796 1 20 . 1 1 47 47 ALA H H 47 8.238 8.238 8.234 0.004 25767 17797 1 20 . 1 1 48 48 LEU N N 48 122.093 122.093 119.109 2.984 25767 17798 1 20 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.026 0.237 25767 17799 1 20 . 1 1 48 48 LEU C C 48 179.103 179.103 179.267 -0.164 25767 17800 1 20 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.421 0.319 25767 17801 1 20 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.495 -0.699 25767 17802 1 20 . 1 1 48 48 LEU H H 48 7.778 7.778 7.749 0.029 25767 17803 1 20 . 1 1 49 49 ALA N N 49 120.130 120.130 121.699 -1.569 25767 17804 1 20 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.927 -0.206 25767 17805 1 20 . 1 1 49 49 ALA C C 49 178.676 178.676 179.458 -0.782 25767 17806 1 20 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.336 0.385 25767 17807 1 20 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.028 -0.201 25767 17808 1 20 . 1 1 49 49 ALA H H 49 8.432 8.432 7.788 0.644 25767 17809 1 20 . 1 1 50 50 THR N N 50 113.333 113.333 115.262 -1.929 25767 17810 1 20 . 1 1 50 50 THR HA H 50 3.895 3.895 3.829 0.066 25767 17811 1 20 . 1 1 50 50 THR C C 50 174.948 174.948 176.443 -1.495 25767 17812 1 20 . 1 1 50 50 THR CA C 50 67.334 67.334 67.892 -0.559 25767 17813 1 20 . 1 1 50 50 THR CB C 50 68.864 68.864 68.647 0.217 25767 17814 1 20 . 1 1 50 50 THR H H 50 7.857 7.857 7.789 0.068 25767 17815 1 20 . 1 1 51 51 GLU N N 51 122.698 122.698 122.291 0.407 25767 17816 1 20 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.020 0.048 25767 17817 1 20 . 1 1 51 51 GLU C C 51 179.997 179.997 178.894 1.103 25767 17818 1 20 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.485 -0.052 25767 17819 1 20 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.588 -0.071 25767 17820 1 20 . 1 1 51 51 GLU H H 51 7.817 7.817 7.628 0.189 25767 17821 1 20 . 1 1 52 52 LEU N N 52 121.100 121.100 119.561 1.539 25767 17822 1 20 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.066 0.063 25767 17823 1 20 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.510 0.379 25767 17824 1 20 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.676 0.271 25767 17825 1 20 . 1 1 52 52 LEU H H 52 8.628 8.628 7.986 0.642 25767 17826 1 20 . 1 1 53 53 LEU N N 53 119.935 119.935 120.389 -0.454 25767 17827 1 20 . 1 1 53 53 LEU C C 53 179.671 179.671 178.356 1.315 25767 17828 1 20 . 1 1 53 53 LEU H H 53 8.303 8.303 7.714 0.589 25767 17829 1 20 . 1 1 54 54 ASP N N 54 120.339 120.339 118.830 1.509 25767 17830 1 20 . 1 1 54 54 ASP C C 54 179.106 179.106 178.480 0.626 25767 17831 1 20 . 1 1 54 54 ASP H H 54 7.901 7.901 7.911 -0.010 25767 17832 1 20 . 1 1 55 55 THR N N 55 120.237 120.237 117.338 2.899 25767 17833 1 20 . 1 1 55 55 THR HA H 55 3.696 3.696 3.977 -0.281 25767 17834 1 20 . 1 1 55 55 THR CA C 55 67.340 67.340 66.943 0.397 25767 17835 1 20 . 1 1 55 55 THR CB C 55 68.151 68.151 68.799 -0.647 25767 17836 1 20 . 1 1 55 55 THR H H 55 8.262 8.262 7.666 0.596 25767 17837 1 20 . 1 1 56 56 ILE N N 56 123.953 123.953 122.093 1.860 25767 17838 1 20 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.730 0.113 25767 17839 1 20 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.892 0.002 25767 17840 1 20 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.630 0.503 25767 17841 1 20 . 1 1 56 56 ILE H H 56 8.930 8.930 7.694 1.236 25767 17842 1 20 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.427 0.154 25767 17843 1 20 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.154 -0.123 25767 17844 1 20 . 1 1 58 58 ALA C C 58 179.875 179.875 179.452 0.423 25767 17845 1 20 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.835 0.431 25767 17846 1 20 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.417 -0.432 25767 17847 1 20 . 1 1 58 58 ALA H H 58 7.764 7.764 8.463 -0.699 25767 17848 1 20 . 1 1 59 59 PHE N N 59 121.988 121.988 119.967 2.021 25767 17849 1 20 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.171 0.055 25767 17850 1 20 . 1 1 59 59 PHE CA C 59 61.439 61.439 59.904 1.535 25767 17851 1 20 . 1 1 59 59 PHE CB C 59 39.363 39.363 38.695 0.668 25767 17852 1 20 . 1 1 59 59 PHE H H 59 8.159 8.159 8.613 -0.454 25767 17853 1 20 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.175 0.366 25767 17854 1 20 . 1 1 60 60 LYS C C 60 179.438 179.438 178.843 0.595 25767 17855 1 20 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.117 1.019 25767 17856 1 20 . 1 1 60 60 LYS CB C 60 32.058 32.058 31.998 0.059 25767 17857 1 20 . 1 1 61 61 LYS N N 61 119.262 119.262 116.874 2.388 25767 17858 1 20 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.177 -0.232 25767 17859 1 20 . 1 1 61 61 LYS C C 61 178.730 178.730 177.736 0.994 25767 17860 1 20 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.286 1.756 25767 17861 1 20 . 1 1 61 61 LYS CB C 61 32.642 32.642 31.991 0.651 25767 17862 1 20 . 1 1 61 61 LYS H H 61 7.832 7.832 7.645 0.187 25767 17863 1 20 . 1 1 62 62 GLU N N 62 120.790 120.790 121.039 -0.249 25767 17864 1 20 . 1 1 62 62 GLU HA H 62 3.935 3.935 4.032 -0.097 25767 17865 1 20 . 1 1 62 62 GLU C C 62 178.424 178.424 178.134 0.290 25767 17866 1 20 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.951 -0.237 25767 17867 1 20 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.533 -0.303 25767 17868 1 20 . 1 1 62 62 GLU H H 62 7.982 7.982 7.803 0.179 25767 17869 1 20 . 1 1 63 63 ILE N N 63 118.463 118.463 117.076 1.387 25767 17870 1 20 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.846 -0.157 25767 17871 1 20 . 1 1 63 63 ILE C C 63 177.555 177.555 177.134 0.421 25767 17872 1 20 . 1 1 63 63 ILE CA C 63 61.499 61.499 62.636 -1.137 25767 17873 1 20 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.428 -1.904 25767 17874 1 20 . 1 1 63 63 ILE H H 63 7.732 7.732 7.472 0.260 25767 17875 1 20 . 1 1 64 64 GLY N N 64 107.973 107.973 107.340 0.633 25767 17876 1 20 . 1 1 64 64 GLY C C 64 175.271 175.271 174.988 0.283 25767 17877 1 20 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.171 -0.269 25767 17878 1 20 . 1 1 64 64 GLY H H 64 7.661 7.661 7.949 -0.288 25767 17879 1 20 . 1 1 65 65 GLY N N 65 108.464 108.464 107.133 1.331 25767 17880 1 20 . 1 1 65 65 GLY C C 65 174.800 174.800 175.809 -1.009 25767 17881 1 20 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.420 0.226 25767 17882 1 20 . 1 1 65 65 GLY H H 65 7.808 7.808 8.160 -0.352 25767 17883 1 20 . 1 1 66 66 GLU N N 66 121.162 121.162 121.068 0.094 25767 17884 1 20 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.032 0.073 25767 17885 1 20 . 1 1 66 66 GLU C C 66 177.230 177.230 178.818 -1.588 25767 17886 1 20 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.042 -1.818 25767 17887 1 20 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.432 0.560 25767 17888 1 20 . 1 1 66 66 GLU H H 66 8.203 8.203 7.723 0.480 25767 17889 1 20 . 1 1 67 67 SER N N 67 116.468 116.468 115.406 1.062 25767 17890 1 20 . 1 1 67 67 SER HA H 67 4.249 4.249 4.272 -0.023 25767 17891 1 20 . 1 1 67 67 SER C C 67 174.640 174.640 176.628 -1.988 25767 17892 1 20 . 1 1 67 67 SER CA C 67 58.930 58.930 60.818 -1.888 25767 17893 1 20 . 1 1 67 67 SER CB C 67 63.912 63.912 62.836 1.076 25767 17894 1 20 . 1 1 67 67 SER H H 67 8.206 8.206 8.410 -0.204 25767 17895 1 20 . 1 1 68 68 GLU N N 68 122.400 122.400 120.074 2.326 25767 17896 1 20 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.038 0.115 25767 17897 1 20 . 1 1 68 68 GLU C C 68 176.349 176.349 176.933 -0.584 25767 17898 1 20 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.565 -1.742 25767 17899 1 20 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.305 0.676 25767 17900 1 20 . 1 1 68 68 GLU H H 68 8.168 8.168 8.457 -0.289 25767 17901 1 20 . 1 1 69 69 ALA N N 69 124.342 124.342 120.094 4.248 25767 17902 1 20 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.036 0.152 25767 17903 1 20 . 1 1 69 69 ALA C C 69 178.027 178.027 178.214 -0.187 25767 17904 1 20 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.800 -1.242 25767 17905 1 20 . 1 1 69 69 ALA CB C 69 19.492 19.492 18.995 0.497 25767 17906 1 20 . 1 1 69 69 ALA H H 69 7.939 7.939 7.372 0.567 25767 17907 1 20 . 1 1 70 70 GLU N N 70 121.059 121.059 118.299 2.760 25767 17908 1 20 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.386 -0.272 25767 17909 1 20 . 1 1 70 70 GLU C C 70 176.519 176.519 175.176 1.343 25767 17910 1 20 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.594 1.710 25767 17911 1 20 . 1 1 70 70 GLU CB C 70 29.827 29.827 30.731 -0.904 25767 17912 1 20 . 1 1 70 70 GLU H H 70 8.430 8.430 7.671 0.759 25767 17913 1 20 . 1 1 71 71 ASP N N 71 120.274 120.274 122.900 -2.626 25767 17914 1 20 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.335 0.197 25767 17915 1 20 . 1 1 71 71 ASP C C 71 176.369 176.369 176.980 -0.611 25767 17916 1 20 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.301 -1.050 25767 17917 1 20 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.795 1.045 25767 17918 1 20 . 1 1 71 71 ASP H H 71 8.305 8.305 8.989 -0.684 25767 17919 1 20 . 1 1 72 72 SER N N 72 116.165 116.165 113.887 2.278 25767 17920 1 20 . 1 1 72 72 SER HA H 72 4.241 4.241 4.032 0.209 25767 17921 1 20 . 1 1 72 72 SER C C 72 174.567 174.567 175.671 -1.104 25767 17922 1 20 . 1 1 72 72 SER CA C 72 59.031 59.031 61.959 -2.928 25767 17923 1 20 . 1 1 72 72 SER CB C 72 64.040 64.040 63.015 1.025 25767 17924 1 20 . 1 1 72 72 SER H H 72 7.964 7.964 8.397 -0.433 25767 17925 1 20 . 1 1 73 73 ASP N N 73 122.440 122.440 122.419 0.021 25767 17926 1 20 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.086 0.448 25767 17927 1 20 . 1 1 73 73 ASP C C 73 176.882 176.882 177.935 -1.053 25767 17928 1 20 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.147 -2.704 25767 17929 1 20 . 1 1 73 73 ASP CB C 73 41.336 41.336 39.832 1.504 25767 17930 1 20 . 1 1 73 73 ASP H H 73 8.392 8.392 8.544 -0.152 25767 17931 1 20 . 1 1 74 74 LYS N N 74 123.270 123.270 120.114 3.156 25767 17932 1 20 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.019 0.074 25767 17933 1 20 . 1 1 74 74 LYS C C 74 177.608 177.608 179.067 -1.459 25767 17934 1 20 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.172 -1.707 25767 17935 1 20 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.496 -0.350 25767 17936 1 20 . 1 1 74 74 LYS H H 74 8.317 8.317 7.347 0.970 25767 17937 1 20 . 1 1 75 75 SER N N 75 116.557 116.557 116.091 0.466 25767 17938 1 20 . 1 1 75 75 SER HA H 75 4.197 4.197 4.108 0.089 25767 17939 1 20 . 1 1 75 75 SER C C 75 175.988 175.988 176.503 -0.515 25767 17940 1 20 . 1 1 75 75 SER CA C 75 60.434 60.434 62.340 -1.906 25767 17941 1 20 . 1 1 75 75 SER CB C 75 63.172 63.172 63.041 0.132 25767 17942 1 20 . 1 1 75 75 SER H H 75 8.387 8.387 7.753 0.634 25767 17943 1 20 . 1 1 76 76 LEU N N 76 123.910 123.910 121.412 2.498 25767 17944 1 20 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.965 0.205 25767 17945 1 20 . 1 1 76 76 LEU C C 76 178.083 178.083 178.892 -0.809 25767 17946 1 20 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.816 -1.324 25767 17947 1 20 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.547 0.150 25767 17948 1 20 . 1 1 76 76 LEU H H 76 8.059 8.059 7.850 0.209 25767 17949 1 20 . 1 1 77 77 HIS N N 77 120.620 120.620 119.044 1.576 25767 17950 1 20 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.246 0.042 25767 17951 1 20 . 1 1 77 77 HIS C C 77 177.667 177.667 178.400 -0.733 25767 17952 1 20 . 1 1 77 77 HIS CA C 77 58.422 58.422 59.260 -0.838 25767 17953 1 20 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.894 0.370 25767 17954 1 20 . 1 1 77 77 HIS H H 77 7.936 7.936 7.846 0.090 25767 17955 1 20 . 1 1 78 78 VAL N N 78 121.774 121.774 119.953 1.821 25767 17956 1 20 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.606 0.071 25767 17957 1 20 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.912 -1.306 25767 17958 1 20 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.841 0.023 25767 17959 1 20 . 1 1 78 78 VAL H H 78 7.916 7.916 8.103 -0.187 25767 17960 1 20 . 1 1 79 79 MET N N 79 119.660 119.660 118.439 1.221 25767 17961 1 20 . 1 1 79 79 MET HA H 79 3.925 3.925 3.997 -0.072 25767 17962 1 20 . 1 1 79 79 MET C C 79 177.077 177.077 178.689 -1.612 25767 17963 1 20 . 1 1 79 79 MET CA C 79 58.862 58.862 59.793 -0.931 25767 17964 1 20 . 1 1 79 79 MET CB C 79 32.852 32.852 32.339 0.513 25767 17965 1 20 . 1 1 79 79 MET H H 79 8.149 8.149 7.913 0.236 25767 17966 1 20 . 1 1 80 80 ASN N N 80 117.337 117.337 118.679 -1.342 25767 17967 1 20 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.855 -0.717 25767 17968 1 20 . 1 1 80 80 ASN C C 80 178.133 178.133 178.540 -0.407 25767 17969 1 20 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.097 0.942 25767 17970 1 20 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.742 0.254 25767 17971 1 20 . 1 1 80 80 ASN H H 80 8.202 8.202 8.897 -0.695 25767 17972 1 20 . 1 1 81 81 THR N N 81 115.517 115.517 118.742 -3.225 25767 17973 1 20 . 1 1 81 81 THR HA H 81 3.896 3.896 4.064 -0.168 25767 17974 1 20 . 1 1 81 81 THR C C 81 175.186 175.186 175.886 -0.700 25767 17975 1 20 . 1 1 81 81 THR CA C 81 66.221 66.221 67.296 -1.075 25767 17976 1 20 . 1 1 81 81 THR CB C 81 69.087 69.087 68.978 0.108 25767 17977 1 20 . 1 1 81 81 THR H H 81 7.944 7.944 8.462 -0.518 25767 17978 1 20 . 1 1 82 82 LEU N N 82 119.074 119.074 120.339 -1.265 25767 17979 1 20 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.087 -0.106 25767 17980 1 20 . 1 1 82 82 LEU C C 82 177.583 177.583 177.953 -0.370 25767 17981 1 20 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.184 -0.644 25767 17982 1 20 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.923 -0.130 25767 17983 1 20 . 1 1 82 82 LEU H H 82 7.547 7.547 7.825 -0.278 25767 17984 1 20 . 1 1 83 83 ILE N N 83 118.085 118.085 115.648 2.437 25767 17985 1 20 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.523 0.320 25767 17986 1 20 . 1 1 83 83 ILE C C 83 176.413 176.413 176.989 -0.576 25767 17987 1 20 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.059 -0.332 25767 17988 1 20 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.234 -0.536 25767 17989 1 20 . 1 1 83 83 ILE H H 83 7.409 7.409 7.522 -0.113 25767 17990 1 20 . 1 1 84 84 HIS N N 84 116.152 116.152 114.817 1.335 25767 17991 1 20 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.457 0.138 25767 17992 1 20 . 1 1 84 84 HIS C C 84 175.707 175.707 175.220 0.487 25767 17993 1 20 . 1 1 84 84 HIS CA C 84 58.628 58.628 57.666 0.962 25767 17994 1 20 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.832 0.571 25767 17995 1 20 . 1 1 84 84 HIS H H 84 7.194 7.194 7.739 -0.545 25767 17996 1 20 . 1 1 85 85 ASP N N 85 122.322 122.322 120.242 2.080 25767 17997 1 20 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.731 -0.197 25767 17998 1 20 . 1 1 85 85 ASP C C 85 175.580 175.580 176.459 -0.879 25767 17999 1 20 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.145 0.200 25767 18000 1 20 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.013 0.105 25767 18001 1 20 . 1 1 85 85 ASP H H 85 8.505 8.505 7.928 0.577 25767 18002 1 20 . 1 1 86 86 GLN N N 86 122.783 122.783 126.849 -4.066 25767 18003 1 20 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.099 -0.136 25767 18004 1 20 . 1 1 86 86 GLN C C 86 178.581 178.581 177.814 0.767 25767 18005 1 20 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.350 -1.396 25767 18006 1 20 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.173 -0.279 25767 18007 1 20 . 1 1 86 86 GLN H H 86 8.803 8.803 8.467 0.336 25767 18008 1 20 . 1 1 87 87 GLU N N 87 121.794 121.794 118.607 3.187 25767 18009 1 20 . 1 1 87 87 GLU HA H 87 4.013 4.013 4.003 0.010 25767 18010 1 20 . 1 1 87 87 GLU C C 87 178.290 178.290 178.583 -0.293 25767 18011 1 20 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.143 -0.105 25767 18012 1 20 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.468 -0.488 25767 18013 1 20 . 1 1 87 87 GLU H H 87 8.072 8.072 8.248 -0.176 25767 18014 1 20 . 1 1 88 88 LYS N N 88 119.345 119.345 119.846 -0.501 25767 18015 1 20 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.060 -0.305 25767 18016 1 20 . 1 1 88 88 LYS C C 88 180.040 180.040 178.461 1.579 25767 18017 1 20 . 1 1 88 88 LYS CA C 88 59.411 59.411 58.738 0.673 25767 18018 1 20 . 1 1 88 88 LYS CB C 88 32.007 32.007 32.132 -0.125 25767 18019 1 20 . 1 1 88 88 LYS H H 88 7.588 7.588 8.105 -0.517 25767 18020 1 20 . 1 1 89 89 ALA N N 89 123.933 123.933 121.767 2.166 25767 18021 1 20 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.045 -0.306 25767 18022 1 20 . 1 1 89 89 ALA C C 89 177.457 177.457 179.291 -1.834 25767 18023 1 20 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.321 0.649 25767 18024 1 20 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.183 0.473 25767 18025 1 20 . 1 1 89 89 ALA H H 89 8.500 8.500 7.674 0.826 25767 18026 1 20 . 1 1 90 90 LYS N N 90 119.244 119.244 119.378 -0.134 25767 18027 1 20 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.450 0.594 25767 18028 1 20 . 1 1 90 90 LYS C C 90 177.774 177.774 178.087 -0.313 25767 18029 1 20 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.072 0.006 25767 18030 1 20 . 1 1 90 90 LYS CB C 90 30.241 30.241 31.927 -1.687 25767 18031 1 20 . 1 1 90 90 LYS H H 90 6.845 6.845 7.413 -0.568 25767 18032 1 20 . 1 1 91 91 ILE N N 91 117.718 117.718 119.935 -2.217 25767 18033 1 20 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.664 -0.266 25767 18034 1 20 . 1 1 91 91 ILE C C 91 177.670 177.670 177.203 0.467 25767 18035 1 20 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.287 -0.289 25767 18036 1 20 . 1 1 91 91 ILE CB C 91 37.801 37.801 36.816 0.985 25767 18037 1 20 . 1 1 91 91 ILE H H 91 7.293 7.293 7.585 -0.292 25767 18038 1 20 . 1 1 92 92 TYR N N 92 121.868 121.868 122.030 -0.162 25767 18039 1 20 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.103 0.020 25767 18040 1 20 . 1 1 92 92 TYR C C 92 178.781 178.781 177.787 0.994 25767 18041 1 20 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.668 -1.026 25767 18042 1 20 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.578 0.643 25767 18043 1 20 . 1 1 92 92 TYR H H 92 8.016 8.016 8.031 -0.015 25767 18044 1 20 . 1 1 93 93 MET N N 93 118.984 118.984 118.024 0.960 25767 18045 1 20 . 1 1 93 93 MET HA H 93 3.952 3.952 4.063 -0.111 25767 18046 1 20 . 1 1 93 93 MET C C 93 179.925 179.925 178.213 1.712 25767 18047 1 20 . 1 1 93 93 MET CA C 93 57.589 57.589 59.272 -1.683 25767 18048 1 20 . 1 1 93 93 MET CB C 93 30.752 30.752 32.656 -1.904 25767 18049 1 20 . 1 1 93 93 MET H H 93 8.464 8.464 8.189 0.275 25767 18050 1 20 . 1 1 94 94 LEU N N 94 125.441 125.441 121.988 3.453 25767 18051 1 20 . 1 1 94 94 LEU HA H 94 3.870 3.870 3.883 -0.013 25767 18052 1 20 . 1 1 94 94 LEU C C 94 177.937 177.937 178.598 -0.661 25767 18053 1 20 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.026 0.735 25767 18054 1 20 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.566 0.196 25767 18055 1 20 . 1 1 94 94 LEU H H 94 8.927 8.927 8.708 0.219 25767 18056 1 20 . 1 1 95 95 ASN N N 95 119.066 119.066 117.794 1.272 25767 18057 1 20 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.376 -0.114 25767 18058 1 20 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.113 0.160 25767 18059 1 20 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.072 -0.467 25767 18060 1 20 . 1 1 95 95 ASN H H 95 8.691 8.691 8.350 0.341 25767 18061 1 20 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.459 0.206 25767 18062 1 20 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.544 0.527 25767 18063 1 20 . 1 1 96 96 PHE H H 96 8.317 8.317 8.042 0.275 25767 18064 1 20 . 1 1 97 97 THR N N 97 118.178 118.178 115.220 2.958 25767 18065 1 20 . 1 1 97 97 THR HA H 97 3.338 3.338 3.905 -0.567 25767 18066 1 20 . 1 1 97 97 THR C C 97 176.074 176.074 176.834 -0.760 25767 18067 1 20 . 1 1 97 97 THR CA C 97 67.986 67.986 66.496 1.490 25767 18068 1 20 . 1 1 97 97 THR H H 97 8.214 8.214 8.676 -0.462 25767 18069 1 20 . 1 1 98 98 MET N N 98 120.097 120.097 121.397 -1.300 25767 18070 1 20 . 1 1 98 98 MET HA H 98 4.403 4.403 4.344 0.059 25767 18071 1 20 . 1 1 98 98 MET C C 98 178.696 178.696 178.445 0.251 25767 18072 1 20 . 1 1 98 98 MET CA C 98 57.029 57.029 59.778 -2.749 25767 18073 1 20 . 1 1 98 98 MET CB C 98 29.898 29.898 32.567 -2.669 25767 18074 1 20 . 1 1 98 98 MET H H 98 8.885 8.885 8.361 0.524 25767 18075 1 20 . 1 1 99 99 SER N N 99 114.959 114.959 116.023 -1.064 25767 18076 1 20 . 1 1 99 99 SER HA H 99 4.199 4.199 4.219 -0.020 25767 18077 1 20 . 1 1 99 99 SER C C 99 176.565 176.565 176.614 -0.049 25767 18078 1 20 . 1 1 99 99 SER CA C 99 61.965 61.965 61.185 0.780 25767 18079 1 20 . 1 1 99 99 SER CB C 99 62.565 62.565 62.685 -0.120 25767 18080 1 20 . 1 1 99 99 SER H H 99 7.515 7.515 8.271 -0.756 25767 18081 1 20 . 1 1 100 100 LEU N N 100 125.380 125.380 124.954 0.426 25767 18082 1 20 . 1 1 100 100 LEU HA H 100 3.776 3.776 4.175 -0.399 25767 18083 1 20 . 1 1 100 100 LEU C C 100 177.689 177.689 178.112 -0.423 25767 18084 1 20 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.981 0.076 25767 18085 1 20 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.654 -0.104 25767 18086 1 20 . 1 1 100 100 LEU H H 100 7.400 7.400 8.483 -1.083 25767 18087 1 20 . 1 1 101 101 TYR N N 101 120.597 120.597 119.909 0.688 25767 18088 1 20 . 1 1 101 101 TYR HA H 101 4.116 4.116 4.092 0.024 25767 18089 1 20 . 1 1 101 101 TYR C C 101 176.825 176.825 177.116 -0.291 25767 18090 1 20 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.286 -0.398 25767 18091 1 20 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.444 0.549 25767 18092 1 20 . 1 1 101 101 TYR H H 101 8.880 8.880 8.438 0.442 25767 18093 1 20 . 1 1 102 102 ASN N N 102 116.869 116.869 117.016 -0.147 25767 18094 1 20 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.269 -0.103 25767 18095 1 20 . 1 1 102 102 ASN C C 102 179.089 179.089 177.619 1.470 25767 18096 1 20 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.274 -0.062 25767 18097 1 20 . 1 1 102 102 ASN CB C 102 37.734 37.734 37.666 0.068 25767 18098 1 20 . 1 1 102 102 ASN H H 102 8.543 8.543 8.108 0.435 25767 18099 1 20 . 1 1 103 103 GLU N N 103 121.259 121.259 121.020 0.239 25767 18100 1 20 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.957 0.029 25767 18101 1 20 . 1 1 103 103 GLU C C 103 179.968 179.968 178.774 1.194 25767 18102 1 20 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.548 -0.031 25767 18103 1 20 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.647 -0.097 25767 18104 1 20 . 1 1 103 103 GLU H H 103 7.872 7.872 8.047 -0.175 25767 18105 1 20 . 1 1 104 104 LYS N N 104 120.268 120.268 119.359 0.909 25767 18106 1 20 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.186 -0.140 25767 18107 1 20 . 1 1 104 104 LYS C C 104 178.355 178.355 179.085 -0.730 25767 18108 1 20 . 1 1 104 104 LYS CA C 104 56.735 56.735 58.978 -2.243 25767 18109 1 20 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.290 -3.177 25767 18110 1 20 . 1 1 104 104 LYS H H 104 8.384 8.384 7.923 0.461 25767 18111 1 20 . 1 1 105 105 LEU N N 105 121.622 121.622 121.088 0.534 25767 18112 1 20 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.566 0.175 25767 18113 1 20 . 1 1 105 105 LEU C C 105 180.552 180.552 177.769 2.783 25767 18114 1 20 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.169 0.003 25767 18115 1 20 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.506 -0.476 25767 18116 1 20 . 1 1 105 105 LEU H H 105 8.400 8.400 8.179 0.221 25767 18117 1 20 . 1 1 106 106 LYS N N 106 119.498 119.498 117.839 1.659 25767 18118 1 20 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.806 0.108 25767 18119 1 20 . 1 1 106 106 LYS C C 106 178.419 178.419 178.896 -0.477 25767 18120 1 20 . 1 1 106 106 LYS CA C 106 59.383 59.383 60.007 -0.624 25767 18121 1 20 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.924 -0.116 25767 18122 1 20 . 1 1 106 106 LYS H H 106 7.067 7.067 7.573 -0.506 25767 18123 1 20 . 1 1 107 107 GLN N N 107 121.405 121.405 119.076 2.329 25767 18124 1 20 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.945 -0.094 25767 18125 1 20 . 1 1 107 107 GLN C C 107 177.935 177.935 178.897 -0.962 25767 18126 1 20 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.755 -0.274 25767 18127 1 20 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.485 -1.687 25767 18128 1 20 . 1 1 107 107 GLN H H 107 7.460 7.460 7.590 -0.130 25767 18129 1 20 . 1 1 108 108 LEU N N 108 119.561 119.561 118.707 0.854 25767 18130 1 20 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.737 0.064 25767 18131 1 20 . 1 1 108 108 LEU C C 108 179.195 179.195 178.087 1.108 25767 18132 1 20 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.306 1.087 25767 18133 1 20 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.716 -0.450 25767 18134 1 20 . 1 1 108 108 LEU H H 108 8.208 8.208 7.832 0.376 25767 18135 1 20 . 1 1 109 109 LYS N N 109 118.535 118.535 116.659 1.876 25767 18136 1 20 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.202 0.050 25767 18137 1 20 . 1 1 109 109 LYS C C 109 177.726 177.726 177.937 -0.211 25767 18138 1 20 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.665 0.065 25767 18139 1 20 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.902 -0.492 25767 18140 1 20 . 1 1 109 109 LYS H H 109 7.168 7.168 7.431 -0.263 25767 18141 1 20 . 1 1 110 110 ASP N N 110 117.463 117.463 116.917 0.546 25767 18142 1 20 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.610 -0.005 25767 18143 1 20 . 1 1 110 110 ASP C C 110 177.360 177.360 176.766 0.594 25767 18144 1 20 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.989 0.907 25767 18145 1 20 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.612 0.965 25767 18146 1 20 . 1 1 110 110 ASP H H 110 7.861 7.861 8.441 -0.580 25767 18147 1 20 . 1 1 111 111 GLY N N 111 113.059 113.059 108.366 4.693 25767 18148 1 20 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.760 -0.708 25767 18149 1 20 . 1 1 111 111 GLY H H 111 8.479 8.479 7.764 0.715 25767 18150 1 20 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.083 0.380 25767 18151 1 20 . 1 1 112 112 PRO C C 112 175.090 175.090 175.605 -0.515 25767 18152 1 20 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.252 -0.888 25767 18153 1 20 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.721 2.129 25767 18154 1 20 . 1 1 113 113 TRP N N 113 123.164 123.164 121.565 1.599 25767 18155 1 20 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.719 -0.009 25767 18156 1 20 . 1 1 113 113 TRP C C 113 174.605 174.605 175.680 -1.075 25767 18157 1 20 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.426 0.479 25767 18158 1 20 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.518 -3.225 25767 18159 1 20 . 1 1 113 113 TRP H H 113 8.687 8.687 8.305 0.382 25767 18160 1 20 . 1 1 114 114 ASP N N 114 121.356 121.356 122.314 -0.958 25767 18161 1 20 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.910 -0.049 25767 18162 1 20 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.973 -0.724 25767 18163 1 20 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.344 -1.203 25767 18164 1 20 . 1 1 114 114 ASP H H 114 6.985 6.985 8.374 -1.389 25767 18165 1 20 . 1 1 115 115 VAL N N 115 118.649 118.649 119.460 -0.811 25767 18166 1 20 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.918 -0.076 25767 18167 1 20 . 1 1 115 115 VAL C C 115 177.739 177.739 177.473 0.266 25767 18168 1 20 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.740 -0.171 25767 18169 1 20 . 1 1 115 115 VAL CB C 115 31.677 31.677 31.953 -0.276 25767 18170 1 20 . 1 1 115 115 VAL H H 115 8.206 8.206 8.490 -0.284 25767 18171 1 20 . 1 1 116 116 MET N N 116 120.401 120.401 118.405 1.996 25767 18172 1 20 . 1 1 116 116 MET HA H 116 4.303 4.303 4.203 0.100 25767 18173 1 20 . 1 1 116 116 MET C C 116 179.269 179.269 178.452 0.817 25767 18174 1 20 . 1 1 116 116 MET CA C 116 57.634 57.634 59.105 -1.471 25767 18175 1 20 . 1 1 116 116 MET CB C 116 30.414 30.414 31.832 -1.419 25767 18176 1 20 . 1 1 116 116 MET H H 116 7.642 7.642 8.101 -0.459 25767 18177 1 20 . 1 1 117 117 LEU N N 117 125.503 125.503 119.278 6.225 25767 18178 1 20 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.037 0.208 25767 18179 1 20 . 1 1 117 117 LEU C C 117 178.445 178.445 179.362 -0.917 25767 18180 1 20 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.549 0.651 25767 18181 1 20 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.239 -1.149 25767 18182 1 20 . 1 1 117 117 LEU H H 117 8.157 8.157 7.483 0.674 25767 18183 1 20 . 1 1 118 118 LYS N N 118 119.052 119.052 119.069 -0.017 25767 18184 1 20 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.973 -0.168 25767 18185 1 20 . 1 1 118 118 LYS C C 118 178.251 178.251 179.321 -1.070 25767 18186 1 20 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.209 0.317 25767 18187 1 20 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.230 -0.102 25767 18188 1 20 . 1 1 118 118 LYS H H 118 7.400 7.400 7.590 -0.190 25767 18189 1 20 . 1 1 119 119 ARG N N 119 117.999 117.999 119.018 -1.019 25767 18190 1 20 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.285 -0.065 25767 18191 1 20 . 1 1 119 119 ARG C C 119 180.441 180.441 179.023 1.418 25767 18192 1 20 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.607 0.210 25767 18193 1 20 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.229 -0.144 25767 18194 1 20 . 1 1 119 119 ARG H H 119 8.265 8.265 7.977 0.288 25767 18195 1 20 . 1 1 120 120 SER N N 120 118.073 118.073 116.226 1.847 25767 18196 1 20 . 1 1 120 120 SER HA H 120 4.182 4.182 4.298 -0.116 25767 18197 1 20 . 1 1 120 120 SER C C 120 176.215 176.215 176.810 -0.595 25767 18198 1 20 . 1 1 120 120 SER CA C 120 62.817 62.817 61.845 0.972 25767 18199 1 20 . 1 1 120 120 SER CB C 120 63.550 63.550 62.977 0.573 25767 18200 1 20 . 1 1 120 120 SER H H 120 8.633 8.633 7.899 0.734 25767 18201 1 20 . 1 1 121 121 LEU N N 121 125.029 125.029 122.722 2.307 25767 18202 1 20 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.054 0.165 25767 18203 1 20 . 1 1 121 121 LEU C C 121 179.679 179.679 178.836 0.843 25767 18204 1 20 . 1 1 121 121 LEU CA C 121 58.849 58.849 57.696 1.153 25767 18205 1 20 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.422 -0.648 25767 18206 1 20 . 1 1 121 121 LEU H H 121 8.313 8.313 7.723 0.590 25767 18207 1 20 . 1 1 122 122 TRP N N 122 120.217 120.217 119.834 0.383 25767 18208 1 20 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.401 -0.061 25767 18209 1 20 . 1 1 122 122 TRP C C 122 177.527 177.527 178.860 -1.333 25767 18210 1 20 . 1 1 122 122 TRP CA C 122 61.758 61.758 61.462 0.296 25767 18211 1 20 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.067 0.581 25767 18212 1 20 . 1 1 122 122 TRP H H 122 7.928 7.928 7.914 0.014 25767 18213 1 20 . 1 1 123 123 CYS N N 123 119.669 119.669 118.829 0.840 25767 18214 1 20 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.319 -0.112 25767 18215 1 20 . 1 1 123 123 CYS C C 123 177.057 177.057 177.122 -0.065 25767 18216 1 20 . 1 1 123 123 CYS CA C 123 62.600 62.600 63.971 -1.371 25767 18217 1 20 . 1 1 123 123 CYS CB C 123 25.899 25.899 27.322 -1.423 25767 18218 1 20 . 1 1 123 123 CYS H H 123 8.273 8.273 8.265 0.008 25767 18219 1 20 . 1 1 124 124 CYS N N 124 116.898 116.898 119.690 -2.792 25767 18220 1 20 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.114 -0.266 25767 18221 1 20 . 1 1 124 124 CYS C C 124 175.759 175.759 176.744 -0.985 25767 18222 1 20 . 1 1 124 124 CYS CA C 124 65.653 65.653 65.421 0.232 25767 18223 1 20 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.673 -0.156 25767 18224 1 20 . 1 1 124 124 CYS H H 124 8.122 8.122 8.062 0.060 25767 18225 1 20 . 1 1 125 125 ILE N N 125 120.498 120.498 120.638 -0.140 25767 18226 1 20 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.705 -0.117 25767 18227 1 20 . 1 1 125 125 ILE C C 125 179.337 179.337 177.765 1.572 25767 18228 1 20 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.739 1.855 25767 18229 1 20 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.535 0.144 25767 18230 1 20 . 1 1 125 125 ILE H H 125 8.092 8.092 8.231 -0.139 25767 18231 1 20 . 1 1 126 126 ASP N N 126 125.084 125.084 120.812 4.272 25767 18232 1 20 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.458 0.159 25767 18233 1 20 . 1 1 126 126 ASP C C 126 178.299 178.299 178.992 -0.693 25767 18234 1 20 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.635 1.369 25767 18235 1 20 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.189 0.107 25767 18236 1 20 . 1 1 126 126 ASP H H 126 9.049 9.049 8.092 0.957 25767 18237 1 20 . 1 1 127 127 LEU N N 127 122.591 122.591 120.256 2.335 25767 18238 1 20 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.819 0.048 25767 18239 1 20 . 1 1 127 127 LEU C C 127 179.655 179.655 178.879 0.776 25767 18240 1 20 . 1 1 127 127 LEU CA C 127 58.661 58.661 58.104 0.557 25767 18241 1 20 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.586 0.608 25767 18242 1 20 . 1 1 127 127 LEU H H 127 8.888 8.888 7.719 1.169 25767 18243 1 20 . 1 1 128 128 PHE N N 128 117.498 117.498 118.795 -1.297 25767 18244 1 20 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.154 0.168 25767 18245 1 20 . 1 1 128 128 PHE C C 128 178.533 178.533 177.963 0.570 25767 18246 1 20 . 1 1 128 128 PHE CA C 128 60.932 60.932 62.398 -1.466 25767 18247 1 20 . 1 1 128 128 PHE CB C 128 39.053 39.053 38.613 0.440 25767 18248 1 20 . 1 1 128 128 PHE H H 128 8.947 8.947 8.004 0.943 25767 18249 1 20 . 1 1 129 129 SER N N 129 115.398 115.398 115.707 -0.309 25767 18250 1 20 . 1 1 129 129 SER HA H 129 4.046 4.046 4.373 -0.327 25767 18251 1 20 . 1 1 129 129 SER C C 129 175.168 175.168 176.967 -1.799 25767 18252 1 20 . 1 1 129 129 SER CA C 129 63.015 63.015 62.155 0.860 25767 18253 1 20 . 1 1 129 129 SER H H 129 8.578 8.578 8.909 -0.332 25767 18254 1 20 . 1 1 130 130 CYS N N 130 125.556 125.556 120.404 5.152 25767 18255 1 20 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.284 -0.175 25767 18256 1 20 . 1 1 130 130 CYS C C 130 175.294 175.294 176.887 -1.593 25767 18257 1 20 . 1 1 130 130 CYS CA C 130 61.438 61.438 63.782 -2.344 25767 18258 1 20 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.011 0.039 25767 18259 1 20 . 1 1 130 130 CYS H H 130 8.289 8.289 8.408 -0.119 25767 18260 1 20 . 1 1 131 131 ILE N N 131 120.232 120.232 119.524 0.708 25767 18261 1 20 . 1 1 131 131 ILE HA H 131 4.033 4.033 4.567 -0.534 25767 18262 1 20 . 1 1 131 131 ILE C C 131 177.297 177.297 178.173 -0.876 25767 18263 1 20 . 1 1 131 131 ILE CA C 131 64.652 64.652 64.825 -0.173 25767 18264 1 20 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.785 1.317 25767 18265 1 20 . 1 1 131 131 ILE H H 131 7.943 7.943 8.064 -0.121 25767 18266 1 20 . 1 1 132 132 LEU N N 132 116.422 116.422 121.611 -5.189 25767 18267 1 20 . 1 1 132 132 LEU HA H 132 3.845 3.845 4.022 -0.177 25767 18268 1 20 . 1 1 132 132 LEU C C 132 177.816 177.816 177.759 0.057 25767 18269 1 20 . 1 1 132 132 LEU CA C 132 57.078 57.078 58.335 -1.257 25767 18270 1 20 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.823 0.390 25767 18271 1 20 . 1 1 132 132 LEU H H 132 7.846 7.846 8.455 -0.609 25767 18272 1 20 . 1 1 133 133 HIS N N 133 116.929 116.929 117.000 -0.071 25767 18273 1 20 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.428 -0.289 25767 18274 1 20 . 1 1 133 133 HIS C C 133 178.669 178.669 178.483 0.186 25767 18275 1 20 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.473 0.263 25767 18276 1 20 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.593 2.559 25767 18277 1 20 . 1 1 133 133 HIS H H 133 7.822 7.822 7.924 -0.102 25767 18278 1 20 . 1 1 134 134 LEU N N 134 116.898 116.898 122.324 -5.426 25767 18279 1 20 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.168 -0.435 25767 18280 1 20 . 1 1 134 134 LEU C C 134 179.402 179.402 178.688 0.714 25767 18281 1 20 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.827 -0.600 25767 18282 1 20 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.109 -2.570 25767 18283 1 20 . 1 1 134 134 LEU H H 134 8.688 8.688 7.966 0.722 25767 18284 1 20 . 1 1 135 135 TRP N N 135 115.602 115.602 116.515 -0.913 25767 18285 1 20 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.708 0.300 25767 18286 1 20 . 1 1 135 135 TRP C C 135 175.022 175.022 177.528 -2.506 25767 18287 1 20 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.020 1.406 25767 18288 1 20 . 1 1 135 135 TRP CB C 135 27.085 27.085 29.043 -1.958 25767 18289 1 20 . 1 1 135 135 TRP H H 135 7.638 7.638 8.670 -1.032 25767 18290 1 20 . 1 1 136 136 LYS N N 136 119.721 119.721 122.358 -2.637 25767 18291 1 20 . 1 1 136 136 LYS HA H 136 3.816 3.816 4.003 -0.187 25767 18292 1 20 . 1 1 136 136 LYS C C 136 178.279 178.279 178.428 -0.149 25767 18293 1 20 . 1 1 136 136 LYS CA C 136 60.193 60.193 60.144 0.049 25767 18294 1 20 . 1 1 136 136 LYS CB C 136 33.057 33.057 32.076 0.981 25767 18295 1 20 . 1 1 136 136 LYS H H 136 6.538 6.538 7.619 -1.081 25767 18296 1 20 . 1 1 137 137 GLU N N 137 115.407 115.407 115.114 0.293 25767 18297 1 20 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.198 -0.031 25767 18298 1 20 . 1 1 137 137 GLU C C 137 176.700 176.700 177.249 -0.549 25767 18299 1 20 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.346 -0.497 25767 18300 1 20 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.089 0.071 25767 18301 1 20 . 1 1 137 137 GLU H H 137 8.596 8.596 8.411 0.185 25767 18302 1 20 . 1 1 138 138 ASN N N 138 116.669 116.669 117.002 -0.333 25767 18303 1 20 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.804 0.102 25767 18304 1 20 . 1 1 138 138 ASN C C 138 173.481 173.481 175.000 -1.519 25767 18305 1 20 . 1 1 138 138 ASN CA C 138 52.814 52.814 54.140 -1.326 25767 18306 1 20 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.778 1.059 25767 18307 1 20 . 1 1 138 138 ASN H H 138 8.343 8.343 8.200 0.143 25767 18308 1 20 . 1 1 139 139 ILE N N 139 120.703 120.703 120.324 0.379 25767 18309 1 20 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.247 0.097 25767 18310 1 20 . 1 1 139 139 ILE C C 139 175.241 175.241 174.749 0.492 25767 18311 1 20 . 1 1 139 139 ILE CA C 139 60.792 60.792 60.483 0.308 25767 18312 1 20 . 1 1 139 139 ILE CB C 139 40.274 40.274 40.385 -0.111 25767 18313 1 20 . 1 1 139 139 ILE H H 139 7.167 7.167 7.370 -0.203 25767 18314 1 20 . 1 1 140 140 SER N N 140 123.284 123.284 120.002 3.282 25767 18315 1 20 . 1 1 140 140 SER HA H 140 4.345 4.345 4.538 -0.193 25767 18316 1 20 . 1 1 140 140 SER CA C 140 58.095 58.095 57.814 0.281 25767 18317 1 20 . 1 1 140 140 SER CB C 140 65.370 65.370 64.352 1.018 25767 18318 1 20 . 1 1 140 140 SER H H 140 8.727 8.727 8.465 0.262 25767 18319 1 20 . 1 1 142 142 THR N N 142 113.868 113.868 115.650 -1.782 25767 18320 1 20 . 1 1 142 142 THR HA H 142 3.976 3.976 4.218 -0.242 25767 18321 1 20 . 1 1 142 142 THR C C 142 177.559 177.559 176.758 0.801 25767 18322 1 20 . 1 1 142 142 THR CA C 142 66.007 66.007 65.886 0.121 25767 18323 1 20 . 1 1 142 142 THR CB C 142 68.530 68.530 68.452 0.078 25767 18324 1 20 . 1 1 142 142 THR H H 142 8.243 8.243 8.206 0.037 25767 18325 1 20 . 1 1 143 143 SER N N 143 120.786 120.786 117.876 2.910 25767 18326 1 20 . 1 1 143 143 SER C C 143 175.844 175.844 176.806 -0.962 25767 18327 1 20 . 1 1 143 143 SER CA C 143 62.102 62.102 62.438 -0.336 25767 18328 1 20 . 1 1 143 143 SER CB C 143 63.086 63.086 62.616 0.470 25767 18329 1 20 . 1 1 143 143 SER H H 143 7.915 7.915 8.255 -0.340 25767 18330 1 20 . 1 1 144 144 THR N N 144 120.946 120.946 118.554 2.392 25767 18331 1 20 . 1 1 144 144 THR HA H 144 4.299 4.299 4.066 0.233 25767 18332 1 20 . 1 1 144 144 THR C C 144 175.874 175.874 175.922 -0.048 25767 18333 1 20 . 1 1 144 144 THR CA C 144 67.487 67.487 66.625 0.862 25767 18334 1 20 . 1 1 144 144 THR CB C 144 68.485 68.485 68.781 -0.296 25767 18335 1 20 . 1 1 144 144 THR H H 144 8.746 8.746 8.487 0.259 25767 18336 1 20 . 1 1 145 145 ASN N N 145 120.069 120.069 119.387 0.682 25767 18337 1 20 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.371 -0.063 25767 18338 1 20 . 1 1 145 145 ASN C C 145 177.917 177.917 177.515 0.402 25767 18339 1 20 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.824 -0.487 25767 18340 1 20 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.519 -0.419 25767 18341 1 20 . 1 1 145 145 ASN H H 145 7.940 7.940 7.955 -0.015 25767 18342 1 20 . 1 1 146 146 SER N N 146 116.905 116.905 116.360 0.545 25767 18343 1 20 . 1 1 146 146 SER HA H 146 3.936 3.936 4.202 -0.266 25767 18344 1 20 . 1 1 146 146 SER C C 146 176.963 176.963 176.616 0.347 25767 18345 1 20 . 1 1 146 146 SER CA C 146 61.997 61.997 61.856 0.141 25767 18346 1 20 . 1 1 146 146 SER CB C 146 62.879 62.879 62.725 0.154 25767 18347 1 20 . 1 1 146 146 SER H H 146 7.951 7.951 7.872 0.079 25767 18348 1 20 . 1 1 147 147 LEU N N 147 123.253 123.253 122.629 0.624 25767 18349 1 20 . 1 1 147 147 LEU HA H 147 3.875 3.875 4.004 -0.129 25767 18350 1 20 . 1 1 147 147 LEU C C 147 178.726 178.726 178.374 0.352 25767 18351 1 20 . 1 1 147 147 LEU CA C 147 58.580 58.580 57.666 0.915 25767 18352 1 20 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.849 -0.989 25767 18353 1 20 . 1 1 147 147 LEU H H 147 8.168 8.168 7.661 0.507 25767 18354 1 20 . 1 1 148 148 GLN N N 148 118.212 118.212 118.205 0.007 25767 18355 1 20 . 1 1 148 148 GLN HA H 148 3.817 3.817 3.922 -0.105 25767 18356 1 20 . 1 1 148 148 GLN C C 148 179.686 179.686 178.584 1.102 25767 18357 1 20 . 1 1 148 148 GLN CA C 148 59.243 59.243 59.126 0.117 25767 18358 1 20 . 1 1 148 148 GLN CB C 148 27.720 27.720 28.259 -0.539 25767 18359 1 20 . 1 1 148 148 GLN H H 148 8.295 8.295 8.908 -0.613 25767 18360 1 20 . 1 1 149 149 LYS N N 149 120.770 120.770 120.201 0.569 25767 18361 1 20 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.953 -0.052 25767 18362 1 20 . 1 1 149 149 LYS C C 149 178.006 178.006 179.048 -1.042 25767 18363 1 20 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.551 -0.019 25767 18364 1 20 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.198 -0.306 25767 18365 1 20 . 1 1 149 149 LYS H H 149 7.955 7.955 7.994 -0.039 25767 18366 1 20 . 1 1 150 150 ARG N N 150 119.244 119.244 119.327 -0.083 25767 18367 1 20 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.929 -0.089 25767 18368 1 20 . 1 1 150 150 ARG C C 150 178.858 178.858 178.706 0.152 25767 18369 1 20 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.208 0.163 25767 18370 1 20 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.931 -1.127 25767 18371 1 20 . 1 1 150 150 ARG H H 150 7.020 7.020 7.561 -0.541 25767 18372 1 20 . 1 1 151 151 ILE N N 151 121.183 121.183 119.861 1.322 25767 18373 1 20 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.377 -0.018 25767 18374 1 20 . 1 1 151 151 ILE C C 151 177.327 177.327 177.426 -0.099 25767 18375 1 20 . 1 1 151 151 ILE CA C 151 67.196 67.196 65.141 2.055 25767 18376 1 20 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.429 0.843 25767 18377 1 20 . 1 1 151 151 ILE H H 151 7.574 7.574 7.616 -0.042 25767 18378 1 20 . 1 1 152 152 LYS N N 152 119.521 119.521 120.403 -0.882 25767 18379 1 20 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.792 -0.019 25767 18380 1 20 . 1 1 152 152 LYS C C 152 178.016 178.016 178.364 -0.348 25767 18381 1 20 . 1 1 152 152 LYS CA C 152 59.830 59.830 59.995 -0.165 25767 18382 1 20 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.304 -0.723 25767 18383 1 20 . 1 1 152 152 LYS H H 152 7.629 7.629 7.726 -0.097 25767 18384 1 20 . 1 1 153 153 TYR N N 153 120.178 120.178 120.523 -0.345 25767 18385 1 20 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.101 -0.029 25767 18386 1 20 . 1 1 153 153 TYR C C 153 178.195 178.195 177.870 0.325 25767 18387 1 20 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.868 -0.552 25767 18388 1 20 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.377 -1.104 25767 18389 1 20 . 1 1 153 153 TYR H H 153 8.407 8.407 7.821 0.586 25767 18390 1 20 . 1 1 154 154 CYS N N 154 117.013 117.013 118.121 -1.108 25767 18391 1 20 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.259 -0.187 25767 18392 1 20 . 1 1 154 154 CYS C C 154 176.827 176.827 176.890 -0.063 25767 18393 1 20 . 1 1 154 154 CYS CA C 154 65.780 65.780 62.374 3.405 25767 18394 1 20 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.041 1.119 25767 18395 1 20 . 1 1 154 154 CYS H H 154 8.291 8.291 7.719 0.572 25767 18396 1 20 . 1 1 155 155 LYS N N 155 118.753 118.753 121.127 -2.374 25767 18397 1 20 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.852 -0.181 25767 18398 1 20 . 1 1 155 155 LYS C C 155 179.904 179.904 178.866 1.038 25767 18399 1 20 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.517 0.967 25767 18400 1 20 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.184 -0.241 25767 18401 1 20 . 1 1 155 155 LYS H H 155 7.934 7.934 7.956 -0.022 25767 18402 1 20 . 1 1 156 156 ILE N N 156 123.873 123.873 120.404 3.469 25767 18403 1 20 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.518 0.066 25767 18404 1 20 . 1 1 156 156 ILE C C 156 179.501 179.501 177.420 2.081 25767 18405 1 20 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.511 -0.271 25767 18406 1 20 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.822 -0.180 25767 18407 1 20 . 1 1 156 156 ILE H H 156 8.314 8.314 8.408 -0.094 25767 18408 1 20 . 1 1 157 157 TYR N N 157 121.132 121.132 119.992 1.140 25767 18409 1 20 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.945 0.220 25767 18410 1 20 . 1 1 157 157 TYR C C 157 178.558 178.558 177.483 1.075 25767 18411 1 20 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.980 0.130 25767 18412 1 20 . 1 1 157 157 TYR H H 157 8.442 8.442 7.695 0.747 25767 18413 1 20 . 1 1 158 158 LEU N N 158 120.964 120.964 119.880 1.084 25767 18414 1 20 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.858 0.054 25767 18415 1 20 . 1 1 158 158 LEU C C 158 180.130 180.130 178.698 1.432 25767 18416 1 20 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.916 0.770 25767 18417 1 20 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.567 0.163 25767 18418 1 20 . 1 1 158 158 LEU H H 158 8.469 8.469 7.861 0.608 25767 18419 1 20 . 1 1 159 159 SER N N 159 116.653 116.653 115.599 1.054 25767 18420 1 20 . 1 1 159 159 SER HA H 159 4.246 4.246 4.069 0.177 25767 18421 1 20 . 1 1 159 159 SER CA C 159 61.460 61.460 62.047 -0.587 25767 18422 1 20 . 1 1 159 159 SER CB C 159 62.849 62.849 62.528 0.321 25767 18423 1 20 . 1 1 159 159 SER H H 159 7.758 7.758 8.500 -0.742 25767 18424 1 20 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.395 -2.022 25767 18425 1 20 . 1 1 160 160 LYS CB C 160 29.832 29.832 32.208 -2.376 25767 18426 1 20 . 1 1 160 160 LYS H H 160 8.425 8.425 7.800 0.625 25767 18427 1 20 . 1 1 161 161 LEU N N 161 121.686 121.686 119.273 2.413 25767 18428 1 20 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.735 0.428 25767 18429 1 20 . 1 1 161 161 LEU C C 161 180.224 180.224 179.074 1.150 25767 18430 1 20 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.218 0.367 25767 18431 1 20 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.425 0.037 25767 18432 1 20 . 1 1 161 161 LEU H H 161 8.323 8.323 7.824 0.499 25767 18433 1 20 . 1 1 162 162 ALA N N 162 123.102 123.102 122.511 0.591 25767 18434 1 20 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.053 0.077 25767 18435 1 20 . 1 1 162 162 ALA C C 162 179.487 179.487 178.984 0.503 25767 18436 1 20 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.616 0.128 25767 18437 1 20 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.445 -0.042 25767 18438 1 20 . 1 1 162 162 ALA H H 162 7.978 7.978 7.917 0.061 25767 18439 1 20 . 1 1 163 163 LYS N N 163 116.069 116.069 116.308 -0.239 25767 18440 1 20 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.201 0.022 25767 18441 1 20 . 1 1 163 163 LYS C C 163 176.987 176.987 177.106 -0.119 25767 18442 1 20 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.346 0.260 25767 18443 1 20 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.705 0.501 25767 18444 1 20 . 1 1 163 163 LYS H H 163 7.697 7.697 7.576 0.121 25767 18445 1 20 . 1 1 164 164 GLY N N 164 108.540 108.540 107.090 1.450 25767 18446 1 20 . 1 1 164 164 GLY C C 164 174.721 174.721 174.222 0.499 25767 18447 1 20 . 1 1 164 164 GLY CA C 164 45.791 45.791 45.042 0.749 25767 18448 1 20 . 1 1 164 164 GLY H H 164 7.772 7.772 7.802 -0.030 25767 18449 1 20 . 1 1 165 165 GLU N N 165 119.886 119.886 121.171 -1.285 25767 18450 1 20 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.296 -0.246 25767 18451 1 20 . 1 1 165 165 GLU C C 165 176.027 176.027 174.881 1.146 25767 18452 1 20 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.549 1.304 25767 18453 1 20 . 1 1 165 165 GLU CB C 165 30.338 30.338 30.233 0.105 25767 18454 1 20 . 1 1 165 165 GLU H H 165 8.065 8.065 7.718 0.347 25767 18455 1 20 . 1 1 166 166 ILE N N 166 117.926 117.926 122.639 -4.713 25767 18456 1 20 . 1 1 166 166 ILE HA H 166 3.902 3.902 4.058 -0.156 25767 18457 1 20 . 1 1 166 166 ILE C C 166 174.138 174.138 173.913 0.225 25767 18458 1 20 . 1 1 166 166 ILE CA C 166 60.455 60.455 60.059 0.396 25767 18459 1 20 . 1 1 166 166 ILE CB C 166 40.202 40.202 40.749 -0.547 25767 18460 1 20 . 1 1 166 166 ILE H H 166 7.282 7.282 7.714 -0.432 25767 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 156 2.216 -0.560 2.151 25767 2 1 1 "Average Difference" HA 150 0.214 0.058 0.207 25767 3 1 1 "Average Difference" C 146 0.992 0.039 0.994 25767 4 1 1 "Average Difference" CA 161 1.116 -0.076 1.117 25767 5 1 1 "Average Difference" CB 150 0.974 0.040 0.976 25767 6 1 1 "Average Difference" HN 160 0.512 -0.056 0.510 25767 7 1 2 "Average Difference" N 156 2.147 -0.621 2.061 25767 8 1 2 "Average Difference" HA 150 0.220 0.043 0.217 25767 9 1 2 "Average Difference" C 146 1.042 -0.002 1.045 25767 10 1 2 "Average Difference" CA 161 1.089 0.027 1.092 25767 11 1 2 "Average Difference" CB 150 0.944 0.092 0.942 25767 12 1 2 "Average Difference" HN 160 0.517 -0.059 0.515 25767 13 1 3 "Average Difference" N 156 2.255 -0.586 2.185 25767 14 1 3 "Average Difference" HA 150 0.227 0.045 0.223 25767 15 1 3 "Average Difference" C 146 0.993 -0.007 0.996 25767 16 1 3 "Average Difference" CA 161 1.076 0.027 1.079 25767 17 1 3 "Average Difference" CB 150 0.940 0.095 0.939 25767 18 1 3 "Average Difference" HN 160 0.515 -0.048 0.514 25767 19 1 4 "Average Difference" N 156 2.284 -0.618 2.205 25767 20 1 4 "Average Difference" HA 150 0.211 0.048 0.206 25767 21 1 4 "Average Difference" C 146 1.016 0.013 1.019 25767 22 1 4 "Average Difference" CA 161 1.012 -0.067 1.013 25767 23 1 4 "Average Difference" CB 150 0.921 0.042 0.923 25767 24 1 4 "Average Difference" HN 160 0.505 -0.046 0.504 25767 25 1 5 "Average Difference" N 156 2.203 -0.598 2.127 25767 26 1 5 "Average Difference" HA 150 0.214 0.048 0.209 25767 27 1 5 "Average Difference" C 146 0.986 0.027 0.989 25767 28 1 5 "Average Difference" CA 161 1.084 0.009 1.087 25767 29 1 5 "Average Difference" CB 150 0.929 0.058 0.930 25767 30 1 5 "Average Difference" HN 160 0.545 -0.051 0.544 25767 31 1 6 "Average Difference" N 156 2.191 -0.555 2.126 25767 32 1 6 "Average Difference" HA 150 0.224 0.041 0.221 25767 33 1 6 "Average Difference" C 146 0.980 0.029 0.983 25767 34 1 6 "Average Difference" CA 161 1.012 0.049 1.014 25767 35 1 6 "Average Difference" CB 150 0.931 0.073 0.931 25767 36 1 6 "Average Difference" HN 160 0.472 -0.040 0.472 25767 37 1 7 "Average Difference" N 156 2.209 -0.594 2.135 25767 38 1 7 "Average Difference" HA 150 0.219 0.030 0.218 25767 39 1 7 "Average Difference" C 146 0.992 -0.034 0.994 25767 40 1 7 "Average Difference" CA 161 1.150 -0.090 1.150 25767 41 1 7 "Average Difference" CB 150 0.928 0.016 0.931 25767 42 1 7 "Average Difference" HN 160 0.524 -0.053 0.523 25767 43 1 8 "Average Difference" N 156 2.184 -0.592 2.109 25767 44 1 8 "Average Difference" HA 150 0.223 0.050 0.218 25767 45 1 8 "Average Difference" C 146 0.992 0.006 0.995 25767 46 1 8 "Average Difference" CA 161 1.116 0.027 1.119 25767 47 1 8 "Average Difference" CB 150 0.951 0.100 0.949 25767 48 1 8 "Average Difference" HN 160 0.510 -0.037 0.511 25767 49 1 9 "Average Difference" N 156 2.226 -0.561 2.161 25767 50 1 9 "Average Difference" HA 150 0.231 0.043 0.227 25767 51 1 9 "Average Difference" C 146 0.987 0.026 0.990 25767 52 1 9 "Average Difference" CA 161 1.092 -0.005 1.095 25767 53 1 9 "Average Difference" CB 150 0.969 0.049 0.971 25767 54 1 9 "Average Difference" HN 160 0.527 -0.010 0.529 25767 55 1 10 "Average Difference" N 156 2.211 -0.600 2.135 25767 56 1 10 "Average Difference" HA 150 0.219 0.044 0.215 25767 57 1 10 "Average Difference" C 146 0.997 0.013 1.000 25767 58 1 10 "Average Difference" CA 161 1.152 0.003 1.156 25767 59 1 10 "Average Difference" CB 150 0.979 0.058 0.981 25767 60 1 10 "Average Difference" HN 160 0.519 -0.044 0.519 25767 61 1 11 "Average Difference" N 156 2.189 -0.636 2.102 25767 62 1 11 "Average Difference" HA 150 0.210 0.036 0.207 25767 63 1 11 "Average Difference" C 146 1.021 0.001 1.025 25767 64 1 11 "Average Difference" CA 161 1.129 0.021 1.132 25767 65 1 11 "Average Difference" CB 150 0.944 0.073 0.944 25767 66 1 11 "Average Difference" HN 160 0.509 -0.057 0.507 25767 67 1 12 "Average Difference" N 156 2.184 -0.585 2.111 25767 68 1 12 "Average Difference" HA 150 0.217 0.055 0.210 25767 69 1 12 "Average Difference" C 146 1.019 0.029 1.022 25767 70 1 12 "Average Difference" CA 161 1.133 0.011 1.137 25767 71 1 12 "Average Difference" CB 150 0.941 0.066 0.942 25767 72 1 12 "Average Difference" HN 160 0.559 -0.036 0.559 25767 73 1 13 "Average Difference" N 156 2.216 -0.651 2.125 25767 74 1 13 "Average Difference" HA 150 0.215 0.045 0.211 25767 75 1 13 "Average Difference" C 146 1.008 -0.013 1.011 25767 76 1 13 "Average Difference" CA 161 1.120 0.018 1.124 25767 77 1 13 "Average Difference" CB 150 0.962 0.101 0.959 25767 78 1 13 "Average Difference" HN 160 0.515 -0.054 0.514 25767 79 1 14 "Average Difference" N 156 2.142 -0.624 2.056 25767 80 1 14 "Average Difference" HA 150 0.217 0.042 0.214 25767 81 1 14 "Average Difference" C 146 0.991 0.010 0.994 25767 82 1 14 "Average Difference" CA 161 1.080 -0.042 1.083 25767 83 1 14 "Average Difference" CB 150 0.943 0.108 0.940 25767 84 1 14 "Average Difference" HN 160 0.520 -0.070 0.517 25767 85 1 15 "Average Difference" N 156 2.282 -0.613 2.206 25767 86 1 15 "Average Difference" HA 150 0.229 0.056 0.223 25767 87 1 15 "Average Difference" C 146 0.983 -0.014 0.986 25767 88 1 15 "Average Difference" CA 161 1.105 -0.016 1.108 25767 89 1 15 "Average Difference" CB 150 0.933 0.066 0.934 25767 90 1 15 "Average Difference" HN 160 0.498 -0.057 0.497 25767 91 1 16 "Average Difference" N 156 2.228 -0.550 2.166 25767 92 1 16 "Average Difference" HA 150 0.223 0.042 0.220 25767 93 1 16 "Average Difference" C 146 1.003 -0.010 1.007 25767 94 1 16 "Average Difference" CA 161 1.072 -0.005 1.076 25767 95 1 16 "Average Difference" CB 150 0.935 0.081 0.934 25767 96 1 16 "Average Difference" HN 160 0.536 -0.056 0.535 25767 97 1 17 "Average Difference" N 156 2.293 -0.558 2.231 25767 98 1 17 "Average Difference" HA 150 0.220 0.049 0.215 25767 99 1 17 "Average Difference" C 146 0.982 -0.014 0.985 25767 100 1 17 "Average Difference" CA 161 1.099 0.017 1.103 25767 101 1 17 "Average Difference" CB 150 0.957 0.095 0.955 25767 102 1 17 "Average Difference" HN 160 0.507 -0.037 0.507 25767 103 1 18 "Average Difference" N 156 2.272 -0.601 2.198 25767 104 1 18 "Average Difference" HA 150 0.223 0.057 0.216 25767 105 1 18 "Average Difference" C 146 1.026 0.028 1.029 25767 106 1 18 "Average Difference" CA 161 1.137 -0.061 1.138 25767 107 1 18 "Average Difference" CB 150 0.952 0.083 0.952 25767 108 1 18 "Average Difference" HN 160 0.515 -0.034 0.516 25767 109 1 19 "Average Difference" N 156 2.329 -0.602 2.257 25767 110 1 19 "Average Difference" HA 150 0.216 0.042 0.212 25767 111 1 19 "Average Difference" C 146 1.036 -0.013 1.039 25767 112 1 19 "Average Difference" CA 161 1.111 0.004 1.114 25767 113 1 19 "Average Difference" CB 150 0.951 0.112 0.947 25767 114 1 19 "Average Difference" HN 160 0.524 -0.066 0.522 25767 115 1 20 "Average Difference" N 156 2.266 -0.599 2.192 25767 116 1 20 "Average Difference" HA 150 0.224 0.047 0.220 25767 117 1 20 "Average Difference" C 146 0.977 -0.041 0.980 25767 118 1 20 "Average Difference" CA 161 1.070 0.035 1.073 25767 119 1 20 "Average Difference" CB 150 0.934 0.122 0.929 25767 120 1 20 "Average Difference" HN 160 0.489 -0.055 0.487 25767 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 25767 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 ALA N N 2 122.811 122.811 123.937 -1.126 25767 2 1 . 1 1 2 2 ALA HA H 2 4.023 4.023 4.098 -0.075 25767 3 1 . 1 1 2 2 ALA C C 2 179.915 179.915 179.200 0.715 25767 4 1 . 1 1 2 2 ALA CA C 2 55.117 55.117 55.419 -0.302 25767 5 1 . 1 1 2 2 ALA CB C 2 18.539 18.539 18.479 0.060 25767 6 1 . 1 1 2 2 ALA H H 2 8.509 8.509 8.722 -0.213 25767 7 1 . 1 1 3 3 SER N N 3 115.308 115.308 114.180 1.128 25767 8 1 . 1 1 3 3 SER HA H 3 4.097 4.097 4.118 -0.021 25767 9 1 . 1 1 3 3 SER C C 3 176.706 176.706 176.320 0.386 25767 10 1 . 1 1 3 3 SER CA C 3 60.665 60.665 61.484 -0.819 25767 11 1 . 1 1 3 3 SER CB C 3 62.710 62.710 62.469 0.241 25767 12 1 . 1 1 3 3 SER H H 3 7.996 7.996 8.586 -0.590 25767 13 1 . 1 1 4 4 ASN N N 4 122.688 122.688 120.490 2.198 25767 14 1 . 1 1 4 4 ASN HA H 4 4.304 4.304 4.410 -0.106 25767 15 1 . 1 1 4 4 ASN C C 4 176.258 176.258 177.235 -0.977 25767 16 1 . 1 1 4 4 ASN CA C 4 55.701 55.701 56.048 -0.347 25767 17 1 . 1 1 4 4 ASN CB C 4 38.177 38.177 37.771 0.406 25767 18 1 . 1 1 4 4 ASN H H 4 8.075 8.075 8.160 -0.085 25767 19 1 . 1 1 5 5 ALA N N 5 121.900 121.900 122.392 -0.492 25767 20 1 . 1 1 5 5 ALA HA H 5 3.575 3.575 4.072 -0.497 25767 21 1 . 1 1 5 5 ALA C C 5 178.475 178.475 179.181 -0.706 25767 22 1 . 1 1 5 5 ALA CA C 5 55.833 55.833 54.991 0.842 25767 23 1 . 1 1 5 5 ALA CB C 5 17.615 17.615 18.269 -0.654 25767 24 1 . 1 1 5 5 ALA H H 5 8.659 8.659 7.692 0.967 25767 25 1 . 1 1 6 6 ALA N N 6 117.768 117.768 121.637 -3.869 25767 26 1 . 1 1 6 6 ALA HA H 6 3.787 3.787 3.985 -0.198 25767 27 1 . 1 1 6 6 ALA C C 6 180.494 180.494 179.439 1.055 25767 28 1 . 1 1 6 6 ALA CA C 6 55.350 55.350 55.072 0.278 25767 29 1 . 1 1 6 6 ALA CB C 6 17.902 17.902 18.090 -0.188 25767 30 1 . 1 1 6 6 ALA H H 6 7.864 7.864 7.802 0.062 25767 31 1 . 1 1 7 7 ARG N N 7 121.173 121.173 119.192 1.981 25767 32 1 . 1 1 7 7 ARG HA H 7 3.903 3.903 4.094 -0.191 25767 33 1 . 1 1 7 7 ARG C C 7 179.189 179.189 178.620 0.569 25767 34 1 . 1 1 7 7 ARG CA C 7 59.312 59.312 58.633 0.679 25767 35 1 . 1 1 7 7 ARG CB C 7 29.222 29.222 29.864 -0.642 25767 36 1 . 1 1 7 7 ARG H H 7 7.514 7.514 8.046 -0.532 25767 37 1 . 1 1 8 8 VAL N N 8 122.979 122.979 119.889 3.090 25767 38 1 . 1 1 8 8 VAL HA H 8 3.253 3.253 3.738 -0.485 25767 39 1 . 1 1 8 8 VAL C C 8 177.821 177.821 178.105 -0.284 25767 40 1 . 1 1 8 8 VAL CA C 8 67.772 67.772 66.645 1.127 25767 41 1 . 1 1 8 8 VAL CB C 8 31.441 31.441 31.401 0.040 25767 42 1 . 1 1 8 8 VAL H H 8 8.101 8.101 7.746 0.355 25767 43 1 . 1 1 9 9 VAL N N 9 119.801 119.801 120.204 -0.403 25767 44 1 . 1 1 9 9 VAL HA H 9 3.266 3.266 3.586 -0.320 25767 45 1 . 1 1 9 9 VAL C C 9 177.373 177.373 177.665 -0.292 25767 46 1 . 1 1 9 9 VAL CA C 9 67.484 67.484 66.610 0.874 25767 47 1 . 1 1 9 9 VAL CB C 9 31.625 31.625 30.822 0.803 25767 48 1 . 1 1 9 9 VAL H H 9 8.362 8.362 7.948 0.414 25767 49 1 . 1 1 10 10 ALA N N 10 122.360 122.360 121.609 0.751 25767 50 1 . 1 1 10 10 ALA HA H 10 3.936 3.936 4.046 -0.110 25767 51 1 . 1 1 10 10 ALA C C 10 180.762 180.762 179.591 1.171 25767 52 1 . 1 1 10 10 ALA CA C 10 55.444 55.444 55.555 -0.111 25767 53 1 . 1 1 10 10 ALA CB C 10 17.737 17.737 18.194 -0.457 25767 54 1 . 1 1 10 10 ALA H H 10 7.776 7.776 7.801 -0.025 25767 55 1 . 1 1 11 11 THR N N 11 117.376 117.376 113.324 4.052 25767 56 1 . 1 1 11 11 THR HA H 11 3.816 3.816 4.053 -0.237 25767 57 1 . 1 1 11 11 THR C C 11 175.775 175.775 176.397 -0.622 25767 58 1 . 1 1 11 11 THR CA C 11 66.509 66.509 65.887 0.622 25767 59 1 . 1 1 11 11 THR CB C 11 68.588 68.588 68.785 -0.197 25767 60 1 . 1 1 11 11 THR H H 11 8.180 8.180 7.841 0.339 25767 61 1 . 1 1 12 12 ALA N N 12 125.308 125.308 124.757 0.551 25767 62 1 . 1 1 12 12 ALA HA H 12 3.997 3.997 3.844 0.153 25767 63 1 . 1 1 12 12 ALA C C 12 179.399 179.399 179.403 -0.004 25767 64 1 . 1 1 12 12 ALA CA C 12 56.076 56.076 55.528 0.548 25767 65 1 . 1 1 12 12 ALA CB C 12 19.244 19.244 18.260 0.984 25767 66 1 . 1 1 12 12 ALA H H 12 8.671 8.671 8.489 0.182 25767 67 1 . 1 1 13 13 LYS N N 13 116.977 116.977 118.168 -1.191 25767 68 1 . 1 1 13 13 LYS C C 13 179.646 179.646 178.744 0.902 25767 69 1 . 1 1 13 13 LYS CA C 13 58.921 58.921 59.827 -0.906 25767 70 1 . 1 1 13 13 LYS CB C 13 31.443 31.443 32.173 -0.730 25767 71 1 . 1 1 13 13 LYS H H 13 8.061 8.061 7.852 0.209 25767 72 1 . 1 1 14 14 ASP N N 14 121.988 121.988 120.125 1.863 25767 73 1 . 1 1 14 14 ASP HA H 14 4.353 4.353 4.450 -0.097 25767 74 1 . 1 1 14 14 ASP C C 14 179.446 179.446 178.664 0.782 25767 75 1 . 1 1 14 14 ASP CA C 14 57.509 57.509 56.970 0.538 25767 76 1 . 1 1 14 14 ASP CB C 14 40.001 40.001 40.559 -0.558 25767 77 1 . 1 1 14 14 ASP H H 14 7.669 7.669 7.682 -0.013 25767 78 1 . 1 1 15 15 PHE N N 15 119.588 119.588 118.297 1.291 25767 79 1 . 1 1 15 15 PHE HA H 15 4.344 4.344 4.202 0.142 25767 80 1 . 1 1 15 15 PHE C C 15 178.373 178.373 178.024 0.349 25767 81 1 . 1 1 15 15 PHE CA C 15 62.237 62.237 61.283 0.954 25767 82 1 . 1 1 15 15 PHE CB C 15 37.496 37.496 38.674 -1.178 25767 83 1 . 1 1 15 15 PHE H H 15 7.913 7.913 8.423 -0.510 25767 84 1 . 1 1 16 16 ASP N N 16 121.705 121.705 119.862 1.843 25767 85 1 . 1 1 16 16 ASP HA H 16 3.995 3.995 4.444 -0.449 25767 86 1 . 1 1 16 16 ASP C C 16 180.071 180.071 179.032 1.039 25767 87 1 . 1 1 16 16 ASP CA C 16 58.149 58.149 57.236 0.914 25767 88 1 . 1 1 16 16 ASP CB C 16 41.487 41.487 40.634 0.853 25767 89 1 . 1 1 16 16 ASP H H 16 8.324 8.324 8.139 0.185 25767 90 1 . 1 1 17 17 LYS N N 17 118.825 118.825 119.259 -0.434 25767 91 1 . 1 1 17 17 LYS HA H 17 4.037 4.037 4.099 -0.062 25767 92 1 . 1 1 17 17 LYS C C 17 178.407 178.407 178.012 0.395 25767 93 1 . 1 1 17 17 LYS CA C 17 59.061 59.061 58.875 0.186 25767 94 1 . 1 1 17 17 LYS CB C 17 32.584 32.584 32.556 0.028 25767 95 1 . 1 1 17 17 LYS H H 17 7.834 7.834 7.736 0.098 25767 96 1 . 1 1 18 18 VAL N N 18 110.562 110.562 117.168 -6.606 25767 97 1 . 1 1 18 18 VAL HA H 18 4.516 4.516 4.047 0.469 25767 98 1 . 1 1 18 18 VAL C C 18 176.144 176.144 176.530 -0.386 25767 99 1 . 1 1 18 18 VAL CA C 18 60.874 60.874 63.038 -2.164 25767 100 1 . 1 1 18 18 VAL CB C 18 31.160 31.160 31.932 -0.772 25767 101 1 . 1 1 18 18 VAL H H 18 7.185 7.185 7.540 -0.355 25767 102 1 . 1 1 19 19 GLY N N 19 109.272 109.272 107.322 1.950 25767 103 1 . 1 1 19 19 GLY C C 19 175.043 175.043 174.880 0.163 25767 104 1 . 1 1 19 19 GLY CA C 19 45.831 45.831 45.455 0.376 25767 105 1 . 1 1 19 19 GLY H H 19 7.723 7.723 7.774 -0.051 25767 106 1 . 1 1 20 20 LEU N N 20 125.428 125.428 121.788 3.640 25767 107 1 . 1 1 20 20 LEU HA H 20 4.320 4.320 4.633 -0.313 25767 108 1 . 1 1 20 20 LEU C C 20 177.949 177.949 177.356 0.593 25767 109 1 . 1 1 20 20 LEU CA C 20 52.804 52.804 53.354 -0.550 25767 110 1 . 1 1 20 20 LEU CB C 20 39.917 39.917 39.582 0.335 25767 111 1 . 1 1 20 20 LEU H H 20 8.083 8.083 8.032 0.051 25767 112 1 . 1 1 21 21 GLY N N 21 107.804 107.804 110.136 -2.332 25767 113 1 . 1 1 21 21 GLY C C 21 176.278 176.278 176.146 0.132 25767 114 1 . 1 1 21 21 GLY CA C 21 47.294 47.294 47.548 -0.254 25767 115 1 . 1 1 21 21 GLY H H 21 7.982 7.982 8.003 -0.021 25767 116 1 . 1 1 22 22 ILE N N 22 121.319 121.319 121.887 -0.568 25767 117 1 . 1 1 22 22 ILE HA H 22 3.910 3.910 3.817 0.093 25767 118 1 . 1 1 22 22 ILE C C 22 176.604 176.604 177.813 -1.210 25767 119 1 . 1 1 22 22 ILE CA C 22 61.446 61.446 63.318 -1.872 25767 120 1 . 1 1 22 22 ILE CB C 22 35.566 35.566 36.768 -1.202 25767 121 1 . 1 1 22 22 ILE H H 22 8.478 8.478 7.957 0.521 25767 122 1 . 1 1 23 23 ILE N N 23 120.377 120.377 119.865 0.512 25767 123 1 . 1 1 23 23 ILE HA H 23 3.713 3.713 3.820 -0.107 25767 124 1 . 1 1 23 23 ILE C C 23 178.581 178.581 178.357 0.224 25767 125 1 . 1 1 23 23 ILE CA C 23 64.246 64.246 63.508 0.738 25767 126 1 . 1 1 23 23 ILE CB C 23 36.199 36.199 36.233 -0.034 25767 127 1 . 1 1 23 23 ILE H H 23 6.869 6.869 7.689 -0.820 25767 128 1 . 1 1 24 24 GLY N N 24 103.449 103.449 108.409 -4.960 25767 129 1 . 1 1 24 24 GLY C C 24 175.308 175.308 175.733 -0.425 25767 130 1 . 1 1 24 24 GLY CA C 24 47.943 47.943 47.258 0.685 25767 131 1 . 1 1 24 24 GLY H H 24 7.488 7.488 8.092 -0.604 25767 132 1 . 1 1 25 25 TYR N N 25 124.685 124.685 124.020 0.665 25767 133 1 . 1 1 25 25 TYR HA H 25 3.666 3.666 3.808 -0.142 25767 134 1 . 1 1 25 25 TYR C C 25 176.208 176.208 177.087 -0.879 25767 135 1 . 1 1 25 25 TYR CA C 25 61.371 61.371 61.243 0.128 25767 136 1 . 1 1 25 25 TYR CB C 25 38.267 38.267 38.398 -0.131 25767 137 1 . 1 1 25 25 TYR H H 25 7.931 7.931 8.149 -0.218 25767 138 1 . 1 1 26 26 TYR N N 26 117.001 117.001 119.741 -2.740 25767 139 1 . 1 1 26 26 TYR HA H 26 3.941 3.941 4.008 -0.067 25767 140 1 . 1 1 26 26 TYR C C 26 178.753 178.753 177.512 1.241 25767 141 1 . 1 1 26 26 TYR CA C 26 64.260 64.260 61.997 2.263 25767 142 1 . 1 1 26 26 TYR CB C 26 37.521 37.521 38.808 -1.287 25767 143 1 . 1 1 26 26 TYR H H 26 7.693 7.693 7.933 -0.240 25767 144 1 . 1 1 27 27 LEU N N 27 118.657 118.657 117.928 0.729 25767 145 1 . 1 1 27 27 LEU HA H 27 4.311 4.311 4.020 0.291 25767 146 1 . 1 1 27 27 LEU CA C 27 58.297 58.297 58.019 0.278 25767 147 1 . 1 1 27 27 LEU CB C 27 42.723 42.723 40.994 1.729 25767 148 1 . 1 1 27 27 LEU H H 27 8.339 8.339 8.268 0.071 25767 149 1 . 1 1 28 28 GLN N N 28 118.593 118.593 118.867 -0.274 25767 150 1 . 1 1 28 28 GLN HA H 28 3.651 3.651 3.851 -0.200 25767 151 1 . 1 1 28 28 GLN C C 28 177.282 177.282 178.490 -1.208 25767 152 1 . 1 1 28 28 GLN CA C 28 58.829 58.829 58.902 -0.073 25767 153 1 . 1 1 28 28 GLN CB C 28 29.648 29.648 28.395 1.253 25767 154 1 . 1 1 28 28 GLN H H 28 7.970 7.970 7.915 0.055 25767 155 1 . 1 1 29 29 LEU N N 29 122.111 122.111 119.628 2.483 25767 156 1 . 1 1 29 29 LEU HA H 29 3.944 3.944 3.723 0.221 25767 157 1 . 1 1 29 29 LEU CA C 29 58.666 58.666 57.597 1.069 25767 158 1 . 1 1 29 29 LEU CB C 29 42.008 42.008 41.282 0.726 25767 159 1 . 1 1 29 29 LEU H H 29 7.979 7.979 7.377 0.601 25767 160 1 . 1 1 30 30 TYR N N 30 119.283 119.283 120.125 -0.842 25767 161 1 . 1 1 30 30 TYR C C 30 175.775 175.775 177.253 -1.478 25767 162 1 . 1 1 30 30 TYR CA C 30 59.094 59.094 60.821 -1.727 25767 163 1 . 1 1 30 30 TYR CB C 30 39.073 39.073 38.303 0.770 25767 164 1 . 1 1 30 30 TYR H H 30 8.093 8.093 7.560 0.533 25767 165 1 . 1 1 31 31 ALA N N 31 121.327 121.327 122.123 -0.796 25767 166 1 . 1 1 31 31 ALA HA H 31 3.368 3.368 3.845 -0.477 25767 167 1 . 1 1 31 31 ALA C C 31 178.955 178.955 178.882 0.073 25767 168 1 . 1 1 31 31 ALA CA C 31 55.547 55.547 55.302 0.245 25767 169 1 . 1 1 31 31 ALA CB C 31 17.963 17.963 18.138 -0.175 25767 170 1 . 1 1 31 31 ALA H H 31 8.394 8.394 8.250 0.144 25767 171 1 . 1 1 32 32 VAL N N 32 116.757 116.757 118.270 -1.513 25767 172 1 . 1 1 32 32 VAL HA H 32 3.260 3.260 3.517 -0.257 25767 173 1 . 1 1 32 32 VAL CA C 32 67.662 67.662 65.869 1.793 25767 174 1 . 1 1 32 32 VAL CB C 32 30.971 30.971 31.551 -0.580 25767 175 1 . 1 1 32 32 VAL H H 32 8.020 8.020 7.583 0.437 25767 176 1 . 1 1 33 33 GLU N N 33 118.775 118.775 119.858 -1.083 25767 177 1 . 1 1 33 33 GLU HA H 33 3.989 3.989 3.815 0.174 25767 178 1 . 1 1 33 33 GLU C C 33 179.746 179.746 178.875 0.871 25767 179 1 . 1 1 33 33 GLU CA C 33 60.003 60.003 59.323 0.680 25767 180 1 . 1 1 33 33 GLU H H 33 7.358 7.358 7.568 -0.210 25767 181 1 . 1 1 34 34 LEU N N 34 120.632 120.632 121.111 -0.479 25767 182 1 . 1 1 34 34 LEU HA H 34 3.649 3.649 3.837 -0.188 25767 183 1 . 1 1 34 34 LEU C C 34 180.336 180.336 178.426 1.910 25767 184 1 . 1 1 34 34 LEU CA C 34 57.675 57.675 57.647 0.028 25767 185 1 . 1 1 34 34 LEU CB C 34 41.588 41.588 41.692 -0.104 25767 186 1 . 1 1 34 34 LEU H H 34 8.390 8.390 7.767 0.623 25767 187 1 . 1 1 35 35 ILE N N 35 121.240 121.240 118.531 2.709 25767 188 1 . 1 1 35 35 ILE HA H 35 3.542 3.542 3.685 -0.143 25767 189 1 . 1 1 35 35 ILE C C 35 178.604 178.604 178.326 0.278 25767 190 1 . 1 1 35 35 ILE CA C 35 65.547 65.547 64.989 0.558 25767 191 1 . 1 1 35 35 ILE CB C 35 38.731 38.731 37.841 0.890 25767 192 1 . 1 1 35 35 ILE H H 35 8.129 8.129 7.510 0.619 25767 193 1 . 1 1 36 36 LEU N N 36 115.637 115.637 118.210 -2.573 25767 194 1 . 1 1 36 36 LEU HA H 36 4.008 4.008 4.043 -0.035 25767 195 1 . 1 1 36 36 LEU C C 36 178.001 178.001 178.099 -0.098 25767 196 1 . 1 1 36 36 LEU CA C 36 56.076 56.076 57.022 -0.945 25767 197 1 . 1 1 36 36 LEU CB C 36 39.934 39.934 41.622 -1.688 25767 198 1 . 1 1 36 36 LEU H H 36 8.416 8.416 7.837 0.579 25767 199 1 . 1 1 37 37 SER N N 37 114.106 114.106 111.183 2.923 25767 200 1 . 1 1 37 37 SER HA H 37 3.991 3.991 4.284 -0.293 25767 201 1 . 1 1 37 37 SER C C 37 173.997 173.997 174.764 -0.768 25767 202 1 . 1 1 37 37 SER CA C 37 60.311 60.311 59.256 1.055 25767 203 1 . 1 1 37 37 SER CB C 37 63.746 63.746 63.546 0.200 25767 204 1 . 1 1 37 37 SER H H 37 7.517 7.517 7.681 -0.164 25767 205 1 . 1 1 38 38 GLU N N 38 123.003 123.003 121.918 1.085 25767 206 1 . 1 1 38 38 GLU HA H 38 4.369 4.369 4.292 0.078 25767 207 1 . 1 1 38 38 GLU C C 38 175.780 175.780 175.943 -0.163 25767 208 1 . 1 1 38 38 GLU CA C 38 55.365 55.365 55.806 -0.441 25767 209 1 . 1 1 38 38 GLU CB C 38 30.293 30.293 30.763 -0.470 25767 210 1 . 1 1 38 38 GLU H H 38 7.151 7.151 7.465 -0.314 25767 211 1 . 1 1 39 39 GLU N N 39 126.166 126.166 122.599 3.567 25767 212 1 . 1 1 39 39 GLU HA H 39 4.009 4.009 4.133 -0.124 25767 213 1 . 1 1 39 39 GLU C C 39 176.652 176.652 175.888 0.764 25767 214 1 . 1 1 39 39 GLU CA C 39 58.198 58.198 56.625 1.573 25767 215 1 . 1 1 39 39 GLU CB C 39 30.035 30.035 30.291 -0.256 25767 216 1 . 1 1 39 39 GLU H H 39 8.587 8.587 8.444 0.143 25767 217 1 . 1 1 40 40 ASP N N 40 120.047 120.047 121.187 -1.140 25767 218 1 . 1 1 40 40 ASP HA H 40 4.550 4.550 4.456 0.094 25767 219 1 . 1 1 40 40 ASP C C 40 175.035 175.035 175.855 -0.820 25767 220 1 . 1 1 40 40 ASP CA C 40 53.368 53.368 55.166 -1.798 25767 221 1 . 1 1 40 40 ASP CB C 40 40.023 40.023 40.830 -0.808 25767 222 1 . 1 1 40 40 ASP H H 40 8.504 8.504 8.518 -0.014 25767 223 1 . 1 1 41 41 ARG N N 41 120.671 120.671 123.400 -2.729 25767 224 1 . 1 1 41 41 ARG HA H 41 4.389 4.389 4.614 -0.225 25767 225 1 . 1 1 41 41 ARG C C 41 175.755 175.755 175.779 -0.024 25767 226 1 . 1 1 41 41 ARG CA C 41 55.008 55.008 54.615 0.393 25767 227 1 . 1 1 41 41 ARG CB C 41 31.549 31.549 32.466 -0.918 25767 228 1 . 1 1 41 41 ARG H H 41 7.672 7.672 8.241 -0.569 25767 229 1 . 1 1 42 42 SER N N 42 120.330 120.330 116.131 4.199 25767 230 1 . 1 1 42 42 SER HA H 42 3.837 3.837 4.363 -0.526 25767 231 1 . 1 1 42 42 SER CA C 42 57.326 57.326 58.432 -1.106 25767 232 1 . 1 1 42 42 SER CB C 42 65.762 65.762 64.086 1.676 25767 233 1 . 1 1 42 42 SER H H 42 8.544 8.544 8.333 0.211 25767 234 1 . 1 1 43 43 GLN HA H 43 3.989 3.989 3.995 -0.006 25767 235 1 . 1 1 43 43 GLN C C 43 178.907 178.907 177.967 0.940 25767 236 1 . 1 1 43 43 GLN CA C 43 59.370 59.370 58.718 0.652 25767 237 1 . 1 1 43 43 GLN CB C 43 27.963 27.963 28.580 -0.617 25767 238 1 . 1 1 44 44 GLU N N 44 120.328 120.328 119.759 0.569 25767 239 1 . 1 1 44 44 GLU HA H 44 4.013 4.013 3.955 0.059 25767 240 1 . 1 1 44 44 GLU C C 44 179.824 179.824 178.669 1.155 25767 241 1 . 1 1 44 44 GLU CA C 44 60.045 60.045 59.177 0.868 25767 242 1 . 1 1 44 44 GLU CB C 44 28.648 28.648 29.215 -0.567 25767 243 1 . 1 1 44 44 GLU H H 44 8.938 8.938 7.972 0.966 25767 244 1 . 1 1 45 45 MET N N 45 121.030 121.030 117.850 3.180 25767 245 1 . 1 1 45 45 MET HA H 45 4.412 4.412 4.243 0.169 25767 246 1 . 1 1 45 45 MET C C 45 180.357 180.357 178.054 2.303 25767 247 1 . 1 1 45 45 MET CA C 45 57.209 57.209 58.294 -1.085 25767 248 1 . 1 1 45 45 MET CB C 45 32.436 32.436 32.161 0.275 25767 249 1 . 1 1 45 45 MET H H 45 7.756 7.756 7.826 -0.070 25767 250 1 . 1 1 46 46 THR N N 46 120.008 120.008 115.714 4.294 25767 251 1 . 1 1 46 46 THR HA H 46 4.071 4.071 3.904 0.167 25767 252 1 . 1 1 46 46 THR CA C 46 67.096 67.096 66.841 0.255 25767 253 1 . 1 1 46 46 THR CB C 46 68.954 68.954 68.361 0.593 25767 254 1 . 1 1 46 46 THR H H 46 8.187 8.187 7.535 0.652 25767 255 1 . 1 1 47 47 ALA HA H 47 4.109 4.109 4.114 -0.005 25767 256 1 . 1 1 47 47 ALA C C 47 180.118 180.118 179.292 0.826 25767 257 1 . 1 1 47 47 ALA CA C 47 55.339 55.339 54.950 0.389 25767 258 1 . 1 1 47 47 ALA CB C 47 17.832 17.832 18.289 -0.457 25767 259 1 . 1 1 47 47 ALA H H 47 8.238 8.238 7.918 0.320 25767 260 1 . 1 1 48 48 LEU N N 48 122.093 122.093 119.714 2.379 25767 261 1 . 1 1 48 48 LEU HA H 48 4.263 4.263 4.028 0.236 25767 262 1 . 1 1 48 48 LEU C C 48 179.103 179.103 179.052 0.051 25767 263 1 . 1 1 48 48 LEU CA C 48 57.740 57.740 57.470 0.270 25767 264 1 . 1 1 48 48 LEU CB C 48 40.796 40.796 41.574 -0.778 25767 265 1 . 1 1 48 48 LEU H H 48 7.778 7.778 7.638 0.140 25767 266 1 . 1 1 49 49 ALA N N 49 120.130 120.130 121.298 -1.167 25767 267 1 . 1 1 49 49 ALA HA H 49 3.721 3.721 3.943 -0.222 25767 268 1 . 1 1 49 49 ALA C C 49 178.676 178.676 179.456 -0.780 25767 269 1 . 1 1 49 49 ALA CA C 49 55.721 55.721 55.391 0.330 25767 270 1 . 1 1 49 49 ALA CB C 49 17.827 17.827 18.047 -0.220 25767 271 1 . 1 1 49 49 ALA H H 49 8.432 8.432 8.285 0.147 25767 272 1 . 1 1 50 50 THR N N 50 113.333 113.333 115.002 -1.669 25767 273 1 . 1 1 50 50 THR HA H 50 3.895 3.895 3.852 0.043 25767 274 1 . 1 1 50 50 THR C C 50 174.948 174.948 176.510 -1.562 25767 275 1 . 1 1 50 50 THR CA C 50 67.334 67.334 67.354 -0.020 25767 276 1 . 1 1 50 50 THR CB C 50 68.864 68.864 68.507 0.357 25767 277 1 . 1 1 50 50 THR H H 50 7.857 7.857 7.798 0.059 25767 278 1 . 1 1 51 51 GLU N N 51 122.698 122.698 122.264 0.434 25767 279 1 . 1 1 51 51 GLU HA H 51 4.068 4.068 4.030 0.038 25767 280 1 . 1 1 51 51 GLU C C 51 179.997 179.997 178.738 1.259 25767 281 1 . 1 1 51 51 GLU CA C 51 59.433 59.433 59.331 0.101 25767 282 1 . 1 1 51 51 GLU CB C 51 29.517 29.517 29.595 -0.078 25767 283 1 . 1 1 51 51 GLU H H 51 7.817 7.817 7.615 0.202 25767 284 1 . 1 1 52 52 LEU N N 52 121.100 121.100 120.550 0.550 25767 285 1 . 1 1 52 52 LEU HA H 52 4.129 4.129 4.055 0.074 25767 286 1 . 1 1 52 52 LEU CA C 52 57.889 57.889 57.746 0.143 25767 287 1 . 1 1 52 52 LEU CB C 52 41.947 41.947 41.686 0.261 25767 288 1 . 1 1 52 52 LEU H H 52 8.628 8.628 7.829 0.799 25767 289 1 . 1 1 53 53 LEU N N 53 119.935 119.935 120.020 -0.085 25767 290 1 . 1 1 53 53 LEU C C 53 179.671 179.671 178.416 1.255 25767 291 1 . 1 1 53 53 LEU H H 53 8.303 8.303 7.795 0.508 25767 292 1 . 1 1 54 54 ASP N N 54 120.339 120.339 118.774 1.565 25767 293 1 . 1 1 54 54 ASP C C 54 179.106 179.106 178.410 0.696 25767 294 1 . 1 1 54 54 ASP H H 54 7.901 7.901 7.943 -0.042 25767 295 1 . 1 1 55 55 THR N N 55 120.237 120.237 116.944 3.294 25767 296 1 . 1 1 55 55 THR HA H 55 3.696 3.696 4.038 -0.342 25767 297 1 . 1 1 55 55 THR CA C 55 67.340 67.340 66.857 0.483 25767 298 1 . 1 1 55 55 THR CB C 55 68.151 68.151 68.550 -0.399 25767 299 1 . 1 1 55 55 THR H H 55 8.262 8.262 7.742 0.520 25767 300 1 . 1 1 56 56 ILE N N 56 123.953 123.953 122.187 1.766 25767 301 1 . 1 1 56 56 ILE HA H 56 3.843 3.843 3.744 0.099 25767 302 1 . 1 1 56 56 ILE CA C 56 65.894 65.894 65.631 0.263 25767 303 1 . 1 1 56 56 ILE CB C 56 38.133 38.133 37.516 0.617 25767 304 1 . 1 1 56 56 ILE H H 56 8.930 8.930 7.732 1.198 25767 305 1 . 1 1 57 57 GLU CB C 57 29.581 29.581 29.551 0.029 25767 306 1 . 1 1 58 58 ALA HA H 58 4.031 4.031 4.146 -0.115 25767 307 1 . 1 1 58 58 ALA C C 58 179.875 179.875 179.459 0.416 25767 308 1 . 1 1 58 58 ALA CA C 58 55.266 55.266 54.814 0.452 25767 309 1 . 1 1 58 58 ALA CB C 58 17.985 17.985 18.348 -0.363 25767 310 1 . 1 1 58 58 ALA H H 58 7.764 7.764 8.448 -0.684 25767 311 1 . 1 1 59 59 PHE N N 59 121.988 121.988 120.034 1.954 25767 312 1 . 1 1 59 59 PHE HA H 59 4.226 4.226 4.168 0.058 25767 313 1 . 1 1 59 59 PHE CA C 59 61.439 61.439 61.069 0.370 25767 314 1 . 1 1 59 59 PHE CB C 59 39.363 39.363 39.199 0.164 25767 315 1 . 1 1 59 59 PHE H H 59 8.159 8.159 8.551 -0.392 25767 316 1 . 1 1 60 60 LYS HA H 60 3.541 3.541 3.749 -0.208 25767 317 1 . 1 1 60 60 LYS C C 60 179.438 179.438 178.854 0.584 25767 318 1 . 1 1 60 60 LYS CA C 60 60.136 60.136 59.504 0.632 25767 319 1 . 1 1 60 60 LYS CB C 60 32.058 32.058 32.339 -0.281 25767 320 1 . 1 1 61 61 LYS N N 61 119.262 119.262 117.661 1.601 25767 321 1 . 1 1 61 61 LYS HA H 61 3.945 3.945 4.191 -0.246 25767 322 1 . 1 1 61 61 LYS C C 61 178.730 178.730 177.952 0.778 25767 323 1 . 1 1 61 61 LYS CA C 61 59.042 59.042 57.415 1.627 25767 324 1 . 1 1 61 61 LYS CB C 61 32.642 32.642 32.063 0.579 25767 325 1 . 1 1 61 61 LYS H H 61 7.832 7.832 7.905 -0.073 25767 326 1 . 1 1 62 62 GLU N N 62 120.790 120.790 120.383 0.407 25767 327 1 . 1 1 62 62 GLU HA H 62 3.935 3.935 3.997 -0.062 25767 328 1 . 1 1 62 62 GLU C C 62 178.424 178.424 178.054 0.370 25767 329 1 . 1 1 62 62 GLU CA C 62 58.714 58.714 58.895 -0.181 25767 330 1 . 1 1 62 62 GLU CB C 62 29.230 29.230 29.321 -0.092 25767 331 1 . 1 1 62 62 GLU H H 62 7.982 7.982 7.913 0.069 25767 332 1 . 1 1 63 63 ILE N N 63 118.463 118.463 116.378 2.085 25767 333 1 . 1 1 63 63 ILE HA H 63 3.689 3.689 3.833 -0.144 25767 334 1 . 1 1 63 63 ILE C C 63 177.555 177.555 177.292 0.263 25767 335 1 . 1 1 63 63 ILE CA C 63 61.499 61.499 62.854 -1.355 25767 336 1 . 1 1 63 63 ILE CB C 63 36.524 36.524 38.466 -1.942 25767 337 1 . 1 1 63 63 ILE H H 63 7.732 7.732 7.336 0.396 25767 338 1 . 1 1 64 64 GLY N N 64 107.973 107.973 107.348 0.625 25767 339 1 . 1 1 64 64 GLY C C 64 175.271 175.271 175.045 0.226 25767 340 1 . 1 1 64 64 GLY CA C 64 45.902 45.902 46.052 -0.150 25767 341 1 . 1 1 64 64 GLY H H 64 7.661 7.661 7.890 -0.229 25767 342 1 . 1 1 65 65 GLY N N 65 108.464 108.464 107.262 1.202 25767 343 1 . 1 1 65 65 GLY C C 65 174.800 174.800 175.590 -0.790 25767 344 1 . 1 1 65 65 GLY CA C 65 45.646 45.646 45.376 0.270 25767 345 1 . 1 1 65 65 GLY H H 65 7.808 7.808 8.064 -0.256 25767 346 1 . 1 1 66 66 GLU N N 66 121.162 121.162 121.120 0.042 25767 347 1 . 1 1 66 66 GLU HA H 66 4.105 4.105 4.056 0.049 25767 348 1 . 1 1 66 66 GLU C C 66 177.230 177.230 178.447 -1.217 25767 349 1 . 1 1 66 66 GLU CA C 66 57.224 57.224 59.097 -1.873 25767 350 1 . 1 1 66 66 GLU CB C 66 29.992 29.992 29.548 0.445 25767 351 1 . 1 1 66 66 GLU H H 66 8.203 8.203 7.767 0.436 25767 352 1 . 1 1 67 67 SER N N 67 116.468 116.468 115.008 1.460 25767 353 1 . 1 1 67 67 SER HA H 67 4.249 4.249 4.218 0.032 25767 354 1 . 1 1 67 67 SER C C 67 174.640 174.640 176.524 -1.884 25767 355 1 . 1 1 67 67 SER CA C 67 58.930 58.930 61.136 -2.206 25767 356 1 . 1 1 67 67 SER CB C 67 63.912 63.912 62.908 1.004 25767 357 1 . 1 1 67 67 SER H H 67 8.206 8.206 8.277 -0.071 25767 358 1 . 1 1 68 68 GLU N N 68 122.400 122.400 120.559 1.840 25767 359 1 . 1 1 68 68 GLU HA H 68 4.153 4.153 4.036 0.117 25767 360 1 . 1 1 68 68 GLU C C 68 176.349 176.349 177.190 -0.841 25767 361 1 . 1 1 68 68 GLU CA C 68 56.823 56.823 58.557 -1.734 25767 362 1 . 1 1 68 68 GLU CB C 68 29.981 29.981 29.271 0.710 25767 363 1 . 1 1 68 68 GLU H H 68 8.168 8.168 8.407 -0.239 25767 364 1 . 1 1 69 69 ALA N N 69 124.342 124.342 120.328 4.014 25767 365 1 . 1 1 69 69 ALA HA H 69 4.188 4.188 4.071 0.117 25767 366 1 . 1 1 69 69 ALA C C 69 178.027 178.027 178.032 -0.005 25767 367 1 . 1 1 69 69 ALA CA C 69 52.558 52.558 53.775 -1.217 25767 368 1 . 1 1 69 69 ALA CB C 69 19.492 19.492 19.005 0.486 25767 369 1 . 1 1 69 69 ALA H H 69 7.939 7.939 7.430 0.509 25767 370 1 . 1 1 70 70 GLU N N 70 121.059 121.059 117.955 3.104 25767 371 1 . 1 1 70 70 GLU HA H 70 4.114 4.114 4.391 -0.277 25767 372 1 . 1 1 70 70 GLU C C 70 176.519 176.519 175.207 1.312 25767 373 1 . 1 1 70 70 GLU CA C 70 57.304 57.304 55.477 1.827 25767 374 1 . 1 1 70 70 GLU CB C 70 29.827 29.827 30.873 -1.046 25767 375 1 . 1 1 70 70 GLU H H 70 8.430 8.430 7.738 0.692 25767 376 1 . 1 1 71 71 ASP N N 71 120.274 120.274 122.183 -1.909 25767 377 1 . 1 1 71 71 ASP HA H 71 4.532 4.532 4.329 0.202 25767 378 1 . 1 1 71 71 ASP C C 71 176.369 176.369 177.010 -0.641 25767 379 1 . 1 1 71 71 ASP CA C 71 54.251 54.251 55.368 -1.117 25767 380 1 . 1 1 71 71 ASP CB C 71 40.840 40.840 39.617 1.224 25767 381 1 . 1 1 71 71 ASP H H 71 8.305 8.305 8.931 -0.626 25767 382 1 . 1 1 72 72 SER N N 72 116.165 116.165 113.357 2.807 25767 383 1 . 1 1 72 72 SER HA H 72 4.241 4.241 4.081 0.160 25767 384 1 . 1 1 72 72 SER C C 72 174.567 174.567 175.696 -1.129 25767 385 1 . 1 1 72 72 SER CA C 72 59.031 59.031 61.375 -2.344 25767 386 1 . 1 1 72 72 SER CB C 72 64.040 64.040 63.285 0.755 25767 387 1 . 1 1 72 72 SER H H 72 7.964 7.964 8.336 -0.372 25767 388 1 . 1 1 73 73 ASP N N 73 122.440 122.440 121.909 0.531 25767 389 1 . 1 1 73 73 ASP HA H 73 4.534 4.534 4.249 0.285 25767 390 1 . 1 1 73 73 ASP C C 73 176.882 176.882 178.172 -1.290 25767 391 1 . 1 1 73 73 ASP CA C 73 54.443 54.443 57.255 -2.812 25767 392 1 . 1 1 73 73 ASP CB C 73 41.336 41.336 40.009 1.327 25767 393 1 . 1 1 73 73 ASP H H 73 8.392 8.392 8.632 -0.240 25767 394 1 . 1 1 74 74 LYS N N 74 123.270 123.270 120.174 3.096 25767 395 1 . 1 1 74 74 LYS HA H 74 4.093 4.093 4.052 0.041 25767 396 1 . 1 1 74 74 LYS C C 74 177.608 177.608 178.800 -1.192 25767 397 1 . 1 1 74 74 LYS CA C 74 57.465 57.465 59.607 -2.142 25767 398 1 . 1 1 74 74 LYS CB C 74 32.146 32.146 32.400 -0.254 25767 399 1 . 1 1 74 74 LYS H H 74 8.317 8.317 7.810 0.507 25767 400 1 . 1 1 75 75 SER N N 75 116.557 116.557 116.124 0.433 25767 401 1 . 1 1 75 75 SER HA H 75 4.197 4.197 4.190 0.007 25767 402 1 . 1 1 75 75 SER C C 75 175.988 175.988 176.663 -0.675 25767 403 1 . 1 1 75 75 SER CA C 75 60.434 60.434 61.877 -1.443 25767 404 1 . 1 1 75 75 SER CB C 75 63.172 63.172 62.763 0.409 25767 405 1 . 1 1 75 75 SER H H 75 8.387 8.387 7.936 0.451 25767 406 1 . 1 1 76 76 LEU N N 76 123.910 123.910 122.254 1.656 25767 407 1 . 1 1 76 76 LEU HA H 76 4.170 4.170 3.961 0.209 25767 408 1 . 1 1 76 76 LEU C C 76 178.083 178.083 178.904 -0.821 25767 409 1 . 1 1 76 76 LEU CA C 76 56.492 56.492 57.913 -1.421 25767 410 1 . 1 1 76 76 LEU CB C 76 41.697 41.697 41.502 0.195 25767 411 1 . 1 1 76 76 LEU H H 76 8.059 8.059 8.125 -0.066 25767 412 1 . 1 1 77 77 HIS N N 77 120.620 120.620 119.151 1.469 25767 413 1 . 1 1 77 77 HIS HA H 77 4.288 4.288 4.269 0.019 25767 414 1 . 1 1 77 77 HIS C C 77 177.667 177.667 178.090 -0.423 25767 415 1 . 1 1 77 77 HIS CA C 77 58.422 58.422 59.570 -1.148 25767 416 1 . 1 1 77 77 HIS CB C 77 30.264 30.264 29.794 0.470 25767 417 1 . 1 1 77 77 HIS H H 77 7.936 7.936 8.041 -0.105 25767 418 1 . 1 1 78 78 VAL N N 78 121.774 121.774 119.859 1.915 25767 419 1 . 1 1 78 78 VAL HA H 78 3.677 3.677 3.628 0.049 25767 420 1 . 1 1 78 78 VAL CA C 78 65.606 65.606 66.667 -1.062 25767 421 1 . 1 1 78 78 VAL CB C 78 31.864 31.864 31.544 0.320 25767 422 1 . 1 1 78 78 VAL H H 78 7.916 7.916 8.028 -0.112 25767 423 1 . 1 1 79 79 MET N N 79 119.660 119.660 118.341 1.319 25767 424 1 . 1 1 79 79 MET HA H 79 3.925 3.925 4.023 -0.098 25767 425 1 . 1 1 79 79 MET C C 79 177.077 177.077 178.636 -1.559 25767 426 1 . 1 1 79 79 MET CA C 79 58.862 58.862 59.088 -0.226 25767 427 1 . 1 1 79 79 MET CB C 79 32.852 32.852 31.892 0.960 25767 428 1 . 1 1 79 79 MET H H 79 8.149 8.149 8.150 -0.001 25767 429 1 . 1 1 80 80 ASN N N 80 117.337 117.337 118.311 -0.974 25767 430 1 . 1 1 80 80 ASN HA H 80 4.138 4.138 4.735 -0.597 25767 431 1 . 1 1 80 80 ASN C C 80 178.133 178.133 178.367 -0.234 25767 432 1 . 1 1 80 80 ASN CA C 80 57.039 57.039 56.315 0.724 25767 433 1 . 1 1 80 80 ASN CB C 80 38.996 38.996 38.453 0.543 25767 434 1 . 1 1 80 80 ASN H H 80 8.202 8.202 8.774 -0.572 25767 435 1 . 1 1 81 81 THR N N 81 115.517 115.517 118.495 -2.978 25767 436 1 . 1 1 81 81 THR HA H 81 3.896 3.896 4.051 -0.155 25767 437 1 . 1 1 81 81 THR C C 81 175.186 175.186 176.215 -1.029 25767 438 1 . 1 1 81 81 THR CA C 81 66.221 66.221 66.993 -0.772 25767 439 1 . 1 1 81 81 THR CB C 81 69.087 69.087 68.742 0.345 25767 440 1 . 1 1 81 81 THR H H 81 7.944 7.944 8.133 -0.189 25767 441 1 . 1 1 82 82 LEU N N 82 119.074 119.074 120.283 -1.209 25767 442 1 . 1 1 82 82 LEU HA H 82 3.981 3.981 4.080 -0.099 25767 443 1 . 1 1 82 82 LEU C C 82 177.583 177.583 178.030 -0.447 25767 444 1 . 1 1 82 82 LEU CA C 82 56.540 56.540 57.307 -0.767 25767 445 1 . 1 1 82 82 LEU CB C 82 41.793 41.793 41.835 -0.042 25767 446 1 . 1 1 82 82 LEU H H 82 7.547 7.547 7.667 -0.120 25767 447 1 . 1 1 83 83 ILE N N 83 118.085 118.085 115.778 2.307 25767 448 1 . 1 1 83 83 ILE HA H 83 3.843 3.843 3.487 0.356 25767 449 1 . 1 1 83 83 ILE C C 83 176.413 176.413 177.346 -0.933 25767 450 1 . 1 1 83 83 ILE CA C 83 62.727 62.727 63.483 -0.756 25767 451 1 . 1 1 83 83 ILE CB C 83 37.698 37.698 38.137 -0.439 25767 452 1 . 1 1 83 83 ILE H H 83 7.409 7.409 7.582 -0.173 25767 453 1 . 1 1 84 84 HIS N N 84 116.152 116.152 115.697 0.455 25767 454 1 . 1 1 84 84 HIS HA H 84 4.595 4.595 4.427 0.168 25767 455 1 . 1 1 84 84 HIS C C 84 175.707 175.707 175.406 0.301 25767 456 1 . 1 1 84 84 HIS CA C 84 58.628 58.628 58.051 0.577 25767 457 1 . 1 1 84 84 HIS CB C 84 31.403 31.403 30.612 0.791 25767 458 1 . 1 1 84 84 HIS H H 84 7.194 7.194 7.829 -0.635 25767 459 1 . 1 1 85 85 ASP N N 85 122.322 122.322 119.872 2.450 25767 460 1 . 1 1 85 85 ASP HA H 85 4.534 4.534 4.773 -0.239 25767 461 1 . 1 1 85 85 ASP C C 85 175.580 175.580 176.560 -0.980 25767 462 1 . 1 1 85 85 ASP CA C 85 53.345 53.345 53.270 0.075 25767 463 1 . 1 1 85 85 ASP CB C 85 41.118 41.118 41.197 -0.079 25767 464 1 . 1 1 85 85 ASP H H 85 8.505 8.505 7.850 0.655 25767 465 1 . 1 1 86 86 GLN N N 86 122.783 122.783 126.494 -3.711 25767 466 1 . 1 1 86 86 GLN HA H 86 3.963 3.963 4.093 -0.129 25767 467 1 . 1 1 86 86 GLN C C 86 178.581 178.581 177.831 0.750 25767 468 1 . 1 1 86 86 GLN CA C 86 57.954 57.954 59.342 -1.388 25767 469 1 . 1 1 86 86 GLN CB C 86 28.894 28.894 29.109 -0.215 25767 470 1 . 1 1 86 86 GLN H H 86 8.803 8.803 8.728 0.075 25767 471 1 . 1 1 87 87 GLU N N 87 121.794 121.794 119.654 2.140 25767 472 1 . 1 1 87 87 GLU HA H 87 4.013 4.013 3.991 0.022 25767 473 1 . 1 1 87 87 GLU C C 87 178.290 178.290 178.870 -0.580 25767 474 1 . 1 1 87 87 GLU CA C 87 59.038 59.038 59.623 -0.585 25767 475 1 . 1 1 87 87 GLU CB C 87 28.980 28.980 29.086 -0.106 25767 476 1 . 1 1 87 87 GLU H H 87 8.072 8.072 8.402 -0.330 25767 477 1 . 1 1 88 88 LYS N N 88 119.345 119.345 118.903 0.442 25767 478 1 . 1 1 88 88 LYS HA H 88 3.755 3.755 4.105 -0.350 25767 479 1 . 1 1 88 88 LYS C C 88 180.040 180.040 178.729 1.311 25767 480 1 . 1 1 88 88 LYS CA C 88 59.411 59.411 58.938 0.473 25767 481 1 . 1 1 88 88 LYS CB C 88 32.007 32.007 31.900 0.107 25767 482 1 . 1 1 88 88 LYS H H 88 7.588 7.588 8.047 -0.459 25767 483 1 . 1 1 89 89 ALA N N 89 123.933 123.933 122.346 1.587 25767 484 1 . 1 1 89 89 ALA HA H 89 3.739 3.739 4.173 -0.434 25767 485 1 . 1 1 89 89 ALA C C 89 177.457 177.457 179.435 -1.978 25767 486 1 . 1 1 89 89 ALA CA C 89 55.970 55.970 55.260 0.710 25767 487 1 . 1 1 89 89 ALA CB C 89 18.656 18.656 18.241 0.415 25767 488 1 . 1 1 89 89 ALA H H 89 8.500 8.500 7.742 0.758 25767 489 1 . 1 1 90 90 LYS N N 90 119.244 119.244 119.862 -0.618 25767 490 1 . 1 1 90 90 LYS HA H 90 4.044 4.044 3.842 0.202 25767 491 1 . 1 1 90 90 LYS C C 90 177.774 177.774 178.580 -0.806 25767 492 1 . 1 1 90 90 LYS CA C 90 59.078 59.078 59.497 -0.419 25767 493 1 . 1 1 90 90 LYS CB C 90 30.241 30.241 32.338 -2.097 25767 494 1 . 1 1 90 90 LYS H H 90 6.845 6.845 7.942 -1.097 25767 495 1 . 1 1 91 91 ILE N N 91 117.718 117.718 118.054 -0.336 25767 496 1 . 1 1 91 91 ILE HA H 91 3.398 3.398 3.680 -0.282 25767 497 1 . 1 1 91 91 ILE C C 91 177.670 177.670 177.359 0.311 25767 498 1 . 1 1 91 91 ILE CA C 91 63.998 63.998 64.423 -0.425 25767 499 1 . 1 1 91 91 ILE CB C 91 37.801 37.801 37.035 0.766 25767 500 1 . 1 1 91 91 ILE H H 91 7.293 7.293 7.853 -0.560 25767 501 1 . 1 1 92 92 TYR N N 92 121.868 121.868 121.718 0.150 25767 502 1 . 1 1 92 92 TYR HA H 92 4.123 4.123 4.070 0.053 25767 503 1 . 1 1 92 92 TYR C C 92 178.781 178.781 177.625 1.156 25767 504 1 . 1 1 92 92 TYR CA C 92 61.642 61.642 62.447 -0.806 25767 505 1 . 1 1 92 92 TYR CB C 92 39.221 39.221 38.731 0.490 25767 506 1 . 1 1 92 92 TYR H H 92 8.016 8.016 7.945 0.071 25767 507 1 . 1 1 93 93 MET N N 93 118.984 118.984 118.202 0.782 25767 508 1 . 1 1 93 93 MET HA H 93 3.952 3.952 4.075 -0.123 25767 509 1 . 1 1 93 93 MET C C 93 179.925 179.925 178.272 1.653 25767 510 1 . 1 1 93 93 MET CA C 93 57.589 57.589 59.187 -1.598 25767 511 1 . 1 1 93 93 MET CB C 93 30.752 30.752 32.610 -1.857 25767 512 1 . 1 1 93 93 MET H H 93 8.464 8.464 8.562 -0.098 25767 513 1 . 1 1 94 94 LEU N N 94 125.441 125.441 121.646 3.795 25767 514 1 . 1 1 94 94 LEU HA H 94 3.870 3.870 3.954 -0.084 25767 515 1 . 1 1 94 94 LEU C C 94 177.937 177.937 178.717 -0.780 25767 516 1 . 1 1 94 94 LEU CA C 94 58.761 58.761 58.086 0.675 25767 517 1 . 1 1 94 94 LEU CB C 94 41.762 41.762 41.489 0.273 25767 518 1 . 1 1 94 94 LEU H H 94 8.927 8.927 8.630 0.297 25767 519 1 . 1 1 95 95 ASN N N 95 119.066 119.066 117.811 1.255 25767 520 1 . 1 1 95 95 ASN HA H 95 4.262 4.262 4.358 -0.096 25767 521 1 . 1 1 95 95 ASN CA C 95 56.273 56.273 56.093 0.180 25767 522 1 . 1 1 95 95 ASN CB C 95 37.605 37.605 38.124 -0.519 25767 523 1 . 1 1 95 95 ASN H H 95 8.691 8.691 8.236 0.455 25767 524 1 . 1 1 96 96 PHE HA H 96 4.665 4.665 4.325 0.340 25767 525 1 . 1 1 96 96 PHE CA C 96 62.071 62.071 61.518 0.553 25767 526 1 . 1 1 96 96 PHE H H 96 8.317 8.317 7.995 0.322 25767 527 1 . 1 1 97 97 THR N N 97 118.178 118.178 115.313 2.865 25767 528 1 . 1 1 97 97 THR HA H 97 3.338 3.338 3.913 -0.575 25767 529 1 . 1 1 97 97 THR C C 97 176.074 176.074 176.803 -0.729 25767 530 1 . 1 1 97 97 THR CA C 97 67.986 67.986 66.460 1.526 25767 531 1 . 1 1 97 97 THR H H 97 8.214 8.214 8.744 -0.530 25767 532 1 . 1 1 98 98 MET N N 98 120.097 120.097 121.646 -1.549 25767 533 1 . 1 1 98 98 MET HA H 98 4.403 4.403 4.159 0.244 25767 534 1 . 1 1 98 98 MET C C 98 178.696 178.696 178.077 0.619 25767 535 1 . 1 1 98 98 MET CA C 98 57.029 57.029 58.946 -1.917 25767 536 1 . 1 1 98 98 MET CB C 98 29.898 29.898 32.128 -2.230 25767 537 1 . 1 1 98 98 MET H H 98 8.885 8.885 8.404 0.481 25767 538 1 . 1 1 99 99 SER N N 99 114.959 114.959 115.991 -1.032 25767 539 1 . 1 1 99 99 SER HA H 99 4.199 4.199 4.141 0.058 25767 540 1 . 1 1 99 99 SER C C 99 176.565 176.565 176.688 -0.123 25767 541 1 . 1 1 99 99 SER CA C 99 61.965 61.965 61.336 0.629 25767 542 1 . 1 1 99 99 SER CB C 99 62.565 62.565 62.986 -0.421 25767 543 1 . 1 1 99 99 SER H H 99 7.515 7.515 7.949 -0.434 25767 544 1 . 1 1 100 100 LEU N N 100 125.380 125.380 123.783 1.597 25767 545 1 . 1 1 100 100 LEU HA H 100 3.776 3.776 3.893 -0.117 25767 546 1 . 1 1 100 100 LEU C C 100 177.689 177.689 178.185 -0.496 25767 547 1 . 1 1 100 100 LEU CA C 100 58.057 58.057 57.527 0.530 25767 548 1 . 1 1 100 100 LEU CB C 100 41.550 41.550 41.482 0.068 25767 549 1 . 1 1 100 100 LEU H H 100 7.400 7.400 8.229 -0.829 25767 550 1 . 1 1 101 101 TYR N N 101 120.597 120.597 119.880 0.717 25767 551 1 . 1 1 101 101 TYR HA H 101 4.116 4.116 3.986 0.130 25767 552 1 . 1 1 101 101 TYR C C 101 176.825 176.825 177.323 -0.498 25767 553 1 . 1 1 101 101 TYR CA C 101 61.888 61.888 62.334 -0.446 25767 554 1 . 1 1 101 101 TYR CB C 101 38.993 38.993 38.364 0.629 25767 555 1 . 1 1 101 101 TYR H H 101 8.880 8.880 8.593 0.287 25767 556 1 . 1 1 102 102 ASN N N 102 116.869 116.869 116.729 0.140 25767 557 1 . 1 1 102 102 ASN HA H 102 4.166 4.166 4.265 -0.099 25767 558 1 . 1 1 102 102 ASN C C 102 179.089 179.089 177.651 1.438 25767 559 1 . 1 1 102 102 ASN CA C 102 56.212 56.212 56.137 0.075 25767 560 1 . 1 1 102 102 ASN CB C 102 37.734 37.734 37.879 -0.146 25767 561 1 . 1 1 102 102 ASN H H 102 8.543 8.543 7.988 0.555 25767 562 1 . 1 1 103 103 GLU N N 103 121.259 121.259 120.442 0.817 25767 563 1 . 1 1 103 103 GLU HA H 103 3.986 3.986 3.927 0.059 25767 564 1 . 1 1 103 103 GLU C C 103 179.968 179.968 178.750 1.218 25767 565 1 . 1 1 103 103 GLU CA C 103 59.517 59.517 59.408 0.109 25767 566 1 . 1 1 103 103 GLU CB C 103 29.550 29.550 29.501 0.049 25767 567 1 . 1 1 103 103 GLU H H 103 7.872 7.872 8.026 -0.154 25767 568 1 . 1 1 104 104 LYS N N 104 120.268 120.268 119.617 0.651 25767 569 1 . 1 1 104 104 LYS HA H 104 4.046 4.046 4.099 -0.053 25767 570 1 . 1 1 104 104 LYS C C 104 178.355 178.355 178.929 -0.574 25767 571 1 . 1 1 104 104 LYS CA C 104 56.735 56.735 58.892 -2.157 25767 572 1 . 1 1 104 104 LYS CB C 104 29.113 29.113 32.131 -3.018 25767 573 1 . 1 1 104 104 LYS H H 104 8.384 8.384 7.773 0.611 25767 574 1 . 1 1 105 105 LEU N N 105 121.622 121.622 119.668 1.954 25767 575 1 . 1 1 105 105 LEU HA H 105 3.741 3.741 3.671 0.070 25767 576 1 . 1 1 105 105 LEU C C 105 180.552 180.552 178.540 2.012 25767 577 1 . 1 1 105 105 LEU CA C 105 58.172 58.172 58.063 0.109 25767 578 1 . 1 1 105 105 LEU CB C 105 41.030 41.030 41.342 -0.312 25767 579 1 . 1 1 105 105 LEU H H 105 8.400 8.400 7.760 0.640 25767 580 1 . 1 1 106 106 LYS N N 106 119.498 119.498 118.201 1.297 25767 581 1 . 1 1 106 106 LYS HA H 106 3.914 3.914 3.838 0.076 25767 582 1 . 1 1 106 106 LYS C C 106 178.419 178.419 179.003 -0.584 25767 583 1 . 1 1 106 106 LYS CA C 106 59.383 59.383 59.764 -0.381 25767 584 1 . 1 1 106 106 LYS CB C 106 31.808 31.808 31.888 -0.080 25767 585 1 . 1 1 106 106 LYS H H 106 7.067 7.067 7.601 -0.534 25767 586 1 . 1 1 107 107 GLN N N 107 121.405 121.405 118.974 2.431 25767 587 1 . 1 1 107 107 GLN HA H 107 3.851 3.851 3.969 -0.118 25767 588 1 . 1 1 107 107 GLN C C 107 177.935 177.935 178.874 -0.939 25767 589 1 . 1 1 107 107 GLN CA C 107 58.481 58.481 58.702 -0.221 25767 590 1 . 1 1 107 107 GLN CB C 107 26.798 26.798 28.422 -1.624 25767 591 1 . 1 1 107 107 GLN H H 107 7.460 7.460 7.749 -0.289 25767 592 1 . 1 1 108 108 LEU N N 108 119.561 119.561 118.970 0.591 25767 593 1 . 1 1 108 108 LEU HA H 108 3.801 3.801 3.807 -0.006 25767 594 1 . 1 1 108 108 LEU C C 108 179.195 179.195 178.398 0.797 25767 595 1 . 1 1 108 108 LEU CA C 108 58.393 58.393 57.474 0.919 25767 596 1 . 1 1 108 108 LEU CB C 108 41.266 41.266 41.693 -0.427 25767 597 1 . 1 1 108 108 LEU H H 108 8.208 8.208 7.869 0.339 25767 598 1 . 1 1 109 109 LYS N N 109 118.535 118.535 117.196 1.339 25767 599 1 . 1 1 109 109 LYS HA H 109 4.252 4.252 4.214 0.038 25767 600 1 . 1 1 109 109 LYS C C 109 177.726 177.726 178.065 -0.339 25767 601 1 . 1 1 109 109 LYS CA C 109 58.730 58.730 58.760 -0.030 25767 602 1 . 1 1 109 109 LYS CB C 109 32.410 32.410 32.840 -0.430 25767 603 1 . 1 1 109 109 LYS H H 109 7.168 7.168 7.549 -0.381 25767 604 1 . 1 1 110 110 ASP N N 110 117.463 117.463 116.726 0.737 25767 605 1 . 1 1 110 110 ASP HA H 110 4.605 4.605 4.656 -0.051 25767 606 1 . 1 1 110 110 ASP C C 110 177.360 177.360 176.660 0.700 25767 607 1 . 1 1 110 110 ASP CA C 110 55.896 55.896 54.813 1.083 25767 608 1 . 1 1 110 110 ASP CB C 110 42.577 42.577 41.810 0.767 25767 609 1 . 1 1 110 110 ASP H H 110 7.861 7.861 8.379 -0.518 25767 610 1 . 1 1 111 111 GLY N N 111 113.059 113.059 108.570 4.489 25767 611 1 . 1 1 111 111 GLY CA C 111 42.052 42.052 42.845 -0.793 25767 612 1 . 1 1 111 111 GLY H H 111 8.479 8.479 7.775 0.704 25767 613 1 . 1 1 112 112 PRO HA H 112 4.463 4.463 4.059 0.404 25767 614 1 . 1 1 112 112 PRO C C 112 175.090 175.090 175.700 -0.610 25767 615 1 . 1 1 112 112 PRO CA C 112 61.364 61.364 62.178 -0.814 25767 616 1 . 1 1 112 112 PRO CB C 112 34.850 34.850 32.737 2.113 25767 617 1 . 1 1 113 113 TRP N N 113 123.164 123.164 121.681 1.483 25767 618 1 . 1 1 113 113 TRP HA H 113 4.710 4.710 4.731 -0.021 25767 619 1 . 1 1 113 113 TRP C C 113 174.605 174.605 175.307 -0.703 25767 620 1 . 1 1 113 113 TRP CA C 113 57.905 57.905 57.092 0.813 25767 621 1 . 1 1 113 113 TRP CB C 113 27.293 27.293 30.319 -3.026 25767 622 1 . 1 1 113 113 TRP H H 113 8.687 8.687 8.354 0.333 25767 623 1 . 1 1 114 114 ASP N N 114 121.356 121.356 122.263 -0.907 25767 624 1 . 1 1 114 114 ASP HA H 114 4.861 4.861 4.932 -0.071 25767 625 1 . 1 1 114 114 ASP CA C 114 52.249 52.249 52.728 -0.479 25767 626 1 . 1 1 114 114 ASP CB C 114 43.141 43.141 44.253 -1.112 25767 627 1 . 1 1 114 114 ASP H H 114 6.985 6.985 8.322 -1.337 25767 628 1 . 1 1 115 115 VAL N N 115 118.649 118.649 119.028 -0.379 25767 629 1 . 1 1 115 115 VAL HA H 115 3.842 3.842 3.867 -0.025 25767 630 1 . 1 1 115 115 VAL C C 115 177.739 177.739 177.448 0.291 25767 631 1 . 1 1 115 115 VAL CA C 115 65.569 65.569 65.726 -0.157 25767 632 1 . 1 1 115 115 VAL CB C 115 31.677 31.677 32.078 -0.401 25767 633 1 . 1 1 115 115 VAL H H 115 8.206 8.206 8.426 -0.220 25767 634 1 . 1 1 116 116 MET N N 116 120.401 120.401 118.276 2.125 25767 635 1 . 1 1 116 116 MET HA H 116 4.303 4.303 4.203 0.100 25767 636 1 . 1 1 116 116 MET C C 116 179.269 179.269 178.333 0.936 25767 637 1 . 1 1 116 116 MET CA C 116 57.634 57.634 59.007 -1.373 25767 638 1 . 1 1 116 116 MET CB C 116 30.414 30.414 31.890 -1.476 25767 639 1 . 1 1 116 116 MET H H 116 7.642 7.642 8.126 -0.484 25767 640 1 . 1 1 117 117 LEU N N 117 125.503 125.503 119.383 6.120 25767 641 1 . 1 1 117 117 LEU HA H 117 4.245 4.245 4.044 0.201 25767 642 1 . 1 1 117 117 LEU C C 117 178.445 178.445 179.223 -0.778 25767 643 1 . 1 1 117 117 LEU CA C 117 58.200 58.200 57.717 0.483 25767 644 1 . 1 1 117 117 LEU CB C 117 40.089 40.089 41.023 -0.934 25767 645 1 . 1 1 117 117 LEU H H 117 8.157 8.157 7.594 0.562 25767 646 1 . 1 1 118 118 LYS N N 118 119.052 119.052 119.418 -0.366 25767 647 1 . 1 1 118 118 LYS HA H 118 3.805 3.805 3.972 -0.167 25767 648 1 . 1 1 118 118 LYS C C 118 178.251 178.251 179.322 -1.071 25767 649 1 . 1 1 118 118 LYS CA C 118 60.526 60.526 60.147 0.379 25767 650 1 . 1 1 118 118 LYS CB C 118 32.128 32.128 32.145 -0.017 25767 651 1 . 1 1 118 118 LYS H H 118 7.400 7.400 7.602 -0.202 25767 652 1 . 1 1 119 119 ARG N N 119 117.999 117.999 119.151 -1.152 25767 653 1 . 1 1 119 119 ARG HA H 119 4.220 4.220 4.276 -0.056 25767 654 1 . 1 1 119 119 ARG C C 119 180.441 180.441 179.051 1.390 25767 655 1 . 1 1 119 119 ARG CA C 119 59.817 59.817 59.586 0.231 25767 656 1 . 1 1 119 119 ARG CB C 119 30.085 30.085 30.210 -0.125 25767 657 1 . 1 1 119 119 ARG H H 119 8.265 8.265 7.975 0.290 25767 658 1 . 1 1 120 120 SER N N 120 118.073 118.073 116.013 2.060 25767 659 1 . 1 1 120 120 SER HA H 120 4.182 4.182 4.316 -0.134 25767 660 1 . 1 1 120 120 SER C C 120 176.215 176.215 176.650 -0.435 25767 661 1 . 1 1 120 120 SER CA C 120 62.817 62.817 62.002 0.815 25767 662 1 . 1 1 120 120 SER CB C 120 63.550 63.550 63.010 0.540 25767 663 1 . 1 1 120 120 SER H H 120 8.633 8.633 7.885 0.748 25767 664 1 . 1 1 121 121 LEU N N 121 125.029 125.029 122.977 2.052 25767 665 1 . 1 1 121 121 LEU HA H 121 4.219 4.219 4.054 0.165 25767 666 1 . 1 1 121 121 LEU C C 121 179.679 179.679 178.295 1.384 25767 667 1 . 1 1 121 121 LEU CA C 121 58.849 58.849 58.045 0.804 25767 668 1 . 1 1 121 121 LEU CB C 121 40.774 40.774 41.513 -0.738 25767 669 1 . 1 1 121 121 LEU H H 121 8.313 8.313 7.988 0.325 25767 670 1 . 1 1 122 122 TRP N N 122 120.217 120.217 119.429 0.788 25767 671 1 . 1 1 122 122 TRP HA H 122 4.340 4.340 4.368 -0.028 25767 672 1 . 1 1 122 122 TRP C C 122 177.527 177.527 178.820 -1.293 25767 673 1 . 1 1 122 122 TRP CA C 122 61.758 61.758 61.166 0.592 25767 674 1 . 1 1 122 122 TRP CB C 122 29.648 29.648 29.105 0.543 25767 675 1 . 1 1 122 122 TRP H H 122 7.928 7.928 7.979 -0.051 25767 676 1 . 1 1 123 123 CYS N N 123 119.669 119.669 118.878 0.791 25767 677 1 . 1 1 123 123 CYS HA H 123 4.207 4.207 4.288 -0.081 25767 678 1 . 1 1 123 123 CYS C C 123 177.057 177.057 177.187 -0.130 25767 679 1 . 1 1 123 123 CYS CA C 123 62.600 62.600 62.936 -0.336 25767 680 1 . 1 1 123 123 CYS CB C 123 25.899 25.899 26.607 -0.708 25767 681 1 . 1 1 123 123 CYS H H 123 8.273 8.273 8.281 -0.008 25767 682 1 . 1 1 124 124 CYS N N 124 116.898 116.898 120.086 -3.188 25767 683 1 . 1 1 124 124 CYS HA H 124 3.848 3.848 4.147 -0.299 25767 684 1 . 1 1 124 124 CYS C C 124 175.759 175.759 176.918 -1.159 25767 685 1 . 1 1 124 124 CYS CA C 124 65.653 65.653 64.708 0.945 25767 686 1 . 1 1 124 124 CYS CB C 124 27.517 27.517 27.419 0.098 25767 687 1 . 1 1 124 124 CYS H H 124 8.122 8.122 8.230 -0.108 25767 688 1 . 1 1 125 125 ILE N N 125 120.498 120.498 120.853 -0.355 25767 689 1 . 1 1 125 125 ILE HA H 125 3.588 3.588 3.698 -0.110 25767 690 1 . 1 1 125 125 ILE C C 125 179.337 179.337 177.568 1.769 25767 691 1 . 1 1 125 125 ILE CA C 125 67.594 67.594 65.823 1.771 25767 692 1 . 1 1 125 125 ILE CB C 125 37.679 37.679 37.457 0.222 25767 693 1 . 1 1 125 125 ILE H H 125 8.092 8.092 8.257 -0.165 25767 694 1 . 1 1 126 126 ASP N N 126 125.084 125.084 120.780 4.304 25767 695 1 . 1 1 126 126 ASP HA H 126 4.617 4.617 4.462 0.155 25767 696 1 . 1 1 126 126 ASP C C 126 178.299 178.299 178.955 -0.656 25767 697 1 . 1 1 126 126 ASP CA C 126 59.004 59.004 57.402 1.602 25767 698 1 . 1 1 126 126 ASP CB C 126 40.296 40.296 40.237 0.059 25767 699 1 . 1 1 126 126 ASP H H 126 9.049 9.049 8.114 0.935 25767 700 1 . 1 1 127 127 LEU N N 127 122.591 122.591 120.531 2.060 25767 701 1 . 1 1 127 127 LEU HA H 127 3.867 3.867 3.937 -0.070 25767 702 1 . 1 1 127 127 LEU C C 127 179.655 179.655 178.660 0.995 25767 703 1 . 1 1 127 127 LEU CA C 127 58.661 58.661 58.038 0.623 25767 704 1 . 1 1 127 127 LEU CB C 127 42.194 42.194 41.753 0.441 25767 705 1 . 1 1 127 127 LEU H H 127 8.888 8.888 7.825 1.063 25767 706 1 . 1 1 128 128 PHE N N 128 117.498 117.498 119.135 -1.637 25767 707 1 . 1 1 128 128 PHE HA H 128 4.322 4.322 4.126 0.196 25767 708 1 . 1 1 128 128 PHE C C 128 178.533 178.533 177.599 0.935 25767 709 1 . 1 1 128 128 PHE CA C 128 60.932 60.932 62.092 -1.160 25767 710 1 . 1 1 128 128 PHE CB C 128 39.053 39.053 39.034 0.019 25767 711 1 . 1 1 128 128 PHE H H 128 8.947 8.947 8.088 0.859 25767 712 1 . 1 1 129 129 SER N N 129 115.398 115.398 115.924 -0.526 25767 713 1 . 1 1 129 129 SER HA H 129 4.046 4.046 4.279 -0.233 25767 714 1 . 1 1 129 129 SER C C 129 175.168 175.168 176.861 -1.693 25767 715 1 . 1 1 129 129 SER CA C 129 63.015 63.015 62.062 0.953 25767 716 1 . 1 1 129 129 SER H H 129 8.578 8.578 8.870 -0.292 25767 717 1 . 1 1 130 130 CYS N N 130 125.556 125.556 121.042 4.514 25767 718 1 . 1 1 130 130 CYS HA H 130 4.109 4.109 4.213 -0.104 25767 719 1 . 1 1 130 130 CYS C C 130 175.294 175.294 176.900 -1.606 25767 720 1 . 1 1 130 130 CYS CA C 130 61.438 61.438 63.846 -2.408 25767 721 1 . 1 1 130 130 CYS CB C 130 27.050 27.050 27.236 -0.186 25767 722 1 . 1 1 130 130 CYS H H 130 8.289 8.289 8.339 -0.050 25767 723 1 . 1 1 131 131 ILE N N 131 120.232 120.232 121.187 -0.955 25767 724 1 . 1 1 131 131 ILE HA H 131 4.033 4.033 4.042 -0.009 25767 725 1 . 1 1 131 131 ILE C C 131 177.297 177.297 178.530 -1.233 25767 726 1 . 1 1 131 131 ILE CA C 131 64.652 64.652 65.498 -0.846 25767 727 1 . 1 1 131 131 ILE CB C 131 39.102 39.102 37.832 1.270 25767 728 1 . 1 1 131 131 ILE H H 131 7.943 7.943 7.913 0.030 25767 729 1 . 1 1 132 132 LEU N N 132 116.422 116.422 120.419 -3.997 25767 730 1 . 1 1 132 132 LEU HA H 132 3.845 3.845 3.949 -0.104 25767 731 1 . 1 1 132 132 LEU C C 132 177.816 177.816 178.558 -0.742 25767 732 1 . 1 1 132 132 LEU CA C 132 57.078 57.078 58.079 -1.001 25767 733 1 . 1 1 132 132 LEU CB C 132 42.213 42.213 41.576 0.637 25767 734 1 . 1 1 132 132 LEU H H 132 7.846 7.846 8.195 -0.349 25767 735 1 . 1 1 133 133 HIS N N 133 116.929 116.929 118.546 -1.617 25767 736 1 . 1 1 133 133 HIS HA H 133 4.139 4.139 4.273 -0.134 25767 737 1 . 1 1 133 133 HIS C C 133 178.669 178.669 177.738 0.931 25767 738 1 . 1 1 133 133 HIS CA C 133 59.736 59.736 59.839 -0.103 25767 739 1 . 1 1 133 133 HIS CB C 133 33.152 33.152 30.381 2.771 25767 740 1 . 1 1 133 133 HIS H H 133 7.822 7.822 8.176 -0.354 25767 741 1 . 1 1 134 134 LEU N N 134 116.898 116.898 120.363 -3.465 25767 742 1 . 1 1 134 134 LEU HA H 134 3.733 3.733 4.124 -0.391 25767 743 1 . 1 1 134 134 LEU C C 134 179.402 179.402 178.850 0.552 25767 744 1 . 1 1 134 134 LEU CA C 134 57.227 57.227 57.772 -0.545 25767 745 1 . 1 1 134 134 LEU CB C 134 39.539 39.539 42.060 -2.521 25767 746 1 . 1 1 134 134 LEU H H 134 8.688 8.688 7.917 0.771 25767 747 1 . 1 1 135 135 TRP N N 135 115.602 115.602 117.464 -1.862 25767 748 1 . 1 1 135 135 TRP HA H 135 5.008 5.008 4.631 0.377 25767 749 1 . 1 1 135 135 TRP C C 135 175.022 175.022 177.946 -2.924 25767 750 1 . 1 1 135 135 TRP CA C 135 59.426 59.426 58.120 1.306 25767 751 1 . 1 1 135 135 TRP CB C 135 27.085 27.085 29.005 -1.920 25767 752 1 . 1 1 135 135 TRP H H 135 7.638 7.638 8.358 -0.720 25767 753 1 . 1 1 136 136 LYS N N 136 119.721 119.721 122.891 -3.170 25767 754 1 . 1 1 136 136 LYS HA H 136 3.816 3.816 3.986 -0.170 25767 755 1 . 1 1 136 136 LYS C C 136 178.279 178.279 178.385 -0.106 25767 756 1 . 1 1 136 136 LYS CA C 136 60.193 60.193 59.620 0.573 25767 757 1 . 1 1 136 136 LYS CB C 136 33.057 33.057 31.828 1.229 25767 758 1 . 1 1 136 136 LYS H H 136 6.538 6.538 8.192 -1.654 25767 759 1 . 1 1 137 137 GLU N N 137 115.407 115.407 115.836 -0.429 25767 760 1 . 1 1 137 137 GLU HA H 137 4.167 4.167 4.152 0.015 25767 761 1 . 1 1 137 137 GLU C C 137 176.700 176.700 177.312 -0.612 25767 762 1 . 1 1 137 137 GLU CA C 137 57.850 57.850 58.505 -0.655 25767 763 1 . 1 1 137 137 GLU CB C 137 29.160 29.160 29.053 0.107 25767 764 1 . 1 1 137 137 GLU H H 137 8.596 8.596 8.226 0.370 25767 765 1 . 1 1 138 138 ASN N N 138 116.669 116.669 116.627 0.042 25767 766 1 . 1 1 138 138 ASN HA H 138 4.906 4.906 4.813 0.093 25767 767 1 . 1 1 138 138 ASN C C 138 173.481 173.481 174.950 -1.469 25767 768 1 . 1 1 138 138 ASN CA C 138 52.814 52.814 53.964 -1.150 25767 769 1 . 1 1 138 138 ASN CB C 138 40.837 40.837 39.669 1.168 25767 770 1 . 1 1 138 138 ASN H H 138 8.343 8.343 8.185 0.158 25767 771 1 . 1 1 139 139 ILE N N 139 120.703 120.703 120.408 0.295 25767 772 1 . 1 1 139 139 ILE HA H 139 4.344 4.344 4.266 0.078 25767 773 1 . 1 1 139 139 ILE C C 139 175.241 175.241 175.320 -0.079 25767 774 1 . 1 1 139 139 ILE CA C 139 60.792 60.792 59.301 1.491 25767 775 1 . 1 1 139 139 ILE CB C 139 40.274 40.274 39.155 1.119 25767 776 1 . 1 1 139 139 ILE H H 139 7.167 7.167 7.537 -0.370 25767 777 1 . 1 1 140 140 SER N N 140 123.284 123.284 120.310 2.974 25767 778 1 . 1 1 140 140 SER HA H 140 4.345 4.345 4.523 -0.178 25767 779 1 . 1 1 140 140 SER CA C 140 58.095 58.095 57.380 0.715 25767 780 1 . 1 1 140 140 SER CB C 140 65.370 65.370 64.696 0.674 25767 781 1 . 1 1 140 140 SER H H 140 8.727 8.727 8.454 0.272 25767 782 1 . 1 1 142 142 THR N N 142 113.868 113.868 115.485 -1.617 25767 783 1 . 1 1 142 142 THR HA H 142 3.976 3.976 4.160 -0.184 25767 784 1 . 1 1 142 142 THR C C 142 177.559 177.559 176.764 0.795 25767 785 1 . 1 1 142 142 THR CA C 142 66.007 66.007 66.024 -0.017 25767 786 1 . 1 1 142 142 THR CB C 142 68.530 68.530 68.454 0.076 25767 787 1 . 1 1 142 142 THR H H 142 8.243 8.243 8.022 0.221 25767 788 1 . 1 1 143 143 SER N N 143 120.786 120.786 117.740 3.046 25767 789 1 . 1 1 143 143 SER C C 143 175.844 175.844 176.661 -0.817 25767 790 1 . 1 1 143 143 SER CA C 143 62.102 62.102 61.899 0.203 25767 791 1 . 1 1 143 143 SER CB C 143 63.086 63.086 62.759 0.327 25767 792 1 . 1 1 143 143 SER H H 143 7.915 7.915 8.287 -0.372 25767 793 1 . 1 1 144 144 THR N N 144 120.946 120.946 117.863 3.083 25767 794 1 . 1 1 144 144 THR HA H 144 4.299 4.299 4.047 0.252 25767 795 1 . 1 1 144 144 THR C C 144 175.874 175.874 176.136 -0.262 25767 796 1 . 1 1 144 144 THR CA C 144 67.487 67.487 66.605 0.882 25767 797 1 . 1 1 144 144 THR CB C 144 68.485 68.485 68.706 -0.221 25767 798 1 . 1 1 144 144 THR H H 144 8.746 8.746 8.549 0.197 25767 799 1 . 1 1 145 145 ASN N N 145 120.069 120.069 119.557 0.512 25767 800 1 . 1 1 145 145 ASN HA H 145 4.308 4.308 4.398 -0.090 25767 801 1 . 1 1 145 145 ASN C C 145 177.917 177.917 177.596 0.321 25767 802 1 . 1 1 145 145 ASN CA C 145 56.337 56.337 56.704 -0.367 25767 803 1 . 1 1 145 145 ASN CB C 145 38.100 38.100 38.574 -0.474 25767 804 1 . 1 1 145 145 ASN H H 145 7.940 7.940 7.955 -0.015 25767 805 1 . 1 1 146 146 SER N N 146 116.905 116.905 116.688 0.217 25767 806 1 . 1 1 146 146 SER HA H 146 3.936 3.936 4.153 -0.217 25767 807 1 . 1 1 146 146 SER C C 146 176.963 176.963 176.661 0.302 25767 808 1 . 1 1 146 146 SER CA C 146 61.997 61.997 62.061 -0.064 25767 809 1 . 1 1 146 146 SER CB C 146 62.879 62.879 63.019 -0.140 25767 810 1 . 1 1 146 146 SER H H 146 7.951 7.951 7.783 0.168 25767 811 1 . 1 1 147 147 LEU N N 147 123.253 123.253 122.088 1.165 25767 812 1 . 1 1 147 147 LEU HA H 147 3.875 3.875 3.966 -0.091 25767 813 1 . 1 1 147 147 LEU C C 147 178.726 178.726 178.891 -0.165 25767 814 1 . 1 1 147 147 LEU CA C 147 58.580 58.580 58.000 0.580 25767 815 1 . 1 1 147 147 LEU CB C 147 40.860 40.860 41.676 -0.816 25767 816 1 . 1 1 147 147 LEU H H 147 8.168 8.168 7.672 0.496 25767 817 1 . 1 1 148 148 GLN N N 148 118.212 118.212 118.053 0.159 25767 818 1 . 1 1 148 148 GLN HA H 148 3.817 3.817 3.997 -0.180 25767 819 1 . 1 1 148 148 GLN C C 148 179.686 179.686 178.416 1.270 25767 820 1 . 1 1 148 148 GLN CA C 148 59.243 59.243 58.546 0.697 25767 821 1 . 1 1 148 148 GLN CB C 148 27.720 27.720 27.884 -0.164 25767 822 1 . 1 1 148 148 GLN H H 148 8.295 8.295 8.735 -0.440 25767 823 1 . 1 1 149 149 LYS N N 149 120.770 120.770 120.531 0.239 25767 824 1 . 1 1 149 149 LYS HA H 149 3.901 3.901 3.951 -0.050 25767 825 1 . 1 1 149 149 LYS C C 149 178.006 178.006 178.921 -0.914 25767 826 1 . 1 1 149 149 LYS CA C 149 59.532 59.532 59.567 -0.035 25767 827 1 . 1 1 149 149 LYS CB C 149 31.892 31.892 32.251 -0.359 25767 828 1 . 1 1 149 149 LYS H H 149 7.955 7.955 8.152 -0.197 25767 829 1 . 1 1 150 150 ARG N N 150 119.244 119.244 118.923 0.321 25767 830 1 . 1 1 150 150 ARG HA H 150 3.840 3.840 3.965 -0.124 25767 831 1 . 1 1 150 150 ARG C C 150 178.858 178.858 178.797 0.061 25767 832 1 . 1 1 150 150 ARG CA C 150 59.371 59.371 59.299 0.072 25767 833 1 . 1 1 150 150 ARG CB C 150 28.804 28.804 29.906 -1.102 25767 834 1 . 1 1 150 150 ARG H H 150 7.020 7.020 7.543 -0.523 25767 835 1 . 1 1 151 151 ILE N N 151 121.183 121.183 119.895 1.288 25767 836 1 . 1 1 151 151 ILE HA H 151 3.359 3.359 3.586 -0.227 25767 837 1 . 1 1 151 151 ILE C C 151 177.327 177.327 177.765 -0.438 25767 838 1 . 1 1 151 151 ILE CA C 151 67.196 67.196 64.307 2.889 25767 839 1 . 1 1 151 151 ILE CB C 151 38.272 38.272 37.245 1.027 25767 840 1 . 1 1 151 151 ILE H H 151 7.574 7.574 7.707 -0.133 25767 841 1 . 1 1 152 152 LYS N N 152 119.521 119.521 120.634 -1.113 25767 842 1 . 1 1 152 152 LYS HA H 152 3.773 3.773 3.865 -0.092 25767 843 1 . 1 1 152 152 LYS C C 152 178.016 178.016 178.595 -0.579 25767 844 1 . 1 1 152 152 LYS CA C 152 59.830 59.830 59.899 -0.069 25767 845 1 . 1 1 152 152 LYS CB C 152 31.581 31.581 32.198 -0.617 25767 846 1 . 1 1 152 152 LYS H H 152 7.629 7.629 8.084 -0.455 25767 847 1 . 1 1 153 153 TYR N N 153 120.178 120.178 120.622 -0.444 25767 848 1 . 1 1 153 153 TYR HA H 153 4.072 4.072 4.138 -0.066 25767 849 1 . 1 1 153 153 TYR C C 153 178.195 178.195 177.875 0.320 25767 850 1 . 1 1 153 153 TYR CA C 153 61.316 61.316 61.857 -0.541 25767 851 1 . 1 1 153 153 TYR CB C 153 37.273 37.273 38.421 -1.148 25767 852 1 . 1 1 153 153 TYR H H 153 8.407 8.407 7.910 0.497 25767 853 1 . 1 1 154 154 CYS N N 154 117.013 117.013 118.161 -1.148 25767 854 1 . 1 1 154 154 CYS HA H 154 4.072 4.072 4.144 -0.072 25767 855 1 . 1 1 154 154 CYS C C 154 176.827 176.827 176.978 -0.151 25767 856 1 . 1 1 154 154 CYS CA C 154 65.780 65.780 63.056 2.724 25767 857 1 . 1 1 154 154 CYS CB C 154 28.160 28.160 27.463 0.697 25767 858 1 . 1 1 154 154 CYS H H 154 8.291 8.291 7.825 0.466 25767 859 1 . 1 1 155 155 LYS N N 155 118.753 118.753 120.768 -2.015 25767 860 1 . 1 1 155 155 LYS HA H 155 3.671 3.671 3.829 -0.158 25767 861 1 . 1 1 155 155 LYS C C 155 179.904 179.904 178.893 1.011 25767 862 1 . 1 1 155 155 LYS CA C 155 60.484 60.484 59.526 0.959 25767 863 1 . 1 1 155 155 LYS CB C 155 31.943 31.943 32.220 -0.277 25767 864 1 . 1 1 155 155 LYS H H 155 7.934 7.934 8.088 -0.154 25767 865 1 . 1 1 156 156 ILE N N 156 123.873 123.873 120.686 3.187 25767 866 1 . 1 1 156 156 ILE HA H 156 3.584 3.584 3.582 0.002 25767 867 1 . 1 1 156 156 ILE C C 156 179.501 179.501 177.667 1.834 25767 868 1 . 1 1 156 156 ILE CA C 156 65.240 65.240 65.533 -0.293 25767 869 1 . 1 1 156 156 ILE CB C 156 37.642 37.642 37.885 -0.243 25767 870 1 . 1 1 156 156 ILE H H 156 8.314 8.314 8.518 -0.204 25767 871 1 . 1 1 157 157 TYR N N 157 121.132 121.132 119.785 1.347 25767 872 1 . 1 1 157 157 TYR HA H 157 4.165 4.165 3.956 0.209 25767 873 1 . 1 1 157 157 TYR C C 157 178.558 178.558 177.498 1.060 25767 874 1 . 1 1 157 157 TYR CA C 157 62.110 62.110 61.915 0.195 25767 875 1 . 1 1 157 157 TYR H H 157 8.442 8.442 7.618 0.824 25767 876 1 . 1 1 158 158 LEU N N 158 120.964 120.964 119.647 1.317 25767 877 1 . 1 1 158 158 LEU HA H 158 3.912 3.912 3.808 0.104 25767 878 1 . 1 1 158 158 LEU C C 158 180.130 180.130 178.738 1.392 25767 879 1 . 1 1 158 158 LEU CA C 158 58.686 58.686 57.763 0.923 25767 880 1 . 1 1 158 158 LEU CB C 158 41.730 41.730 41.483 0.247 25767 881 1 . 1 1 158 158 LEU H H 158 8.469 8.469 7.836 0.633 25767 882 1 . 1 1 159 159 SER N N 159 116.653 116.653 114.952 1.702 25767 883 1 . 1 1 159 159 SER HA H 159 4.246 4.246 4.051 0.195 25767 884 1 . 1 1 159 159 SER CA C 159 61.460 61.460 61.953 -0.493 25767 885 1 . 1 1 159 159 SER CB C 159 62.849 62.849 62.708 0.141 25767 886 1 . 1 1 159 159 SER H H 159 7.758 7.758 8.317 -0.559 25767 887 1 . 1 1 160 160 LYS CA C 160 57.373 57.373 59.272 -1.899 25767 888 1 . 1 1 160 160 LYS CB C 160 29.832 29.832 32.056 -2.224 25767 889 1 . 1 1 160 160 LYS H H 160 8.425 8.425 7.466 0.959 25767 890 1 . 1 1 161 161 LEU N N 161 121.686 121.686 118.869 2.817 25767 891 1 . 1 1 161 161 LEU HA H 161 4.163 4.163 3.828 0.335 25767 892 1 . 1 1 161 161 LEU C C 161 180.224 180.224 179.114 1.110 25767 893 1 . 1 1 161 161 LEU CA C 161 57.584 57.584 57.435 0.149 25767 894 1 . 1 1 161 161 LEU CB C 161 41.462 41.462 41.399 0.063 25767 895 1 . 1 1 161 161 LEU H H 161 8.323 8.323 7.528 0.795 25767 896 1 . 1 1 162 162 ALA N N 162 123.102 123.102 121.110 1.992 25767 897 1 . 1 1 162 162 ALA HA H 162 4.130 4.130 4.066 0.064 25767 898 1 . 1 1 162 162 ALA C C 162 179.487 179.487 179.129 0.358 25767 899 1 . 1 1 162 162 ALA CA C 162 54.744 54.744 54.662 0.082 25767 900 1 . 1 1 162 162 ALA CB C 162 18.403 18.403 18.442 -0.039 25767 901 1 . 1 1 162 162 ALA H H 162 7.978 7.978 7.618 0.360 25767 902 1 . 1 1 163 163 LYS N N 163 116.069 116.069 116.647 -0.578 25767 903 1 . 1 1 163 163 LYS HA H 163 4.223 4.223 4.251 -0.028 25767 904 1 . 1 1 163 163 LYS C C 163 176.987 176.987 176.692 0.295 25767 905 1 . 1 1 163 163 LYS CA C 163 56.606 56.606 56.311 0.295 25767 906 1 . 1 1 163 163 LYS CB C 163 33.206 33.206 32.777 0.429 25767 907 1 . 1 1 163 163 LYS H H 163 7.697 7.697 7.707 -0.010 25767 908 1 . 1 1 164 164 GLY N N 164 108.540 108.540 106.844 1.696 25767 909 1 . 1 1 164 164 GLY C C 164 174.721 174.721 174.108 0.613 25767 910 1 . 1 1 164 164 GLY CA C 164 45.791 45.791 44.953 0.838 25767 911 1 . 1 1 164 164 GLY H H 164 7.772 7.772 7.541 0.231 25767 912 1 . 1 1 165 165 GLU N N 165 119.886 119.886 120.417 -0.531 25767 913 1 . 1 1 165 165 GLU HA H 165 4.050 4.050 4.366 -0.316 25767 914 1 . 1 1 165 165 GLU C C 165 176.027 176.027 174.951 1.076 25767 915 1 . 1 1 165 165 GLU CA C 165 56.853 56.853 55.103 1.750 25767 916 1 . 1 1 165 165 GLU CB C 165 30.338 30.338 31.048 -0.710 25767 917 1 . 1 1 165 165 GLU H H 165 8.065 8.065 7.844 0.221 25767 918 1 . 1 1 166 166 ILE N N 166 117.926 117.926 121.723 -3.797 25767 919 1 . 1 1 166 166 ILE HA H 166 3.902 3.902 3.951 -0.049 25767 920 1 . 1 1 166 166 ILE C C 166 174.138 174.138 176.167 -2.029 25767 921 1 . 1 1 166 166 ILE CA C 166 60.455 60.455 58.965 1.490 25767 922 1 . 1 1 166 166 ILE CB C 166 40.202 40.202 39.262 0.940 25767 923 1 . 1 1 166 166 ILE H H 166 7.282 7.282 8.114 -0.832 25767 stop_ save_