data_19854 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19854 _Entry.PDB_ID 2MMG 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 19854 _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 2 131.228 131.228 123.182 8.046 19854 2 1 1 . 1 1 2 2 ALA C C 2 187.031 187.031 179.531 7.500 19854 3 1 1 . 1 1 2 2 ALA CA C 2 53.407 53.407 55.081 -1.674 19854 4 1 1 . 1 1 2 2 ALA CB C 2 20.027 20.027 18.335 1.692 19854 5 1 1 . 1 1 2 2 ALA H H 2 10.644 10.644 8.308 2.336 19854 6 1 1 . 1 1 3 3 ALA N N 3 124.521 124.521 120.687 3.834 19854 7 1 1 . 1 1 3 3 ALA C C 3 176.566 176.566 179.113 -2.547 19854 8 1 1 . 1 1 3 3 ALA CA C 3 49.894 49.894 54.288 -4.394 19854 9 1 1 . 1 1 3 3 ALA CB C 3 18.270 18.270 17.895 0.375 19854 10 1 1 . 1 1 3 3 ALA H H 3 8.669 8.669 8.334 0.335 19854 11 1 1 . 1 1 4 4 GLN N N 4 118.080 118.080 117.203 0.877 19854 12 1 1 . 1 1 4 4 GLN C C 4 176.273 176.273 176.819 -0.546 19854 13 1 1 . 1 1 4 4 GLN CA C 4 54.579 54.579 56.605 -2.026 19854 14 1 1 . 1 1 4 4 GLN CB C 4 27.054 27.054 29.128 -2.074 19854 15 1 1 . 1 1 4 4 GLN H H 4 8.919 8.919 8.157 0.762 19854 16 1 1 . 1 1 5 5 GLY N N 5 121.002 121.002 105.237 15.765 19854 17 1 1 . 1 1 5 5 GLY C C 5 181.877 181.877 173.738 8.139 19854 18 1 1 . 1 1 5 5 GLY CA C 5 45.794 45.794 44.748 1.046 19854 19 1 1 . 1 1 5 5 GLY H H 5 8.082 8.082 8.139 -0.057 19854 20 1 1 . 1 1 6 6 GLU N N 6 129.435 129.435 121.279 8.156 19854 21 1 1 . 1 1 6 6 GLU C C 6 176.566 176.566 174.858 1.708 19854 22 1 1 . 1 1 6 6 GLU CA C 6 56.336 56.336 53.436 2.900 19854 23 1 1 . 1 1 6 6 GLU CB C 6 28.811 28.811 29.693 -0.882 19854 24 1 1 . 1 1 6 6 GLU H H 6 9.267 9.267 7.806 1.461 19854 25 1 1 . 1 1 7 7 PRO C C 7 176.566 176.566 176.863 -0.297 19854 26 1 1 . 1 1 7 7 PRO CA C 7 63.672 63.672 65.143 -1.471 19854 27 1 1 . 1 1 7 7 PRO CB C 7 31.146 31.146 32.117 -0.971 19854 28 1 1 . 1 1 8 8 GLN N N 8 112.502 112.502 113.906 -1.404 19854 29 1 1 . 1 1 8 8 GLN C C 8 177.445 177.445 175.499 1.946 19854 30 1 1 . 1 1 8 8 GLN CA C 8 50.479 50.479 56.133 -5.654 19854 31 1 1 . 1 1 8 8 GLN CB C 8 28.811 28.811 31.546 -2.735 19854 32 1 1 . 1 1 8 8 GLN H H 8 6.220 6.220 8.197 -1.977 19854 33 1 1 . 1 1 9 9 VAL N N 9 117.416 117.416 118.617 -1.201 19854 34 1 1 . 1 1 9 9 VAL C C 9 178.324 178.324 173.820 4.504 19854 35 1 1 . 1 1 9 9 VAL CA C 9 63.363 63.363 60.664 2.699 19854 36 1 1 . 1 1 9 9 VAL CB C 9 34.668 34.668 34.787 -0.119 19854 37 1 1 . 1 1 9 9 VAL H H 9 6.561 6.561 7.753 -1.192 19854 38 1 1 . 1 1 10 10 GLN N N 10 113.896 113.896 123.109 -9.213 19854 39 1 1 . 1 1 10 10 GLN C C 10 176.273 176.273 174.364 1.909 19854 40 1 1 . 1 1 10 10 GLN CA C 10 55.164 55.164 53.754 1.410 19854 41 1 1 . 1 1 10 10 GLN CB C 10 28.226 28.226 32.219 -3.993 19854 42 1 1 . 1 1 10 10 GLN H H 10 7.847 7.847 7.969 -0.122 19854 43 1 1 . 1 1 11 11 PHE N N 11 118.744 118.744 124.415 -5.671 19854 44 1 1 . 1 1 11 11 PHE C C 11 176.566 176.566 174.871 1.695 19854 45 1 1 . 1 1 11 11 PHE CA C 11 59.849 59.849 56.502 3.347 19854 46 1 1 . 1 1 11 11 PHE CB C 11 41.109 41.109 42.452 -1.343 19854 47 1 1 . 1 1 11 11 PHE H H 11 8.262 8.262 9.088 -0.826 19854 48 1 1 . 1 1 12 12 LYS N N 12 129.437 129.437 126.146 3.291 19854 49 1 1 . 1 1 12 12 LYS C C 12 178.609 178.609 174.875 3.734 19854 50 1 1 . 1 1 12 12 LYS CA C 12 57.808 57.808 55.950 1.858 19854 51 1 1 . 1 1 12 12 LYS H H 12 10.015 10.015 8.875 1.140 19854 52 1 1 . 1 1 13 13 LEU N N 13 112.103 112.103 129.603 -17.500 19854 53 1 1 . 1 1 13 13 LEU C C 13 177.738 177.738 174.644 3.094 19854 54 1 1 . 1 1 13 13 LEU CA C 13 54.579 54.579 53.529 1.050 19854 55 1 1 . 1 1 13 13 LEU CB C 13 42.866 42.866 46.182 -3.316 19854 56 1 1 . 1 1 13 13 LEU H H 13 6.905 6.905 8.959 -2.054 19854 57 1 1 . 1 1 14 14 VAL N N 14 127.310 127.310 126.706 0.604 19854 58 1 1 . 1 1 14 14 VAL C C 14 175.393 175.393 174.193 1.200 19854 59 1 1 . 1 1 14 14 VAL CA C 14 70.976 70.976 61.777 9.199 19854 60 1 1 . 1 1 14 14 VAL CB C 14 28.811 28.811 33.411 -4.601 19854 61 1 1 . 1 1 14 14 VAL H H 14 8.305 8.305 8.732 -0.427 19854 62 1 1 . 1 1 15 15 LEU N N 15 128.640 128.640 130.991 -2.351 19854 63 1 1 . 1 1 15 15 LEU C C 15 177.730 177.730 175.109 2.621 19854 64 1 1 . 1 1 15 15 LEU CA C 15 55.758 55.758 53.280 2.478 19854 65 1 1 . 1 1 15 15 LEU H H 15 7.718 7.718 8.938 -1.220 19854 66 1 1 . 1 1 16 16 VAL N N 16 121.267 121.267 121.611 -0.344 19854 67 1 1 . 1 1 16 16 VAL C C 16 178.324 178.324 174.277 4.047 19854 68 1 1 . 1 1 16 16 VAL CA C 16 63.363 63.363 58.672 4.691 19854 69 1 1 . 1 1 16 16 VAL CB C 16 35.839 35.839 35.211 0.628 19854 70 1 1 . 1 1 16 16 VAL H H 16 8.935 8.935 8.872 0.063 19854 71 1 1 . 1 1 17 17 GLY N N 17 127.908 127.908 106.794 21.114 19854 72 1 1 . 1 1 17 17 GLY C C 17 174.514 174.514 172.586 1.928 19854 73 1 1 . 1 1 17 17 GLY CA C 17 42.281 42.281 44.531 -2.250 19854 74 1 1 . 1 1 17 17 GLY H H 17 9.682 9.682 6.792 2.890 19854 75 1 1 . 1 1 18 18 ASP N N 18 125.054 125.054 120.808 4.246 19854 76 1 1 . 1 1 18 18 ASP C C 18 176.851 176.851 177.591 -0.740 19854 77 1 1 . 1 1 18 18 ASP CA C 18 57.515 57.515 54.603 2.912 19854 78 1 1 . 1 1 18 18 ASP CB C 18 46.090 46.090 42.004 4.087 19854 79 1 1 . 1 1 18 18 ASP H H 18 8.282 8.282 8.280 0.002 19854 80 1 1 . 1 1 19 19 GLY N N 19 120.670 120.670 107.056 13.614 19854 81 1 1 . 1 1 19 19 GLY C C 19 178.324 178.324 175.142 3.182 19854 82 1 1 . 1 1 19 19 GLY CA C 19 42.281 42.281 45.795 -3.514 19854 83 1 1 . 1 1 19 19 GLY H H 19 8.825 8.825 8.671 0.154 19854 84 1 1 . 1 1 20 20 GLY N N 20 129.369 129.369 112.605 16.764 19854 85 1 1 . 1 1 20 20 GLY C C 20 174.221 174.221 175.773 -1.552 19854 86 1 1 . 1 1 20 20 GLY CA C 20 41.695 41.695 45.600 -3.905 19854 87 1 1 . 1 1 20 20 GLY H H 20 8.477 8.477 8.618 -0.141 19854 88 1 1 . 1 1 21 21 THR N N 21 122.199 122.199 114.155 8.044 19854 89 1 1 . 1 1 21 21 THR C C 21 171.291 171.291 175.106 -3.815 19854 90 1 1 . 1 1 21 21 THR CA C 21 61.914 61.914 64.601 -2.687 19854 91 1 1 . 1 1 21 21 THR CB C 21 65.137 65.137 69.272 -4.135 19854 92 1 1 . 1 1 21 21 THR H H 21 8.059 8.059 7.664 0.395 19854 93 1 1 . 1 1 22 22 GLY N N 22 112.369 112.369 108.318 4.051 19854 94 1 1 . 1 1 22 22 GLY C C 22 184.807 184.807 175.470 9.337 19854 95 1 1 . 1 1 22 22 GLY CA C 22 45.209 45.209 45.065 0.144 19854 96 1 1 . 1 1 22 22 GLY H H 22 6.772 6.772 8.330 -1.558 19854 97 1 1 . 1 1 23 23 LYS N N 23 122.066 122.066 120.584 1.482 19854 98 1 1 . 1 1 23 23 LYS C C 23 178.589 178.589 178.225 0.364 19854 99 1 1 . 1 1 23 23 LYS CA C 23 58.101 58.101 59.865 -1.764 19854 100 1 1 . 1 1 23 23 LYS CB C 23 40.230 40.230 32.402 7.828 19854 101 1 1 . 1 1 23 23 LYS H H 23 7.441 7.441 7.591 -0.150 19854 102 1 1 . 1 1 24 24 THR N N 24 114.627 114.627 114.058 0.569 19854 103 1 1 . 1 1 24 24 THR C C 24 178.324 178.324 176.796 1.528 19854 104 1 1 . 1 1 24 24 THR CA C 24 62.192 62.192 67.128 -4.936 19854 105 1 1 . 1 1 24 24 THR CB C 24 71.562 71.562 68.149 3.413 19854 106 1 1 . 1 1 24 24 THR H H 24 8.469 8.469 8.505 -0.036 19854 107 1 1 . 1 1 25 25 THR N N 25 110.377 110.377 119.300 -8.923 19854 108 1 1 . 1 1 25 25 THR C C 25 178.324 178.324 176.117 2.207 19854 109 1 1 . 1 1 25 25 THR CA C 25 64.534 64.534 66.813 -2.279 19854 110 1 1 . 1 1 25 25 THR CB C 25 71.562 71.562 68.424 3.138 19854 111 1 1 . 1 1 25 25 THR H H 25 8.415 8.415 8.127 0.288 19854 112 1 1 . 1 1 26 26 PHE N N 26 114.295 114.295 122.520 -8.225 19854 113 1 1 . 1 1 26 26 PHE C C 26 174.514 174.514 176.926 -2.412 19854 114 1 1 . 1 1 26 26 PHE CA C 26 53.407 53.407 61.904 -8.497 19854 115 1 1 . 1 1 26 26 PHE CB C 26 40.524 40.524 39.176 1.348 19854 116 1 1 . 1 1 26 26 PHE H H 26 7.707 7.707 8.451 -0.744 19854 117 1 1 . 1 1 27 27 VAL N N 27 123.525 123.525 119.958 3.567 19854 118 1 1 . 1 1 27 27 VAL C C 27 178.031 178.031 177.886 0.145 19854 119 1 1 . 1 1 27 27 VAL CA C 27 67.462 67.462 67.186 0.276 19854 120 1 1 . 1 1 27 27 VAL CB C 27 29.397 29.397 31.515 -2.118 19854 121 1 1 . 1 1 27 27 VAL H H 27 6.967 6.967 8.263 -1.296 19854 122 1 1 . 1 1 28 28 LYS N N 28 114.228 114.228 119.528 -5.300 19854 123 1 1 . 1 1 28 28 LYS C C 28 176.566 176.566 178.597 -2.031 19854 124 1 1 . 1 1 28 28 LYS CA C 28 58.092 58.092 59.849 -1.757 19854 125 1 1 . 1 1 28 28 LYS CB C 28 34.082 34.082 31.897 2.185 19854 126 1 1 . 1 1 28 28 LYS H H 28 7.429 7.429 8.177 -0.748 19854 127 1 1 . 1 1 29 29 ARG N N 29 112.037 112.037 119.735 -7.698 19854 128 1 1 . 1 1 29 29 ARG C C 29 174.221 174.221 178.975 -4.754 19854 129 1 1 . 1 1 29 29 ARG CA C 29 72.147 72.147 58.946 13.201 19854 130 1 1 . 1 1 29 29 ARG CB C 29 37.596 37.596 29.712 7.885 19854 131 1 1 . 1 1 29 29 ARG H H 29 6.803 6.803 7.932 -1.129 19854 132 1 1 . 1 1 30 30 HIS N N 30 122.396 122.396 117.263 5.133 19854 133 1 1 . 1 1 30 30 HIS C C 30 172.170 172.170 176.858 -4.688 19854 134 1 1 . 1 1 30 30 HIS CA C 30 51.651 51.651 59.081 -7.430 19854 135 1 1 . 1 1 30 30 HIS CB C 30 30.568 30.568 29.722 0.846 19854 136 1 1 . 1 1 30 30 HIS H H 30 7.644 7.644 7.490 0.154 19854 137 1 1 . 1 1 31 31 LEU N N 31 110.377 110.377 117.134 -6.757 19854 138 1 1 . 1 1 31 31 LEU C C 31 178.031 178.031 178.492 -0.461 19854 139 1 1 . 1 1 31 31 LEU CA C 31 55.164 55.164 57.217 -2.053 19854 140 1 1 . 1 1 31 31 LEU CB C 31 42.281 42.281 42.265 0.016 19854 141 1 1 . 1 1 31 31 LEU H H 31 7.894 7.894 8.068 -0.174 19854 142 1 1 . 1 1 32 32 THR N N 32 121.468 121.468 106.209 15.259 19854 143 1 1 . 1 1 32 32 THR C C 32 170.705 170.705 175.588 -4.883 19854 144 1 1 . 1 1 32 32 THR CA C 32 63.668 63.668 61.829 1.839 19854 145 1 1 . 1 1 32 32 THR CB C 32 75.679 75.679 70.738 4.941 19854 146 1 1 . 1 1 32 32 THR H H 32 8.372 8.372 8.258 0.114 19854 147 1 1 . 1 1 33 33 GLY N N 33 127.841 127.841 110.001 17.840 19854 148 1 1 . 1 1 33 33 GLY C C 33 161.914 161.914 174.166 -12.252 19854 149 1 1 . 1 1 33 33 GLY CA C 33 42.866 42.866 44.753 -1.887 19854 150 1 1 . 1 1 33 33 GLY H H 33 9.662 9.662 7.749 1.913 19854 151 1 1 . 1 1 34 34 GLU N N 34 120.871 120.871 120.068 0.803 19854 152 1 1 . 1 1 34 34 GLU C C 34 174.508 174.508 174.804 -0.296 19854 153 1 1 . 1 1 34 34 GLU CA C 34 58.101 58.101 56.032 2.069 19854 154 1 1 . 1 1 34 34 GLU CB C 34 34.371 34.371 30.656 3.715 19854 155 1 1 . 1 1 34 34 GLU H H 34 8.211 8.211 7.424 0.787 19854 156 1 1 . 1 1 35 35 PHE N N 35 111.838 111.838 119.620 -7.782 19854 157 1 1 . 1 1 35 35 PHE C C 35 174.221 174.221 175.314 -1.093 19854 158 1 1 . 1 1 35 35 PHE CA C 35 49.308 49.308 56.958 -7.650 19854 159 1 1 . 1 1 35 35 PHE CB C 35 41.695 41.695 40.623 1.072 19854 160 1 1 . 1 1 35 35 PHE H H 35 6.772 6.772 8.453 -1.681 19854 161 1 1 . 1 1 36 36 GLU N N 36 120.672 120.672 125.463 -4.791 19854 162 1 1 . 1 1 36 36 GLU C C 36 175.686 175.686 176.461 -0.775 19854 163 1 1 . 1 1 36 36 GLU CA C 36 58.980 58.980 55.246 3.734 19854 164 1 1 . 1 1 36 36 GLU CB C 36 48.140 48.140 29.553 18.587 19854 165 1 1 . 1 1 36 36 GLU H H 36 8.293 8.293 8.637 -0.344 19854 166 1 1 . 1 1 37 37 LYS N N 37 118.810 118.810 126.420 -7.610 19854 167 1 1 . 1 1 37 37 LYS C C 37 172.756 172.756 177.470 -4.714 19854 168 1 1 . 1 1 37 37 LYS CA C 37 48.137 48.137 57.111 -8.974 19854 169 1 1 . 1 1 37 37 LYS CB C 37 37.010 37.010 32.674 4.336 19854 170 1 1 . 1 1 37 37 LYS H H 37 8.509 8.509 8.465 0.044 19854 171 1 1 . 1 1 38 38 LYS N N 38 108.052 108.052 120.342 -12.290 19854 172 1 1 . 1 1 38 38 LYS C C 38 176.273 176.273 176.006 0.267 19854 173 1 1 . 1 1 38 38 LYS CA C 38 59.849 59.849 56.110 3.739 19854 174 1 1 . 1 1 38 38 LYS CB C 38 34.668 34.668 32.810 1.858 19854 175 1 1 . 1 1 38 38 LYS H H 38 7.715 7.715 7.714 0.001 19854 176 1 1 . 1 1 39 39 TYR N N 39 108.650 108.650 123.154 -14.504 19854 177 1 1 . 1 1 39 39 TYR C C 39 175.686 175.686 175.803 -0.117 19854 178 1 1 . 1 1 39 39 TYR CA C 39 61.020 61.020 58.161 2.859 19854 179 1 1 . 1 1 39 39 TYR CB C 39 36.424 36.424 38.937 -2.513 19854 180 1 1 . 1 1 39 39 TYR H H 39 7.362 7.362 8.577 -1.215 19854 181 1 1 . 1 1 40 40 VAL N N 40 117.947 117.947 127.277 -9.330 19854 182 1 1 . 1 1 40 40 VAL C C 40 175.393 175.393 175.286 0.107 19854 183 1 1 . 1 1 40 40 VAL CA C 40 61.020 61.020 61.171 -0.151 19854 184 1 1 . 1 1 40 40 VAL CB C 40 31.154 31.154 34.009 -2.855 19854 185 1 1 . 1 1 40 40 VAL H H 40 8.442 8.442 8.351 0.091 19854 186 1 1 . 1 1 42 42 THR N N 42 117.150 117.150 117.359 -0.209 19854 187 1 1 . 1 1 42 42 THR C C 42 178.910 178.910 173.721 5.189 19854 188 1 1 . 1 1 42 42 THR CA C 42 60.435 60.435 62.671 -2.236 19854 189 1 1 . 1 1 42 42 THR CB C 42 70.390 70.390 69.633 0.757 19854 190 1 1 . 1 1 42 42 THR H H 42 8.192 8.192 8.359 -0.167 19854 191 1 1 . 1 1 43 43 LEU N N 43 119.209 119.209 127.812 -8.603 19854 192 1 1 . 1 1 43 43 LEU C C 43 174.807 174.807 177.729 -2.922 19854 193 1 1 . 1 1 43 43 LEU CA C 43 57.507 57.507 54.256 3.251 19854 194 1 1 . 1 1 43 43 LEU CB C 43 42.866 42.866 42.691 0.174 19854 195 1 1 . 1 1 43 43 LEU H H 43 9.260 9.260 8.511 0.749 19854 196 1 1 . 1 1 44 44 GLY N N 44 114.361 114.361 114.004 0.357 19854 197 1 1 . 1 1 44 44 GLY C C 44 178.910 178.910 172.682 6.228 19854 198 1 1 . 1 1 44 44 GLY CA C 44 54.579 54.579 46.116 8.463 19854 199 1 1 . 1 1 44 44 GLY H H 44 6.979 6.979 8.656 -1.677 19854 200 1 1 . 1 1 45 45 VAL N N 45 110.244 110.244 124.008 -13.764 19854 201 1 1 . 1 1 45 45 VAL C C 45 174.807 174.807 174.574 0.233 19854 202 1 1 . 1 1 45 45 VAL CA C 45 63.363 63.363 59.931 3.432 19854 203 1 1 . 1 1 45 45 VAL CB C 45 17.099 17.099 34.815 -17.716 19854 204 1 1 . 1 1 45 45 VAL H H 45 8.309 8.309 8.170 0.139 19854 205 1 1 . 1 1 46 46 GLU N N 46 130.365 130.365 128.763 1.602 19854 206 1 1 . 1 1 46 46 GLU C C 46 176.859 176.859 174.394 2.465 19854 207 1 1 . 1 1 46 46 GLU CA C 46 55.164 55.164 53.659 1.505 19854 208 1 1 . 1 1 46 46 GLU CB C 46 32.325 32.325 32.017 0.308 19854 209 1 1 . 1 1 46 46 GLU H H 46 9.741 9.741 8.916 0.825 19854 210 1 1 . 1 1 47 47 VAL N N 47 125.254 125.254 125.183 0.071 19854 211 1 1 . 1 1 47 47 VAL C C 47 175.661 175.661 175.804 -0.143 19854 212 1 1 . 1 1 47 47 VAL CA C 47 63.375 63.375 61.195 2.180 19854 213 1 1 . 1 1 47 47 VAL CB C 47 37.300 37.300 32.383 4.917 19854 214 1 1 . 1 1 47 47 VAL H H 47 8.250 8.250 8.228 0.022 19854 215 1 1 . 1 1 48 48 HIS N N 48 129.236 129.236 127.304 1.932 19854 216 1 1 . 1 1 48 48 HIS C C 48 169.240 169.240 173.117 -3.877 19854 217 1 1 . 1 1 48 48 HIS CA C 48 49.894 49.894 53.482 -3.588 19854 218 1 1 . 1 1 48 48 HIS CB C 48 27.640 27.640 32.184 -4.544 19854 219 1 1 . 1 1 48 48 HIS H H 48 10.390 10.390 9.175 1.215 19854 220 1 1 . 1 1 49 49 PRO C C 49 176.273 176.273 175.639 0.634 19854 221 1 1 . 1 1 49 49 PRO CA C 49 62.500 62.500 62.586 -0.085 19854 222 1 1 . 1 1 49 49 PRO CB C 49 29.974 29.974 32.284 -2.310 19854 223 1 1 . 1 1 50 50 LEU N N 50 119.408 119.408 127.505 -8.097 19854 224 1 1 . 1 1 50 50 LEU C C 50 177.445 177.445 174.543 2.902 19854 225 1 1 . 1 1 50 50 LEU CA C 50 59.264 59.264 54.599 4.665 19854 226 1 1 . 1 1 50 50 LEU CB C 50 42.281 42.281 45.590 -3.309 19854 227 1 1 . 1 1 50 50 LEU H H 50 7.492 7.492 9.029 -1.537 19854 228 1 1 . 1 1 51 51 VAL N N 51 117.947 117.947 126.258 -8.311 19854 229 1 1 . 1 1 51 51 VAL C C 51 174.514 174.514 175.555 -1.041 19854 230 1 1 . 1 1 51 51 VAL CA C 51 64.534 64.534 61.138 3.396 19854 231 1 1 . 1 1 51 51 VAL CB C 51 37.010 37.010 33.658 3.352 19854 232 1 1 . 1 1 51 51 VAL H H 51 7.715 7.715 8.112 -0.397 19854 233 1 1 . 1 1 52 52 PHE N N 52 124.853 124.853 126.310 -1.457 19854 234 1 1 . 1 1 52 52 PHE C C 52 175.100 175.100 174.154 0.946 19854 235 1 1 . 1 1 52 52 PHE CA C 52 56.336 56.336 56.805 -0.469 19854 236 1 1 . 1 1 52 52 PHE CB C 52 39.938 39.938 43.417 -3.479 19854 237 1 1 . 1 1 52 52 PHE H H 52 8.935 8.935 9.284 -0.349 19854 238 1 1 . 1 1 53 53 HIS N N 53 120.603 120.603 122.917 -2.314 19854 239 1 1 . 1 1 53 53 HIS C C 53 170.119 170.119 174.262 -4.143 19854 240 1 1 . 1 1 53 53 HIS CA C 53 55.164 55.164 55.332 -0.168 19854 241 1 1 . 1 1 53 53 HIS CB C 53 30.568 30.568 32.018 -1.450 19854 242 1 1 . 1 1 53 53 HIS H H 53 8.356 8.356 9.469 -1.113 19854 243 1 1 . 1 1 54 54 THR N N 54 112.634 112.634 118.828 -6.194 19854 244 1 1 . 1 1 54 54 THR C C 54 178.910 178.910 176.195 2.715 19854 245 1 1 . 1 1 54 54 THR CA C 54 63.363 63.363 59.480 3.883 19854 246 1 1 . 1 1 54 54 THR CB C 54 72.733 72.733 71.922 0.811 19854 247 1 1 . 1 1 54 54 THR H H 54 7.574 7.574 8.083 -0.509 19854 248 1 1 . 1 1 55 55 ASN N N 55 131.095 131.095 119.804 11.291 19854 249 1 1 . 1 1 55 55 ASN C C 55 176.273 176.273 176.788 -0.515 19854 250 1 1 . 1 1 55 55 ASN CA C 55 51.065 51.065 55.929 -4.864 19854 251 1 1 . 1 1 55 55 ASN CB C 55 37.010 37.010 38.309 -1.299 19854 252 1 1 . 1 1 55 55 ASN H H 55 10.187 10.187 8.678 1.509 19854 253 1 1 . 1 1 56 56 ARG N N 56 122.064 122.064 118.977 3.087 19854 254 1 1 . 1 1 56 56 ARG C C 56 175.100 175.100 175.836 -0.736 19854 255 1 1 . 1 1 56 56 ARG CA C 56 61.606 61.606 55.715 5.891 19854 256 1 1 . 1 1 56 56 ARG CB C 56 32.911 32.911 30.375 2.535 19854 257 1 1 . 1 1 56 56 ARG H H 56 7.433 7.433 7.681 -0.248 19854 258 1 1 . 1 1 57 57 GLY N N 57 127.709 127.709 108.246 19.463 19854 259 1 1 . 1 1 57 57 GLY C C 57 175.979 175.979 171.509 4.470 19854 260 1 1 . 1 1 57 57 GLY CA C 57 42.281 42.281 44.023 -1.742 19854 261 1 1 . 1 1 57 57 GLY H H 57 9.373 9.373 7.555 1.818 19854 262 1 1 . 1 1 58 58 PRO C C 58 177.152 177.152 176.166 0.986 19854 263 1 1 . 1 1 58 58 PRO CA C 58 65.137 65.137 62.685 2.452 19854 264 1 1 . 1 1 58 58 PRO CB C 58 29.095 29.095 32.242 -3.147 19854 265 1 1 . 1 1 59 59 ILE N N 59 128.638 128.638 115.024 13.614 19854 266 1 1 . 1 1 59 59 ILE C C 59 175.979 175.979 173.894 2.085 19854 267 1 1 . 1 1 59 59 ILE CA C 59 65.120 65.120 59.209 5.911 19854 268 1 1 . 1 1 59 59 ILE CB C 59 40.524 40.524 42.279 -1.755 19854 269 1 1 . 1 1 59 59 ILE H H 59 8.794 8.794 8.952 -0.158 19854 270 1 1 . 1 1 60 60 LYS N N 60 127.711 127.711 124.224 3.487 19854 271 1 1 . 1 1 60 60 LYS C C 60 178.902 178.902 174.776 4.126 19854 272 1 1 . 1 1 60 60 LYS CA C 60 74.293 74.293 54.413 19.880 19854 273 1 1 . 1 1 60 60 LYS CB C 60 32.027 32.027 35.920 -3.893 19854 274 1 1 . 1 1 60 60 LYS H H 60 8.024 8.024 8.643 -0.619 19854 275 1 1 . 1 1 61 61 PHE N N 61 120.670 120.670 124.633 -3.963 19854 276 1 1 . 1 1 61 61 PHE C C 61 175.393 175.393 174.961 0.432 19854 277 1 1 . 1 1 61 61 PHE CA C 61 57.507 57.507 56.830 0.677 19854 278 1 1 . 1 1 61 61 PHE CB C 61 41.109 41.109 41.211 -0.102 19854 279 1 1 . 1 1 61 61 PHE H H 61 7.515 7.515 9.497 -1.982 19854 280 1 1 . 1 1 62 62 ASN N N 62 124.789 124.789 123.803 0.986 19854 281 1 1 . 1 1 62 62 ASN C C 62 173.336 173.336 174.662 -1.326 19854 282 1 1 . 1 1 62 62 ASN CA C 62 53.121 53.121 52.555 0.566 19854 283 1 1 . 1 1 62 62 ASN CB C 62 41.695 41.695 39.516 2.179 19854 284 1 1 . 1 1 62 62 ASN H H 62 8.325 8.325 9.338 -1.013 19854 285 1 1 . 1 1 63 63 VAL N N 63 106.127 106.127 127.130 -21.003 19854 286 1 1 . 1 1 63 63 VAL C C 63 175.100 175.100 175.434 -0.334 19854 287 1 1 . 1 1 63 63 VAL CA C 63 61.020 61.020 63.054 -2.034 19854 288 1 1 . 1 1 63 63 VAL CB C 63 31.154 31.154 32.811 -1.657 19854 289 1 1 . 1 1 63 63 VAL H H 63 8.113 8.113 8.939 -0.826 19854 290 1 1 . 1 1 64 64 TRP N N 64 129.302 129.302 130.047 -0.745 19854 291 1 1 . 1 1 64 64 TRP C C 64 177.152 177.152 175.179 1.973 19854 292 1 1 . 1 1 64 64 TRP CA C 64 59.264 59.264 55.818 3.446 19854 293 1 1 . 1 1 64 64 TRP CB C 64 29.397 29.397 29.749 -0.352 19854 294 1 1 . 1 1 64 64 TRP H H 64 8.970 8.970 9.643 -0.673 19854 295 1 1 . 1 1 65 65 ASP N N 65 119.607 119.607 126.111 -6.504 19854 296 1 1 . 1 1 65 65 ASP C C 65 174.514 174.514 175.792 -1.278 19854 297 1 1 . 1 1 65 65 ASP CA C 65 55.164 55.164 53.221 1.943 19854 298 1 1 . 1 1 65 65 ASP CB C 65 41.109 41.109 43.018 -1.909 19854 299 1 1 . 1 1 65 65 ASP H H 65 8.638 8.638 9.076 -0.438 19854 300 1 1 . 1 1 66 66 THR N N 66 122.463 122.463 117.791 4.672 19854 301 1 1 . 1 1 66 66 THR C C 66 178.617 178.617 173.699 4.918 19854 302 1 1 . 1 1 66 66 THR CA C 66 68.048 68.048 59.617 8.431 19854 303 1 1 . 1 1 66 66 THR CB C 66 71.562 71.562 71.311 0.251 19854 304 1 1 . 1 1 66 66 THR H H 66 8.293 8.293 8.442 -0.149 19854 305 1 1 . 1 1 67 67 ALA N N 67 104.865 104.865 122.402 -17.537 19854 306 1 1 . 1 1 67 67 ALA C C 67 177.738 177.738 178.258 -0.520 19854 307 1 1 . 1 1 67 67 ALA CA C 67 48.722 48.722 51.629 -2.907 19854 308 1 1 . 1 1 67 67 ALA CB C 67 14.171 14.171 20.105 -5.934 19854 309 1 1 . 1 1 67 67 ALA H H 67 8.657 8.657 7.936 0.721 19854 310 1 1 . 1 1 68 68 GLY N N 68 115.357 115.357 110.025 5.332 19854 311 1 1 . 1 1 68 68 GLY C C 68 189.533 189.533 176.072 13.461 19854 312 1 1 . 1 1 68 68 GLY CA C 68 45.209 45.209 46.114 -0.905 19854 313 1 1 . 1 1 68 68 GLY H H 68 10.969 10.969 8.960 2.009 19854 314 1 1 . 1 1 69 69 GLN N N 69 122.730 122.730 119.914 2.816 19854 315 1 1 . 1 1 69 69 GLN C C 69 174.508 174.508 176.321 -1.813 19854 316 1 1 . 1 1 69 69 GLN CA C 69 58.394 58.394 57.436 0.958 19854 317 1 1 . 1 1 69 69 GLN CB C 69 31.441 31.441 28.772 2.669 19854 318 1 1 . 1 1 69 69 GLN H H 69 8.336 8.336 8.514 -0.178 19854 319 1 1 . 1 1 70 70 GLU N N 70 114.826 114.826 120.381 -5.555 19854 320 1 1 . 1 1 70 70 GLU C C 70 176.273 176.273 175.632 0.641 19854 321 1 1 . 1 1 70 70 GLU CA C 70 57.507 57.507 56.489 1.018 19854 322 1 1 . 1 1 70 70 GLU CB C 70 28.811 28.811 30.322 -1.511 19854 323 1 1 . 1 1 70 70 GLU H H 70 9.651 9.651 8.299 1.352 19854 324 1 1 . 1 1 71 71 LYS N N 71 116.685 116.685 123.134 -6.449 19854 325 1 1 . 1 1 71 71 LYS C C 71 175.979 175.979 176.348 -0.369 19854 326 1 1 . 1 1 71 71 LYS CA C 71 48.722 48.722 56.100 -7.378 19854 327 1 1 . 1 1 71 71 LYS CB C 71 37.010 37.010 32.901 4.109 19854 328 1 1 . 1 1 71 71 LYS H H 71 8.712 8.712 8.275 0.437 19854 329 1 1 . 1 1 72 72 PHE N N 72 114.959 114.959 120.156 -5.197 19854 330 1 1 . 1 1 72 72 PHE C C 72 175.686 175.686 176.859 -1.173 19854 331 1 1 . 1 1 72 72 PHE CA C 72 56.336 56.336 58.635 -2.299 19854 332 1 1 . 1 1 72 72 PHE CB C 72 36.424 36.424 38.868 -2.444 19854 333 1 1 . 1 1 72 72 PHE H H 72 7.965 7.965 8.000 -0.035 19854 334 1 1 . 1 1 73 73 GLY N N 73 117.084 117.084 112.396 4.688 19854 335 1 1 . 1 1 73 73 GLY C C 73 168.068 168.068 174.498 -6.430 19854 336 1 1 . 1 1 73 73 GLY CA C 73 42.281 42.281 44.956 -2.675 19854 337 1 1 . 1 1 73 73 GLY H H 73 7.609 7.609 7.656 -0.047 19854 338 1 1 . 1 1 74 74 GLY N N 74 120.537 120.537 107.650 12.887 19854 339 1 1 . 1 1 74 74 GLY C C 74 174.514 174.514 176.478 -1.964 19854 340 1 1 . 1 1 74 74 GLY CA C 74 44.037 44.037 46.361 -2.324 19854 341 1 1 . 1 1 74 74 GLY H H 74 9.326 9.326 8.656 0.670 19854 342 1 1 . 1 1 75 75 LEU N N 75 127.177 127.177 121.648 5.529 19854 343 1 1 . 1 1 75 75 LEU C C 75 178.617 178.617 178.243 0.374 19854 344 1 1 . 1 1 75 75 LEU CA C 75 53.407 53.407 57.064 -3.657 19854 345 1 1 . 1 1 75 75 LEU CB C 75 42.281 42.281 41.714 0.567 19854 346 1 1 . 1 1 75 75 LEU H H 75 7.628 7.628 7.783 -0.155 19854 347 1 1 . 1 1 76 76 ARG N N 76 116.486 116.486 116.467 0.019 19854 348 1 1 . 1 1 76 76 ARG C C 76 176.859 176.859 176.795 0.064 19854 349 1 1 . 1 1 76 76 ARG CA C 76 59.264 59.264 56.257 3.007 19854 350 1 1 . 1 1 76 76 ARG CB C 76 31.154 31.154 29.739 1.415 19854 351 1 1 . 1 1 76 76 ARG H H 76 7.143 7.143 7.466 -0.323 19854 352 1 1 . 1 1 77 77 ASP N N 77 129.236 129.236 120.901 8.335 19854 353 1 1 . 1 1 77 77 ASP C C 77 177.152 177.152 177.901 -0.749 19854 354 1 1 . 1 1 77 77 ASP CA C 77 52.822 52.822 57.534 -4.712 19854 355 1 1 . 1 1 77 77 ASP CB C 77 41.695 41.695 40.380 1.315 19854 356 1 1 . 1 1 77 77 ASP H H 77 8.947 8.947 7.540 1.407 19854 357 1 1 . 1 1 78 78 GLY N N 78 127.244 127.244 107.360 19.884 19854 358 1 1 . 1 1 78 78 GLY C C 78 173.928 173.928 176.352 -2.424 19854 359 1 1 . 1 1 78 78 GLY CA C 78 44.623 44.623 47.055 -2.432 19854 360 1 1 . 1 1 78 78 GLY H H 78 8.219 8.219 8.506 -0.287 19854 361 1 1 . 1 1 79 79 TYR N N 79 120.537 120.537 119.337 1.200 19854 362 1 1 . 1 1 79 79 TYR C C 79 176.273 176.273 177.625 -1.352 19854 363 1 1 . 1 1 79 79 TYR CA C 79 58.678 58.678 59.103 -0.425 19854 364 1 1 . 1 1 79 79 TYR CB C 79 40.524 40.524 37.990 2.534 19854 365 1 1 . 1 1 79 79 TYR H H 79 8.563 8.563 7.400 1.163 19854 366 1 1 . 1 1 80 80 TYR N N 80 122.132 122.132 118.467 3.665 19854 367 1 1 . 1 1 80 80 TYR C C 80 175.979 175.979 175.774 0.205 19854 368 1 1 . 1 1 80 80 TYR CA C 80 62.203 62.203 59.313 2.890 19854 369 1 1 . 1 1 80 80 TYR CB C 80 41.988 41.988 39.441 2.547 19854 370 1 1 . 1 1 80 80 TYR H H 80 8.254 8.254 7.604 0.650 19854 371 1 1 . 1 1 81 81 ILE N N 81 120.072 120.072 120.419 -0.347 19854 372 1 1 . 1 1 81 81 ILE C C 81 177.445 177.445 175.935 1.510 19854 373 1 1 . 1 1 81 81 ILE CA C 81 67.462 67.462 63.461 4.002 19854 374 1 1 . 1 1 81 81 ILE CB C 81 41.109 41.109 37.891 3.218 19854 375 1 1 . 1 1 81 81 ILE H H 81 8.837 8.837 8.112 0.725 19854 376 1 1 . 1 1 82 82 GLN N N 82 121.601 121.601 119.686 1.915 19854 377 1 1 . 1 1 82 82 GLN C C 82 173.342 173.342 174.506 -1.164 19854 378 1 1 . 1 1 82 82 GLN CA C 82 59.859 59.859 56.394 3.465 19854 379 1 1 . 1 1 82 82 GLN CB C 82 30.855 30.855 25.892 4.963 19854 380 1 1 . 1 1 82 82 GLN H H 82 8.184 8.184 9.006 -0.822 19854 381 1 1 . 1 1 83 83 ALA N N 83 109.713 109.713 119.915 -10.202 19854 382 1 1 . 1 1 83 83 ALA C C 83 175.979 175.979 177.002 -1.023 19854 383 1 1 . 1 1 83 83 ALA CA C 83 54.579 54.579 52.544 2.035 19854 384 1 1 . 1 1 83 83 ALA CB C 83 16.513 16.513 19.303 -2.790 19854 385 1 1 . 1 1 83 83 ALA H H 83 6.306 6.306 7.405 -1.099 19854 386 1 1 . 1 1 84 84 GLN N N 84 121.203 121.203 119.309 1.894 19854 387 1 1 . 1 1 84 84 GLN C C 84 177.144 177.144 176.028 1.116 19854 388 1 1 . 1 1 84 84 GLN CA C 84 60.152 60.152 56.108 4.044 19854 389 1 1 . 1 1 84 84 GLN CB C 84 34.957 34.957 31.102 3.854 19854 390 1 1 . 1 1 84 84 GLN H H 84 8.180 8.180 8.737 -0.557 19854 391 1 1 . 1 1 85 85 CYS N N 85 120.605 120.605 111.878 8.727 19854 392 1 1 . 1 1 85 85 CYS C C 85 176.566 176.566 172.681 3.885 19854 393 1 1 . 1 1 85 85 CYS CA C 85 65.430 65.430 56.337 9.093 19854 394 1 1 . 1 1 85 85 CYS CB C 85 39.644 39.644 31.419 8.225 19854 395 1 1 . 1 1 85 85 CYS H H 85 8.364 8.364 7.667 0.697 19854 396 1 1 . 1 1 86 86 ALA N N 86 114.295 114.295 121.454 -7.159 19854 397 1 1 . 1 1 86 86 ALA CA C 86 57.507 57.507 51.001 6.506 19854 398 1 1 . 1 1 86 86 ALA CB C 86 21.784 21.784 22.897 -1.113 19854 399 1 1 . 1 1 86 86 ALA H H 86 6.897 6.897 8.674 -1.777 19854 400 1 1 . 1 1 87 87 ILE N N 87 120.670 120.670 120.360 0.310 19854 401 1 1 . 1 1 87 87 ILE C C 87 173.928 173.928 174.626 -0.698 19854 402 1 1 . 1 1 87 87 ILE CA C 87 61.020 61.020 59.999 1.020 19854 403 1 1 . 1 1 87 87 ILE CB C 87 39.938 39.938 41.366 -1.428 19854 404 1 1 . 1 1 87 87 ILE H H 87 8.282 8.282 8.620 -0.338 19854 405 1 1 . 1 1 88 88 ILE N N 88 120.205 120.205 127.212 -7.007 19854 406 1 1 . 1 1 88 88 ILE C C 88 173.635 173.635 174.924 -1.289 19854 407 1 1 . 1 1 88 88 ILE CA C 88 64.534 64.534 60.117 4.417 19854 408 1 1 . 1 1 88 88 ILE CB C 88 37.596 37.596 40.120 -2.523 19854 409 1 1 . 1 1 88 88 ILE H H 88 5.528 5.528 8.938 -3.410 19854 410 1 1 . 1 1 89 89 MET N N 89 120.472 120.472 126.078 -5.606 19854 411 1 1 . 1 1 89 89 MET C C 89 178.617 178.617 175.080 3.537 19854 412 1 1 . 1 1 89 89 MET CA C 89 58.980 58.980 54.319 4.661 19854 413 1 1 . 1 1 89 89 MET CB C 89 34.957 34.957 35.095 -0.138 19854 414 1 1 . 1 1 89 89 MET H H 89 8.176 8.176 8.716 -0.540 19854 415 1 1 . 1 1 90 90 PHE N N 90 121.134 121.134 118.695 2.439 19854 416 1 1 . 1 1 90 90 PHE C C 90 175.393 175.393 173.001 2.392 19854 417 1 1 . 1 1 90 90 PHE CA C 90 60.435 60.435 55.360 5.075 19854 418 1 1 . 1 1 90 90 PHE CB C 90 38.767 38.767 42.115 -3.348 19854 419 1 1 . 1 1 90 90 PHE H H 90 9.334 9.334 8.724 0.610 19854 420 1 1 . 1 1 91 91 ASP N N 91 120.273 120.273 120.677 -0.404 19854 421 1 1 . 1 1 91 91 ASP C C 91 177.730 177.730 178.072 -0.342 19854 422 1 1 . 1 1 91 91 ASP CA C 91 59.859 59.859 52.345 7.514 19854 423 1 1 . 1 1 91 91 ASP CB C 91 44.039 44.039 42.758 1.281 19854 424 1 1 . 1 1 91 91 ASP H H 91 7.597 7.597 8.952 -1.355 19854 425 1 1 . 1 1 92 92 VAL N N 92 115.158 115.158 123.572 -8.414 19854 426 1 1 . 1 1 92 92 VAL C C 92 173.342 173.342 176.570 -3.228 19854 427 1 1 . 1 1 92 92 VAL CA C 92 64.534 64.534 64.957 -0.423 19854 428 1 1 . 1 1 92 92 VAL CB C 92 37.596 37.596 31.370 6.226 19854 429 1 1 . 1 1 92 92 VAL H H 92 7.738 7.738 8.563 -0.825 19854 430 1 1 . 1 1 93 93 THR N N 93 127.179 127.179 110.198 16.981 19854 431 1 1 . 1 1 93 93 THR C C 93 178.902 178.902 174.709 4.193 19854 432 1 1 . 1 1 93 93 THR CA C 93 64.254 64.254 62.903 1.351 19854 433 1 1 . 1 1 93 93 THR CB C 93 74.215 74.215 69.128 5.087 19854 434 1 1 . 1 1 93 93 THR H H 93 7.636 7.636 8.214 -0.578 19854 435 1 1 . 1 1 94 94 SER N N 94 122.263 122.263 116.501 5.762 19854 436 1 1 . 1 1 94 94 SER C C 94 163.965 163.965 174.840 -10.875 19854 437 1 1 . 1 1 94 94 SER CA C 94 59.849 59.849 55.585 4.264 19854 438 1 1 . 1 1 94 94 SER CB C 94 62.192 62.192 64.141 -1.949 19854 439 1 1 . 1 1 94 94 SER H H 94 7.628 7.628 7.944 -0.316 19854 440 1 1 . 1 1 95 95 ARG N N 95 113.099 113.099 128.128 -15.029 19854 441 1 1 . 1 1 95 95 ARG C C 95 176.273 176.273 177.929 -1.656 19854 442 1 1 . 1 1 95 95 ARG CA C 95 53.407 53.407 59.598 -6.191 19854 443 1 1 . 1 1 95 95 ARG CB C 95 31.154 31.154 30.115 1.039 19854 444 1 1 . 1 1 95 95 ARG H H 95 8.102 8.102 9.010 -0.908 19854 445 1 1 . 1 1 96 96 VAL N N 96 124.787 124.787 119.236 5.551 19854 446 1 1 . 1 1 96 96 VAL C C 96 178.031 178.031 177.737 0.294 19854 447 1 1 . 1 1 96 96 VAL CA C 96 68.634 68.634 66.397 2.237 19854 448 1 1 . 1 1 96 96 VAL CB C 96 24.126 24.126 31.359 -7.233 19854 449 1 1 . 1 1 96 96 VAL H H 96 9.146 9.146 8.180 0.966 19854 450 1 1 . 1 1 97 97 THR N N 97 111.970 111.970 116.058 -4.088 19854 451 1 1 . 1 1 97 97 THR C C 97 178.031 178.031 175.974 2.057 19854 452 1 1 . 1 1 97 97 THR CA C 97 63.949 63.949 66.354 -2.405 19854 453 1 1 . 1 1 97 97 THR CB C 97 70.390 70.390 69.008 1.382 19854 454 1 1 . 1 1 97 97 THR H H 97 7.984 7.984 7.584 0.400 19854 455 1 1 . 1 1 98 98 TYR N N 98 113.232 113.232 121.122 -7.890 19854 456 1 1 . 1 1 98 98 TYR C C 98 176.273 176.273 177.473 -1.200 19854 457 1 1 . 1 1 98 98 TYR H H 98 7.605 7.605 7.674 -0.069 19854 458 1 1 . 1 1 99 99 LYS N N 99 123.726 123.726 118.570 5.156 19854 459 1 1 . 1 1 99 99 LYS C C 99 178.316 178.316 178.356 -0.040 19854 460 1 1 . 1 1 99 99 LYS CA C 99 58.691 58.691 59.366 -0.675 19854 461 1 1 . 1 1 99 99 LYS CB C 99 36.127 36.127 32.013 4.114 19854 462 1 1 . 1 1 99 99 LYS H H 99 8.360 8.360 8.058 0.302 19854 463 1 1 . 1 1 100 100 ASN N N 100 111.970 111.970 115.993 -4.023 19854 464 1 1 . 1 1 100 100 ASN C C 100 175.979 175.979 176.701 -0.722 19854 465 1 1 . 1 1 100 100 ASN CA C 100 53.407 53.407 54.986 -1.579 19854 466 1 1 . 1 1 100 100 ASN CB C 100 37.596 37.596 38.758 -1.162 19854 467 1 1 . 1 1 100 100 ASN H H 100 5.778 5.778 7.633 -1.855 19854 468 1 1 . 1 1 101 101 VAL N N 101 118.877 118.877 121.574 -2.697 19854 469 1 1 . 1 1 101 101 VAL C C 101 173.635 173.635 175.086 -1.451 19854 470 1 1 . 1 1 101 101 VAL CA C 101 62.777 62.777 68.482 -5.705 19854 471 1 1 . 1 1 101 101 VAL CB C 101 27.054 27.054 29.115 -2.061 19854 472 1 1 . 1 1 101 101 VAL H H 101 7.370 7.370 7.682 -0.312 19854 473 1 1 . 1 1 102 102 PRO C C 102 176.566 176.566 176.982 -0.416 19854 474 1 1 . 1 1 102 102 PRO CA C 102 62.500 62.500 65.201 -2.701 19854 475 1 1 . 1 1 102 102 PRO CB C 102 30.853 30.853 30.855 -0.002 19854 476 1 1 . 1 1 103 103 ASN N N 103 122.728 122.728 116.581 6.147 19854 477 1 1 . 1 1 103 103 ASN C C 103 175.100 175.100 176.924 -1.824 19854 478 1 1 . 1 1 103 103 ASN CA C 103 54.579 54.579 54.767 -0.188 19854 479 1 1 . 1 1 103 103 ASN CB C 103 38.767 38.767 37.251 1.516 19854 480 1 1 . 1 1 103 103 ASN H H 103 7.879 7.879 7.443 0.436 19854 481 1 1 . 1 1 104 104 TRP N N 104 122.730 122.730 120.191 2.539 19854 482 1 1 . 1 1 104 104 TRP C C 104 174.215 174.215 177.538 -3.323 19854 483 1 1 . 1 1 104 104 TRP CA C 104 59.273 59.273 60.502 -1.229 19854 484 1 1 . 1 1 104 104 TRP CB C 104 35.250 35.250 30.055 5.195 19854 485 1 1 . 1 1 104 104 TRP H H 104 7.902 7.902 7.638 0.264 19854 486 1 1 . 1 1 105 105 HIS N N 105 120.869 120.869 117.127 3.742 19854 487 1 1 . 1 1 105 105 HIS C C 105 177.738 177.738 174.466 3.272 19854 488 1 1 . 1 1 105 105 HIS H H 105 6.971 6.971 8.408 -1.437 19854 489 1 1 . 1 1 106 106 ARG N N 106 126.314 126.314 123.332 2.982 19854 490 1 1 . 1 1 106 106 ARG C C 106 176.566 176.566 176.273 0.293 19854 491 1 1 . 1 1 106 106 ARG CA C 106 62.777 62.777 57.543 5.234 19854 492 1 1 . 1 1 106 106 ARG CB C 106 29.397 29.397 31.126 -1.729 19854 493 1 1 . 1 1 106 106 ARG H H 106 7.507 7.507 7.866 -0.359 19854 494 1 1 . 1 1 107 107 ASP N N 107 119.076 119.076 121.623 -2.547 19854 495 1 1 . 1 1 107 107 ASP C C 107 176.566 176.566 178.433 -1.867 19854 496 1 1 . 1 1 107 107 ASP CA C 107 55.164 55.164 57.655 -2.491 19854 497 1 1 . 1 1 107 107 ASP CB C 107 41.695 41.695 41.003 0.692 19854 498 1 1 . 1 1 107 107 ASP H H 107 9.076 9.076 7.890 1.186 19854 499 1 1 . 1 1 108 108 LEU N N 108 113.299 113.299 119.327 -6.028 19854 500 1 1 . 1 1 108 108 LEU C C 108 176.273 176.273 178.393 -2.120 19854 501 1 1 . 1 1 108 108 LEU CA C 108 59.264 59.264 58.255 1.009 19854 502 1 1 . 1 1 108 108 LEU CB C 108 48.722 48.722 41.386 7.336 19854 503 1 1 . 1 1 108 108 LEU H H 108 6.725 6.725 7.870 -1.145 19854 504 1 1 . 1 1 109 109 VAL N N 109 121.267 121.267 113.803 7.464 19854 505 1 1 . 1 1 109 109 VAL C C 109 175.393 175.393 178.211 -2.818 19854 506 1 1 . 1 1 109 109 VAL CA C 109 63.949 63.949 64.581 -0.632 19854 507 1 1 . 1 1 109 109 VAL CB C 109 32.911 32.911 30.963 1.948 19854 508 1 1 . 1 1 109 109 VAL H H 109 8.763 8.763 7.691 1.072 19854 509 1 1 . 1 1 110 110 ARG N N 110 112.900 112.900 120.325 -7.425 19854 510 1 1 . 1 1 110 110 ARG C C 110 176.273 176.273 177.674 -1.401 19854 511 1 1 . 1 1 110 110 ARG CA C 110 57.507 57.507 59.217 -1.710 19854 512 1 1 . 1 1 110 110 ARG CB C 110 30.568 30.568 30.198 0.370 19854 513 1 1 . 1 1 110 110 ARG H H 110 7.241 7.241 7.852 -0.611 19854 514 1 1 . 1 1 111 111 VAL N N 111 115.556 115.556 117.531 -1.975 19854 515 1 1 . 1 1 111 111 VAL C C 111 177.445 177.445 176.908 0.537 19854 516 1 1 . 1 1 111 111 VAL CA C 111 59.849 59.849 65.154 -5.305 19854 517 1 1 . 1 1 111 111 VAL CB C 111 32.911 32.911 32.959 -0.048 19854 518 1 1 . 1 1 111 111 VAL H H 111 7.566 7.566 7.723 -0.157 19854 519 1 1 . 1 1 112 112 CYS N N 112 114.295 114.295 115.287 -0.992 19854 520 1 1 . 1 1 112 112 CYS C C 112 169.826 169.826 174.544 -4.718 19854 521 1 1 . 1 1 112 112 CYS CA C 112 57.507 57.507 59.028 -1.521 19854 522 1 1 . 1 1 112 112 CYS CB C 112 35.839 35.839 29.120 6.719 19854 523 1 1 . 1 1 112 112 CYS H H 112 7.425 7.425 8.251 -0.826 19854 524 1 1 . 1 1 113 113 GLU N N 113 116.486 116.486 117.726 -1.240 19854 525 1 1 . 1 1 113 113 GLU C C 113 176.566 176.566 175.837 0.729 19854 526 1 1 . 1 1 113 113 GLU CA C 113 69.219 69.219 58.349 10.870 19854 527 1 1 . 1 1 113 113 GLU CB C 113 30.568 30.568 28.229 2.339 19854 528 1 1 . 1 1 113 113 GLU H H 113 7.241 7.241 8.060 -0.819 19854 529 1 1 . 1 1 114 114 ASN N N 114 129.302 129.302 122.072 7.230 19854 530 1 1 . 1 1 114 114 ASN C C 114 175.100 175.100 174.763 0.337 19854 531 1 1 . 1 1 114 114 ASN CA C 114 52.236 52.236 53.090 -0.854 19854 532 1 1 . 1 1 114 114 ASN CB C 114 39.938 39.938 38.137 1.801 19854 533 1 1 . 1 1 114 114 ASN H H 114 8.919 8.919 8.243 0.676 19854 534 1 1 . 1 1 115 115 ILE N N 115 110.443 110.443 121.282 -10.839 19854 535 1 1 . 1 1 115 115 ILE C C 115 175.100 175.100 173.160 1.940 19854 536 1 1 . 1 1 115 115 ILE CA C 115 65.705 65.705 58.018 7.687 19854 537 1 1 . 1 1 115 115 ILE CB C 115 39.353 39.353 39.841 -0.488 19854 538 1 1 . 1 1 115 115 ILE H H 115 9.287 9.287 7.785 1.502 19854 539 1 1 . 1 1 116 116 PRO C C 116 175.979 175.979 175.555 0.424 19854 540 1 1 . 1 1 116 116 PRO CA C 116 63.086 63.086 63.180 -0.094 19854 541 1 1 . 1 1 116 116 PRO CB C 116 29.681 29.681 32.224 -2.543 19854 542 1 1 . 1 1 117 117 ILE N N 117 123.591 123.591 124.375 -0.784 19854 543 1 1 . 1 1 117 117 ILE C C 117 174.807 174.807 174.978 -0.171 19854 544 1 1 . 1 1 117 117 ILE CA C 117 66.291 66.291 60.335 5.956 19854 545 1 1 . 1 1 117 117 ILE CB C 117 38.767 38.767 42.224 -3.457 19854 546 1 1 . 1 1 117 117 ILE H H 117 7.781 7.781 8.472 -0.691 19854 547 1 1 . 1 1 118 118 VAL N N 118 119.009 119.009 125.831 -6.822 19854 548 1 1 . 1 1 118 118 VAL C C 118 178.324 178.324 174.782 3.542 19854 549 1 1 . 1 1 118 118 VAL CA C 118 62.777 62.777 60.904 1.873 19854 550 1 1 . 1 1 118 118 VAL CB C 118 31.154 31.154 34.012 -2.858 19854 551 1 1 . 1 1 118 118 VAL H H 118 8.767 8.767 8.567 0.200 19854 552 1 1 . 1 1 119 119 LEU N N 119 119.408 119.408 126.825 -7.417 19854 553 1 1 . 1 1 119 119 LEU C C 119 178.031 178.031 176.121 1.910 19854 554 1 1 . 1 1 119 119 LEU CA C 119 42.866 42.866 53.816 -10.950 19854 555 1 1 . 1 1 119 119 LEU CB C 119 38.767 38.767 43.602 -4.835 19854 556 1 1 . 1 1 119 119 LEU H H 119 7.734 7.734 9.269 -1.535 19854 557 1 1 . 1 1 120 120 CYS N N 120 113.232 113.232 122.360 -9.128 19854 558 1 1 . 1 1 120 120 CYS C C 120 178.031 178.031 174.260 3.771 19854 559 1 1 . 1 1 120 120 CYS H H 120 8.317 8.317 9.141 -0.824 19854 560 1 1 . 1 1 121 121 GLY N N 121 117.349 117.349 113.025 4.324 19854 561 1 1 . 1 1 121 121 GLY C C 121 176.851 176.851 173.135 3.716 19854 562 1 1 . 1 1 121 121 GLY CA C 121 41.109 41.109 43.584 -2.475 19854 563 1 1 . 1 1 121 121 GLY H H 121 7.515 7.515 9.011 -1.496 19854 564 1 1 . 1 1 122 122 ASN N N 122 125.318 125.318 125.958 -0.640 19854 565 1 1 . 1 1 122 122 ASN C C 122 175.686 175.686 175.664 0.022 19854 566 1 1 . 1 1 122 122 ASN CA C 122 50.479 50.479 52.678 -2.199 19854 567 1 1 . 1 1 122 122 ASN CB C 122 39.353 39.353 40.549 -1.196 19854 568 1 1 . 1 1 122 122 ASN H H 122 9.162 9.162 8.561 0.601 19854 569 1 1 . 1 1 123 123 LYS N N 123 122.132 122.132 113.788 8.344 19854 570 1 1 . 1 1 123 123 LYS C C 123 173.043 173.043 177.463 -4.420 19854 571 1 1 . 1 1 123 123 LYS CA C 123 58.101 58.101 57.622 0.479 19854 572 1 1 . 1 1 123 123 LYS CB C 123 35.543 35.543 30.027 5.516 19854 573 1 1 . 1 1 123 123 LYS H H 123 7.953 7.953 8.860 -0.907 19854 574 1 1 . 1 1 124 124 VAL N N 124 123.726 123.726 113.010 10.716 19854 575 1 1 . 1 1 124 124 VAL C C 124 175.679 175.679 176.609 -0.930 19854 576 1 1 . 1 1 124 124 VAL CA C 124 64.840 64.840 64.779 0.061 19854 577 1 1 . 1 1 124 124 VAL CB C 124 42.574 42.574 31.448 11.126 19854 578 1 1 . 1 1 124 124 VAL H H 124 8.555 8.555 7.522 1.033 19854 579 1 1 . 1 1 125 125 ASP N N 125 119.607 119.607 119.345 0.262 19854 580 1 1 . 1 1 125 125 ASP C C 125 176.566 176.566 176.609 -0.043 19854 581 1 1 . 1 1 125 125 ASP CA C 125 55.750 55.750 56.353 -0.604 19854 582 1 1 . 1 1 125 125 ASP CB C 125 40.524 40.524 41.099 -0.575 19854 583 1 1 . 1 1 125 125 ASP H H 125 7.875 7.875 8.069 -0.194 19854 584 1 1 . 1 1 126 126 ILE N N 126 116.088 116.088 120.063 -3.975 19854 585 1 1 . 1 1 126 126 ILE C C 126 177.152 177.152 176.345 0.807 19854 586 1 1 . 1 1 126 126 ILE CA C 126 66.291 66.291 62.027 4.264 19854 587 1 1 . 1 1 126 126 ILE CB C 126 39.353 39.353 38.172 1.181 19854 588 1 1 . 1 1 126 126 ILE H H 126 7.511 7.511 7.499 0.012 19854 589 1 1 . 1 1 127 127 LYS N N 127 121.203 121.203 127.118 -5.915 19854 590 1 1 . 1 1 127 127 LYS C C 127 175.979 175.979 177.380 -1.401 19854 591 1 1 . 1 1 127 127 LYS CA C 127 58.101 58.101 59.221 -1.120 19854 592 1 1 . 1 1 127 127 LYS CB C 127 35.834 35.834 32.768 3.066 19854 593 1 1 . 1 1 127 127 LYS H H 127 8.113 8.113 8.499 -0.386 19854 594 1 1 . 1 1 128 128 ASP N N 128 118.279 118.279 119.300 -1.021 19854 595 1 1 . 1 1 128 128 ASP C C 128 176.566 176.566 175.433 1.133 19854 596 1 1 . 1 1 128 128 ASP CA C 128 53.407 53.407 52.762 0.645 19854 597 1 1 . 1 1 128 128 ASP CB C 128 40.524 40.524 39.909 0.615 19854 598 1 1 . 1 1 128 128 ASP H H 128 7.241 7.241 8.395 -1.154 19854 599 1 1 . 1 1 129 129 ARG N N 129 118.943 118.943 122.312 -3.369 19854 600 1 1 . 1 1 129 129 ARG C C 129 177.738 177.738 176.718 1.020 19854 601 1 1 . 1 1 129 129 ARG CA C 129 45.794 45.794 56.711 -10.917 19854 602 1 1 . 1 1 129 129 ARG CB C 129 31.154 31.154 31.140 0.014 19854 603 1 1 . 1 1 129 129 ARG H H 129 8.423 8.423 7.830 0.593 19854 604 1 1 . 1 1 130 130 LYS N N 130 109.381 109.381 121.302 -11.921 19854 605 1 1 . 1 1 130 130 LYS C C 130 176.566 176.566 176.919 -0.353 19854 606 1 1 . 1 1 130 130 LYS CA C 130 55.164 55.164 56.255 -1.091 19854 607 1 1 . 1 1 130 130 LYS CB C 130 36.424 36.424 33.859 2.565 19854 608 1 1 . 1 1 130 130 LYS H H 130 7.296 7.296 8.552 -1.256 19854 609 1 1 . 1 1 131 131 VAL N N 131 110.377 110.377 121.725 -11.348 19854 610 1 1 . 1 1 131 131 VAL C C 131 178.617 178.617 174.429 4.188 19854 611 1 1 . 1 1 131 131 VAL CA C 131 65.705 65.705 61.570 4.135 19854 612 1 1 . 1 1 131 131 VAL CB C 131 35.839 35.839 31.276 4.563 19854 613 1 1 . 1 1 131 131 VAL H H 131 9.283 9.283 8.057 1.226 19854 614 1 1 . 1 1 132 132 LYS N N 132 110.310 110.310 128.108 -17.798 19854 615 1 1 . 1 1 132 132 LYS C C 132 176.273 176.273 177.359 -1.086 19854 616 1 1 . 1 1 132 132 LYS CA C 132 59.849 59.849 55.959 3.890 19854 617 1 1 . 1 1 132 132 LYS CB C 132 35.253 35.253 33.508 1.744 19854 618 1 1 . 1 1 132 132 LYS H H 132 9.709 9.709 8.248 1.461 19854 619 1 1 . 1 1 133 133 ALA N N 133 134.349 134.349 127.248 7.101 19854 620 1 1 . 1 1 133 133 ALA CA C 133 51.065 51.065 54.751 -3.686 19854 621 1 1 . 1 1 133 133 ALA CB C 133 12.999 12.999 18.410 -5.410 19854 622 1 1 . 1 1 133 133 ALA H H 133 6.322 6.322 8.786 -2.464 19854 623 1 1 . 1 1 134 134 LYS N N 134 117.615 117.615 117.174 0.441 19854 624 1 1 . 1 1 134 134 LYS C C 134 176.859 176.859 177.631 -0.772 19854 625 1 1 . 1 1 134 134 LYS CA C 134 55.750 55.750 58.538 -2.788 19854 626 1 1 . 1 1 134 134 LYS CB C 134 54.579 54.579 32.368 22.211 19854 627 1 1 . 1 1 134 134 LYS H H 134 6.549 6.549 8.085 -1.536 19854 628 1 1 . 1 1 135 135 SER N N 135 109.314 109.314 113.832 -4.518 19854 629 1 1 . 1 1 135 135 SER C C 135 173.635 173.635 175.019 -1.384 19854 630 1 1 . 1 1 135 135 SER CA C 135 56.336 56.336 59.853 -3.517 19854 631 1 1 . 1 1 135 135 SER CB C 135 63.949 63.949 63.418 0.531 19854 632 1 1 . 1 1 135 135 SER H H 135 7.840 7.840 7.559 0.281 19854 633 1 1 . 1 1 136 136 ILE N N 136 124.123 124.123 122.150 1.973 19854 634 1 1 . 1 1 136 136 ILE C C 136 175.100 175.100 176.100 -1.000 19854 635 1 1 . 1 1 136 136 ILE CA C 136 68.634 68.634 62.865 5.769 19854 636 1 1 . 1 1 136 136 ILE CB C 136 43.452 43.452 37.637 5.815 19854 637 1 1 . 1 1 136 136 ILE H H 136 8.098 8.098 7.295 0.803 19854 638 1 1 . 1 1 137 137 VAL N N 137 113.232 113.232 122.967 -9.735 19854 639 1 1 . 1 1 137 137 VAL C C 137 176.859 176.859 176.097 0.762 19854 640 1 1 . 1 1 137 137 VAL CA C 137 64.534 64.534 61.643 2.891 19854 641 1 1 . 1 1 137 137 VAL CB C 137 34.082 34.082 33.024 1.058 19854 642 1 1 . 1 1 137 137 VAL H H 137 7.711 7.711 8.034 -0.323 19854 643 1 1 . 1 1 138 138 PHE N N 138 118.279 118.279 123.208 -4.929 19854 644 1 1 . 1 1 138 138 PHE C C 138 175.393 175.393 176.302 -0.909 19854 645 1 1 . 1 1 138 138 PHE CA C 138 58.092 58.092 62.512 -4.420 19854 646 1 1 . 1 1 138 138 PHE CB C 138 39.353 39.353 39.242 0.111 19854 647 1 1 . 1 1 138 138 PHE H H 138 8.317 8.317 7.625 0.692 19854 648 1 1 . 1 1 139 139 HIS N N 139 120.605 120.605 115.755 4.850 19854 649 1 1 . 1 1 139 139 HIS C C 139 175.979 175.979 176.898 -0.919 19854 650 1 1 . 1 1 139 139 HIS CA C 139 67.775 67.775 59.055 8.720 19854 651 1 1 . 1 1 139 139 HIS CB C 139 35.836 35.836 29.000 6.835 19854 652 1 1 . 1 1 139 139 HIS H H 139 8.094 8.094 8.873 -0.779 19854 653 1 1 . 1 1 140 140 ARG N N 140 120.140 120.140 119.695 0.445 19854 654 1 1 . 1 1 140 140 ARG C C 140 178.023 178.023 178.946 -0.923 19854 655 1 1 . 1 1 140 140 ARG CA C 140 58.394 58.394 58.013 0.381 19854 656 1 1 . 1 1 140 140 ARG CB C 140 39.644 39.644 29.198 10.446 19854 657 1 1 . 1 1 140 140 ARG H H 140 8.149 8.149 7.090 1.059 19854 658 1 1 . 1 1 141 141 LYS N N 141 115.623 115.623 119.447 -3.824 19854 659 1 1 . 1 1 141 141 LYS C C 141 173.635 173.635 178.081 -4.446 19854 660 1 1 . 1 1 141 141 LYS CA C 141 58.092 58.092 58.730 -0.638 19854 661 1 1 . 1 1 141 141 LYS CB C 141 33.496 33.496 32.199 1.298 19854 662 1 1 . 1 1 141 141 LYS H H 141 7.449 7.449 7.365 0.084 19854 663 1 1 . 1 1 142 142 LYS N N 142 114.162 114.162 115.378 -1.216 19854 664 1 1 . 1 1 142 142 LYS C C 142 175.979 175.979 175.808 0.171 19854 665 1 1 . 1 1 142 142 LYS CA C 142 51.065 51.065 55.114 -4.049 19854 666 1 1 . 1 1 142 142 LYS CB C 142 34.668 34.668 31.988 2.680 19854 667 1 1 . 1 1 142 142 LYS H H 142 8.982 8.982 7.562 1.420 19854 668 1 1 . 1 1 143 143 ASN N N 143 112.103 112.103 116.050 -3.947 19854 669 1 1 . 1 1 143 143 ASN C C 143 175.100 175.100 174.066 1.034 19854 670 1 1 . 1 1 143 143 ASN CA C 143 53.407 53.407 54.177 -0.770 19854 671 1 1 . 1 1 143 143 ASN CB C 143 39.938 39.938 36.059 3.879 19854 672 1 1 . 1 1 143 143 ASN H H 143 7.402 7.402 7.838 -0.436 19854 673 1 1 . 1 1 144 144 LEU N N 144 118.810 118.810 116.812 1.998 19854 674 1 1 . 1 1 144 144 LEU CA C 144 53.993 53.993 53.331 0.662 19854 675 1 1 . 1 1 144 144 LEU CB C 144 42.866 42.866 44.095 -1.229 19854 676 1 1 . 1 1 144 144 LEU H H 144 7.793 7.793 7.935 -0.142 19854 677 1 1 . 1 1 145 145 GLN N N 145 119.607 119.607 118.136 1.471 19854 678 1 1 . 1 1 145 145 GLN C C 145 176.859 176.859 174.279 2.580 19854 679 1 1 . 1 1 145 145 GLN CA C 145 55.164 55.164 53.802 1.362 19854 680 1 1 . 1 1 145 145 GLN CB C 145 29.983 29.983 31.152 -1.169 19854 681 1 1 . 1 1 145 145 GLN H H 145 7.014 7.014 8.176 -1.162 19854 682 1 1 . 1 1 146 146 TYR N N 146 119.275 119.275 124.405 -5.130 19854 683 1 1 . 1 1 146 146 TYR C C 146 174.807 174.807 174.279 0.528 19854 684 1 1 . 1 1 146 146 TYR CA C 146 62.777 62.777 55.994 6.783 19854 685 1 1 . 1 1 146 146 TYR CB C 146 41.109 41.109 40.677 0.432 19854 686 1 1 . 1 1 146 146 TYR H H 146 9.350 9.350 8.143 1.207 19854 687 1 1 . 1 1 147 147 TYR N N 147 123.658 123.658 125.331 -1.673 19854 688 1 1 . 1 1 147 147 TYR C C 147 177.738 177.738 173.773 3.965 19854 689 1 1 . 1 1 147 147 TYR CA C 147 58.092 58.092 56.276 1.816 19854 690 1 1 . 1 1 147 147 TYR CB C 147 39.938 39.938 42.143 -2.205 19854 691 1 1 . 1 1 147 147 TYR H H 147 8.340 8.340 8.663 -0.323 19854 692 1 1 . 1 1 148 148 ASP N N 148 121.267 121.267 123.695 -2.428 19854 693 1 1 . 1 1 148 148 ASP C C 148 176.859 176.859 175.470 1.389 19854 694 1 1 . 1 1 148 148 ASP CA C 148 54.579 54.579 54.420 0.159 19854 695 1 1 . 1 1 148 148 ASP CB C 148 41.109 41.109 41.634 -0.525 19854 696 1 1 . 1 1 148 148 ASP H H 148 8.911 8.911 8.423 0.488 19854 697 1 1 . 1 1 149 149 ILE N N 149 119.607 119.607 117.307 2.300 19854 698 1 1 . 1 1 149 149 ILE C C 149 174.807 174.807 174.209 0.598 19854 699 1 1 . 1 1 149 149 ILE CA C 149 61.020 61.020 59.115 1.905 19854 700 1 1 . 1 1 149 149 ILE CB C 149 39.353 39.353 42.703 -3.350 19854 701 1 1 . 1 1 149 149 ILE H H 149 8.712 8.712 8.593 0.119 19854 702 1 1 . 1 1 150 150 SER N N 150 117.349 117.349 116.424 0.925 19854 703 1 1 . 1 1 150 150 SER C C 150 175.686 175.686 174.496 1.190 19854 704 1 1 . 1 1 150 150 SER CA C 150 60.435 60.435 55.501 4.934 19854 705 1 1 . 1 1 150 150 SER CB C 150 62.192 62.192 65.381 -3.189 19854 706 1 1 . 1 1 150 150 SER H H 150 8.454 8.454 8.454 -0.000 19854 707 1 1 . 1 1 151 151 ALA N N 151 131.162 131.162 131.290 -0.128 19854 708 1 1 . 1 1 151 151 ALA C C 151 160.742 160.742 179.456 -18.714 19854 709 1 1 . 1 1 151 151 ALA CA C 151 53.993 53.993 55.046 -1.053 19854 710 1 1 . 1 1 151 151 ALA CB C 151 22.369 22.369 18.723 3.646 19854 711 1 1 . 1 1 151 151 ALA H H 151 10.640 10.640 9.025 1.615 19854 712 1 1 . 1 1 152 152 LYS N N 152 121.400 121.400 115.971 5.429 19854 713 1 1 . 1 1 152 152 LYS C C 152 174.221 174.221 177.476 -3.255 19854 714 1 1 . 1 1 152 152 LYS CA C 152 59.849 59.849 58.926 0.923 19854 715 1 1 . 1 1 152 152 LYS CB C 152 34.668 34.668 32.759 1.909 19854 716 1 1 . 1 1 152 152 LYS H H 152 9.099 9.099 8.314 0.785 19854 717 1 1 . 1 1 153 153 SER N N 153 135.212 135.212 109.392 25.820 19854 718 1 1 . 1 1 153 153 SER C C 153 177.152 177.152 174.865 2.287 19854 719 1 1 . 1 1 153 153 SER CA C 153 62.192 62.192 58.052 4.140 19854 720 1 1 . 1 1 153 153 SER CB C 153 66.291 66.291 64.870 1.421 19854 721 1 1 . 1 1 153 153 SER H H 153 8.935 8.935 7.849 1.086 19854 722 1 1 . 1 1 154 154 ASN N N 154 119.341 119.341 117.361 1.980 19854 723 1 1 . 1 1 154 154 ASN C C 154 175.979 175.979 173.938 2.041 19854 724 1 1 . 1 1 154 154 ASN CA C 154 49.894 49.894 54.457 -4.563 19854 725 1 1 . 1 1 154 154 ASN CB C 154 39.353 39.353 37.168 2.185 19854 726 1 1 . 1 1 154 154 ASN H H 154 7.488 7.488 8.419 -0.931 19854 727 1 1 . 1 1 155 155 TYR N N 155 120.074 120.074 122.479 -2.405 19854 728 1 1 . 1 1 155 155 TYR C C 155 177.144 177.144 175.327 1.817 19854 729 1 1 . 1 1 155 155 TYR CA C 155 60.738 60.738 59.936 0.802 19854 730 1 1 . 1 1 155 155 TYR CB C 155 41.402 41.402 38.613 2.789 19854 731 1 1 . 1 1 155 155 TYR H H 155 7.945 7.945 7.548 0.397 19854 732 1 1 . 1 1 156 156 ASN N N 156 124.058 124.058 122.827 1.231 19854 733 1 1 . 1 1 156 156 ASN C C 156 175.679 175.679 176.379 -0.700 19854 734 1 1 . 1 1 156 156 ASN CA C 156 53.121 53.121 54.572 -1.451 19854 735 1 1 . 1 1 156 156 ASN CB C 156 38.179 38.179 35.727 2.452 19854 736 1 1 . 1 1 156 156 ASN H H 156 8.192 8.192 8.839 -0.647 19854 737 1 1 . 1 1 157 157 PHE N N 157 123.459 123.459 117.263 6.196 19854 738 1 1 . 1 1 157 157 PHE C C 157 174.221 174.221 176.655 -2.434 19854 739 1 1 . 1 1 157 157 PHE CA C 157 57.507 57.507 60.930 -3.423 19854 740 1 1 . 1 1 157 157 PHE CB C 157 39.353 39.353 38.382 0.972 19854 741 1 1 . 1 1 157 157 PHE H H 157 7.429 7.429 8.010 -0.581 19854 742 1 1 . 1 1 158 158 GLU N N 158 112.568 112.568 117.806 -5.238 19854 743 1 1 . 1 1 158 158 GLU C C 158 176.566 176.566 177.881 -1.315 19854 744 1 1 . 1 1 158 158 GLU CA C 158 72.147 72.147 57.041 15.106 19854 745 1 1 . 1 1 158 158 GLU CB C 158 27.640 27.640 28.367 -0.727 19854 746 1 1 . 1 1 158 158 GLU H H 158 7.495 7.495 7.967 -0.472 19854 747 1 1 . 1 1 159 159 LYS N N 159 113.232 113.232 119.675 -6.443 19854 748 1 1 . 1 1 159 159 LYS C C 159 176.566 176.566 175.844 0.722 19854 749 1 1 . 1 1 159 159 LYS CA C 159 53.993 53.993 61.481 -7.488 19854 750 1 1 . 1 1 159 159 LYS CB C 159 33.496 33.496 30.048 3.448 19854 751 1 1 . 1 1 159 159 LYS H H 159 6.862 6.862 7.354 -0.492 19854 752 1 1 . 1 1 160 160 PRO C C 160 176.273 176.273 178.576 -2.303 19854 753 1 1 . 1 1 160 160 PRO CA C 160 64.258 64.258 65.516 -1.258 19854 754 1 1 . 1 1 160 160 PRO CB C 160 32.318 32.318 31.056 1.262 19854 755 1 1 . 1 1 161 161 PHE N N 161 123.726 123.726 116.873 6.853 19854 756 1 1 . 1 1 161 161 PHE C C 161 176.851 176.851 177.619 -0.768 19854 757 1 1 . 1 1 161 161 PHE CA C 161 60.445 60.445 61.818 -1.373 19854 758 1 1 . 1 1 161 161 PHE CB C 161 40.816 40.816 37.700 3.116 19854 759 1 1 . 1 1 161 161 PHE H H 161 8.215 8.215 7.243 0.972 19854 760 1 1 . 1 1 162 162 LEU N N 162 110.177 110.177 119.240 -9.063 19854 761 1 1 . 1 1 162 162 LEU C C 162 176.273 176.273 178.766 -2.493 19854 762 1 1 . 1 1 162 162 LEU CA C 162 55.750 55.750 57.939 -2.189 19854 763 1 1 . 1 1 162 162 LEU CB C 162 44.037 44.037 41.460 2.577 19854 764 1 1 . 1 1 162 162 LEU H H 162 7.527 7.527 7.722 -0.195 19854 765 1 1 . 1 1 163 163 TRP N N 163 123.525 123.525 121.184 2.341 19854 766 1 1 . 1 1 163 163 TRP C C 163 177.152 177.152 178.193 -1.041 19854 767 1 1 . 1 1 163 163 TRP CA C 163 61.606 61.606 61.189 0.417 19854 768 1 1 . 1 1 163 163 TRP CB C 163 28.811 28.811 29.897 -1.086 19854 769 1 1 . 1 1 163 163 TRP H H 163 7.476 7.476 8.341 -0.866 19854 770 1 1 . 1 1 164 164 LEU N N 164 119.740 119.740 118.733 1.007 19854 771 1 1 . 1 1 164 164 LEU C C 164 175.686 175.686 178.818 -3.132 19854 772 1 1 . 1 1 164 164 LEU CA C 164 61.020 61.020 57.807 3.213 19854 773 1 1 . 1 1 164 164 LEU CB C 164 45.794 45.794 41.398 4.396 19854 774 1 1 . 1 1 164 164 LEU H H 164 9.412 9.412 8.038 1.374 19854 775 1 1 . 1 1 165 165 ALA N N 165 118.013 118.013 121.536 -3.523 19854 776 1 1 . 1 1 165 165 ALA C C 165 165.723 165.723 179.539 -13.816 19854 777 1 1 . 1 1 165 165 ALA CA C 165 52.236 52.236 55.241 -3.005 19854 778 1 1 . 1 1 165 165 ALA CB C 165 21.784 21.784 18.115 3.669 19854 779 1 1 . 1 1 165 165 ALA H H 165 7.707 7.707 8.310 -0.604 19854 780 1 1 . 1 1 166 166 ARG N N 166 122.994 122.994 118.401 4.593 19854 781 1 1 . 1 1 166 166 ARG C C 166 175.979 175.979 179.145 -3.166 19854 782 1 1 . 1 1 166 166 ARG CA C 166 49.308 49.308 59.331 -10.023 19854 783 1 1 . 1 1 166 166 ARG CB C 166 29.397 29.397 29.900 -0.503 19854 784 1 1 . 1 1 166 166 ARG H H 166 8.692 8.692 7.874 0.818 19854 785 1 1 . 1 1 167 167 LYS N N 167 112.568 112.568 119.756 -7.188 19854 786 1 1 . 1 1 167 167 LYS C C 167 176.273 176.273 179.440 -3.167 19854 787 1 1 . 1 1 167 167 LYS CA C 167 58.092 58.092 59.164 -1.072 19854 788 1 1 . 1 1 167 167 LYS CB C 167 34.668 34.668 32.280 2.388 19854 789 1 1 . 1 1 167 167 LYS H H 167 6.819 6.819 7.505 -0.686 19854 790 1 1 . 1 1 168 168 LEU N N 168 114.959 114.959 119.784 -4.825 19854 791 1 1 . 1 1 168 168 LEU C C 168 177.738 177.738 178.996 -1.258 19854 792 1 1 . 1 1 168 168 LEU CA C 168 56.921 56.921 57.553 -0.632 19854 793 1 1 . 1 1 168 168 LEU CB C 168 41.695 41.695 41.664 0.031 19854 794 1 1 . 1 1 168 168 LEU H H 168 7.269 7.269 7.917 -0.648 19854 795 1 1 . 1 1 169 169 ILE N N 169 122.199 122.199 115.886 6.313 19854 796 1 1 . 1 1 169 169 ILE C C 169 177.445 177.445 177.178 0.267 19854 797 1 1 . 1 1 169 169 ILE CA C 169 63.375 63.375 63.219 0.156 19854 798 1 1 . 1 1 169 169 ILE CB C 169 42.281 42.281 38.663 3.618 19854 799 1 1 . 1 1 169 169 ILE H H 169 8.360 8.360 8.114 0.246 19854 800 1 1 . 1 1 170 170 GLY N N 170 113.099 113.099 106.508 6.591 19854 801 1 1 . 1 1 170 170 GLY C C 170 162.496 162.496 173.737 -11.241 19854 802 1 1 . 1 1 170 170 GLY CA C 170 44.037 44.037 44.861 -0.825 19854 803 1 1 . 1 1 170 170 GLY H H 170 6.686 6.686 7.977 -1.291 19854 804 1 1 . 1 1 171 171 ASP N N 171 113.232 113.232 121.437 -8.205 19854 805 1 1 . 1 1 171 171 ASP C C 171 178.910 178.910 175.847 3.063 19854 806 1 1 . 1 1 171 171 ASP CA C 171 50.479 50.479 50.498 -0.019 19854 807 1 1 . 1 1 171 171 ASP CB C 171 41.109 41.109 42.323 -1.214 19854 808 1 1 . 1 1 171 171 ASP H H 171 6.815 6.815 7.531 -0.716 19854 809 1 1 . 1 1 172 172 PRO C C 172 176.566 176.566 177.032 -0.466 19854 810 1 1 . 1 1 172 172 PRO CA C 172 63.965 63.965 64.055 -0.090 19854 811 1 1 . 1 1 172 172 PRO CB C 172 31.732 31.732 32.081 -0.349 19854 812 1 1 . 1 1 173 173 ASN N N 173 109.779 109.779 116.336 -6.557 19854 813 1 1 . 1 1 173 173 ASN C C 173 175.979 175.979 175.636 0.343 19854 814 1 1 . 1 1 173 173 ASN CA C 173 54.579 54.579 53.092 1.487 19854 815 1 1 . 1 1 173 173 ASN CB C 173 36.424 36.424 39.319 -2.895 19854 816 1 1 . 1 1 173 173 ASN H H 173 8.016 8.016 8.367 -0.351 19854 817 1 1 . 1 1 174 174 LEU N N 174 109.248 109.248 122.001 -12.753 19854 818 1 1 . 1 1 174 174 LEU C C 174 176.566 176.566 175.721 0.845 19854 819 1 1 . 1 1 174 174 LEU CA C 174 56.336 56.336 55.925 0.411 19854 820 1 1 . 1 1 174 174 LEU CB C 174 44.037 44.037 42.276 1.761 19854 821 1 1 . 1 1 174 174 LEU H H 174 7.871 7.871 7.344 0.527 19854 822 1 1 . 1 1 175 175 GLU N N 175 125.185 125.185 122.876 2.309 19854 823 1 1 . 1 1 175 175 GLU C C 175 177.445 177.445 174.766 2.679 19854 824 1 1 . 1 1 175 175 GLU CA C 175 76.247 76.247 54.316 21.931 19854 825 1 1 . 1 1 175 175 GLU CB C 175 28.811 28.811 33.869 -5.058 19854 826 1 1 . 1 1 175 175 GLU H H 175 9.127 9.127 8.192 0.935 19854 827 1 1 . 1 1 176 176 PHE N N 176 136.873 136.873 124.144 12.729 19854 828 1 1 . 1 1 176 176 PHE C C 176 178.617 178.617 175.102 3.515 19854 829 1 1 . 1 1 176 176 PHE CA C 176 59.264 59.264 58.227 1.038 19854 830 1 1 . 1 1 176 176 PHE CB C 176 44.623 44.623 40.026 4.598 19854 831 1 1 . 1 1 176 176 PHE H H 176 10.058 10.058 8.724 1.334 19854 832 1 1 . 1 1 177 177 VAL N N 177 118.877 118.877 127.294 -8.417 19854 833 1 1 . 1 1 177 177 VAL C C 177 177.445 177.445 174.656 2.789 19854 834 1 1 . 1 1 177 177 VAL CA C 177 62.777 62.777 60.075 2.702 19854 835 1 1 . 1 1 177 177 VAL CB C 177 34.668 34.668 34.424 0.244 19854 836 1 1 . 1 1 177 177 VAL H H 177 7.789 7.789 7.902 -0.113 19854 837 1 1 . 1 1 178 178 ALA N N 178 123.859 123.859 126.326 -2.467 19854 838 1 1 . 1 1 178 178 ALA C C 178 177.144 177.144 177.693 -0.549 19854 839 1 1 . 1 1 178 178 ALA CA C 178 54.000 54.000 54.066 -0.066 19854 840 1 1 . 1 1 178 178 ALA CB C 178 15.035 15.035 18.959 -3.924 19854 841 1 1 . 1 1 178 178 ALA H H 178 7.683 7.683 8.162 -0.479 19854 842 1 1 . 1 1 179 179 MET N N 179 121.668 121.668 116.798 4.870 19854 843 1 1 . 1 1 179 179 MET C C 179 177.144 177.144 173.108 4.036 19854 844 1 1 . 1 1 179 179 MET CA C 179 60.445 60.445 54.474 5.971 19854 845 1 1 . 1 1 179 179 MET CB C 179 39.351 39.351 32.473 6.878 19854 846 1 1 . 1 1 179 179 MET H H 179 7.648 7.648 7.471 0.177 19854 847 1 1 . 1 1 180 180 PRO C C 180 177.445 177.445 175.609 1.836 19854 848 1 1 . 1 1 180 180 PRO CA C 180 64.844 64.844 62.892 1.952 19854 849 1 1 . 1 1 180 180 PRO CB C 180 29.974 29.974 32.049 -2.075 19854 850 1 1 . 1 1 181 181 ALA N N 181 128.439 128.439 126.207 2.232 19854 851 1 1 . 1 1 181 181 ALA C C 181 176.273 176.273 177.484 -1.211 19854 852 1 1 . 1 1 181 181 ALA CA C 181 58.092 58.092 52.002 6.090 19854 853 1 1 . 1 1 181 181 ALA CB C 181 21.198 21.198 19.444 1.754 19854 854 1 1 . 1 1 181 181 ALA H H 181 8.673 8.673 8.209 0.464 19854 855 1 1 . 1 1 182 182 LEU N N 182 122.130 122.130 122.484 -0.354 19854 856 1 1 . 1 1 182 182 LEU C C 182 177.445 177.445 176.809 0.636 19854 857 1 1 . 1 1 182 182 LEU CA C 182 55.164 55.164 54.080 1.084 19854 858 1 1 . 1 1 182 182 LEU CB C 182 42.866 42.866 43.101 -0.235 19854 859 1 1 . 1 1 182 182 LEU H H 182 8.821 8.821 8.275 0.546 19854 860 1 1 . 1 1 183 183 ALA N N 183 121.004 121.004 126.681 -5.677 19854 861 1 1 . 1 1 183 183 ALA C C 183 178.617 178.617 176.098 2.519 19854 862 1 1 . 1 1 183 183 ALA CA C 183 57.808 57.808 50.529 7.279 19854 863 1 1 . 1 1 183 183 ALA CB C 183 24.117 24.117 18.446 5.671 19854 864 1 1 . 1 1 183 183 ALA H H 183 8.356 8.356 8.163 0.193 19854 865 1 1 . 1 1 184 184 PRO C C 184 177.152 177.152 175.090 2.062 19854 866 1 1 . 1 1 184 184 PRO CA C 184 64.258 64.258 61.980 2.278 19854 867 1 1 . 1 1 184 184 PRO CB C 184 29.681 29.681 31.627 -1.946 19854 868 1 1 . 1 1 185 185 PRO C C 185 175.686 175.686 177.158 -1.472 19854 869 1 1 . 1 1 185 185 PRO CA C 185 63.379 63.379 62.808 0.571 19854 870 1 1 . 1 1 185 185 PRO CB C 185 35.248 35.248 32.421 2.827 19854 871 1 1 . 1 1 186 186 GLU N N 186 120.539 120.539 120.805 -0.266 19854 872 1 1 . 1 1 186 186 GLU C C 186 176.273 176.273 176.179 0.094 19854 873 1 1 . 1 1 186 186 GLU CA C 186 58.101 58.101 57.402 0.699 19854 874 1 1 . 1 1 186 186 GLU CB C 186 35.836 35.836 29.785 6.051 19854 875 1 1 . 1 1 186 186 GLU H H 186 8.086 8.086 8.509 -0.423 19854 876 1 1 . 1 1 187 187 VAL N N 187 124.455 124.455 117.964 6.491 19854 877 1 1 . 1 1 187 187 VAL C C 187 178.910 178.910 175.243 3.667 19854 878 1 1 . 1 1 187 187 VAL CA C 187 63.363 63.363 62.754 0.609 19854 879 1 1 . 1 1 187 187 VAL CB C 187 34.082 34.082 31.501 2.581 19854 880 1 1 . 1 1 187 187 VAL H H 187 8.622 8.622 7.863 0.759 19854 881 1 1 . 1 1 188 188 VAL N N 188 128.572 128.572 125.557 3.015 19854 882 1 1 . 1 1 188 188 VAL C C 188 178.324 178.324 176.695 1.629 19854 883 1 1 . 1 1 188 188 VAL CA C 188 68.634 68.634 62.518 6.116 19854 884 1 1 . 1 1 188 188 VAL CB C 188 31.154 31.154 32.175 -1.021 19854 885 1 1 . 1 1 188 188 VAL H H 188 8.497 8.497 7.943 0.554 19854 886 1 1 . 1 1 189 189 MET N N 189 122.795 122.795 118.863 3.932 19854 887 1 1 . 1 1 189 189 MET C C 189 177.445 177.445 176.039 1.406 19854 888 1 1 . 1 1 189 189 MET CA C 189 55.164 55.164 57.534 -2.370 19854 889 1 1 . 1 1 189 189 MET CB C 189 35.253 35.253 32.324 2.929 19854 890 1 1 . 1 1 189 189 MET H H 189 6.991 6.991 7.985 -0.994 19854 891 1 1 . 1 1 190 190 ASP N N 190 114.959 114.959 112.535 2.424 19854 892 1 1 . 1 1 190 190 ASP C C 190 175.686 175.686 175.376 0.310 19854 893 1 1 . 1 1 190 190 ASP CA C 190 51.065 51.065 54.963 -3.898 19854 894 1 1 . 1 1 190 190 ASP CB C 190 41.695 41.695 38.325 3.370 19854 895 1 1 . 1 1 190 190 ASP H H 190 7.210 7.210 8.468 -1.258 19854 896 1 1 . 1 1 191 191 PRO C C 191 176.566 176.566 177.981 -1.415 19854 897 1 1 . 1 1 191 191 PRO CA C 191 63.965 63.965 64.857 -0.892 19854 898 1 1 . 1 1 191 191 PRO CB C 191 31.146 31.146 31.490 -0.344 19854 899 1 1 . 1 1 192 192 ALA N N 192 109.513 109.513 120.754 -11.241 19854 900 1 1 . 1 1 192 192 ALA CA C 192 53.993 53.993 54.313 -0.320 19854 901 1 1 . 1 1 192 192 ALA CB C 192 19.441 19.441 18.212 1.229 19854 902 1 1 . 1 1 192 192 ALA H H 192 7.394 7.394 7.958 -0.564 19854 903 1 1 . 1 1 193 193 LEU N N 193 119.009 119.009 117.540 1.469 19854 904 1 1 . 1 1 193 193 LEU C C 193 175.979 175.979 177.085 -1.106 19854 905 1 1 . 1 1 193 193 LEU CA C 193 56.336 56.336 55.757 0.579 19854 906 1 1 . 1 1 193 193 LEU CB C 193 42.866 42.866 42.000 0.866 19854 907 1 1 . 1 1 193 193 LEU H H 193 8.340 8.340 7.835 0.505 19854 908 1 1 . 1 1 194 194 ALA N N 194 121.666 121.666 119.765 1.901 19854 909 1 1 . 1 1 194 194 ALA C C 194 166.896 166.896 178.001 -11.105 19854 910 1 1 . 1 1 194 194 ALA CA C 194 55.164 55.164 52.870 2.294 19854 911 1 1 . 1 1 194 194 ALA CB C 194 16.513 16.513 19.139 -2.626 19854 912 1 1 . 1 1 194 194 ALA H H 194 8.176 8.176 7.590 0.586 19854 913 1 1 . 1 1 195 195 ALA N N 195 119.541 119.541 120.602 -1.061 19854 914 1 1 . 1 1 195 195 ALA C C 195 173.928 173.928 179.207 -5.279 19854 915 1 1 . 1 1 195 195 ALA CA C 195 57.507 57.507 54.357 3.150 19854 916 1 1 . 1 1 195 195 ALA CB C 195 19.441 19.441 17.210 2.231 19854 917 1 1 . 1 1 195 195 ALA H H 195 8.364 8.364 8.682 -0.318 19854 918 1 1 . 1 1 196 196 GLN N N 196 107.322 107.322 119.141 -11.819 19854 919 1 1 . 1 1 196 196 GLN C C 196 176.273 176.273 178.168 -1.895 19854 920 1 1 . 1 1 196 196 GLN CA C 196 56.921 56.921 58.652 -1.731 19854 921 1 1 . 1 1 196 196 GLN CB C 196 29.983 29.983 28.847 1.136 19854 922 1 1 . 1 1 196 196 GLN H H 196 7.910 7.910 7.805 0.105 19854 923 1 1 . 1 1 197 197 TYR N N 197 119.277 119.277 117.708 1.569 19854 924 1 1 . 1 1 197 197 TYR C C 197 178.316 178.316 178.176 0.140 19854 925 1 1 . 1 1 197 197 TYR CA C 197 56.343 56.343 60.365 -4.022 19854 926 1 1 . 1 1 197 197 TYR CB C 197 43.453 43.453 37.620 5.833 19854 927 1 1 . 1 1 197 197 TYR H H 197 8.180 8.180 8.177 0.003 19854 928 1 1 . 1 1 198 198 GLU N N 198 110.244 110.244 118.487 -8.243 19854 929 1 1 . 1 1 198 198 GLU C C 198 176.273 176.273 178.415 -2.142 19854 930 1 1 . 1 1 198 198 GLU CA C 198 53.407 53.407 59.395 -5.988 19854 931 1 1 . 1 1 198 198 GLU CB C 198 30.568 30.568 29.276 1.292 19854 932 1 1 . 1 1 198 198 GLU H H 198 7.523 7.523 8.067 -0.544 19854 933 1 1 . 1 1 199 199 HIS N N 199 119.211 119.211 118.985 0.226 19854 934 1 1 . 1 1 199 199 HIS C C 199 178.902 178.902 177.299 1.603 19854 935 1 1 . 1 1 199 199 HIS CA C 199 58.687 58.687 60.186 -1.499 19854 936 1 1 . 1 1 199 199 HIS CB C 199 34.957 34.957 29.709 5.248 19854 937 1 1 . 1 1 199 199 HIS H H 199 8.258 8.258 7.673 0.585 19854 938 1 1 . 1 1 200 200 ASP N N 200 124.722 124.722 119.576 5.146 19854 939 1 1 . 1 1 200 200 ASP C C 200 176.705 176.705 178.644 -1.939 19854 940 1 1 . 1 1 200 200 ASP CA C 200 58.687 58.687 57.138 1.550 19854 941 1 1 . 1 1 200 200 ASP CB C 200 39.644 39.644 40.472 -0.828 19854 942 1 1 . 1 1 200 200 ASP H H 200 8.086 8.086 7.770 0.316 19854 943 1 1 . 1 1 201 201 LEU N N 201 116.353 116.353 120.448 -4.095 19854 944 1 1 . 1 1 201 201 LEU C C 201 178.910 178.910 179.102 -0.192 19854 945 1 1 . 1 1 201 201 LEU CA C 201 61.606 61.606 58.258 3.348 19854 946 1 1 . 1 1 201 201 LEU CB C 201 41.109 41.109 41.704 -0.595 19854 947 1 1 . 1 1 201 201 LEU H H 201 7.722 7.722 8.146 -0.424 19854 948 1 1 . 1 1 202 202 GLU N N 202 118.080 118.080 119.099 -1.019 19854 949 1 1 . 1 1 202 202 GLU C C 202 176.566 176.566 179.337 -2.771 19854 950 1 1 . 1 1 202 202 GLU CA C 202 56.921 56.921 59.045 -2.124 19854 951 1 1 . 1 1 202 202 GLU CB C 202 30.568 30.568 29.099 1.469 19854 952 1 1 . 1 1 202 202 GLU H H 202 8.857 8.857 7.988 0.869 19854 953 1 1 . 1 1 203 203 VAL N N 203 129.369 129.369 120.276 9.093 19854 954 1 1 . 1 1 203 203 VAL C C 203 178.617 178.617 177.917 0.700 19854 955 1 1 . 1 1 203 203 VAL CA C 203 64.534 64.534 66.582 -2.048 19854 956 1 1 . 1 1 203 203 VAL CB C 203 27.640 27.640 31.201 -3.561 19854 957 1 1 . 1 1 203 203 VAL H H 203 9.283 9.283 7.436 1.847 19854 958 1 1 . 1 1 204 204 ALA N N 204 109.580 109.580 121.777 -12.197 19854 959 1 1 . 1 1 204 204 ALA C C 204 176.859 176.859 178.888 -2.029 19854 960 1 1 . 1 1 204 204 ALA CA C 204 54.579 54.579 54.975 -0.397 19854 961 1 1 . 1 1 204 204 ALA CB C 204 18.270 18.270 18.538 -0.268 19854 962 1 1 . 1 1 204 204 ALA H H 204 8.528 8.528 7.817 0.711 19854 963 1 1 . 1 1 205 205 GLN N N 205 123.328 123.328 116.642 6.686 19854 964 1 1 . 1 1 205 205 GLN C C 205 177.418 177.418 177.912 -0.494 19854 965 1 1 . 1 1 205 205 GLN CA C 205 57.515 57.515 58.051 -0.536 19854 966 1 1 . 1 1 205 205 GLN CB C 205 33.785 33.785 29.104 4.681 19854 967 1 1 . 1 1 205 205 GLN H H 205 8.160 8.160 7.937 0.223 19854 968 1 1 . 1 1 206 206 THR N N 206 120.271 120.271 113.725 6.546 19854 969 1 1 . 1 1 206 206 THR C C 206 176.273 176.273 175.316 0.957 19854 970 1 1 . 1 1 206 206 THR CA C 206 67.462 67.462 64.668 2.794 19854 971 1 1 . 1 1 206 206 THR CB C 206 70.390 70.390 69.191 1.199 19854 972 1 1 . 1 1 206 206 THR H H 206 7.585 7.585 7.783 -0.198 19854 973 1 1 . 1 1 207 207 THR N N 207 111.970 111.970 119.418 -7.448 19854 974 1 1 . 1 1 207 207 THR C C 207 176.566 176.566 173.303 3.263 19854 975 1 1 . 1 1 207 207 THR CA C 207 64.534 64.534 64.282 0.252 19854 976 1 1 . 1 1 207 207 THR CB C 207 72.733 72.733 69.311 3.422 19854 977 1 1 . 1 1 207 207 THR H H 207 7.468 7.468 7.763 -0.295 19854 978 1 1 . 1 1 208 208 ALA N N 208 115.623 115.623 127.656 -12.033 19854 979 1 1 . 1 1 208 208 ALA C C 208 168.947 168.947 176.733 -7.786 19854 980 1 1 . 1 1 208 208 ALA CA C 208 55.164 55.164 50.754 4.410 19854 981 1 1 . 1 1 208 208 ALA CB C 208 22.369 22.369 20.835 1.534 19854 982 1 1 . 1 1 208 208 ALA H H 208 7.390 7.390 8.035 -0.645 19854 983 1 1 . 1 1 209 209 LEU N N 209 117.814 117.814 121.655 -3.841 19854 984 1 1 . 1 1 209 209 LEU C C 209 176.273 176.273 175.608 0.665 19854 985 1 1 . 1 1 209 209 LEU CA C 209 58.678 58.678 53.395 5.282 19854 986 1 1 . 1 1 209 209 LEU CB C 209 46.380 46.380 41.904 4.476 19854 987 1 1 . 1 1 209 209 LEU H H 209 7.652 7.652 8.454 -0.802 19854 988 1 1 . 1 1 210 210 PRO C C 210 176.566 176.566 175.396 1.170 19854 989 1 1 . 1 1 210 210 PRO CA C 210 63.086 63.086 62.595 0.491 19854 990 1 1 . 1 1 210 210 PRO CB C 210 31.146 31.146 30.842 0.304 19854 991 1 1 . 1 1 211 211 ASP N N 211 122.863 122.863 124.412 -1.549 19854 992 1 1 . 1 1 211 211 ASP C C 211 175.686 175.686 175.805 -0.119 19854 993 1 1 . 1 1 211 211 ASP CA C 211 56.343 56.343 52.834 3.509 19854 994 1 1 . 1 1 211 211 ASP CB C 211 41.402 41.402 41.478 -0.076 19854 995 1 1 . 1 1 211 211 ASP H H 211 8.360 8.360 7.921 0.439 19854 996 1 1 . 1 1 212 212 GLU N N 212 131.162 131.162 126.291 4.871 19854 997 1 1 . 1 1 212 212 GLU C C 212 176.273 176.273 176.691 -0.418 19854 998 1 1 . 1 1 212 212 GLU CA C 212 55.164 55.164 57.192 -2.028 19854 999 1 1 . 1 1 212 212 GLU CB C 212 30.568 30.568 31.370 -0.802 19854 1000 1 1 . 1 1 212 212 GLU H H 212 8.399 8.399 8.360 0.039 19854 1001 1 1 . 1 1 213 213 ASP N N 213 122.797 122.797 118.740 4.057 19854 1002 1 1 . 1 1 213 213 ASP C C 213 177.152 177.152 175.802 1.350 19854 1003 1 1 . 1 1 213 213 ASP CA C 213 61.914 61.914 53.525 8.389 19854 1004 1 1 . 1 1 213 213 ASP CB C 213 49.607 49.607 41.843 7.764 19854 1005 1 1 . 1 1 213 213 ASP H H 213 8.168 8.168 8.185 -0.017 19854 1006 1 1 . 1 1 214 214 ASP N N 214 112.369 112.369 121.043 -8.674 19854 1007 1 1 . 1 1 214 214 ASP C C 214 178.910 178.910 177.457 1.453 19854 1008 1 1 . 1 1 214 214 ASP CA C 214 54.579 54.579 56.723 -2.144 19854 1009 1 1 . 1 1 214 214 ASP CB C 214 39.353 39.353 40.752 -1.399 19854 1010 1 1 . 1 1 214 214 ASP H H 214 7.464 7.464 8.117 -0.653 19854 1011 1 1 . 1 1 215 215 ASP N N 215 127.244 127.244 119.036 8.208 19854 1012 1 1 . 1 1 215 215 ASP C C 215 176.859 176.859 177.159 -0.300 19854 1013 1 1 . 1 1 215 215 ASP CA C 215 54.579 54.579 55.190 -0.611 19854 1014 1 1 . 1 1 215 215 ASP CB C 215 40.524 40.524 40.832 -0.308 19854 1015 1 1 . 1 1 215 215 ASP H H 215 8.301 8.301 8.383 -0.082 19854 1016 1 2 . 1 1 2 2 ALA N N 2 131.228 131.228 123.202 8.026 19854 1017 1 2 . 1 1 2 2 ALA C C 2 187.031 187.031 179.146 7.885 19854 1018 1 2 . 1 1 2 2 ALA CA C 2 53.407 53.407 54.953 -1.546 19854 1019 1 2 . 1 1 2 2 ALA CB C 2 20.027 20.027 18.092 1.935 19854 1020 1 2 . 1 1 2 2 ALA H H 2 10.644 10.644 8.367 2.277 19854 1021 1 2 . 1 1 3 3 ALA N N 3 124.521 124.521 121.062 3.459 19854 1022 1 2 . 1 1 3 3 ALA C C 3 176.566 176.566 179.329 -2.763 19854 1023 1 2 . 1 1 3 3 ALA CA C 3 49.894 49.894 54.355 -4.461 19854 1024 1 2 . 1 1 3 3 ALA CB C 3 18.270 18.270 18.283 -0.013 19854 1025 1 2 . 1 1 3 3 ALA H H 3 8.669 8.669 7.976 0.693 19854 1026 1 2 . 1 1 4 4 GLN N N 4 118.080 118.080 116.911 1.169 19854 1027 1 2 . 1 1 4 4 GLN C C 4 176.273 176.273 177.058 -0.785 19854 1028 1 2 . 1 1 4 4 GLN CA C 4 54.579 54.579 56.648 -2.069 19854 1029 1 2 . 1 1 4 4 GLN CB C 4 27.054 27.054 29.298 -2.244 19854 1030 1 2 . 1 1 4 4 GLN H H 4 8.919 8.919 8.185 0.734 19854 1031 1 2 . 1 1 5 5 GLY N N 5 121.002 121.002 105.800 15.202 19854 1032 1 2 . 1 1 5 5 GLY C C 5 181.877 181.877 173.697 8.180 19854 1033 1 2 . 1 1 5 5 GLY CA C 5 45.794 45.794 44.891 0.903 19854 1034 1 2 . 1 1 5 5 GLY H H 5 8.082 8.082 7.999 0.083 19854 1035 1 2 . 1 1 6 6 GLU N N 6 129.435 129.435 121.928 7.507 19854 1036 1 2 . 1 1 6 6 GLU C C 6 176.566 176.566 175.426 1.140 19854 1037 1 2 . 1 1 6 6 GLU CA C 6 56.336 56.336 52.963 3.373 19854 1038 1 2 . 1 1 6 6 GLU CB C 6 28.811 28.811 30.546 -1.735 19854 1039 1 2 . 1 1 6 6 GLU H H 6 9.267 9.267 7.842 1.425 19854 1040 1 2 . 1 1 7 7 PRO C C 7 176.566 176.566 177.016 -0.450 19854 1041 1 2 . 1 1 7 7 PRO CA C 7 63.672 63.672 65.039 -1.367 19854 1042 1 2 . 1 1 7 7 PRO CB C 7 31.146 31.146 32.368 -1.222 19854 1043 1 2 . 1 1 8 8 GLN N N 8 112.502 112.502 114.432 -1.930 19854 1044 1 2 . 1 1 8 8 GLN C C 8 177.445 177.445 175.782 1.663 19854 1045 1 2 . 1 1 8 8 GLN CA C 8 50.479 50.479 56.001 -5.522 19854 1046 1 2 . 1 1 8 8 GLN CB C 8 28.811 28.811 31.385 -2.574 19854 1047 1 2 . 1 1 8 8 GLN H H 8 6.220 6.220 8.315 -2.095 19854 1048 1 2 . 1 1 9 9 VAL N N 9 117.416 117.416 113.022 4.394 19854 1049 1 2 . 1 1 9 9 VAL C C 9 178.324 178.324 173.916 4.408 19854 1050 1 2 . 1 1 9 9 VAL CA C 9 63.363 63.363 59.259 4.104 19854 1051 1 2 . 1 1 9 9 VAL CB C 9 34.668 34.668 34.743 -0.075 19854 1052 1 2 . 1 1 9 9 VAL H H 9 6.561 6.561 7.715 -1.154 19854 1053 1 2 . 1 1 10 10 GLN N N 10 113.896 113.896 122.348 -8.452 19854 1054 1 2 . 1 1 10 10 GLN C C 10 176.273 176.273 174.586 1.687 19854 1055 1 2 . 1 1 10 10 GLN CA C 10 55.164 55.164 54.244 0.920 19854 1056 1 2 . 1 1 10 10 GLN CB C 10 28.226 28.226 32.154 -3.928 19854 1057 1 2 . 1 1 10 10 GLN H H 10 7.847 7.847 7.937 -0.090 19854 1058 1 2 . 1 1 11 11 PHE N N 11 118.744 118.744 124.291 -5.547 19854 1059 1 2 . 1 1 11 11 PHE C C 11 176.566 176.566 174.767 1.799 19854 1060 1 2 . 1 1 11 11 PHE CA C 11 59.849 59.849 56.511 3.338 19854 1061 1 2 . 1 1 11 11 PHE CB C 11 41.109 41.109 42.314 -1.205 19854 1062 1 2 . 1 1 11 11 PHE H H 11 8.262 8.262 9.139 -0.877 19854 1063 1 2 . 1 1 12 12 LYS N N 12 129.437 129.437 126.239 3.198 19854 1064 1 2 . 1 1 12 12 LYS C C 12 178.609 178.609 174.842 3.767 19854 1065 1 2 . 1 1 12 12 LYS CA C 12 57.808 57.808 55.895 1.913 19854 1066 1 2 . 1 1 12 12 LYS H H 12 10.015 10.015 8.850 1.165 19854 1067 1 2 . 1 1 13 13 LEU N N 13 112.103 112.103 129.788 -17.685 19854 1068 1 2 . 1 1 13 13 LEU C C 13 177.738 177.738 174.570 3.168 19854 1069 1 2 . 1 1 13 13 LEU CA C 13 54.579 54.579 53.473 1.106 19854 1070 1 2 . 1 1 13 13 LEU CB C 13 42.866 42.866 45.852 -2.986 19854 1071 1 2 . 1 1 13 13 LEU H H 13 6.905 6.905 8.957 -2.052 19854 1072 1 2 . 1 1 14 14 VAL N N 14 127.310 127.310 127.587 -0.277 19854 1073 1 2 . 1 1 14 14 VAL C C 14 175.393 175.393 174.499 0.894 19854 1074 1 2 . 1 1 14 14 VAL CA C 14 70.976 70.976 61.661 9.315 19854 1075 1 2 . 1 1 14 14 VAL CB C 14 28.811 28.811 33.636 -4.825 19854 1076 1 2 . 1 1 14 14 VAL H H 14 8.305 8.305 8.780 -0.475 19854 1077 1 2 . 1 1 15 15 LEU N N 15 128.640 128.640 130.059 -1.419 19854 1078 1 2 . 1 1 15 15 LEU C C 15 177.730 177.730 176.140 1.590 19854 1079 1 2 . 1 1 15 15 LEU CA C 15 55.758 55.758 54.088 1.670 19854 1080 1 2 . 1 1 15 15 LEU H H 15 7.718 7.718 8.944 -1.226 19854 1081 1 2 . 1 1 16 16 VAL N N 16 121.267 121.267 118.551 2.716 19854 1082 1 2 . 1 1 16 16 VAL C C 16 178.324 178.324 174.408 3.916 19854 1083 1 2 . 1 1 16 16 VAL CA C 16 63.363 63.363 58.644 4.719 19854 1084 1 2 . 1 1 16 16 VAL CB C 16 35.839 35.839 35.285 0.554 19854 1085 1 2 . 1 1 16 16 VAL H H 16 8.935 8.935 8.826 0.109 19854 1086 1 2 . 1 1 17 17 GLY N N 17 127.908 127.908 107.009 20.899 19854 1087 1 2 . 1 1 17 17 GLY C C 17 174.514 174.514 172.523 1.991 19854 1088 1 2 . 1 1 17 17 GLY CA C 17 42.281 42.281 44.511 -2.229 19854 1089 1 2 . 1 1 17 17 GLY H H 17 9.682 9.682 6.765 2.917 19854 1090 1 2 . 1 1 18 18 ASP N N 18 125.054 125.054 120.585 4.469 19854 1091 1 2 . 1 1 18 18 ASP C C 18 176.851 176.851 177.267 -0.416 19854 1092 1 2 . 1 1 18 18 ASP CA C 18 57.515 57.515 54.515 3.000 19854 1093 1 2 . 1 1 18 18 ASP CB C 18 46.090 46.090 42.101 3.989 19854 1094 1 2 . 1 1 18 18 ASP H H 18 8.282 8.282 8.272 0.010 19854 1095 1 2 . 1 1 19 19 GLY N N 19 120.670 120.670 107.283 13.387 19854 1096 1 2 . 1 1 19 19 GLY C C 19 178.324 178.324 174.964 3.360 19854 1097 1 2 . 1 1 19 19 GLY CA C 19 42.281 42.281 45.396 -3.115 19854 1098 1 2 . 1 1 19 19 GLY H H 19 8.825 8.825 8.651 0.174 19854 1099 1 2 . 1 1 20 20 GLY N N 20 129.369 129.369 111.506 17.863 19854 1100 1 2 . 1 1 20 20 GLY C C 20 174.221 174.221 175.807 -1.586 19854 1101 1 2 . 1 1 20 20 GLY CA C 20 41.695 41.695 45.349 -3.654 19854 1102 1 2 . 1 1 20 20 GLY H H 20 8.477 8.477 8.622 -0.145 19854 1103 1 2 . 1 1 21 21 THR N N 21 122.199 122.199 114.043 8.156 19854 1104 1 2 . 1 1 21 21 THR C C 21 171.291 171.291 175.117 -3.826 19854 1105 1 2 . 1 1 21 21 THR CA C 21 61.914 61.914 64.622 -2.708 19854 1106 1 2 . 1 1 21 21 THR CB C 21 65.137 65.137 69.227 -4.090 19854 1107 1 2 . 1 1 21 21 THR H H 21 8.059 8.059 7.626 0.433 19854 1108 1 2 . 1 1 22 22 GLY N N 22 112.369 112.369 108.137 4.232 19854 1109 1 2 . 1 1 22 22 GLY C C 22 184.807 184.807 175.508 9.299 19854 1110 1 2 . 1 1 22 22 GLY CA C 22 45.209 45.209 45.092 0.117 19854 1111 1 2 . 1 1 22 22 GLY H H 22 6.772 6.772 8.306 -1.534 19854 1112 1 2 . 1 1 23 23 LYS N N 23 122.066 122.066 120.551 1.515 19854 1113 1 2 . 1 1 23 23 LYS C C 23 178.589 178.589 178.285 0.304 19854 1114 1 2 . 1 1 23 23 LYS CA C 23 58.101 58.101 59.854 -1.753 19854 1115 1 2 . 1 1 23 23 LYS CB C 23 40.230 40.230 32.416 7.814 19854 1116 1 2 . 1 1 23 23 LYS H H 23 7.441 7.441 7.578 -0.137 19854 1117 1 2 . 1 1 24 24 THR N N 24 114.627 114.627 114.129 0.498 19854 1118 1 2 . 1 1 24 24 THR C C 24 178.324 178.324 176.804 1.520 19854 1119 1 2 . 1 1 24 24 THR CA C 24 62.192 62.192 67.173 -4.981 19854 1120 1 2 . 1 1 24 24 THR CB C 24 71.562 71.562 68.173 3.389 19854 1121 1 2 . 1 1 24 24 THR H H 24 8.469 8.469 8.523 -0.054 19854 1122 1 2 . 1 1 25 25 THR N N 25 110.377 110.377 119.292 -8.915 19854 1123 1 2 . 1 1 25 25 THR C C 25 178.324 178.324 176.135 2.189 19854 1124 1 2 . 1 1 25 25 THR CA C 25 64.534 64.534 66.771 -2.237 19854 1125 1 2 . 1 1 25 25 THR CB C 25 71.562 71.562 68.423 3.139 19854 1126 1 2 . 1 1 25 25 THR H H 25 8.415 8.415 8.127 0.288 19854 1127 1 2 . 1 1 26 26 PHE N N 26 114.295 114.295 123.194 -8.899 19854 1128 1 2 . 1 1 26 26 PHE C C 26 174.514 174.514 176.817 -2.303 19854 1129 1 2 . 1 1 26 26 PHE CA C 26 53.407 53.407 61.852 -8.445 19854 1130 1 2 . 1 1 26 26 PHE CB C 26 40.524 40.524 38.903 1.621 19854 1131 1 2 . 1 1 26 26 PHE H H 26 7.707 7.707 8.477 -0.770 19854 1132 1 2 . 1 1 27 27 VAL N N 27 123.525 123.525 119.849 3.676 19854 1133 1 2 . 1 1 27 27 VAL C C 27 178.031 178.031 177.629 0.402 19854 1134 1 2 . 1 1 27 27 VAL CA C 27 67.462 67.462 67.012 0.450 19854 1135 1 2 . 1 1 27 27 VAL CB C 27 29.397 29.397 31.462 -2.065 19854 1136 1 2 . 1 1 27 27 VAL H H 27 6.967 6.967 8.204 -1.237 19854 1137 1 2 . 1 1 28 28 LYS N N 28 114.228 114.228 119.862 -5.634 19854 1138 1 2 . 1 1 28 28 LYS C C 28 176.566 176.566 178.324 -1.758 19854 1139 1 2 . 1 1 28 28 LYS CA C 28 58.092 58.092 59.645 -1.553 19854 1140 1 2 . 1 1 28 28 LYS CB C 28 34.082 34.082 32.145 1.937 19854 1141 1 2 . 1 1 28 28 LYS H H 28 7.429 7.429 8.127 -0.698 19854 1142 1 2 . 1 1 29 29 ARG N N 29 112.037 112.037 119.382 -7.345 19854 1143 1 2 . 1 1 29 29 ARG C C 29 174.221 174.221 179.068 -4.847 19854 1144 1 2 . 1 1 29 29 ARG CA C 29 72.147 72.147 58.768 13.379 19854 1145 1 2 . 1 1 29 29 ARG CB C 29 37.596 37.596 29.471 8.125 19854 1146 1 2 . 1 1 29 29 ARG H H 29 6.803 6.803 7.872 -1.069 19854 1147 1 2 . 1 1 30 30 HIS N N 30 122.396 122.396 117.139 5.257 19854 1148 1 2 . 1 1 30 30 HIS C C 30 172.170 172.170 176.745 -4.575 19854 1149 1 2 . 1 1 30 30 HIS CA C 30 51.651 51.651 59.292 -7.641 19854 1150 1 2 . 1 1 30 30 HIS CB C 30 30.568 30.568 29.596 0.973 19854 1151 1 2 . 1 1 30 30 HIS H H 30 7.644 7.644 7.424 0.220 19854 1152 1 2 . 1 1 31 31 LEU N N 31 110.377 110.377 116.559 -6.182 19854 1153 1 2 . 1 1 31 31 LEU C C 31 178.031 178.031 178.588 -0.557 19854 1154 1 2 . 1 1 31 31 LEU CA C 31 55.164 55.164 57.164 -2.000 19854 1155 1 2 . 1 1 31 31 LEU CB C 31 42.281 42.281 42.296 -0.015 19854 1156 1 2 . 1 1 31 31 LEU H H 31 7.894 7.894 7.982 -0.088 19854 1157 1 2 . 1 1 32 32 THR N N 32 121.468 121.468 106.062 15.406 19854 1158 1 2 . 1 1 32 32 THR C C 32 170.705 170.705 175.529 -4.824 19854 1159 1 2 . 1 1 32 32 THR CA C 32 63.668 63.668 61.822 1.846 19854 1160 1 2 . 1 1 32 32 THR CB C 32 75.679 75.679 70.839 4.840 19854 1161 1 2 . 1 1 32 32 THR H H 32 8.372 8.372 8.243 0.129 19854 1162 1 2 . 1 1 33 33 GLY N N 33 127.841 127.841 110.735 17.106 19854 1163 1 2 . 1 1 33 33 GLY C C 33 161.914 161.914 173.904 -11.990 19854 1164 1 2 . 1 1 33 33 GLY CA C 33 42.866 42.866 44.799 -1.933 19854 1165 1 2 . 1 1 33 33 GLY H H 33 9.662 9.662 7.740 1.922 19854 1166 1 2 . 1 1 34 34 GLU N N 34 120.871 120.871 120.731 0.140 19854 1167 1 2 . 1 1 34 34 GLU C C 34 174.508 174.508 175.248 -0.740 19854 1168 1 2 . 1 1 34 34 GLU CA C 34 58.101 58.101 55.889 2.212 19854 1169 1 2 . 1 1 34 34 GLU CB C 34 34.371 34.371 30.671 3.700 19854 1170 1 2 . 1 1 34 34 GLU H H 34 8.211 8.211 7.499 0.712 19854 1171 1 2 . 1 1 35 35 PHE N N 35 111.838 111.838 119.576 -7.738 19854 1172 1 2 . 1 1 35 35 PHE C C 35 174.221 174.221 175.468 -1.247 19854 1173 1 2 . 1 1 35 35 PHE CA C 35 49.308 49.308 56.887 -7.579 19854 1174 1 2 . 1 1 35 35 PHE CB C 35 41.695 41.695 40.597 1.098 19854 1175 1 2 . 1 1 35 35 PHE H H 35 6.772 6.772 8.198 -1.426 19854 1176 1 2 . 1 1 36 36 GLU N N 36 120.672 120.672 125.403 -4.731 19854 1177 1 2 . 1 1 36 36 GLU C C 36 175.686 175.686 176.288 -0.602 19854 1178 1 2 . 1 1 36 36 GLU CA C 36 58.980 58.980 55.489 3.491 19854 1179 1 2 . 1 1 36 36 GLU CB C 36 48.140 48.140 29.973 18.167 19854 1180 1 2 . 1 1 36 36 GLU H H 36 8.293 8.293 8.766 -0.473 19854 1181 1 2 . 1 1 37 37 LYS N N 37 118.810 118.810 125.190 -6.380 19854 1182 1 2 . 1 1 37 37 LYS C C 37 172.756 172.756 176.548 -3.792 19854 1183 1 2 . 1 1 37 37 LYS CA C 37 48.137 48.137 56.228 -8.091 19854 1184 1 2 . 1 1 37 37 LYS CB C 37 37.010 37.010 33.209 3.801 19854 1185 1 2 . 1 1 37 37 LYS H H 37 8.509 8.509 8.599 -0.090 19854 1186 1 2 . 1 1 38 38 LYS N N 38 108.052 108.052 120.953 -12.901 19854 1187 1 2 . 1 1 38 38 LYS C C 38 176.273 176.273 175.371 0.902 19854 1188 1 2 . 1 1 38 38 LYS CA C 38 59.849 59.849 55.726 4.123 19854 1189 1 2 . 1 1 38 38 LYS CB C 38 34.668 34.668 33.278 1.391 19854 1190 1 2 . 1 1 38 38 LYS H H 38 7.715 7.715 7.655 0.060 19854 1191 1 2 . 1 1 39 39 TYR N N 39 108.650 108.650 124.966 -16.316 19854 1192 1 2 . 1 1 39 39 TYR C C 39 175.686 175.686 175.707 -0.021 19854 1193 1 2 . 1 1 39 39 TYR CA C 39 61.020 61.020 58.306 2.713 19854 1194 1 2 . 1 1 39 39 TYR CB C 39 36.424 36.424 39.178 -2.754 19854 1195 1 2 . 1 1 39 39 TYR H H 39 7.362 7.362 8.701 -1.339 19854 1196 1 2 . 1 1 40 40 VAL N N 40 117.947 117.947 127.118 -9.171 19854 1197 1 2 . 1 1 40 40 VAL C C 40 175.393 175.393 175.297 0.096 19854 1198 1 2 . 1 1 40 40 VAL CA C 40 61.020 61.020 61.175 -0.155 19854 1199 1 2 . 1 1 40 40 VAL CB C 40 31.154 31.154 34.315 -3.161 19854 1200 1 2 . 1 1 40 40 VAL H H 40 8.442 8.442 8.374 0.068 19854 1201 1 2 . 1 1 42 42 THR N N 42 117.150 117.150 117.986 -0.836 19854 1202 1 2 . 1 1 42 42 THR C C 42 178.910 178.910 173.955 4.955 19854 1203 1 2 . 1 1 42 42 THR CA C 42 60.435 60.435 62.964 -2.529 19854 1204 1 2 . 1 1 42 42 THR CB C 42 70.390 70.390 69.598 0.792 19854 1205 1 2 . 1 1 42 42 THR H H 42 8.192 8.192 8.387 -0.195 19854 1206 1 2 . 1 1 43 43 LEU N N 43 119.209 119.209 128.049 -8.840 19854 1207 1 2 . 1 1 43 43 LEU C C 43 174.807 174.807 178.021 -3.214 19854 1208 1 2 . 1 1 43 43 LEU CA C 43 57.507 57.507 54.321 3.187 19854 1209 1 2 . 1 1 43 43 LEU CB C 43 42.866 42.866 42.961 -0.095 19854 1210 1 2 . 1 1 43 43 LEU H H 43 9.260 9.260 8.464 0.796 19854 1211 1 2 . 1 1 44 44 GLY N N 44 114.361 114.361 113.214 1.147 19854 1212 1 2 . 1 1 44 44 GLY C C 44 178.910 178.910 172.709 6.201 19854 1213 1 2 . 1 1 44 44 GLY CA C 44 54.579 54.579 46.093 8.486 19854 1214 1 2 . 1 1 44 44 GLY H H 44 6.979 6.979 8.674 -1.695 19854 1215 1 2 . 1 1 45 45 VAL N N 45 110.244 110.244 123.858 -13.614 19854 1216 1 2 . 1 1 45 45 VAL C C 45 174.807 174.807 174.454 0.353 19854 1217 1 2 . 1 1 45 45 VAL CA C 45 63.363 63.363 59.997 3.366 19854 1218 1 2 . 1 1 45 45 VAL CB C 45 17.099 17.099 35.074 -17.975 19854 1219 1 2 . 1 1 45 45 VAL H H 45 8.309 8.309 8.184 0.125 19854 1220 1 2 . 1 1 46 46 GLU N N 46 130.365 130.365 128.728 1.637 19854 1221 1 2 . 1 1 46 46 GLU C C 46 176.859 176.859 174.405 2.454 19854 1222 1 2 . 1 1 46 46 GLU CA C 46 55.164 55.164 54.712 0.452 19854 1223 1 2 . 1 1 46 46 GLU CB C 46 32.325 32.325 32.310 0.015 19854 1224 1 2 . 1 1 46 46 GLU H H 46 9.741 9.741 8.829 0.912 19854 1225 1 2 . 1 1 47 47 VAL N N 47 125.254 125.254 124.704 0.550 19854 1226 1 2 . 1 1 47 47 VAL C C 47 175.661 175.661 175.760 -0.099 19854 1227 1 2 . 1 1 47 47 VAL CA C 47 63.375 63.375 61.151 2.224 19854 1228 1 2 . 1 1 47 47 VAL CB C 47 37.300 37.300 32.409 4.891 19854 1229 1 2 . 1 1 47 47 VAL H H 47 8.250 8.250 8.267 -0.017 19854 1230 1 2 . 1 1 48 48 HIS N N 48 129.236 129.236 127.036 2.200 19854 1231 1 2 . 1 1 48 48 HIS C C 48 169.240 169.240 172.940 -3.700 19854 1232 1 2 . 1 1 48 48 HIS CA C 48 49.894 49.894 53.342 -3.448 19854 1233 1 2 . 1 1 48 48 HIS CB C 48 27.640 27.640 32.120 -4.480 19854 1234 1 2 . 1 1 48 48 HIS H H 48 10.390 10.390 9.147 1.243 19854 1235 1 2 . 1 1 49 49 PRO C C 49 176.273 176.273 175.634 0.639 19854 1236 1 2 . 1 1 49 49 PRO CA C 49 62.500 62.500 62.649 -0.149 19854 1237 1 2 . 1 1 49 49 PRO CB C 49 29.974 29.974 32.344 -2.370 19854 1238 1 2 . 1 1 50 50 LEU N N 50 119.408 119.408 127.700 -8.292 19854 1239 1 2 . 1 1 50 50 LEU C C 50 177.445 177.445 174.509 2.936 19854 1240 1 2 . 1 1 50 50 LEU CA C 50 59.264 59.264 54.429 4.835 19854 1241 1 2 . 1 1 50 50 LEU CB C 50 42.281 42.281 45.663 -3.382 19854 1242 1 2 . 1 1 50 50 LEU H H 50 7.492 7.492 9.124 -1.632 19854 1243 1 2 . 1 1 51 51 VAL N N 51 117.947 117.947 126.612 -8.665 19854 1244 1 2 . 1 1 51 51 VAL C C 51 174.514 174.514 175.559 -1.045 19854 1245 1 2 . 1 1 51 51 VAL CA C 51 64.534 64.534 61.294 3.240 19854 1246 1 2 . 1 1 51 51 VAL CB C 51 37.010 37.010 33.707 3.303 19854 1247 1 2 . 1 1 51 51 VAL H H 51 7.715 7.715 8.146 -0.431 19854 1248 1 2 . 1 1 52 52 PHE N N 52 124.853 124.853 126.201 -1.348 19854 1249 1 2 . 1 1 52 52 PHE C C 52 175.100 175.100 174.471 0.629 19854 1250 1 2 . 1 1 52 52 PHE CA C 52 56.336 56.336 55.760 0.576 19854 1251 1 2 . 1 1 52 52 PHE CB C 52 39.938 39.938 43.684 -3.746 19854 1252 1 2 . 1 1 52 52 PHE H H 52 8.935 8.935 9.257 -0.322 19854 1253 1 2 . 1 1 53 53 HIS N N 53 120.603 120.603 123.307 -2.704 19854 1254 1 2 . 1 1 53 53 HIS C C 53 170.119 170.119 174.451 -4.332 19854 1255 1 2 . 1 1 53 53 HIS CA C 53 55.164 55.164 54.856 0.308 19854 1256 1 2 . 1 1 53 53 HIS CB C 53 30.568 30.568 31.899 -1.331 19854 1257 1 2 . 1 1 53 53 HIS H H 53 8.356 8.356 8.974 -0.618 19854 1258 1 2 . 1 1 54 54 THR N N 54 112.634 112.634 118.570 -5.936 19854 1259 1 2 . 1 1 54 54 THR C C 54 178.910 178.910 175.906 3.004 19854 1260 1 2 . 1 1 54 54 THR CA C 54 63.363 63.363 58.898 4.465 19854 1261 1 2 . 1 1 54 54 THR CB C 54 72.733 72.733 71.807 0.926 19854 1262 1 2 . 1 1 54 54 THR H H 54 7.574 7.574 8.175 -0.601 19854 1263 1 2 . 1 1 55 55 ASN N N 55 131.095 131.095 119.461 11.634 19854 1264 1 2 . 1 1 55 55 ASN C C 55 176.273 176.273 176.638 -0.365 19854 1265 1 2 . 1 1 55 55 ASN CA C 55 51.065 51.065 55.812 -4.747 19854 1266 1 2 . 1 1 55 55 ASN CB C 55 37.010 37.010 38.224 -1.214 19854 1267 1 2 . 1 1 55 55 ASN H H 55 10.187 10.187 8.548 1.639 19854 1268 1 2 . 1 1 56 56 ARG N N 56 122.064 122.064 118.233 3.831 19854 1269 1 2 . 1 1 56 56 ARG C C 56 175.100 175.100 176.020 -0.920 19854 1270 1 2 . 1 1 56 56 ARG CA C 56 61.606 61.606 55.751 5.855 19854 1271 1 2 . 1 1 56 56 ARG CB C 56 32.911 32.911 30.501 2.410 19854 1272 1 2 . 1 1 56 56 ARG H H 56 7.433 7.433 7.769 -0.336 19854 1273 1 2 . 1 1 57 57 GLY N N 57 127.709 127.709 108.184 19.525 19854 1274 1 2 . 1 1 57 57 GLY C C 57 175.979 175.979 172.166 3.813 19854 1275 1 2 . 1 1 57 57 GLY CA C 57 42.281 42.281 44.230 -1.949 19854 1276 1 2 . 1 1 57 57 GLY H H 57 9.373 9.373 7.560 1.813 19854 1277 1 2 . 1 1 58 58 PRO C C 58 177.152 177.152 176.266 0.886 19854 1278 1 2 . 1 1 58 58 PRO CA C 58 65.137 65.137 63.005 2.132 19854 1279 1 2 . 1 1 58 58 PRO CB C 58 29.095 29.095 32.363 -3.268 19854 1280 1 2 . 1 1 59 59 ILE N N 59 128.638 128.638 114.967 13.671 19854 1281 1 2 . 1 1 59 59 ILE C C 59 175.979 175.979 173.843 2.136 19854 1282 1 2 . 1 1 59 59 ILE CA C 59 65.120 65.120 59.347 5.773 19854 1283 1 2 . 1 1 59 59 ILE CB C 59 40.524 40.524 42.203 -1.679 19854 1284 1 2 . 1 1 59 59 ILE H H 59 8.794 8.794 9.010 -0.216 19854 1285 1 2 . 1 1 60 60 LYS N N 60 127.711 127.711 124.291 3.420 19854 1286 1 2 . 1 1 60 60 LYS C C 60 178.902 178.902 174.806 4.096 19854 1287 1 2 . 1 1 60 60 LYS CA C 60 74.293 74.293 54.308 19.985 19854 1288 1 2 . 1 1 60 60 LYS CB C 60 32.027 32.027 36.331 -4.304 19854 1289 1 2 . 1 1 60 60 LYS H H 60 8.024 8.024 8.578 -0.554 19854 1290 1 2 . 1 1 61 61 PHE N N 61 120.670 120.670 124.586 -3.916 19854 1291 1 2 . 1 1 61 61 PHE C C 61 175.393 175.393 175.020 0.373 19854 1292 1 2 . 1 1 61 61 PHE CA C 61 57.507 57.507 56.872 0.635 19854 1293 1 2 . 1 1 61 61 PHE CB C 61 41.109 41.109 40.774 0.335 19854 1294 1 2 . 1 1 61 61 PHE H H 61 7.515 7.515 9.447 -1.932 19854 1295 1 2 . 1 1 62 62 ASN N N 62 124.789 124.789 123.889 0.900 19854 1296 1 2 . 1 1 62 62 ASN C C 62 173.336 173.336 174.414 -1.078 19854 1297 1 2 . 1 1 62 62 ASN CA C 62 53.121 53.121 52.118 1.003 19854 1298 1 2 . 1 1 62 62 ASN CB C 62 41.695 41.695 39.059 2.636 19854 1299 1 2 . 1 1 62 62 ASN H H 62 8.325 8.325 9.284 -0.959 19854 1300 1 2 . 1 1 63 63 VAL N N 63 106.127 106.127 127.410 -21.283 19854 1301 1 2 . 1 1 63 63 VAL C C 63 175.100 175.100 175.411 -0.311 19854 1302 1 2 . 1 1 63 63 VAL CA C 63 61.020 61.020 63.053 -2.034 19854 1303 1 2 . 1 1 63 63 VAL CB C 63 31.154 31.154 32.566 -1.412 19854 1304 1 2 . 1 1 63 63 VAL H H 63 8.113 8.113 8.900 -0.787 19854 1305 1 2 . 1 1 64 64 TRP N N 64 129.302 129.302 130.005 -0.703 19854 1306 1 2 . 1 1 64 64 TRP C C 64 177.152 177.152 175.103 2.049 19854 1307 1 2 . 1 1 64 64 TRP CA C 64 59.264 59.264 55.833 3.431 19854 1308 1 2 . 1 1 64 64 TRP CB C 64 29.397 29.397 29.947 -0.550 19854 1309 1 2 . 1 1 64 64 TRP H H 64 8.970 8.970 9.614 -0.644 19854 1310 1 2 . 1 1 65 65 ASP N N 65 119.607 119.607 126.037 -6.430 19854 1311 1 2 . 1 1 65 65 ASP C C 65 174.514 174.514 175.866 -1.352 19854 1312 1 2 . 1 1 65 65 ASP CA C 65 55.164 55.164 53.059 2.105 19854 1313 1 2 . 1 1 65 65 ASP CB C 65 41.109 41.109 43.208 -2.099 19854 1314 1 2 . 1 1 65 65 ASP H H 65 8.638 8.638 9.109 -0.471 19854 1315 1 2 . 1 1 66 66 THR N N 66 122.463 122.463 117.793 4.670 19854 1316 1 2 . 1 1 66 66 THR C C 66 178.617 178.617 173.723 4.894 19854 1317 1 2 . 1 1 66 66 THR CA C 66 68.048 68.048 59.738 8.310 19854 1318 1 2 . 1 1 66 66 THR CB C 66 71.562 71.562 71.118 0.444 19854 1319 1 2 . 1 1 66 66 THR H H 66 8.293 8.293 8.431 -0.138 19854 1320 1 2 . 1 1 67 67 ALA N N 67 104.865 104.865 122.599 -17.734 19854 1321 1 2 . 1 1 67 67 ALA C C 67 177.738 177.738 178.040 -0.302 19854 1322 1 2 . 1 1 67 67 ALA CA C 67 48.722 48.722 51.559 -2.837 19854 1323 1 2 . 1 1 67 67 ALA CB C 67 14.171 14.171 20.321 -6.150 19854 1324 1 2 . 1 1 67 67 ALA H H 67 8.657 8.657 7.755 0.902 19854 1325 1 2 . 1 1 68 68 GLY N N 68 115.357 115.357 109.519 5.838 19854 1326 1 2 . 1 1 68 68 GLY C C 68 189.533 189.533 176.110 13.423 19854 1327 1 2 . 1 1 68 68 GLY CA C 68 45.209 45.209 46.140 -0.931 19854 1328 1 2 . 1 1 68 68 GLY H H 68 10.969 10.969 8.914 2.055 19854 1329 1 2 . 1 1 69 69 GLN N N 69 122.730 122.730 119.800 2.930 19854 1330 1 2 . 1 1 69 69 GLN C C 69 174.508 174.508 176.441 -1.933 19854 1331 1 2 . 1 1 69 69 GLN CA C 69 58.394 58.394 57.425 0.969 19854 1332 1 2 . 1 1 69 69 GLN CB C 69 31.441 31.441 28.782 2.659 19854 1333 1 2 . 1 1 69 69 GLN H H 69 8.336 8.336 8.497 -0.161 19854 1334 1 2 . 1 1 70 70 GLU N N 70 114.826 114.826 120.334 -5.508 19854 1335 1 2 . 1 1 70 70 GLU C C 70 176.273 176.273 175.636 0.637 19854 1336 1 2 . 1 1 70 70 GLU CA C 70 57.507 57.507 56.496 1.011 19854 1337 1 2 . 1 1 70 70 GLU CB C 70 28.811 28.811 30.338 -1.527 19854 1338 1 2 . 1 1 70 70 GLU H H 70 9.651 9.651 8.269 1.382 19854 1339 1 2 . 1 1 71 71 LYS N N 71 116.685 116.685 123.244 -6.559 19854 1340 1 2 . 1 1 71 71 LYS C C 71 175.979 175.979 176.095 -0.116 19854 1341 1 2 . 1 1 71 71 LYS CA C 71 48.722 48.722 56.030 -7.308 19854 1342 1 2 . 1 1 71 71 LYS CB C 71 37.010 37.010 32.961 4.049 19854 1343 1 2 . 1 1 71 71 LYS H H 71 8.712 8.712 8.286 0.426 19854 1344 1 2 . 1 1 72 72 PHE N N 72 114.959 114.959 119.222 -4.263 19854 1345 1 2 . 1 1 72 72 PHE C C 72 175.686 175.686 176.765 -1.079 19854 1346 1 2 . 1 1 72 72 PHE CA C 72 56.336 56.336 58.594 -2.258 19854 1347 1 2 . 1 1 72 72 PHE CB C 72 36.424 36.424 38.784 -2.360 19854 1348 1 2 . 1 1 72 72 PHE H H 72 7.965 7.965 7.892 0.073 19854 1349 1 2 . 1 1 73 73 GLY N N 73 117.084 117.084 112.061 5.023 19854 1350 1 2 . 1 1 73 73 GLY C C 73 168.068 168.068 174.380 -6.312 19854 1351 1 2 . 1 1 73 73 GLY CA C 73 42.281 42.281 44.933 -2.652 19854 1352 1 2 . 1 1 73 73 GLY H H 73 7.609 7.609 7.980 -0.371 19854 1353 1 2 . 1 1 74 74 GLY N N 74 120.537 120.537 107.813 12.724 19854 1354 1 2 . 1 1 74 74 GLY C C 74 174.514 174.514 176.578 -2.064 19854 1355 1 2 . 1 1 74 74 GLY CA C 74 44.037 44.037 46.390 -2.353 19854 1356 1 2 . 1 1 74 74 GLY H H 74 9.326 9.326 8.436 0.890 19854 1357 1 2 . 1 1 75 75 LEU N N 75 127.177 127.177 117.748 9.429 19854 1358 1 2 . 1 1 75 75 LEU C C 75 178.617 178.617 177.734 0.883 19854 1359 1 2 . 1 1 75 75 LEU CA C 75 53.407 53.407 56.902 -3.495 19854 1360 1 2 . 1 1 75 75 LEU CB C 75 42.281 42.281 41.383 0.898 19854 1361 1 2 . 1 1 75 75 LEU H H 75 7.628 7.628 7.646 -0.018 19854 1362 1 2 . 1 1 76 76 ARG N N 76 116.486 116.486 117.380 -0.894 19854 1363 1 2 . 1 1 76 76 ARG C C 76 176.859 176.859 176.737 0.122 19854 1364 1 2 . 1 1 76 76 ARG CA C 76 59.264 59.264 56.115 3.149 19854 1365 1 2 . 1 1 76 76 ARG CB C 76 31.154 31.154 29.976 1.178 19854 1366 1 2 . 1 1 76 76 ARG H H 76 7.143 7.143 7.446 -0.303 19854 1367 1 2 . 1 1 77 77 ASP N N 77 129.236 129.236 120.986 8.250 19854 1368 1 2 . 1 1 77 77 ASP C C 77 177.152 177.152 177.898 -0.746 19854 1369 1 2 . 1 1 77 77 ASP CA C 77 52.822 52.822 57.597 -4.775 19854 1370 1 2 . 1 1 77 77 ASP CB C 77 41.695 41.695 40.372 1.323 19854 1371 1 2 . 1 1 77 77 ASP H H 77 8.947 8.947 7.589 1.358 19854 1372 1 2 . 1 1 78 78 GLY N N 78 127.244 127.244 107.346 19.898 19854 1373 1 2 . 1 1 78 78 GLY C C 78 173.928 173.928 176.058 -2.130 19854 1374 1 2 . 1 1 78 78 GLY CA C 78 44.623 44.623 47.020 -2.397 19854 1375 1 2 . 1 1 78 78 GLY H H 78 8.219 8.219 8.499 -0.280 19854 1376 1 2 . 1 1 79 79 TYR N N 79 120.537 120.537 118.665 1.872 19854 1377 1 2 . 1 1 79 79 TYR C C 79 176.273 176.273 177.085 -0.812 19854 1378 1 2 . 1 1 79 79 TYR CA C 79 58.678 58.678 59.633 -0.955 19854 1379 1 2 . 1 1 79 79 TYR CB C 79 40.524 40.524 38.169 2.355 19854 1380 1 2 . 1 1 79 79 TYR H H 79 8.563 8.563 7.325 1.238 19854 1381 1 2 . 1 1 80 80 TYR N N 80 122.132 122.132 117.227 4.905 19854 1382 1 2 . 1 1 80 80 TYR C C 80 175.979 175.979 175.914 0.065 19854 1383 1 2 . 1 1 80 80 TYR CA C 80 62.203 62.203 58.397 3.806 19854 1384 1 2 . 1 1 80 80 TYR CB C 80 41.988 41.988 40.147 1.841 19854 1385 1 2 . 1 1 80 80 TYR H H 80 8.254 8.254 7.587 0.667 19854 1386 1 2 . 1 1 81 81 ILE N N 81 120.072 120.072 116.504 3.568 19854 1387 1 2 . 1 1 81 81 ILE C C 81 177.445 177.445 175.660 1.785 19854 1388 1 2 . 1 1 81 81 ILE CA C 81 67.462 67.462 62.706 4.756 19854 1389 1 2 . 1 1 81 81 ILE CB C 81 41.109 41.109 37.897 3.212 19854 1390 1 2 . 1 1 81 81 ILE H H 81 8.837 8.837 8.072 0.765 19854 1391 1 2 . 1 1 82 82 GLN N N 82 121.601 121.601 118.919 2.682 19854 1392 1 2 . 1 1 82 82 GLN C C 82 173.342 173.342 174.584 -1.242 19854 1393 1 2 . 1 1 82 82 GLN CA C 82 59.859 59.859 56.983 2.876 19854 1394 1 2 . 1 1 82 82 GLN CB C 82 30.855 30.855 25.835 5.020 19854 1395 1 2 . 1 1 82 82 GLN H H 82 8.184 8.184 8.935 -0.751 19854 1396 1 2 . 1 1 83 83 ALA N N 83 109.713 109.713 120.084 -10.371 19854 1397 1 2 . 1 1 83 83 ALA C C 83 175.979 175.979 176.750 -0.771 19854 1398 1 2 . 1 1 83 83 ALA CA C 83 54.579 54.579 52.453 2.126 19854 1399 1 2 . 1 1 83 83 ALA CB C 83 16.513 16.513 19.211 -2.698 19854 1400 1 2 . 1 1 83 83 ALA H H 83 6.306 6.306 7.365 -1.059 19854 1401 1 2 . 1 1 84 84 GLN N N 84 121.203 121.203 121.096 0.107 19854 1402 1 2 . 1 1 84 84 GLN C C 84 177.144 177.144 176.165 0.979 19854 1403 1 2 . 1 1 84 84 GLN CA C 84 60.152 60.152 57.001 3.151 19854 1404 1 2 . 1 1 84 84 GLN CB C 84 34.957 34.957 31.095 3.862 19854 1405 1 2 . 1 1 84 84 GLN H H 84 8.180 8.180 8.531 -0.351 19854 1406 1 2 . 1 1 85 85 CYS N N 85 120.605 120.605 111.531 9.074 19854 1407 1 2 . 1 1 85 85 CYS C C 85 176.566 176.566 172.751 3.815 19854 1408 1 2 . 1 1 85 85 CYS CA C 85 65.430 65.430 56.308 9.122 19854 1409 1 2 . 1 1 85 85 CYS CB C 85 39.644 39.644 31.723 7.921 19854 1410 1 2 . 1 1 85 85 CYS H H 85 8.364 8.364 7.604 0.760 19854 1411 1 2 . 1 1 86 86 ALA N N 86 114.295 114.295 121.369 -7.074 19854 1412 1 2 . 1 1 86 86 ALA CA C 86 57.507 57.507 51.003 6.504 19854 1413 1 2 . 1 1 86 86 ALA CB C 86 21.784 21.784 22.953 -1.169 19854 1414 1 2 . 1 1 86 86 ALA H H 86 6.897 6.897 8.692 -1.795 19854 1415 1 2 . 1 1 87 87 ILE N N 87 120.670 120.670 120.491 0.179 19854 1416 1 2 . 1 1 87 87 ILE C C 87 173.928 173.928 174.670 -0.742 19854 1417 1 2 . 1 1 87 87 ILE CA C 87 61.020 61.020 60.046 0.974 19854 1418 1 2 . 1 1 87 87 ILE CB C 87 39.938 39.938 41.524 -1.586 19854 1419 1 2 . 1 1 87 87 ILE H H 87 8.282 8.282 8.644 -0.362 19854 1420 1 2 . 1 1 88 88 ILE N N 88 120.205 120.205 127.454 -7.249 19854 1421 1 2 . 1 1 88 88 ILE C C 88 173.635 173.635 174.928 -1.293 19854 1422 1 2 . 1 1 88 88 ILE CA C 88 64.534 64.534 60.234 4.300 19854 1423 1 2 . 1 1 88 88 ILE CB C 88 37.596 37.596 39.938 -2.341 19854 1424 1 2 . 1 1 88 88 ILE H H 88 5.528 5.528 8.975 -3.447 19854 1425 1 2 . 1 1 89 89 MET N N 89 120.472 120.472 126.277 -5.805 19854 1426 1 2 . 1 1 89 89 MET C C 89 178.617 178.617 175.027 3.590 19854 1427 1 2 . 1 1 89 89 MET CA C 89 58.980 58.980 54.372 4.608 19854 1428 1 2 . 1 1 89 89 MET CB C 89 34.957 34.957 34.840 0.117 19854 1429 1 2 . 1 1 89 89 MET H H 89 8.176 8.176 8.749 -0.573 19854 1430 1 2 . 1 1 90 90 PHE N N 90 121.134 121.134 118.841 2.293 19854 1431 1 2 . 1 1 90 90 PHE C C 90 175.393 175.393 172.979 2.414 19854 1432 1 2 . 1 1 90 90 PHE CA C 90 60.435 60.435 55.361 5.074 19854 1433 1 2 . 1 1 90 90 PHE CB C 90 38.767 38.767 42.152 -3.385 19854 1434 1 2 . 1 1 90 90 PHE H H 90 9.334 9.334 8.736 0.598 19854 1435 1 2 . 1 1 91 91 ASP N N 91 120.273 120.273 120.642 -0.369 19854 1436 1 2 . 1 1 91 91 ASP C C 91 177.730 177.730 178.089 -0.359 19854 1437 1 2 . 1 1 91 91 ASP CA C 91 59.859 59.859 52.371 7.488 19854 1438 1 2 . 1 1 91 91 ASP CB C 91 44.039 44.039 42.778 1.261 19854 1439 1 2 . 1 1 91 91 ASP H H 91 7.597 7.597 8.905 -1.308 19854 1440 1 2 . 1 1 92 92 VAL N N 92 115.158 115.158 123.481 -8.323 19854 1441 1 2 . 1 1 92 92 VAL C C 92 173.342 173.342 176.547 -3.205 19854 1442 1 2 . 1 1 92 92 VAL CA C 92 64.534 64.534 64.916 -0.382 19854 1443 1 2 . 1 1 92 92 VAL CB C 92 37.596 37.596 31.291 6.304 19854 1444 1 2 . 1 1 92 92 VAL H H 92 7.738 7.738 8.470 -0.732 19854 1445 1 2 . 1 1 93 93 THR N N 93 127.179 127.179 110.296 16.883 19854 1446 1 2 . 1 1 93 93 THR C C 93 178.902 178.902 174.767 4.135 19854 1447 1 2 . 1 1 93 93 THR CA C 93 64.254 64.254 63.004 1.250 19854 1448 1 2 . 1 1 93 93 THR CB C 93 74.215 74.215 69.173 5.042 19854 1449 1 2 . 1 1 93 93 THR H H 93 7.636 7.636 8.136 -0.500 19854 1450 1 2 . 1 1 94 94 SER N N 94 122.263 122.263 116.467 5.796 19854 1451 1 2 . 1 1 94 94 SER C C 94 163.965 163.965 174.857 -10.892 19854 1452 1 2 . 1 1 94 94 SER CA C 94 59.849 59.849 55.574 4.275 19854 1453 1 2 . 1 1 94 94 SER CB C 94 62.192 62.192 64.179 -1.987 19854 1454 1 2 . 1 1 94 94 SER H H 94 7.628 7.628 7.934 -0.306 19854 1455 1 2 . 1 1 95 95 ARG N N 95 113.099 113.099 128.537 -15.438 19854 1456 1 2 . 1 1 95 95 ARG C C 95 176.273 176.273 178.121 -1.848 19854 1457 1 2 . 1 1 95 95 ARG CA C 95 53.407 53.407 59.579 -6.172 19854 1458 1 2 . 1 1 95 95 ARG CB C 95 31.154 31.154 30.104 1.050 19854 1459 1 2 . 1 1 95 95 ARG H H 95 8.102 8.102 9.073 -0.971 19854 1460 1 2 . 1 1 96 96 VAL N N 96 124.787 124.787 119.189 5.598 19854 1461 1 2 . 1 1 96 96 VAL C C 96 178.031 178.031 177.743 0.288 19854 1462 1 2 . 1 1 96 96 VAL CA C 96 68.634 68.634 66.426 2.208 19854 1463 1 2 . 1 1 96 96 VAL CB C 96 24.126 24.126 31.347 -7.221 19854 1464 1 2 . 1 1 96 96 VAL H H 96 9.146 9.146 8.132 1.014 19854 1465 1 2 . 1 1 97 97 THR N N 97 111.970 111.970 116.089 -4.119 19854 1466 1 2 . 1 1 97 97 THR C C 97 178.031 178.031 175.951 2.080 19854 1467 1 2 . 1 1 97 97 THR CA C 97 63.949 63.949 66.318 -2.369 19854 1468 1 2 . 1 1 97 97 THR CB C 97 70.390 70.390 68.990 1.400 19854 1469 1 2 . 1 1 97 97 THR H H 97 7.984 7.984 7.594 0.390 19854 1470 1 2 . 1 1 98 98 TYR N N 98 113.232 113.232 121.119 -7.887 19854 1471 1 2 . 1 1 98 98 TYR C C 98 176.273 176.273 177.459 -1.186 19854 1472 1 2 . 1 1 98 98 TYR H H 98 7.605 7.605 7.673 -0.068 19854 1473 1 2 . 1 1 99 99 LYS N N 99 123.726 123.726 118.711 5.015 19854 1474 1 2 . 1 1 99 99 LYS C C 99 178.316 178.316 178.461 -0.145 19854 1475 1 2 . 1 1 99 99 LYS CA C 99 58.691 58.691 59.417 -0.726 19854 1476 1 2 . 1 1 99 99 LYS CB C 99 36.127 36.127 32.014 4.113 19854 1477 1 2 . 1 1 99 99 LYS H H 99 8.360 8.360 8.073 0.287 19854 1478 1 2 . 1 1 100 100 ASN N N 100 111.970 111.970 116.140 -4.170 19854 1479 1 2 . 1 1 100 100 ASN C C 100 175.979 175.979 176.792 -0.813 19854 1480 1 2 . 1 1 100 100 ASN CA C 100 53.407 53.407 55.082 -1.675 19854 1481 1 2 . 1 1 100 100 ASN CB C 100 37.596 37.596 38.741 -1.145 19854 1482 1 2 . 1 1 100 100 ASN H H 100 5.778 5.778 7.762 -1.984 19854 1483 1 2 . 1 1 101 101 VAL N N 101 118.877 118.877 121.712 -2.835 19854 1484 1 2 . 1 1 101 101 VAL C C 101 173.635 173.635 174.980 -1.345 19854 1485 1 2 . 1 1 101 101 VAL CA C 101 62.777 62.777 68.493 -5.716 19854 1486 1 2 . 1 1 101 101 VAL CB C 101 27.054 27.054 29.280 -2.226 19854 1487 1 2 . 1 1 101 101 VAL H H 101 7.370 7.370 7.660 -0.290 19854 1488 1 2 . 1 1 102 102 PRO C C 102 176.566 176.566 176.989 -0.423 19854 1489 1 2 . 1 1 102 102 PRO CA C 102 62.500 62.500 65.212 -2.712 19854 1490 1 2 . 1 1 102 102 PRO CB C 102 30.853 30.853 30.999 -0.146 19854 1491 1 2 . 1 1 103 103 ASN N N 103 122.728 122.728 114.761 7.967 19854 1492 1 2 . 1 1 103 103 ASN C C 103 175.100 175.100 176.893 -1.793 19854 1493 1 2 . 1 1 103 103 ASN CA C 103 54.579 54.579 54.582 -0.003 19854 1494 1 2 . 1 1 103 103 ASN CB C 103 38.767 38.767 37.412 1.355 19854 1495 1 2 . 1 1 103 103 ASN H H 103 7.879 7.879 7.386 0.493 19854 1496 1 2 . 1 1 104 104 TRP N N 104 122.730 122.730 120.148 2.582 19854 1497 1 2 . 1 1 104 104 TRP C C 104 174.215 174.215 177.544 -3.329 19854 1498 1 2 . 1 1 104 104 TRP CA C 104 59.273 59.273 60.584 -1.311 19854 1499 1 2 . 1 1 104 104 TRP CB C 104 35.250 35.250 30.038 5.212 19854 1500 1 2 . 1 1 104 104 TRP H H 104 7.902 7.902 7.650 0.252 19854 1501 1 2 . 1 1 105 105 HIS N N 105 120.869 120.869 117.141 3.728 19854 1502 1 2 . 1 1 105 105 HIS C C 105 177.738 177.738 174.449 3.289 19854 1503 1 2 . 1 1 105 105 HIS H H 105 6.971 6.971 8.398 -1.427 19854 1504 1 2 . 1 1 106 106 ARG N N 106 126.314 126.314 123.163 3.151 19854 1505 1 2 . 1 1 106 106 ARG C C 106 176.566 176.566 176.262 0.304 19854 1506 1 2 . 1 1 106 106 ARG CA C 106 62.777 62.777 57.563 5.213 19854 1507 1 2 . 1 1 106 106 ARG CB C 106 29.397 29.397 31.138 -1.741 19854 1508 1 2 . 1 1 106 106 ARG H H 106 7.507 7.507 7.917 -0.410 19854 1509 1 2 . 1 1 107 107 ASP N N 107 119.076 119.076 121.810 -2.734 19854 1510 1 2 . 1 1 107 107 ASP C C 107 176.566 176.566 178.419 -1.853 19854 1511 1 2 . 1 1 107 107 ASP CA C 107 55.164 55.164 57.709 -2.545 19854 1512 1 2 . 1 1 107 107 ASP CB C 107 41.695 41.695 40.980 0.715 19854 1513 1 2 . 1 1 107 107 ASP H H 107 9.076 9.076 7.907 1.169 19854 1514 1 2 . 1 1 108 108 LEU N N 108 113.299 113.299 119.794 -6.495 19854 1515 1 2 . 1 1 108 108 LEU C C 108 176.273 176.273 178.566 -2.293 19854 1516 1 2 . 1 1 108 108 LEU CA C 108 59.264 59.264 58.105 1.159 19854 1517 1 2 . 1 1 108 108 LEU CB C 108 48.722 48.722 41.422 7.301 19854 1518 1 2 . 1 1 108 108 LEU H H 108 6.725 6.725 7.809 -1.084 19854 1519 1 2 . 1 1 109 109 VAL N N 109 121.267 121.267 118.638 2.629 19854 1520 1 2 . 1 1 109 109 VAL C C 109 175.393 175.393 178.792 -3.399 19854 1521 1 2 . 1 1 109 109 VAL CA C 109 63.949 63.949 66.182 -2.233 19854 1522 1 2 . 1 1 109 109 VAL CB C 109 32.911 32.911 31.177 1.734 19854 1523 1 2 . 1 1 109 109 VAL H H 109 8.763 8.763 7.820 0.943 19854 1524 1 2 . 1 1 110 110 ARG N N 110 112.900 112.900 119.022 -6.122 19854 1525 1 2 . 1 1 110 110 ARG C C 110 176.273 176.273 178.017 -1.744 19854 1526 1 2 . 1 1 110 110 ARG CA C 110 57.507 57.507 59.432 -1.925 19854 1527 1 2 . 1 1 110 110 ARG CB C 110 30.568 30.568 30.397 0.171 19854 1528 1 2 . 1 1 110 110 ARG H H 110 7.241 7.241 8.087 -0.846 19854 1529 1 2 . 1 1 111 111 VAL N N 111 115.556 115.556 114.490 1.066 19854 1530 1 2 . 1 1 111 111 VAL C C 111 177.445 177.445 176.710 0.735 19854 1531 1 2 . 1 1 111 111 VAL CA C 111 59.849 59.849 63.973 -4.124 19854 1532 1 2 . 1 1 111 111 VAL CB C 111 32.911 32.911 32.965 -0.054 19854 1533 1 2 . 1 1 111 111 VAL H H 111 7.566 7.566 7.691 -0.125 19854 1534 1 2 . 1 1 112 112 CYS N N 112 114.295 114.295 117.183 -2.888 19854 1535 1 2 . 1 1 112 112 CYS C C 112 169.826 169.826 174.921 -5.095 19854 1536 1 2 . 1 1 112 112 CYS CA C 112 57.507 57.507 59.465 -1.958 19854 1537 1 2 . 1 1 112 112 CYS CB C 112 35.839 35.839 29.116 6.723 19854 1538 1 2 . 1 1 112 112 CYS H H 112 7.425 7.425 8.288 -0.863 19854 1539 1 2 . 1 1 113 113 GLU N N 113 116.486 116.486 118.069 -1.583 19854 1540 1 2 . 1 1 113 113 GLU C C 113 176.566 176.566 175.591 0.975 19854 1541 1 2 . 1 1 113 113 GLU CA C 113 69.219 69.219 58.498 10.721 19854 1542 1 2 . 1 1 113 113 GLU CB C 113 30.568 30.568 28.225 2.343 19854 1543 1 2 . 1 1 113 113 GLU H H 113 7.241 7.241 8.205 -0.964 19854 1544 1 2 . 1 1 114 114 ASN N N 114 129.302 129.302 121.396 7.906 19854 1545 1 2 . 1 1 114 114 ASN C C 114 175.100 175.100 174.864 0.236 19854 1546 1 2 . 1 1 114 114 ASN CA C 114 52.236 52.236 53.241 -1.005 19854 1547 1 2 . 1 1 114 114 ASN CB C 114 39.938 39.938 38.124 1.814 19854 1548 1 2 . 1 1 114 114 ASN H H 114 8.919 8.919 8.293 0.626 19854 1549 1 2 . 1 1 115 115 ILE N N 115 110.443 110.443 119.986 -9.543 19854 1550 1 2 . 1 1 115 115 ILE C C 115 175.100 175.100 173.349 1.751 19854 1551 1 2 . 1 1 115 115 ILE CA C 115 65.705 65.705 57.846 7.859 19854 1552 1 2 . 1 1 115 115 ILE CB C 115 39.353 39.353 40.145 -0.792 19854 1553 1 2 . 1 1 115 115 ILE H H 115 9.287 9.287 7.841 1.446 19854 1554 1 2 . 1 1 116 116 PRO C C 116 175.979 175.979 175.671 0.308 19854 1555 1 2 . 1 1 116 116 PRO CA C 116 63.086 63.086 63.108 -0.022 19854 1556 1 2 . 1 1 116 116 PRO CB C 116 29.681 29.681 32.522 -2.841 19854 1557 1 2 . 1 1 117 117 ILE N N 117 123.591 123.591 123.727 -0.136 19854 1558 1 2 . 1 1 117 117 ILE C C 117 174.807 174.807 175.159 -0.352 19854 1559 1 2 . 1 1 117 117 ILE CA C 117 66.291 66.291 60.323 5.968 19854 1560 1 2 . 1 1 117 117 ILE CB C 117 38.767 38.767 42.299 -3.532 19854 1561 1 2 . 1 1 117 117 ILE H H 117 7.781 7.781 8.517 -0.736 19854 1562 1 2 . 1 1 118 118 VAL N N 118 119.009 119.009 125.762 -6.753 19854 1563 1 2 . 1 1 118 118 VAL C C 118 178.324 178.324 174.846 3.478 19854 1564 1 2 . 1 1 118 118 VAL CA C 118 62.777 62.777 60.875 1.902 19854 1565 1 2 . 1 1 118 118 VAL CB C 118 31.154 31.154 34.164 -3.010 19854 1566 1 2 . 1 1 118 118 VAL H H 118 8.767 8.767 8.661 0.106 19854 1567 1 2 . 1 1 119 119 LEU N N 119 119.408 119.408 126.921 -7.513 19854 1568 1 2 . 1 1 119 119 LEU C C 119 178.031 178.031 176.116 1.915 19854 1569 1 2 . 1 1 119 119 LEU CA C 119 42.866 42.866 53.964 -11.098 19854 1570 1 2 . 1 1 119 119 LEU CB C 119 38.767 38.767 43.619 -4.852 19854 1571 1 2 . 1 1 119 119 LEU H H 119 7.734 7.734 9.240 -1.506 19854 1572 1 2 . 1 1 120 120 CYS N N 120 113.232 113.232 122.322 -9.090 19854 1573 1 2 . 1 1 120 120 CYS C C 120 178.031 178.031 174.227 3.804 19854 1574 1 2 . 1 1 120 120 CYS H H 120 8.317 8.317 9.224 -0.907 19854 1575 1 2 . 1 1 121 121 GLY N N 121 117.349 117.349 112.956 4.393 19854 1576 1 2 . 1 1 121 121 GLY C C 121 176.851 176.851 173.134 3.717 19854 1577 1 2 . 1 1 121 121 GLY CA C 121 41.109 41.109 43.563 -2.454 19854 1578 1 2 . 1 1 121 121 GLY H H 121 7.515 7.515 8.980 -1.465 19854 1579 1 2 . 1 1 122 122 ASN N N 122 125.318 125.318 125.953 -0.635 19854 1580 1 2 . 1 1 122 122 ASN C C 122 175.686 175.686 175.584 0.102 19854 1581 1 2 . 1 1 122 122 ASN CA C 122 50.479 50.479 52.768 -2.289 19854 1582 1 2 . 1 1 122 122 ASN CB C 122 39.353 39.353 40.549 -1.196 19854 1583 1 2 . 1 1 122 122 ASN H H 122 9.162 9.162 8.530 0.632 19854 1584 1 2 . 1 1 123 123 LYS N N 123 122.132 122.132 113.986 8.146 19854 1585 1 2 . 1 1 123 123 LYS C C 123 173.043 173.043 177.496 -4.453 19854 1586 1 2 . 1 1 123 123 LYS CA C 123 58.101 58.101 57.504 0.597 19854 1587 1 2 . 1 1 123 123 LYS CB C 123 35.543 35.543 29.967 5.576 19854 1588 1 2 . 1 1 123 123 LYS H H 123 7.953 7.953 8.834 -0.881 19854 1589 1 2 . 1 1 124 124 VAL N N 124 123.726 123.726 112.650 11.076 19854 1590 1 2 . 1 1 124 124 VAL C C 124 175.679 175.679 176.547 -0.868 19854 1591 1 2 . 1 1 124 124 VAL CA C 124 64.840 64.840 64.645 0.195 19854 1592 1 2 . 1 1 124 124 VAL CB C 124 42.574 42.574 31.385 11.189 19854 1593 1 2 . 1 1 124 124 VAL H H 124 8.555 8.555 7.550 1.005 19854 1594 1 2 . 1 1 125 125 ASP N N 125 119.607 119.607 119.889 -0.282 19854 1595 1 2 . 1 1 125 125 ASP C C 125 176.566 176.566 177.021 -0.455 19854 1596 1 2 . 1 1 125 125 ASP CA C 125 55.750 55.750 56.270 -0.520 19854 1597 1 2 . 1 1 125 125 ASP CB C 125 40.524 40.524 40.629 -0.105 19854 1598 1 2 . 1 1 125 125 ASP H H 125 7.875 7.875 8.139 -0.264 19854 1599 1 2 . 1 1 126 126 ILE N N 126 116.088 116.088 120.799 -4.711 19854 1600 1 2 . 1 1 126 126 ILE C C 126 177.152 177.152 176.293 0.859 19854 1601 1 2 . 1 1 126 126 ILE CA C 126 66.291 66.291 61.637 4.654 19854 1602 1 2 . 1 1 126 126 ILE CB C 126 39.353 39.353 38.560 0.793 19854 1603 1 2 . 1 1 126 126 ILE H H 126 7.511 7.511 7.440 0.071 19854 1604 1 2 . 1 1 127 127 LYS N N 127 121.203 121.203 124.303 -3.100 19854 1605 1 2 . 1 1 127 127 LYS C C 127 175.979 175.979 177.572 -1.593 19854 1606 1 2 . 1 1 127 127 LYS CA C 127 58.101 58.101 58.148 -0.047 19854 1607 1 2 . 1 1 127 127 LYS CB C 127 35.834 35.834 32.600 3.234 19854 1608 1 2 . 1 1 127 127 LYS H H 127 8.113 8.113 8.309 -0.196 19854 1609 1 2 . 1 1 128 128 ASP N N 128 118.279 118.279 120.341 -2.062 19854 1610 1 2 . 1 1 128 128 ASP C C 128 176.566 176.566 175.022 1.544 19854 1611 1 2 . 1 1 128 128 ASP CA C 128 53.407 53.407 52.914 0.493 19854 1612 1 2 . 1 1 128 128 ASP CB C 128 40.524 40.524 39.685 0.839 19854 1613 1 2 . 1 1 128 128 ASP H H 128 7.241 7.241 8.214 -0.973 19854 1614 1 2 . 1 1 129 129 ARG N N 129 118.943 118.943 123.532 -4.589 19854 1615 1 2 . 1 1 129 129 ARG C C 129 177.738 177.738 176.713 1.025 19854 1616 1 2 . 1 1 129 129 ARG CA C 129 45.794 45.794 56.673 -10.879 19854 1617 1 2 . 1 1 129 129 ARG CB C 129 31.154 31.154 30.686 0.468 19854 1618 1 2 . 1 1 129 129 ARG H H 129 8.423 8.423 7.836 0.587 19854 1619 1 2 . 1 1 130 130 LYS N N 130 109.381 109.381 121.779 -12.398 19854 1620 1 2 . 1 1 130 130 LYS C C 130 176.566 176.566 176.912 -0.346 19854 1621 1 2 . 1 1 130 130 LYS CA C 130 55.164 55.164 55.932 -0.768 19854 1622 1 2 . 1 1 130 130 LYS CB C 130 36.424 36.424 33.641 2.783 19854 1623 1 2 . 1 1 130 130 LYS H H 130 7.296 7.296 8.352 -1.056 19854 1624 1 2 . 1 1 131 131 VAL N N 131 110.377 110.377 122.072 -11.695 19854 1625 1 2 . 1 1 131 131 VAL C C 131 178.617 178.617 174.494 4.123 19854 1626 1 2 . 1 1 131 131 VAL CA C 131 65.705 65.705 61.651 4.054 19854 1627 1 2 . 1 1 131 131 VAL CB C 131 35.839 35.839 31.257 4.582 19854 1628 1 2 . 1 1 131 131 VAL H H 131 9.283 9.283 8.224 1.059 19854 1629 1 2 . 1 1 132 132 LYS N N 132 110.310 110.310 127.531 -17.221 19854 1630 1 2 . 1 1 132 132 LYS C C 132 176.273 176.273 177.679 -1.406 19854 1631 1 2 . 1 1 132 132 LYS CA C 132 59.849 59.849 55.947 3.902 19854 1632 1 2 . 1 1 132 132 LYS CB C 132 35.253 35.253 34.114 1.139 19854 1633 1 2 . 1 1 132 132 LYS H H 132 9.709 9.709 8.158 1.551 19854 1634 1 2 . 1 1 133 133 ALA N N 133 134.349 134.349 126.211 8.138 19854 1635 1 2 . 1 1 133 133 ALA CA C 133 51.065 51.065 54.779 -3.714 19854 1636 1 2 . 1 1 133 133 ALA CB C 133 12.999 12.999 18.293 -5.294 19854 1637 1 2 . 1 1 133 133 ALA H H 133 6.322 6.322 8.764 -2.442 19854 1638 1 2 . 1 1 134 134 LYS N N 134 117.615 117.615 116.970 0.645 19854 1639 1 2 . 1 1 134 134 LYS C C 134 176.859 176.859 177.456 -0.597 19854 1640 1 2 . 1 1 134 134 LYS CA C 134 55.750 55.750 58.399 -2.649 19854 1641 1 2 . 1 1 134 134 LYS CB C 134 54.579 54.579 32.416 22.163 19854 1642 1 2 . 1 1 134 134 LYS H H 134 6.549 6.549 8.187 -1.638 19854 1643 1 2 . 1 1 135 135 SER N N 135 109.314 109.314 113.406 -4.092 19854 1644 1 2 . 1 1 135 135 SER C C 135 173.635 173.635 174.945 -1.310 19854 1645 1 2 . 1 1 135 135 SER CA C 135 56.336 56.336 59.351 -3.015 19854 1646 1 2 . 1 1 135 135 SER CB C 135 63.949 63.949 63.335 0.614 19854 1647 1 2 . 1 1 135 135 SER H H 135 7.840 7.840 7.537 0.303 19854 1648 1 2 . 1 1 136 136 ILE N N 136 124.123 124.123 122.195 1.928 19854 1649 1 2 . 1 1 136 136 ILE C C 136 175.100 175.100 175.294 -0.194 19854 1650 1 2 . 1 1 136 136 ILE CA C 136 68.634 68.634 62.817 5.817 19854 1651 1 2 . 1 1 136 136 ILE CB C 136 43.452 43.452 37.883 5.569 19854 1652 1 2 . 1 1 136 136 ILE H H 136 8.098 8.098 7.243 0.855 19854 1653 1 2 . 1 1 137 137 VAL N N 137 113.232 113.232 126.522 -13.290 19854 1654 1 2 . 1 1 137 137 VAL C C 137 176.859 176.859 176.129 0.730 19854 1655 1 2 . 1 1 137 137 VAL CA C 137 64.534 64.534 61.487 3.047 19854 1656 1 2 . 1 1 137 137 VAL CB C 137 34.082 34.082 34.354 -0.272 19854 1657 1 2 . 1 1 137 137 VAL H H 137 7.711 7.711 8.165 -0.454 19854 1658 1 2 . 1 1 138 138 PHE N N 138 118.279 118.279 122.530 -4.251 19854 1659 1 2 . 1 1 138 138 PHE C C 138 175.393 175.393 176.140 -0.747 19854 1660 1 2 . 1 1 138 138 PHE CA C 138 58.092 58.092 62.017 -3.925 19854 1661 1 2 . 1 1 138 138 PHE CB C 138 39.353 39.353 39.133 0.220 19854 1662 1 2 . 1 1 138 138 PHE H H 138 8.317 8.317 7.692 0.625 19854 1663 1 2 . 1 1 139 139 HIS N N 139 120.605 120.605 115.467 5.138 19854 1664 1 2 . 1 1 139 139 HIS C C 139 175.979 175.979 176.981 -1.002 19854 1665 1 2 . 1 1 139 139 HIS CA C 139 67.775 67.775 59.246 8.529 19854 1666 1 2 . 1 1 139 139 HIS CB C 139 35.836 35.836 28.905 6.931 19854 1667 1 2 . 1 1 139 139 HIS H H 139 8.094 8.094 8.906 -0.812 19854 1668 1 2 . 1 1 140 140 ARG N N 140 120.140 120.140 120.036 0.104 19854 1669 1 2 . 1 1 140 140 ARG C C 140 178.023 178.023 179.065 -1.042 19854 1670 1 2 . 1 1 140 140 ARG CA C 140 58.394 58.394 59.086 -0.691 19854 1671 1 2 . 1 1 140 140 ARG CB C 140 39.644 39.644 29.768 9.876 19854 1672 1 2 . 1 1 140 140 ARG H H 140 8.149 8.149 6.969 1.180 19854 1673 1 2 . 1 1 141 141 LYS N N 141 115.623 115.623 119.861 -4.238 19854 1674 1 2 . 1 1 141 141 LYS C C 141 173.635 173.635 178.156 -4.521 19854 1675 1 2 . 1 1 141 141 LYS CA C 141 58.092 58.092 58.678 -0.586 19854 1676 1 2 . 1 1 141 141 LYS CB C 141 33.496 33.496 32.336 1.160 19854 1677 1 2 . 1 1 141 141 LYS H H 141 7.449 7.449 7.363 0.086 19854 1678 1 2 . 1 1 142 142 LYS N N 142 114.162 114.162 115.284 -1.122 19854 1679 1 2 . 1 1 142 142 LYS C C 142 175.979 175.979 175.801 0.178 19854 1680 1 2 . 1 1 142 142 LYS CA C 142 51.065 51.065 55.084 -4.019 19854 1681 1 2 . 1 1 142 142 LYS CB C 142 34.668 34.668 32.054 2.614 19854 1682 1 2 . 1 1 142 142 LYS H H 142 8.982 8.982 7.583 1.399 19854 1683 1 2 . 1 1 143 143 ASN N N 143 112.103 112.103 115.935 -3.832 19854 1684 1 2 . 1 1 143 143 ASN C C 143 175.100 175.100 174.278 0.822 19854 1685 1 2 . 1 1 143 143 ASN CA C 143 53.407 53.407 54.121 -0.714 19854 1686 1 2 . 1 1 143 143 ASN CB C 143 39.938 39.938 36.180 3.758 19854 1687 1 2 . 1 1 143 143 ASN H H 143 7.402 7.402 7.804 -0.402 19854 1688 1 2 . 1 1 144 144 LEU N N 144 118.810 118.810 117.173 1.637 19854 1689 1 2 . 1 1 144 144 LEU CA C 144 53.993 53.993 53.496 0.497 19854 1690 1 2 . 1 1 144 144 LEU CB C 144 42.866 42.866 44.239 -1.373 19854 1691 1 2 . 1 1 144 144 LEU H H 144 7.793 7.793 8.017 -0.224 19854 1692 1 2 . 1 1 145 145 GLN N N 145 119.607 119.607 118.063 1.544 19854 1693 1 2 . 1 1 145 145 GLN C C 145 176.859 176.859 174.257 2.602 19854 1694 1 2 . 1 1 145 145 GLN CA C 145 55.164 55.164 53.584 1.580 19854 1695 1 2 . 1 1 145 145 GLN CB C 145 29.983 29.983 31.242 -1.259 19854 1696 1 2 . 1 1 145 145 GLN H H 145 7.014 7.014 8.171 -1.157 19854 1697 1 2 . 1 1 146 146 TYR N N 146 119.275 119.275 124.490 -5.215 19854 1698 1 2 . 1 1 146 146 TYR C C 146 174.807 174.807 174.388 0.419 19854 1699 1 2 . 1 1 146 146 TYR CA C 146 62.777 62.777 56.112 6.665 19854 1700 1 2 . 1 1 146 146 TYR CB C 146 41.109 41.109 40.762 0.347 19854 1701 1 2 . 1 1 146 146 TYR H H 146 9.350 9.350 8.192 1.158 19854 1702 1 2 . 1 1 147 147 TYR N N 147 123.658 123.658 125.044 -1.386 19854 1703 1 2 . 1 1 147 147 TYR C C 147 177.738 177.738 173.747 3.991 19854 1704 1 2 . 1 1 147 147 TYR CA C 147 58.092 58.092 56.267 1.825 19854 1705 1 2 . 1 1 147 147 TYR CB C 147 39.938 39.938 42.128 -2.190 19854 1706 1 2 . 1 1 147 147 TYR H H 147 8.340 8.340 8.583 -0.243 19854 1707 1 2 . 1 1 148 148 ASP N N 148 121.267 121.267 123.550 -2.283 19854 1708 1 2 . 1 1 148 148 ASP C C 148 176.859 176.859 175.510 1.349 19854 1709 1 2 . 1 1 148 148 ASP CA C 148 54.579 54.579 54.321 0.258 19854 1710 1 2 . 1 1 148 148 ASP CB C 148 41.109 41.109 41.736 -0.627 19854 1711 1 2 . 1 1 148 148 ASP H H 148 8.911 8.911 8.433 0.478 19854 1712 1 2 . 1 1 149 149 ILE N N 149 119.607 119.607 117.255 2.352 19854 1713 1 2 . 1 1 149 149 ILE C C 149 174.807 174.807 174.240 0.567 19854 1714 1 2 . 1 1 149 149 ILE CA C 149 61.020 61.020 59.094 1.926 19854 1715 1 2 . 1 1 149 149 ILE CB C 149 39.353 39.353 42.605 -3.252 19854 1716 1 2 . 1 1 149 149 ILE H H 149 8.712 8.712 8.553 0.159 19854 1717 1 2 . 1 1 150 150 SER N N 150 117.349 117.349 116.339 1.010 19854 1718 1 2 . 1 1 150 150 SER C C 150 175.686 175.686 174.503 1.183 19854 1719 1 2 . 1 1 150 150 SER CA C 150 60.435 60.435 55.476 4.959 19854 1720 1 2 . 1 1 150 150 SER CB C 150 62.192 62.192 65.442 -3.251 19854 1721 1 2 . 1 1 150 150 SER H H 150 8.454 8.454 8.424 0.030 19854 1722 1 2 . 1 1 151 151 ALA N N 151 131.162 131.162 131.369 -0.207 19854 1723 1 2 . 1 1 151 151 ALA C C 151 160.742 160.742 179.307 -18.565 19854 1724 1 2 . 1 1 151 151 ALA CA C 151 53.993 53.993 55.281 -1.288 19854 1725 1 2 . 1 1 151 151 ALA CB C 151 22.369 22.369 19.037 3.332 19854 1726 1 2 . 1 1 151 151 ALA H H 151 10.640 10.640 9.004 1.636 19854 1727 1 2 . 1 1 152 152 LYS N N 152 121.400 121.400 118.363 3.037 19854 1728 1 2 . 1 1 152 152 LYS C C 152 174.221 174.221 177.902 -3.681 19854 1729 1 2 . 1 1 152 152 LYS CA C 152 59.849 59.849 58.634 1.215 19854 1730 1 2 . 1 1 152 152 LYS CB C 152 34.668 34.668 32.412 2.256 19854 1731 1 2 . 1 1 152 152 LYS H H 152 9.099 9.099 8.196 0.903 19854 1732 1 2 . 1 1 153 153 SER N N 153 135.212 135.212 110.238 24.974 19854 1733 1 2 . 1 1 153 153 SER C C 153 177.152 177.152 174.277 2.875 19854 1734 1 2 . 1 1 153 153 SER CA C 153 62.192 62.192 58.059 4.133 19854 1735 1 2 . 1 1 153 153 SER CB C 153 66.291 66.291 64.794 1.497 19854 1736 1 2 . 1 1 153 153 SER H H 153 8.935 8.935 7.693 1.242 19854 1737 1 2 . 1 1 154 154 ASN N N 154 119.341 119.341 116.466 2.875 19854 1738 1 2 . 1 1 154 154 ASN C C 154 175.979 175.979 174.145 1.834 19854 1739 1 2 . 1 1 154 154 ASN CA C 154 49.894 49.894 54.542 -4.648 19854 1740 1 2 . 1 1 154 154 ASN CB C 154 39.353 39.353 36.016 3.337 19854 1741 1 2 . 1 1 154 154 ASN H H 154 7.488 7.488 8.512 -1.024 19854 1742 1 2 . 1 1 155 155 TYR N N 155 120.074 120.074 123.476 -3.402 19854 1743 1 2 . 1 1 155 155 TYR C C 155 177.144 177.144 175.356 1.788 19854 1744 1 2 . 1 1 155 155 TYR CA C 155 60.738 60.738 60.084 0.654 19854 1745 1 2 . 1 1 155 155 TYR CB C 155 41.402 41.402 38.577 2.825 19854 1746 1 2 . 1 1 155 155 TYR H H 155 7.945 7.945 7.466 0.479 19854 1747 1 2 . 1 1 156 156 ASN N N 156 124.058 124.058 122.540 1.518 19854 1748 1 2 . 1 1 156 156 ASN C C 156 175.679 175.679 176.381 -0.702 19854 1749 1 2 . 1 1 156 156 ASN CA C 156 53.121 53.121 54.563 -1.442 19854 1750 1 2 . 1 1 156 156 ASN CB C 156 38.179 38.179 35.684 2.495 19854 1751 1 2 . 1 1 156 156 ASN H H 156 8.192 8.192 8.729 -0.537 19854 1752 1 2 . 1 1 157 157 PHE N N 157 123.459 123.459 117.381 6.078 19854 1753 1 2 . 1 1 157 157 PHE C C 157 174.221 174.221 176.227 -2.006 19854 1754 1 2 . 1 1 157 157 PHE CA C 157 57.507 57.507 60.715 -3.208 19854 1755 1 2 . 1 1 157 157 PHE CB C 157 39.353 39.353 38.479 0.874 19854 1756 1 2 . 1 1 157 157 PHE H H 157 7.429 7.429 8.144 -0.715 19854 1757 1 2 . 1 1 158 158 GLU N N 158 112.568 112.568 117.465 -4.897 19854 1758 1 2 . 1 1 158 158 GLU C C 158 176.566 176.566 177.692 -1.126 19854 1759 1 2 . 1 1 158 158 GLU CA C 158 72.147 72.147 57.248 14.899 19854 1760 1 2 . 1 1 158 158 GLU CB C 158 27.640 27.640 28.541 -0.901 19854 1761 1 2 . 1 1 158 158 GLU H H 158 7.495 7.495 8.049 -0.554 19854 1762 1 2 . 1 1 159 159 LYS N N 159 113.232 113.232 119.620 -6.388 19854 1763 1 2 . 1 1 159 159 LYS C C 159 176.566 176.566 175.935 0.631 19854 1764 1 2 . 1 1 159 159 LYS CA C 159 53.993 53.993 61.505 -7.512 19854 1765 1 2 . 1 1 159 159 LYS CB C 159 33.496 33.496 30.047 3.449 19854 1766 1 2 . 1 1 159 159 LYS H H 159 6.862 6.862 7.362 -0.500 19854 1767 1 2 . 1 1 160 160 PRO C C 160 176.273 176.273 178.726 -2.453 19854 1768 1 2 . 1 1 160 160 PRO CA C 160 64.258 64.258 65.648 -1.390 19854 1769 1 2 . 1 1 160 160 PRO CB C 160 32.318 32.318 31.177 1.141 19854 1770 1 2 . 1 1 161 161 PHE N N 161 123.726 123.726 117.074 6.652 19854 1771 1 2 . 1 1 161 161 PHE C C 161 176.851 176.851 177.954 -1.103 19854 1772 1 2 . 1 1 161 161 PHE CA C 161 60.445 60.445 62.305 -1.860 19854 1773 1 2 . 1 1 161 161 PHE CB C 161 40.816 40.816 38.285 2.531 19854 1774 1 2 . 1 1 161 161 PHE H H 161 8.215 8.215 7.466 0.749 19854 1775 1 2 . 1 1 162 162 LEU N N 162 110.177 110.177 119.296 -9.119 19854 1776 1 2 . 1 1 162 162 LEU C C 162 176.273 176.273 178.824 -2.551 19854 1777 1 2 . 1 1 162 162 LEU CA C 162 55.750 55.750 58.044 -2.294 19854 1778 1 2 . 1 1 162 162 LEU CB C 162 44.037 44.037 41.557 2.480 19854 1779 1 2 . 1 1 162 162 LEU H H 162 7.527 7.527 7.954 -0.427 19854 1780 1 2 . 1 1 163 163 TRP N N 163 123.525 123.525 121.480 2.045 19854 1781 1 2 . 1 1 163 163 TRP C C 163 177.152 177.152 178.047 -0.895 19854 1782 1 2 . 1 1 163 163 TRP CA C 163 61.606 61.606 60.852 0.754 19854 1783 1 2 . 1 1 163 163 TRP CB C 163 28.811 28.811 29.947 -1.136 19854 1784 1 2 . 1 1 163 163 TRP H H 163 7.476 7.476 8.446 -0.970 19854 1785 1 2 . 1 1 164 164 LEU N N 164 119.740 119.740 118.814 0.926 19854 1786 1 2 . 1 1 164 164 LEU C C 164 175.686 175.686 178.806 -3.120 19854 1787 1 2 . 1 1 164 164 LEU CA C 164 61.020 61.020 57.677 3.343 19854 1788 1 2 . 1 1 164 164 LEU CB C 164 45.794 45.794 41.411 4.383 19854 1789 1 2 . 1 1 164 164 LEU H H 164 9.412 9.412 8.123 1.289 19854 1790 1 2 . 1 1 165 165 ALA N N 165 118.013 118.013 121.520 -3.507 19854 1791 1 2 . 1 1 165 165 ALA C C 165 165.723 165.723 179.505 -13.782 19854 1792 1 2 . 1 1 165 165 ALA CA C 165 52.236 52.236 55.151 -2.915 19854 1793 1 2 . 1 1 165 165 ALA CB C 165 21.784 21.784 18.108 3.676 19854 1794 1 2 . 1 1 165 165 ALA H H 165 7.707 7.707 8.329 -0.622 19854 1795 1 2 . 1 1 166 166 ARG N N 166 122.994 122.994 118.431 4.563 19854 1796 1 2 . 1 1 166 166 ARG C C 166 175.979 175.979 178.765 -2.786 19854 1797 1 2 . 1 1 166 166 ARG CA C 166 49.308 49.308 59.277 -9.969 19854 1798 1 2 . 1 1 166 166 ARG CB C 166 29.397 29.397 30.070 -0.673 19854 1799 1 2 . 1 1 166 166 ARG H H 166 8.692 8.692 8.059 0.633 19854 1800 1 2 . 1 1 167 167 LYS N N 167 112.568 112.568 120.165 -7.597 19854 1801 1 2 . 1 1 167 167 LYS C C 167 176.273 176.273 179.307 -3.034 19854 1802 1 2 . 1 1 167 167 LYS CA C 167 58.092 58.092 59.006 -0.914 19854 1803 1 2 . 1 1 167 167 LYS CB C 167 34.668 34.668 32.020 2.648 19854 1804 1 2 . 1 1 167 167 LYS H H 167 6.819 6.819 7.347 -0.528 19854 1805 1 2 . 1 1 168 168 LEU N N 168 114.959 114.959 119.699 -4.740 19854 1806 1 2 . 1 1 168 168 LEU C C 168 177.738 177.738 179.029 -1.291 19854 1807 1 2 . 1 1 168 168 LEU CA C 168 56.921 56.921 57.608 -0.687 19854 1808 1 2 . 1 1 168 168 LEU CB C 168 41.695 41.695 41.935 -0.240 19854 1809 1 2 . 1 1 168 168 LEU H H 168 7.269 7.269 7.824 -0.555 19854 1810 1 2 . 1 1 169 169 ILE N N 169 122.199 122.199 116.034 6.165 19854 1811 1 2 . 1 1 169 169 ILE C C 169 177.445 177.445 177.146 0.299 19854 1812 1 2 . 1 1 169 169 ILE CA C 169 63.375 63.375 63.383 -0.008 19854 1813 1 2 . 1 1 169 169 ILE CB C 169 42.281 42.281 38.675 3.606 19854 1814 1 2 . 1 1 169 169 ILE H H 169 8.360 8.360 8.079 0.281 19854 1815 1 2 . 1 1 170 170 GLY N N 170 113.099 113.099 106.431 6.668 19854 1816 1 2 . 1 1 170 170 GLY C C 170 162.496 162.496 173.818 -11.322 19854 1817 1 2 . 1 1 170 170 GLY CA C 170 44.037 44.037 44.886 -0.849 19854 1818 1 2 . 1 1 170 170 GLY H H 170 6.686 6.686 8.031 -1.345 19854 1819 1 2 . 1 1 171 171 ASP N N 171 113.232 113.232 121.451 -8.219 19854 1820 1 2 . 1 1 171 171 ASP C C 171 178.910 178.910 175.805 3.105 19854 1821 1 2 . 1 1 171 171 ASP CA C 171 50.479 50.479 50.630 -0.151 19854 1822 1 2 . 1 1 171 171 ASP CB C 171 41.109 41.109 42.364 -1.255 19854 1823 1 2 . 1 1 171 171 ASP H H 171 6.815 6.815 7.554 -0.739 19854 1824 1 2 . 1 1 172 172 PRO C C 172 176.566 176.566 176.983 -0.417 19854 1825 1 2 . 1 1 172 172 PRO CA C 172 63.965 63.965 64.233 -0.268 19854 1826 1 2 . 1 1 172 172 PRO CB C 172 31.732 31.732 32.167 -0.435 19854 1827 1 2 . 1 1 173 173 ASN N N 173 109.779 109.779 115.703 -5.924 19854 1828 1 2 . 1 1 173 173 ASN C C 173 175.979 175.979 175.530 0.449 19854 1829 1 2 . 1 1 173 173 ASN CA C 173 54.579 54.579 52.950 1.629 19854 1830 1 2 . 1 1 173 173 ASN CB C 173 36.424 36.424 39.516 -3.092 19854 1831 1 2 . 1 1 173 173 ASN H H 173 8.016 8.016 8.452 -0.436 19854 1832 1 2 . 1 1 174 174 LEU N N 174 109.248 109.248 121.923 -12.675 19854 1833 1 2 . 1 1 174 174 LEU C C 174 176.566 176.566 175.555 1.011 19854 1834 1 2 . 1 1 174 174 LEU CA C 174 56.336 56.336 56.167 0.169 19854 1835 1 2 . 1 1 174 174 LEU CB C 174 44.037 44.037 42.155 1.882 19854 1836 1 2 . 1 1 174 174 LEU H H 174 7.871 7.871 7.373 0.498 19854 1837 1 2 . 1 1 175 175 GLU N N 175 125.185 125.185 120.411 4.774 19854 1838 1 2 . 1 1 175 175 GLU C C 175 177.445 177.445 174.856 2.589 19854 1839 1 2 . 1 1 175 175 GLU CA C 175 76.247 76.247 54.394 21.853 19854 1840 1 2 . 1 1 175 175 GLU CB C 175 28.811 28.811 34.153 -5.342 19854 1841 1 2 . 1 1 175 175 GLU H H 175 9.127 9.127 8.134 0.993 19854 1842 1 2 . 1 1 176 176 PHE N N 176 136.873 136.873 123.460 13.413 19854 1843 1 2 . 1 1 176 176 PHE C C 176 178.617 178.617 175.311 3.306 19854 1844 1 2 . 1 1 176 176 PHE CA C 176 59.264 59.264 58.495 0.769 19854 1845 1 2 . 1 1 176 176 PHE CB C 176 44.623 44.623 39.987 4.636 19854 1846 1 2 . 1 1 176 176 PHE H H 176 10.058 10.058 8.583 1.475 19854 1847 1 2 . 1 1 177 177 VAL N N 177 118.877 118.877 122.212 -3.335 19854 1848 1 2 . 1 1 177 177 VAL C C 177 177.445 177.445 174.476 2.969 19854 1849 1 2 . 1 1 177 177 VAL CA C 177 62.777 62.777 59.553 3.224 19854 1850 1 2 . 1 1 177 177 VAL CB C 177 34.668 34.668 34.601 0.067 19854 1851 1 2 . 1 1 177 177 VAL H H 177 7.789 7.789 8.046 -0.257 19854 1852 1 2 . 1 1 178 178 ALA N N 178 123.859 123.859 131.131 -7.272 19854 1853 1 2 . 1 1 178 178 ALA C C 178 177.144 177.144 176.198 0.946 19854 1854 1 2 . 1 1 178 178 ALA CA C 178 54.000 54.000 53.932 0.068 19854 1855 1 2 . 1 1 178 178 ALA CB C 178 15.035 15.035 18.300 -3.265 19854 1856 1 2 . 1 1 178 178 ALA H H 178 7.683 7.683 8.304 -0.621 19854 1857 1 2 . 1 1 179 179 MET N N 179 121.668 121.668 116.877 4.791 19854 1858 1 2 . 1 1 179 179 MET C C 179 177.144 177.144 173.327 3.817 19854 1859 1 2 . 1 1 179 179 MET CA C 179 60.445 60.445 54.356 6.089 19854 1860 1 2 . 1 1 179 179 MET CB C 179 39.351 39.351 32.698 6.653 19854 1861 1 2 . 1 1 179 179 MET H H 179 7.648 7.648 8.359 -0.711 19854 1862 1 2 . 1 1 180 180 PRO C C 180 177.445 177.445 175.672 1.773 19854 1863 1 2 . 1 1 180 180 PRO CA C 180 64.844 64.844 62.392 2.452 19854 1864 1 2 . 1 1 180 180 PRO CB C 180 29.974 29.974 32.833 -2.859 19854 1865 1 2 . 1 1 181 181 ALA N N 181 128.439 128.439 121.649 6.790 19854 1866 1 2 . 1 1 181 181 ALA C C 181 176.273 176.273 178.403 -2.130 19854 1867 1 2 . 1 1 181 181 ALA CA C 181 58.092 58.092 51.873 6.219 19854 1868 1 2 . 1 1 181 181 ALA CB C 181 21.198 21.198 19.602 1.596 19854 1869 1 2 . 1 1 181 181 ALA H H 181 8.673 8.673 8.207 0.466 19854 1870 1 2 . 1 1 182 182 LEU N N 182 122.130 122.130 122.222 -0.092 19854 1871 1 2 . 1 1 182 182 LEU C C 182 177.445 177.445 177.051 0.394 19854 1872 1 2 . 1 1 182 182 LEU CA C 182 55.164 55.164 55.153 0.011 19854 1873 1 2 . 1 1 182 182 LEU CB C 182 42.866 42.866 41.764 1.102 19854 1874 1 2 . 1 1 182 182 LEU H H 182 8.821 8.821 8.769 0.052 19854 1875 1 2 . 1 1 183 183 ALA N N 183 121.004 121.004 128.682 -7.678 19854 1876 1 2 . 1 1 183 183 ALA C C 183 178.617 178.617 175.646 2.971 19854 1877 1 2 . 1 1 183 183 ALA CA C 183 57.808 57.808 50.062 7.746 19854 1878 1 2 . 1 1 183 183 ALA CB C 183 24.117 24.117 19.075 5.042 19854 1879 1 2 . 1 1 183 183 ALA H H 183 8.356 8.356 8.076 0.280 19854 1880 1 2 . 1 1 184 184 PRO C C 184 177.152 177.152 175.103 2.049 19854 1881 1 2 . 1 1 184 184 PRO CA C 184 64.258 64.258 61.742 2.516 19854 1882 1 2 . 1 1 184 184 PRO CB C 184 29.681 29.681 31.276 -1.595 19854 1883 1 2 . 1 1 185 185 PRO C C 185 175.686 175.686 176.610 -0.924 19854 1884 1 2 . 1 1 185 185 PRO CA C 185 63.379 63.379 63.038 0.341 19854 1885 1 2 . 1 1 185 185 PRO CB C 185 35.248 35.248 32.128 3.120 19854 1886 1 2 . 1 1 186 186 GLU N N 186 120.539 120.539 122.680 -2.141 19854 1887 1 2 . 1 1 186 186 GLU C C 186 176.273 176.273 175.202 1.071 19854 1888 1 2 . 1 1 186 186 GLU CA C 186 58.101 58.101 57.389 0.712 19854 1889 1 2 . 1 1 186 186 GLU CB C 186 35.836 35.836 29.937 5.899 19854 1890 1 2 . 1 1 186 186 GLU H H 186 8.086 8.086 8.502 -0.416 19854 1891 1 2 . 1 1 187 187 VAL N N 187 124.455 124.455 122.703 1.752 19854 1892 1 2 . 1 1 187 187 VAL C C 187 178.910 178.910 175.622 3.288 19854 1893 1 2 . 1 1 187 187 VAL CA C 187 63.363 63.363 62.205 1.158 19854 1894 1 2 . 1 1 187 187 VAL CB C 187 34.082 34.082 32.826 1.256 19854 1895 1 2 . 1 1 187 187 VAL H H 187 8.622 8.622 8.183 0.439 19854 1896 1 2 . 1 1 188 188 VAL N N 188 128.572 128.572 126.346 2.226 19854 1897 1 2 . 1 1 188 188 VAL C C 188 178.324 178.324 176.463 1.861 19854 1898 1 2 . 1 1 188 188 VAL CA C 188 68.634 68.634 63.554 5.080 19854 1899 1 2 . 1 1 188 188 VAL CB C 188 31.154 31.154 32.044 -0.890 19854 1900 1 2 . 1 1 188 188 VAL H H 188 8.497 8.497 8.185 0.312 19854 1901 1 2 . 1 1 189 189 MET N N 189 122.795 122.795 118.471 4.324 19854 1902 1 2 . 1 1 189 189 MET C C 189 177.445 177.445 175.382 2.063 19854 1903 1 2 . 1 1 189 189 MET CA C 189 55.164 55.164 55.778 -0.614 19854 1904 1 2 . 1 1 189 189 MET CB C 189 35.253 35.253 33.551 1.702 19854 1905 1 2 . 1 1 189 189 MET H H 189 6.991 6.991 7.701 -0.710 19854 1906 1 2 . 1 1 190 190 ASP N N 190 114.959 114.959 119.075 -4.116 19854 1907 1 2 . 1 1 190 190 ASP C C 190 175.686 175.686 175.821 -0.135 19854 1908 1 2 . 1 1 190 190 ASP CA C 190 51.065 51.065 56.098 -5.033 19854 1909 1 2 . 1 1 190 190 ASP CB C 190 41.695 41.695 40.437 1.258 19854 1910 1 2 . 1 1 190 190 ASP H H 190 7.210 7.210 8.639 -1.429 19854 1911 1 2 . 1 1 191 191 PRO C C 191 176.566 176.566 177.411 -0.845 19854 1912 1 2 . 1 1 191 191 PRO CA C 191 63.965 63.965 65.334 -1.369 19854 1913 1 2 . 1 1 191 191 PRO CB C 191 31.146 31.146 31.331 -0.185 19854 1914 1 2 . 1 1 192 192 ALA N N 192 109.513 109.513 119.452 -9.939 19854 1915 1 2 . 1 1 192 192 ALA CA C 192 53.993 53.993 53.907 0.086 19854 1916 1 2 . 1 1 192 192 ALA CB C 192 19.441 19.441 18.395 1.046 19854 1917 1 2 . 1 1 192 192 ALA H H 192 7.394 7.394 8.400 -1.006 19854 1918 1 2 . 1 1 193 193 LEU N N 193 119.009 119.009 118.333 0.676 19854 1919 1 2 . 1 1 193 193 LEU C C 193 175.979 175.979 177.361 -1.382 19854 1920 1 2 . 1 1 193 193 LEU CA C 193 56.336 56.336 55.800 0.536 19854 1921 1 2 . 1 1 193 193 LEU CB C 193 42.866 42.866 42.100 0.766 19854 1922 1 2 . 1 1 193 193 LEU H H 193 8.340 8.340 7.817 0.523 19854 1923 1 2 . 1 1 194 194 ALA N N 194 121.666 121.666 119.985 1.681 19854 1924 1 2 . 1 1 194 194 ALA C C 194 166.896 166.896 178.223 -11.327 19854 1925 1 2 . 1 1 194 194 ALA CA C 194 55.164 55.164 53.046 2.118 19854 1926 1 2 . 1 1 194 194 ALA CB C 194 16.513 16.513 19.367 -2.854 19854 1927 1 2 . 1 1 194 194 ALA H H 194 8.176 8.176 7.946 0.230 19854 1928 1 2 . 1 1 195 195 ALA N N 195 119.541 119.541 121.156 -1.615 19854 1929 1 2 . 1 1 195 195 ALA C C 195 173.928 173.928 179.234 -5.306 19854 1930 1 2 . 1 1 195 195 ALA CA C 195 57.507 57.507 54.268 3.239 19854 1931 1 2 . 1 1 195 195 ALA CB C 195 19.441 19.441 17.392 2.049 19854 1932 1 2 . 1 1 195 195 ALA H H 195 8.364 8.364 8.824 -0.460 19854 1933 1 2 . 1 1 196 196 GLN N N 196 107.322 107.322 119.217 -11.895 19854 1934 1 2 . 1 1 196 196 GLN C C 196 176.273 176.273 178.036 -1.763 19854 1935 1 2 . 1 1 196 196 GLN CA C 196 56.921 56.921 58.585 -1.664 19854 1936 1 2 . 1 1 196 196 GLN CB C 196 29.983 29.983 28.740 1.243 19854 1937 1 2 . 1 1 196 196 GLN H H 196 7.910 7.910 7.799 0.111 19854 1938 1 2 . 1 1 197 197 TYR N N 197 119.277 119.277 118.305 0.972 19854 1939 1 2 . 1 1 197 197 TYR C C 197 178.316 178.316 178.223 0.093 19854 1940 1 2 . 1 1 197 197 TYR CA C 197 56.343 56.343 60.712 -4.369 19854 1941 1 2 . 1 1 197 197 TYR CB C 197 43.453 43.453 37.816 5.637 19854 1942 1 2 . 1 1 197 197 TYR H H 197 8.180 8.180 8.245 -0.065 19854 1943 1 2 . 1 1 198 198 GLU N N 198 110.244 110.244 118.500 -8.256 19854 1944 1 2 . 1 1 198 198 GLU C C 198 176.273 176.273 178.503 -2.230 19854 1945 1 2 . 1 1 198 198 GLU CA C 198 53.407 53.407 59.693 -6.286 19854 1946 1 2 . 1 1 198 198 GLU CB C 198 30.568 30.568 29.342 1.226 19854 1947 1 2 . 1 1 198 198 GLU H H 198 7.523 7.523 7.966 -0.443 19854 1948 1 2 . 1 1 199 199 HIS N N 199 119.211 119.211 119.184 0.027 19854 1949 1 2 . 1 1 199 199 HIS C C 199 178.902 178.902 177.319 1.583 19854 1950 1 2 . 1 1 199 199 HIS CA C 199 58.687 58.687 59.738 -1.051 19854 1951 1 2 . 1 1 199 199 HIS CB C 199 34.957 34.957 29.657 5.300 19854 1952 1 2 . 1 1 199 199 HIS H H 199 8.258 8.258 7.706 0.552 19854 1953 1 2 . 1 1 200 200 ASP N N 200 124.722 124.722 120.089 4.633 19854 1954 1 2 . 1 1 200 200 ASP C C 200 176.705 176.705 178.877 -2.172 19854 1955 1 2 . 1 1 200 200 ASP CA C 200 58.687 58.687 57.244 1.443 19854 1956 1 2 . 1 1 200 200 ASP CB C 200 39.644 39.644 40.471 -0.827 19854 1957 1 2 . 1 1 200 200 ASP H H 200 8.086 8.086 7.739 0.347 19854 1958 1 2 . 1 1 201 201 LEU N N 201 116.353 116.353 120.362 -4.009 19854 1959 1 2 . 1 1 201 201 LEU C C 201 178.910 178.910 179.203 -0.293 19854 1960 1 2 . 1 1 201 201 LEU CA C 201 61.606 61.606 58.148 3.458 19854 1961 1 2 . 1 1 201 201 LEU CB C 201 41.109 41.109 41.764 -0.654 19854 1962 1 2 . 1 1 201 201 LEU H H 201 7.722 7.722 8.148 -0.426 19854 1963 1 2 . 1 1 202 202 GLU N N 202 118.080 118.080 118.705 -0.625 19854 1964 1 2 . 1 1 202 202 GLU C C 202 176.566 176.566 179.309 -2.743 19854 1965 1 2 . 1 1 202 202 GLU CA C 202 56.921 56.921 59.285 -2.364 19854 1966 1 2 . 1 1 202 202 GLU CB C 202 30.568 30.568 29.277 1.291 19854 1967 1 2 . 1 1 202 202 GLU H H 202 8.857 8.857 7.988 0.869 19854 1968 1 2 . 1 1 203 203 VAL N N 203 129.369 129.369 117.543 11.826 19854 1969 1 2 . 1 1 203 203 VAL C C 203 178.617 178.617 177.709 0.908 19854 1970 1 2 . 1 1 203 203 VAL CA C 203 64.534 64.534 66.030 -1.496 19854 1971 1 2 . 1 1 203 203 VAL CB C 203 27.640 27.640 30.590 -2.950 19854 1972 1 2 . 1 1 203 203 VAL H H 203 9.283 9.283 7.575 1.708 19854 1973 1 2 . 1 1 204 204 ALA N N 204 109.580 109.580 122.548 -12.968 19854 1974 1 2 . 1 1 204 204 ALA C C 204 176.859 176.859 179.680 -2.821 19854 1975 1 2 . 1 1 204 204 ALA CA C 204 54.579 54.579 54.588 -0.009 19854 1976 1 2 . 1 1 204 204 ALA CB C 204 18.270 18.270 18.530 -0.260 19854 1977 1 2 . 1 1 204 204 ALA H H 204 8.528 8.528 7.936 0.592 19854 1978 1 2 . 1 1 205 205 GLN N N 205 123.328 123.328 116.513 6.815 19854 1979 1 2 . 1 1 205 205 GLN C C 205 177.418 177.418 178.252 -0.834 19854 1980 1 2 . 1 1 205 205 GLN CA C 205 57.515 57.515 58.520 -1.005 19854 1981 1 2 . 1 1 205 205 GLN CB C 205 33.785 33.785 29.070 4.715 19854 1982 1 2 . 1 1 205 205 GLN H H 205 8.160 8.160 7.998 0.162 19854 1983 1 2 . 1 1 206 206 THR N N 206 120.271 120.271 114.533 5.738 19854 1984 1 2 . 1 1 206 206 THR C C 206 176.273 176.273 175.442 0.831 19854 1985 1 2 . 1 1 206 206 THR CA C 206 67.462 67.462 64.565 2.897 19854 1986 1 2 . 1 1 206 206 THR CB C 206 70.390 70.390 69.085 1.305 19854 1987 1 2 . 1 1 206 206 THR H H 206 7.585 7.585 7.812 -0.227 19854 1988 1 2 . 1 1 207 207 THR N N 207 111.970 111.970 119.039 -7.069 19854 1989 1 2 . 1 1 207 207 THR C C 207 176.566 176.566 173.812 2.754 19854 1990 1 2 . 1 1 207 207 THR CA C 207 64.534 64.534 63.356 1.178 19854 1991 1 2 . 1 1 207 207 THR CB C 207 72.733 72.733 69.525 3.208 19854 1992 1 2 . 1 1 207 207 THR H H 207 7.468 7.468 7.551 -0.083 19854 1993 1 2 . 1 1 208 208 ALA N N 208 115.623 115.623 129.289 -13.666 19854 1994 1 2 . 1 1 208 208 ALA C C 208 168.947 168.947 176.876 -7.929 19854 1995 1 2 . 1 1 208 208 ALA CA C 208 55.164 55.164 51.590 3.574 19854 1996 1 2 . 1 1 208 208 ALA CB C 208 22.369 22.369 19.617 2.752 19854 1997 1 2 . 1 1 208 208 ALA H H 208 7.390 7.390 8.436 -1.046 19854 1998 1 2 . 1 1 209 209 LEU N N 209 117.814 117.814 123.844 -6.030 19854 1999 1 2 . 1 1 209 209 LEU C C 209 176.273 176.273 175.029 1.244 19854 2000 1 2 . 1 1 209 209 LEU CA C 209 58.678 58.678 51.684 6.994 19854 2001 1 2 . 1 1 209 209 LEU CB C 209 46.380 46.380 43.237 3.143 19854 2002 1 2 . 1 1 209 209 LEU H H 209 7.652 7.652 8.228 -0.576 19854 2003 1 2 . 1 1 210 210 PRO C C 210 176.566 176.566 175.251 1.315 19854 2004 1 2 . 1 1 210 210 PRO CA C 210 63.086 63.086 62.460 0.626 19854 2005 1 2 . 1 1 210 210 PRO CB C 210 31.146 31.146 30.862 0.284 19854 2006 1 2 . 1 1 211 211 ASP N N 211 122.863 122.863 121.140 1.723 19854 2007 1 2 . 1 1 211 211 ASP C C 211 175.686 175.686 176.291 -0.605 19854 2008 1 2 . 1 1 211 211 ASP CA C 211 56.343 56.343 53.413 2.929 19854 2009 1 2 . 1 1 211 211 ASP CB C 211 41.402 41.402 41.625 -0.223 19854 2010 1 2 . 1 1 211 211 ASP H H 211 8.360 8.360 8.002 0.358 19854 2011 1 2 . 1 1 212 212 GLU N N 212 131.162 131.162 126.865 4.297 19854 2012 1 2 . 1 1 212 212 GLU C C 212 176.273 176.273 176.128 0.145 19854 2013 1 2 . 1 1 212 212 GLU CA C 212 55.164 55.164 57.999 -2.835 19854 2014 1 2 . 1 1 212 212 GLU CB C 212 30.568 30.568 30.706 -0.138 19854 2015 1 2 . 1 1 212 212 GLU H H 212 8.399 8.399 8.570 -0.171 19854 2016 1 2 . 1 1 213 213 ASP N N 213 122.797 122.797 113.928 8.869 19854 2017 1 2 . 1 1 213 213 ASP C C 213 177.152 177.152 176.716 0.436 19854 2018 1 2 . 1 1 213 213 ASP CA C 213 61.914 61.914 53.651 8.263 19854 2019 1 2 . 1 1 213 213 ASP CB C 213 49.607 49.607 40.266 9.341 19854 2020 1 2 . 1 1 213 213 ASP H H 213 8.168 8.168 7.878 0.290 19854 2021 1 2 . 1 1 214 214 ASP N N 214 112.369 112.369 121.639 -9.270 19854 2022 1 2 . 1 1 214 214 ASP C C 214 178.910 178.910 176.816 2.094 19854 2023 1 2 . 1 1 214 214 ASP CA C 214 54.579 54.579 57.477 -2.898 19854 2024 1 2 . 1 1 214 214 ASP CB C 214 39.353 39.353 40.466 -1.113 19854 2025 1 2 . 1 1 214 214 ASP H H 214 7.464 7.464 8.300 -0.836 19854 2026 1 2 . 1 1 215 215 ASP N N 215 127.244 127.244 119.383 7.861 19854 2027 1 2 . 1 1 215 215 ASP C C 215 176.859 176.859 176.947 -0.088 19854 2028 1 2 . 1 1 215 215 ASP CA C 215 54.579 54.579 56.206 -1.627 19854 2029 1 2 . 1 1 215 215 ASP CB C 215 40.524 40.524 41.566 -1.042 19854 2030 1 2 . 1 1 215 215 ASP H H 215 8.301 8.301 8.170 0.131 19854 2031 1 3 . 1 1 2 2 ALA N N 2 131.228 131.228 123.692 7.536 19854 2032 1 3 . 1 1 2 2 ALA C C 2 187.031 187.031 179.385 7.646 19854 2033 1 3 . 1 1 2 2 ALA CA C 2 53.407 53.407 55.145 -1.738 19854 2034 1 3 . 1 1 2 2 ALA CB C 2 20.027 20.027 18.230 1.798 19854 2035 1 3 . 1 1 2 2 ALA H H 2 10.644 10.644 8.361 2.283 19854 2036 1 3 . 1 1 3 3 ALA N N 3 124.521 124.521 120.710 3.811 19854 2037 1 3 . 1 1 3 3 ALA C C 3 176.566 176.566 179.325 -2.759 19854 2038 1 3 . 1 1 3 3 ALA CA C 3 49.894 49.894 54.522 -4.628 19854 2039 1 3 . 1 1 3 3 ALA CB C 3 18.270 18.270 18.100 0.170 19854 2040 1 3 . 1 1 3 3 ALA H H 3 8.669 8.669 8.009 0.660 19854 2041 1 3 . 1 1 4 4 GLN N N 4 118.080 118.080 117.008 1.072 19854 2042 1 3 . 1 1 4 4 GLN C C 4 176.273 176.273 177.101 -0.828 19854 2043 1 3 . 1 1 4 4 GLN CA C 4 54.579 54.579 57.022 -2.443 19854 2044 1 3 . 1 1 4 4 GLN CB C 4 27.054 27.054 29.085 -2.031 19854 2045 1 3 . 1 1 4 4 GLN H H 4 8.919 8.919 8.055 0.864 19854 2046 1 3 . 1 1 5 5 GLY N N 5 121.002 121.002 105.923 15.079 19854 2047 1 3 . 1 1 5 5 GLY C C 5 181.877 181.877 173.641 8.236 19854 2048 1 3 . 1 1 5 5 GLY CA C 5 45.794 45.794 44.936 0.858 19854 2049 1 3 . 1 1 5 5 GLY H H 5 8.082 8.082 8.055 0.027 19854 2050 1 3 . 1 1 6 6 GLU N N 6 129.435 129.435 122.034 7.401 19854 2051 1 3 . 1 1 6 6 GLU C C 6 176.566 176.566 174.880 1.686 19854 2052 1 3 . 1 1 6 6 GLU CA C 6 56.336 56.336 52.955 3.381 19854 2053 1 3 . 1 1 6 6 GLU CB C 6 28.811 28.811 30.476 -1.665 19854 2054 1 3 . 1 1 6 6 GLU H H 6 9.267 9.267 7.815 1.452 19854 2055 1 3 . 1 1 7 7 PRO C C 7 176.566 176.566 176.590 -0.024 19854 2056 1 3 . 1 1 7 7 PRO CA C 7 63.672 63.672 65.318 -1.646 19854 2057 1 3 . 1 1 7 7 PRO CB C 7 31.146 31.146 32.148 -1.002 19854 2058 1 3 . 1 1 8 8 GLN N N 8 112.502 112.502 114.717 -2.215 19854 2059 1 3 . 1 1 8 8 GLN C C 8 177.445 177.445 175.575 1.870 19854 2060 1 3 . 1 1 8 8 GLN CA C 8 50.479 50.479 56.076 -5.597 19854 2061 1 3 . 1 1 8 8 GLN CB C 8 28.811 28.811 31.166 -2.355 19854 2062 1 3 . 1 1 8 8 GLN H H 8 6.220 6.220 8.183 -1.963 19854 2063 1 3 . 1 1 9 9 VAL N N 9 117.416 117.416 119.074 -1.658 19854 2064 1 3 . 1 1 9 9 VAL C C 9 178.324 178.324 173.810 4.514 19854 2065 1 3 . 1 1 9 9 VAL CA C 9 63.363 63.363 60.884 2.479 19854 2066 1 3 . 1 1 9 9 VAL CB C 9 34.668 34.668 34.266 0.402 19854 2067 1 3 . 1 1 9 9 VAL H H 9 6.561 6.561 7.852 -1.291 19854 2068 1 3 . 1 1 10 10 GLN N N 10 113.896 113.896 123.303 -9.407 19854 2069 1 3 . 1 1 10 10 GLN C C 10 176.273 176.273 174.426 1.847 19854 2070 1 3 . 1 1 10 10 GLN CA C 10 55.164 55.164 53.997 1.167 19854 2071 1 3 . 1 1 10 10 GLN CB C 10 28.226 28.226 32.229 -4.003 19854 2072 1 3 . 1 1 10 10 GLN H H 10 7.847 7.847 8.130 -0.283 19854 2073 1 3 . 1 1 11 11 PHE N N 11 118.744 118.744 124.408 -5.664 19854 2074 1 3 . 1 1 11 11 PHE C C 11 176.566 176.566 174.669 1.897 19854 2075 1 3 . 1 1 11 11 PHE CA C 11 59.849 59.849 56.503 3.346 19854 2076 1 3 . 1 1 11 11 PHE CB C 11 41.109 41.109 42.177 -1.068 19854 2077 1 3 . 1 1 11 11 PHE H H 11 8.262 8.262 9.115 -0.853 19854 2078 1 3 . 1 1 12 12 LYS N N 12 129.437 129.437 126.037 3.400 19854 2079 1 3 . 1 1 12 12 LYS C C 12 178.609 178.609 174.810 3.799 19854 2080 1 3 . 1 1 12 12 LYS CA C 12 57.808 57.808 55.775 2.033 19854 2081 1 3 . 1 1 12 12 LYS H H 12 10.015 10.015 8.782 1.233 19854 2082 1 3 . 1 1 13 13 LEU N N 13 112.103 112.103 129.774 -17.671 19854 2083 1 3 . 1 1 13 13 LEU C C 13 177.738 177.738 174.538 3.200 19854 2084 1 3 . 1 1 13 13 LEU CA C 13 54.579 54.579 53.567 1.012 19854 2085 1 3 . 1 1 13 13 LEU CB C 13 42.866 42.866 45.576 -2.710 19854 2086 1 3 . 1 1 13 13 LEU H H 13 6.905 6.905 8.810 -1.905 19854 2087 1 3 . 1 1 14 14 VAL N N 14 127.310 127.310 127.691 -0.381 19854 2088 1 3 . 1 1 14 14 VAL C C 14 175.393 175.393 174.151 1.242 19854 2089 1 3 . 1 1 14 14 VAL CA C 14 70.976 70.976 61.862 9.114 19854 2090 1 3 . 1 1 14 14 VAL CB C 14 28.811 28.811 33.325 -4.514 19854 2091 1 3 . 1 1 14 14 VAL H H 14 8.305 8.305 8.774 -0.469 19854 2092 1 3 . 1 1 15 15 LEU N N 15 128.640 128.640 130.957 -2.317 19854 2093 1 3 . 1 1 15 15 LEU C C 15 177.730 177.730 175.044 2.686 19854 2094 1 3 . 1 1 15 15 LEU CA C 15 55.758 55.758 53.293 2.465 19854 2095 1 3 . 1 1 15 15 LEU H H 15 7.718 7.718 9.019 -1.301 19854 2096 1 3 . 1 1 16 16 VAL N N 16 121.267 121.267 121.609 -0.342 19854 2097 1 3 . 1 1 16 16 VAL C C 16 178.324 178.324 174.283 4.041 19854 2098 1 3 . 1 1 16 16 VAL CA C 16 63.363 63.363 58.641 4.722 19854 2099 1 3 . 1 1 16 16 VAL CB C 16 35.839 35.839 35.182 0.657 19854 2100 1 3 . 1 1 16 16 VAL H H 16 8.935 8.935 8.864 0.071 19854 2101 1 3 . 1 1 17 17 GLY N N 17 127.908 127.908 106.898 21.010 19854 2102 1 3 . 1 1 17 17 GLY C C 17 174.514 174.514 172.745 1.769 19854 2103 1 3 . 1 1 17 17 GLY CA C 17 42.281 42.281 44.488 -2.207 19854 2104 1 3 . 1 1 17 17 GLY H H 17 9.682 9.682 6.749 2.933 19854 2105 1 3 . 1 1 18 18 ASP N N 18 125.054 125.054 120.733 4.321 19854 2106 1 3 . 1 1 18 18 ASP C C 18 176.851 176.851 177.601 -0.750 19854 2107 1 3 . 1 1 18 18 ASP CA C 18 57.515 57.515 54.678 2.837 19854 2108 1 3 . 1 1 18 18 ASP CB C 18 46.090 46.090 41.867 4.223 19854 2109 1 3 . 1 1 18 18 ASP H H 18 8.282 8.282 8.303 -0.021 19854 2110 1 3 . 1 1 19 19 GLY N N 19 120.670 120.670 106.073 14.597 19854 2111 1 3 . 1 1 19 19 GLY C C 19 178.324 178.324 175.012 3.312 19854 2112 1 3 . 1 1 19 19 GLY CA C 19 42.281 42.281 45.535 -3.253 19854 2113 1 3 . 1 1 19 19 GLY H H 19 8.825 8.825 8.554 0.271 19854 2114 1 3 . 1 1 20 20 GLY N N 20 129.369 129.369 112.522 16.847 19854 2115 1 3 . 1 1 20 20 GLY C C 20 174.221 174.221 175.560 -1.339 19854 2116 1 3 . 1 1 20 20 GLY CA C 20 41.695 41.695 45.760 -4.065 19854 2117 1 3 . 1 1 20 20 GLY H H 20 8.477 8.477 8.424 0.053 19854 2118 1 3 . 1 1 21 21 THR N N 21 122.199 122.199 114.007 8.192 19854 2119 1 3 . 1 1 21 21 THR C C 21 171.291 171.291 175.130 -3.839 19854 2120 1 3 . 1 1 21 21 THR CA C 21 61.914 61.914 64.616 -2.702 19854 2121 1 3 . 1 1 21 21 THR CB C 21 65.137 65.137 69.204 -4.067 19854 2122 1 3 . 1 1 21 21 THR H H 21 8.059 8.059 7.595 0.464 19854 2123 1 3 . 1 1 22 22 GLY N N 22 112.369 112.369 108.102 4.267 19854 2124 1 3 . 1 1 22 22 GLY C C 22 184.807 184.807 175.489 9.318 19854 2125 1 3 . 1 1 22 22 GLY CA C 22 45.209 45.209 45.064 0.145 19854 2126 1 3 . 1 1 22 22 GLY H H 22 6.772 6.772 8.276 -1.504 19854 2127 1 3 . 1 1 23 23 LYS N N 23 122.066 122.066 120.590 1.476 19854 2128 1 3 . 1 1 23 23 LYS C C 23 178.589 178.589 178.220 0.369 19854 2129 1 3 . 1 1 23 23 LYS CA C 23 58.101 58.101 59.915 -1.814 19854 2130 1 3 . 1 1 23 23 LYS CB C 23 40.230 40.230 32.412 7.818 19854 2131 1 3 . 1 1 23 23 LYS H H 23 7.441 7.441 7.592 -0.151 19854 2132 1 3 . 1 1 24 24 THR N N 24 114.627 114.627 114.097 0.530 19854 2133 1 3 . 1 1 24 24 THR C C 24 178.324 178.324 176.793 1.531 19854 2134 1 3 . 1 1 24 24 THR CA C 24 62.192 62.192 67.159 -4.967 19854 2135 1 3 . 1 1 24 24 THR CB C 24 71.562 71.562 68.149 3.413 19854 2136 1 3 . 1 1 24 24 THR H H 24 8.469 8.469 8.524 -0.055 19854 2137 1 3 . 1 1 25 25 THR N N 25 110.377 110.377 119.460 -9.083 19854 2138 1 3 . 1 1 25 25 THR C C 25 178.324 178.324 176.162 2.162 19854 2139 1 3 . 1 1 25 25 THR CA C 25 64.534 64.534 67.288 -2.754 19854 2140 1 3 . 1 1 25 25 THR CB C 25 71.562 71.562 68.460 3.102 19854 2141 1 3 . 1 1 25 25 THR H H 25 8.415 8.415 8.184 0.231 19854 2142 1 3 . 1 1 26 26 PHE N N 26 114.295 114.295 123.166 -8.871 19854 2143 1 3 . 1 1 26 26 PHE C C 26 174.514 174.514 176.836 -2.322 19854 2144 1 3 . 1 1 26 26 PHE CA C 26 53.407 53.407 61.957 -8.550 19854 2145 1 3 . 1 1 26 26 PHE CB C 26 40.524 40.524 38.921 1.603 19854 2146 1 3 . 1 1 26 26 PHE H H 26 7.707 7.707 8.473 -0.766 19854 2147 1 3 . 1 1 27 27 VAL N N 27 123.525 123.525 119.787 3.738 19854 2148 1 3 . 1 1 27 27 VAL C C 27 178.031 178.031 177.599 0.432 19854 2149 1 3 . 1 1 27 27 VAL CA C 27 67.462 67.462 67.202 0.260 19854 2150 1 3 . 1 1 27 27 VAL CB C 27 29.397 29.397 31.486 -2.089 19854 2151 1 3 . 1 1 27 27 VAL H H 27 6.967 6.967 8.227 -1.260 19854 2152 1 3 . 1 1 28 28 LYS N N 28 114.228 114.228 119.903 -5.675 19854 2153 1 3 . 1 1 28 28 LYS C C 28 176.566 176.566 178.297 -1.731 19854 2154 1 3 . 1 1 28 28 LYS CA C 28 58.092 58.092 59.685 -1.593 19854 2155 1 3 . 1 1 28 28 LYS CB C 28 34.082 34.082 32.134 1.948 19854 2156 1 3 . 1 1 28 28 LYS H H 28 7.429 7.429 8.187 -0.758 19854 2157 1 3 . 1 1 29 29 ARG N N 29 112.037 112.037 119.307 -7.270 19854 2158 1 3 . 1 1 29 29 ARG C C 29 174.221 174.221 179.068 -4.847 19854 2159 1 3 . 1 1 29 29 ARG CA C 29 72.147 72.147 58.676 13.471 19854 2160 1 3 . 1 1 29 29 ARG CB C 29 37.596 37.596 29.378 8.218 19854 2161 1 3 . 1 1 29 29 ARG H H 29 6.803 6.803 7.803 -1.000 19854 2162 1 3 . 1 1 30 30 HIS N N 30 122.396 122.396 118.042 4.354 19854 2163 1 3 . 1 1 30 30 HIS C C 30 172.170 172.170 177.242 -5.072 19854 2164 1 3 . 1 1 30 30 HIS CA C 30 51.651 51.651 58.902 -7.251 19854 2165 1 3 . 1 1 30 30 HIS CB C 30 30.568 30.568 29.619 0.949 19854 2166 1 3 . 1 1 30 30 HIS H H 30 7.644 7.644 7.506 0.138 19854 2167 1 3 . 1 1 31 31 LEU N N 31 110.377 110.377 119.435 -9.058 19854 2168 1 3 . 1 1 31 31 LEU C C 31 178.031 178.031 178.682 -0.651 19854 2169 1 3 . 1 1 31 31 LEU CA C 31 55.164 55.164 57.565 -2.401 19854 2170 1 3 . 1 1 31 31 LEU CB C 31 42.281 42.281 42.182 0.099 19854 2171 1 3 . 1 1 31 31 LEU H H 31 7.894 7.894 8.147 -0.253 19854 2172 1 3 . 1 1 32 32 THR N N 32 121.468 121.468 106.138 15.330 19854 2173 1 3 . 1 1 32 32 THR C C 32 170.705 170.705 175.551 -4.846 19854 2174 1 3 . 1 1 32 32 THR CA C 32 63.668 63.668 61.806 1.861 19854 2175 1 3 . 1 1 32 32 THR CB C 32 75.679 75.679 70.745 4.934 19854 2176 1 3 . 1 1 32 32 THR H H 32 8.372 8.372 8.216 0.156 19854 2177 1 3 . 1 1 33 33 GLY N N 33 127.841 127.841 109.970 17.871 19854 2178 1 3 . 1 1 33 33 GLY C C 33 161.914 161.914 174.126 -12.212 19854 2179 1 3 . 1 1 33 33 GLY CA C 33 42.866 42.866 44.716 -1.850 19854 2180 1 3 . 1 1 33 33 GLY H H 33 9.662 9.662 7.724 1.938 19854 2181 1 3 . 1 1 34 34 GLU N N 34 120.871 120.871 120.642 0.229 19854 2182 1 3 . 1 1 34 34 GLU C C 34 174.508 174.508 175.054 -0.546 19854 2183 1 3 . 1 1 34 34 GLU CA C 34 58.101 58.101 55.436 2.665 19854 2184 1 3 . 1 1 34 34 GLU CB C 34 34.371 34.371 30.796 3.575 19854 2185 1 3 . 1 1 34 34 GLU H H 34 8.211 8.211 7.474 0.737 19854 2186 1 3 . 1 1 35 35 PHE N N 35 111.838 111.838 118.695 -6.857 19854 2187 1 3 . 1 1 35 35 PHE C C 35 174.221 174.221 175.006 -0.785 19854 2188 1 3 . 1 1 35 35 PHE CA C 35 49.308 49.308 56.810 -7.502 19854 2189 1 3 . 1 1 35 35 PHE CB C 35 41.695 41.695 40.605 1.091 19854 2190 1 3 . 1 1 35 35 PHE H H 35 6.772 6.772 8.536 -1.764 19854 2191 1 3 . 1 1 36 36 GLU N N 36 120.672 120.672 126.031 -5.359 19854 2192 1 3 . 1 1 36 36 GLU C C 36 175.686 175.686 175.945 -0.259 19854 2193 1 3 . 1 1 36 36 GLU CA C 36 58.980 58.980 55.499 3.481 19854 2194 1 3 . 1 1 36 36 GLU CB C 36 48.140 48.140 29.987 18.153 19854 2195 1 3 . 1 1 36 36 GLU H H 36 8.293 8.293 8.663 -0.370 19854 2196 1 3 . 1 1 37 37 LYS N N 37 118.810 118.810 126.430 -7.620 19854 2197 1 3 . 1 1 37 37 LYS C C 37 172.756 172.756 177.230 -4.474 19854 2198 1 3 . 1 1 37 37 LYS CA C 37 48.137 48.137 57.215 -9.078 19854 2199 1 3 . 1 1 37 37 LYS CB C 37 37.010 37.010 33.442 3.568 19854 2200 1 3 . 1 1 37 37 LYS H H 37 8.509 8.509 8.642 -0.133 19854 2201 1 3 . 1 1 38 38 LYS N N 38 108.052 108.052 120.545 -12.493 19854 2202 1 3 . 1 1 38 38 LYS C C 38 176.273 176.273 175.821 0.452 19854 2203 1 3 . 1 1 38 38 LYS CA C 38 59.849 59.849 55.934 3.914 19854 2204 1 3 . 1 1 38 38 LYS CB C 38 34.668 34.668 32.924 1.744 19854 2205 1 3 . 1 1 38 38 LYS H H 38 7.715 7.715 7.685 0.030 19854 2206 1 3 . 1 1 39 39 TYR N N 39 108.650 108.650 123.706 -15.056 19854 2207 1 3 . 1 1 39 39 TYR C C 39 175.686 175.686 175.645 0.041 19854 2208 1 3 . 1 1 39 39 TYR CA C 39 61.020 61.020 58.118 2.901 19854 2209 1 3 . 1 1 39 39 TYR CB C 39 36.424 36.424 39.141 -2.717 19854 2210 1 3 . 1 1 39 39 TYR H H 39 7.362 7.362 8.581 -1.219 19854 2211 1 3 . 1 1 40 40 VAL N N 40 117.947 117.947 124.902 -6.955 19854 2212 1 3 . 1 1 40 40 VAL C C 40 175.393 175.393 175.595 -0.202 19854 2213 1 3 . 1 1 40 40 VAL CA C 40 61.020 61.020 61.528 -0.507 19854 2214 1 3 . 1 1 40 40 VAL CB C 40 31.154 31.154 33.468 -2.314 19854 2215 1 3 . 1 1 40 40 VAL H H 40 8.442 8.442 8.557 -0.115 19854 2216 1 3 . 1 1 42 42 THR N N 42 117.150 117.150 116.982 0.168 19854 2217 1 3 . 1 1 42 42 THR C C 42 178.910 178.910 173.979 4.931 19854 2218 1 3 . 1 1 42 42 THR CA C 42 60.435 60.435 62.595 -2.160 19854 2219 1 3 . 1 1 42 42 THR CB C 42 70.390 70.390 69.780 0.610 19854 2220 1 3 . 1 1 42 42 THR H H 42 8.192 8.192 8.336 -0.144 19854 2221 1 3 . 1 1 43 43 LEU N N 43 119.209 119.209 128.086 -8.877 19854 2222 1 3 . 1 1 43 43 LEU C C 43 174.807 174.807 177.929 -3.122 19854 2223 1 3 . 1 1 43 43 LEU CA C 43 57.507 57.507 54.234 3.273 19854 2224 1 3 . 1 1 43 43 LEU CB C 43 42.866 42.866 42.742 0.124 19854 2225 1 3 . 1 1 43 43 LEU H H 43 9.260 9.260 8.470 0.790 19854 2226 1 3 . 1 1 44 44 GLY N N 44 114.361 114.361 114.383 -0.022 19854 2227 1 3 . 1 1 44 44 GLY C C 44 178.910 178.910 172.730 6.180 19854 2228 1 3 . 1 1 44 44 GLY CA C 44 54.579 54.579 46.015 8.564 19854 2229 1 3 . 1 1 44 44 GLY H H 44 6.979 6.979 8.566 -1.587 19854 2230 1 3 . 1 1 45 45 VAL N N 45 110.244 110.244 123.962 -13.718 19854 2231 1 3 . 1 1 45 45 VAL C C 45 174.807 174.807 174.440 0.367 19854 2232 1 3 . 1 1 45 45 VAL CA C 45 63.363 63.363 59.878 3.485 19854 2233 1 3 . 1 1 45 45 VAL CB C 45 17.099 17.099 34.898 -17.799 19854 2234 1 3 . 1 1 45 45 VAL H H 45 8.309 8.309 8.156 0.153 19854 2235 1 3 . 1 1 46 46 GLU N N 46 130.365 130.365 129.054 1.311 19854 2236 1 3 . 1 1 46 46 GLU C C 46 176.859 176.859 174.431 2.428 19854 2237 1 3 . 1 1 46 46 GLU CA C 46 55.164 55.164 54.703 0.461 19854 2238 1 3 . 1 1 46 46 GLU CB C 46 32.325 32.325 32.322 0.003 19854 2239 1 3 . 1 1 46 46 GLU H H 46 9.741 9.741 8.858 0.883 19854 2240 1 3 . 1 1 47 47 VAL N N 47 125.254 125.254 124.929 0.325 19854 2241 1 3 . 1 1 47 47 VAL C C 47 175.661 175.661 175.783 -0.122 19854 2242 1 3 . 1 1 47 47 VAL CA C 47 63.375 63.375 61.524 1.851 19854 2243 1 3 . 1 1 47 47 VAL CB C 47 37.300 37.300 32.283 5.017 19854 2244 1 3 . 1 1 47 47 VAL H H 47 8.250 8.250 8.299 -0.049 19854 2245 1 3 . 1 1 48 48 HIS N N 48 129.236 129.236 127.732 1.504 19854 2246 1 3 . 1 1 48 48 HIS C C 48 169.240 169.240 173.209 -3.969 19854 2247 1 3 . 1 1 48 48 HIS CA C 48 49.894 49.894 53.543 -3.649 19854 2248 1 3 . 1 1 48 48 HIS CB C 48 27.640 27.640 32.091 -4.451 19854 2249 1 3 . 1 1 48 48 HIS H H 48 10.390 10.390 9.307 1.083 19854 2250 1 3 . 1 1 49 49 PRO C C 49 176.273 176.273 175.688 0.585 19854 2251 1 3 . 1 1 49 49 PRO CA C 49 62.500 62.500 62.532 -0.032 19854 2252 1 3 . 1 1 49 49 PRO CB C 49 29.974 29.974 32.420 -2.446 19854 2253 1 3 . 1 1 50 50 LEU N N 50 119.408 119.408 127.305 -7.897 19854 2254 1 3 . 1 1 50 50 LEU C C 50 177.445 177.445 174.556 2.889 19854 2255 1 3 . 1 1 50 50 LEU CA C 50 59.264 59.264 54.557 4.707 19854 2256 1 3 . 1 1 50 50 LEU CB C 50 42.281 42.281 45.631 -3.350 19854 2257 1 3 . 1 1 50 50 LEU H H 50 7.492 7.492 9.070 -1.578 19854 2258 1 3 . 1 1 51 51 VAL N N 51 117.947 117.947 126.277 -8.330 19854 2259 1 3 . 1 1 51 51 VAL C C 51 174.514 174.514 175.439 -0.925 19854 2260 1 3 . 1 1 51 51 VAL CA C 51 64.534 64.534 61.188 3.346 19854 2261 1 3 . 1 1 51 51 VAL CB C 51 37.010 37.010 33.297 3.713 19854 2262 1 3 . 1 1 51 51 VAL H H 51 7.715 7.715 8.111 -0.396 19854 2263 1 3 . 1 1 52 52 PHE N N 52 124.853 124.853 126.175 -1.322 19854 2264 1 3 . 1 1 52 52 PHE C C 52 175.100 175.100 174.212 0.888 19854 2265 1 3 . 1 1 52 52 PHE CA C 52 56.336 56.336 56.708 -0.372 19854 2266 1 3 . 1 1 52 52 PHE CB C 52 39.938 39.938 42.875 -2.937 19854 2267 1 3 . 1 1 52 52 PHE H H 52 8.935 8.935 9.172 -0.237 19854 2268 1 3 . 1 1 53 53 HIS N N 53 120.603 120.603 122.123 -1.520 19854 2269 1 3 . 1 1 53 53 HIS C C 53 170.119 170.119 175.004 -4.885 19854 2270 1 3 . 1 1 53 53 HIS CA C 53 55.164 55.164 55.318 -0.154 19854 2271 1 3 . 1 1 53 53 HIS CB C 53 30.568 30.568 31.253 -0.685 19854 2272 1 3 . 1 1 53 53 HIS H H 53 8.356 8.356 9.319 -0.963 19854 2273 1 3 . 1 1 54 54 THR N N 54 112.634 112.634 115.768 -3.134 19854 2274 1 3 . 1 1 54 54 THR C C 54 178.910 178.910 176.234 2.676 19854 2275 1 3 . 1 1 54 54 THR CA C 54 63.363 63.363 59.339 4.024 19854 2276 1 3 . 1 1 54 54 THR CB C 54 72.733 72.733 71.647 1.086 19854 2277 1 3 . 1 1 54 54 THR H H 54 7.574 7.574 8.399 -0.825 19854 2278 1 3 . 1 1 55 55 ASN N N 55 131.095 131.095 120.200 10.895 19854 2279 1 3 . 1 1 55 55 ASN C C 55 176.273 176.273 176.256 0.017 19854 2280 1 3 . 1 1 55 55 ASN CA C 55 51.065 51.065 55.650 -4.585 19854 2281 1 3 . 1 1 55 55 ASN CB C 55 37.010 37.010 38.342 -1.332 19854 2282 1 3 . 1 1 55 55 ASN H H 55 10.187 10.187 8.574 1.613 19854 2283 1 3 . 1 1 56 56 ARG N N 56 122.064 122.064 118.029 4.035 19854 2284 1 3 . 1 1 56 56 ARG C C 56 175.100 175.100 176.262 -1.162 19854 2285 1 3 . 1 1 56 56 ARG CA C 56 61.606 61.606 55.235 6.371 19854 2286 1 3 . 1 1 56 56 ARG CB C 56 32.911 32.911 29.981 2.930 19854 2287 1 3 . 1 1 56 56 ARG H H 56 7.433 7.433 7.597 -0.164 19854 2288 1 3 . 1 1 57 57 GLY N N 57 127.709 127.709 109.339 18.370 19854 2289 1 3 . 1 1 57 57 GLY C C 57 175.979 175.979 171.983 3.996 19854 2290 1 3 . 1 1 57 57 GLY CA C 57 42.281 42.281 44.351 -2.070 19854 2291 1 3 . 1 1 57 57 GLY H H 57 9.373 9.373 7.797 1.576 19854 2292 1 3 . 1 1 58 58 PRO C C 58 177.152 177.152 176.262 0.890 19854 2293 1 3 . 1 1 58 58 PRO CA C 58 65.137 65.137 62.882 2.255 19854 2294 1 3 . 1 1 58 58 PRO CB C 58 29.095 29.095 32.297 -3.202 19854 2295 1 3 . 1 1 59 59 ILE N N 59 128.638 128.638 114.997 13.641 19854 2296 1 3 . 1 1 59 59 ILE C C 59 175.979 175.979 173.874 2.105 19854 2297 1 3 . 1 1 59 59 ILE CA C 59 65.120 65.120 59.361 5.759 19854 2298 1 3 . 1 1 59 59 ILE CB C 59 40.524 40.524 42.359 -1.835 19854 2299 1 3 . 1 1 59 59 ILE H H 59 8.794 8.794 8.893 -0.099 19854 2300 1 3 . 1 1 60 60 LYS N N 60 127.711 127.711 123.972 3.739 19854 2301 1 3 . 1 1 60 60 LYS C C 60 178.902 178.902 174.842 4.060 19854 2302 1 3 . 1 1 60 60 LYS CA C 60 74.293 74.293 54.442 19.851 19854 2303 1 3 . 1 1 60 60 LYS CB C 60 32.027 32.027 36.462 -4.435 19854 2304 1 3 . 1 1 60 60 LYS H H 60 8.024 8.024 8.605 -0.581 19854 2305 1 3 . 1 1 61 61 PHE N N 61 120.670 120.670 124.810 -4.140 19854 2306 1 3 . 1 1 61 61 PHE C C 61 175.393 175.393 175.122 0.271 19854 2307 1 3 . 1 1 61 61 PHE CA C 61 57.507 57.507 57.104 0.403 19854 2308 1 3 . 1 1 61 61 PHE CB C 61 41.109 41.109 40.928 0.180 19854 2309 1 3 . 1 1 61 61 PHE H H 61 7.515 7.515 9.625 -2.110 19854 2310 1 3 . 1 1 62 62 ASN N N 62 124.789 124.789 123.999 0.790 19854 2311 1 3 . 1 1 62 62 ASN C C 62 173.336 173.336 174.609 -1.273 19854 2312 1 3 . 1 1 62 62 ASN CA C 62 53.121 53.121 52.191 0.930 19854 2313 1 3 . 1 1 62 62 ASN CB C 62 41.695 41.695 39.218 2.477 19854 2314 1 3 . 1 1 62 62 ASN H H 62 8.325 8.325 9.276 -0.951 19854 2315 1 3 . 1 1 63 63 VAL N N 63 106.127 106.127 127.468 -21.341 19854 2316 1 3 . 1 1 63 63 VAL C C 63 175.100 175.100 175.457 -0.357 19854 2317 1 3 . 1 1 63 63 VAL CA C 63 61.020 61.020 63.091 -2.071 19854 2318 1 3 . 1 1 63 63 VAL CB C 63 31.154 31.154 32.714 -1.560 19854 2319 1 3 . 1 1 63 63 VAL H H 63 8.113 8.113 9.075 -0.962 19854 2320 1 3 . 1 1 64 64 TRP N N 64 129.302 129.302 129.689 -0.387 19854 2321 1 3 . 1 1 64 64 TRP C C 64 177.152 177.152 175.324 1.828 19854 2322 1 3 . 1 1 64 64 TRP CA C 64 59.264 59.264 54.512 4.752 19854 2323 1 3 . 1 1 64 64 TRP CB C 64 29.397 29.397 29.692 -0.295 19854 2324 1 3 . 1 1 64 64 TRP H H 64 8.970 8.970 9.559 -0.589 19854 2325 1 3 . 1 1 65 65 ASP N N 65 119.607 119.607 126.189 -6.582 19854 2326 1 3 . 1 1 65 65 ASP C C 65 174.514 174.514 175.682 -1.168 19854 2327 1 3 . 1 1 65 65 ASP CA C 65 55.164 55.164 53.286 1.878 19854 2328 1 3 . 1 1 65 65 ASP CB C 65 41.109 41.109 42.978 -1.869 19854 2329 1 3 . 1 1 65 65 ASP H H 65 8.638 8.638 9.134 -0.496 19854 2330 1 3 . 1 1 66 66 THR N N 66 122.463 122.463 117.420 5.043 19854 2331 1 3 . 1 1 66 66 THR C C 66 178.617 178.617 174.262 4.355 19854 2332 1 3 . 1 1 66 66 THR CA C 66 68.048 68.048 59.588 8.460 19854 2333 1 3 . 1 1 66 66 THR CB C 66 71.562 71.562 71.025 0.537 19854 2334 1 3 . 1 1 66 66 THR H H 66 8.293 8.293 8.166 0.127 19854 2335 1 3 . 1 1 67 67 ALA N N 67 104.865 104.865 123.049 -18.184 19854 2336 1 3 . 1 1 67 67 ALA C C 67 177.738 177.738 177.958 -0.220 19854 2337 1 3 . 1 1 67 67 ALA CA C 67 48.722 48.722 51.549 -2.827 19854 2338 1 3 . 1 1 67 67 ALA CB C 67 14.171 14.171 20.087 -5.916 19854 2339 1 3 . 1 1 67 67 ALA H H 67 8.657 8.657 8.055 0.602 19854 2340 1 3 . 1 1 68 68 GLY N N 68 115.357 115.357 109.979 5.378 19854 2341 1 3 . 1 1 68 68 GLY C C 68 189.533 189.533 176.028 13.505 19854 2342 1 3 . 1 1 68 68 GLY CA C 68 45.209 45.209 45.992 -0.783 19854 2343 1 3 . 1 1 68 68 GLY H H 68 10.969 10.969 8.945 2.024 19854 2344 1 3 . 1 1 69 69 GLN N N 69 122.730 122.730 119.989 2.741 19854 2345 1 3 . 1 1 69 69 GLN C C 69 174.508 174.508 176.259 -1.751 19854 2346 1 3 . 1 1 69 69 GLN CA C 69 58.394 58.394 57.478 0.916 19854 2347 1 3 . 1 1 69 69 GLN CB C 69 31.441 31.441 28.782 2.659 19854 2348 1 3 . 1 1 69 69 GLN H H 69 8.336 8.336 8.509 -0.173 19854 2349 1 3 . 1 1 70 70 GLU N N 70 114.826 114.826 120.292 -5.466 19854 2350 1 3 . 1 1 70 70 GLU C C 70 176.273 176.273 175.595 0.678 19854 2351 1 3 . 1 1 70 70 GLU CA C 70 57.507 57.507 56.468 1.039 19854 2352 1 3 . 1 1 70 70 GLU CB C 70 28.811 28.811 30.331 -1.520 19854 2353 1 3 . 1 1 70 70 GLU H H 70 9.651 9.651 8.328 1.323 19854 2354 1 3 . 1 1 71 71 LYS N N 71 116.685 116.685 123.019 -6.334 19854 2355 1 3 . 1 1 71 71 LYS C C 71 175.979 175.979 176.373 -0.394 19854 2356 1 3 . 1 1 71 71 LYS CA C 71 48.722 48.722 56.083 -7.361 19854 2357 1 3 . 1 1 71 71 LYS CB C 71 37.010 37.010 32.903 4.107 19854 2358 1 3 . 1 1 71 71 LYS H H 71 8.712 8.712 8.272 0.440 19854 2359 1 3 . 1 1 72 72 PHE N N 72 114.959 114.959 120.679 -5.720 19854 2360 1 3 . 1 1 72 72 PHE C C 72 175.686 175.686 176.969 -1.283 19854 2361 1 3 . 1 1 72 72 PHE CA C 72 56.336 56.336 58.701 -2.365 19854 2362 1 3 . 1 1 72 72 PHE CB C 72 36.424 36.424 38.772 -2.348 19854 2363 1 3 . 1 1 72 72 PHE H H 72 7.965 7.965 8.020 -0.055 19854 2364 1 3 . 1 1 73 73 GLY N N 73 117.084 117.084 111.926 5.158 19854 2365 1 3 . 1 1 73 73 GLY C C 73 168.068 168.068 174.469 -6.401 19854 2366 1 3 . 1 1 73 73 GLY CA C 73 42.281 42.281 45.056 -2.775 19854 2367 1 3 . 1 1 73 73 GLY H H 73 7.609 7.609 7.862 -0.253 19854 2368 1 3 . 1 1 74 74 GLY N N 74 120.537 120.537 108.300 12.237 19854 2369 1 3 . 1 1 74 74 GLY C C 74 174.514 174.514 176.357 -1.843 19854 2370 1 3 . 1 1 74 74 GLY CA C 74 44.037 44.037 46.436 -2.399 19854 2371 1 3 . 1 1 74 74 GLY H H 74 9.326 9.326 8.692 0.634 19854 2372 1 3 . 1 1 75 75 LEU N N 75 127.177 127.177 121.636 5.541 19854 2373 1 3 . 1 1 75 75 LEU C C 75 178.617 178.617 178.211 0.406 19854 2374 1 3 . 1 1 75 75 LEU CA C 75 53.407 53.407 57.077 -3.670 19854 2375 1 3 . 1 1 75 75 LEU CB C 75 42.281 42.281 41.735 0.546 19854 2376 1 3 . 1 1 75 75 LEU H H 75 7.628 7.628 7.804 -0.176 19854 2377 1 3 . 1 1 76 76 ARG N N 76 116.486 116.486 116.372 0.114 19854 2378 1 3 . 1 1 76 76 ARG C C 76 176.859 176.859 176.781 0.078 19854 2379 1 3 . 1 1 76 76 ARG CA C 76 59.264 59.264 56.125 3.139 19854 2380 1 3 . 1 1 76 76 ARG CB C 76 31.154 31.154 29.803 1.351 19854 2381 1 3 . 1 1 76 76 ARG H H 76 7.143 7.143 7.488 -0.345 19854 2382 1 3 . 1 1 77 77 ASP N N 77 129.236 129.236 121.078 8.158 19854 2383 1 3 . 1 1 77 77 ASP C C 77 177.152 177.152 177.951 -0.799 19854 2384 1 3 . 1 1 77 77 ASP CA C 77 52.822 52.822 57.621 -4.799 19854 2385 1 3 . 1 1 77 77 ASP CB C 77 41.695 41.695 40.427 1.268 19854 2386 1 3 . 1 1 77 77 ASP H H 77 8.947 8.947 7.592 1.355 19854 2387 1 3 . 1 1 78 78 GLY N N 78 127.244 127.244 107.524 19.720 19854 2388 1 3 . 1 1 78 78 GLY C C 78 173.928 173.928 176.434 -2.506 19854 2389 1 3 . 1 1 78 78 GLY CA C 78 44.623 44.623 47.176 -2.553 19854 2390 1 3 . 1 1 78 78 GLY H H 78 8.219 8.219 8.575 -0.356 19854 2391 1 3 . 1 1 79 79 TYR N N 79 120.537 120.537 119.094 1.443 19854 2392 1 3 . 1 1 79 79 TYR C C 79 176.273 176.273 177.635 -1.362 19854 2393 1 3 . 1 1 79 79 TYR CA C 79 58.678 58.678 59.600 -0.922 19854 2394 1 3 . 1 1 79 79 TYR CB C 79 40.524 40.524 38.107 2.417 19854 2395 1 3 . 1 1 79 79 TYR H H 79 8.563 8.563 7.486 1.077 19854 2396 1 3 . 1 1 80 80 TYR N N 80 122.132 122.132 118.234 3.898 19854 2397 1 3 . 1 1 80 80 TYR C C 80 175.979 175.979 175.936 0.043 19854 2398 1 3 . 1 1 80 80 TYR CA C 80 62.203 62.203 59.561 2.642 19854 2399 1 3 . 1 1 80 80 TYR CB C 80 41.988 41.988 39.527 2.461 19854 2400 1 3 . 1 1 80 80 TYR H H 80 8.254 8.254 7.595 0.659 19854 2401 1 3 . 1 1 81 81 ILE N N 81 120.072 120.072 120.841 -0.769 19854 2402 1 3 . 1 1 81 81 ILE C C 81 177.445 177.445 175.927 1.518 19854 2403 1 3 . 1 1 81 81 ILE CA C 81 67.462 67.462 63.700 3.761 19854 2404 1 3 . 1 1 81 81 ILE CB C 81 41.109 41.109 37.944 3.165 19854 2405 1 3 . 1 1 81 81 ILE H H 81 8.837 8.837 8.326 0.511 19854 2406 1 3 . 1 1 82 82 GLN N N 82 121.601 121.601 119.863 1.738 19854 2407 1 3 . 1 1 82 82 GLN C C 82 173.342 173.342 174.436 -1.094 19854 2408 1 3 . 1 1 82 82 GLN CA C 82 59.859 59.859 56.643 3.216 19854 2409 1 3 . 1 1 82 82 GLN CB C 82 30.855 30.855 25.579 5.276 19854 2410 1 3 . 1 1 82 82 GLN H H 82 8.184 8.184 9.013 -0.829 19854 2411 1 3 . 1 1 83 83 ALA N N 83 109.713 109.713 120.264 -10.551 19854 2412 1 3 . 1 1 83 83 ALA C C 83 175.979 175.979 176.950 -0.971 19854 2413 1 3 . 1 1 83 83 ALA CA C 83 54.579 54.579 52.458 2.121 19854 2414 1 3 . 1 1 83 83 ALA CB C 83 16.513 16.513 19.336 -2.823 19854 2415 1 3 . 1 1 83 83 ALA H H 83 6.306 6.306 7.450 -1.144 19854 2416 1 3 . 1 1 84 84 GLN N N 84 121.203 121.203 120.825 0.378 19854 2417 1 3 . 1 1 84 84 GLN C C 84 177.144 177.144 176.036 1.108 19854 2418 1 3 . 1 1 84 84 GLN CA C 84 60.152 60.152 56.739 3.413 19854 2419 1 3 . 1 1 84 84 GLN CB C 84 34.957 34.957 31.350 3.607 19854 2420 1 3 . 1 1 84 84 GLN H H 84 8.180 8.180 8.537 -0.357 19854 2421 1 3 . 1 1 85 85 CYS N N 85 120.605 120.605 111.977 8.628 19854 2422 1 3 . 1 1 85 85 CYS C C 85 176.566 176.566 172.732 3.834 19854 2423 1 3 . 1 1 85 85 CYS CA C 85 65.430 65.430 56.237 9.193 19854 2424 1 3 . 1 1 85 85 CYS CB C 85 39.644 39.644 31.886 7.758 19854 2425 1 3 . 1 1 85 85 CYS H H 85 8.364 8.364 7.715 0.649 19854 2426 1 3 . 1 1 86 86 ALA N N 86 114.295 114.295 121.482 -7.187 19854 2427 1 3 . 1 1 86 86 ALA CA C 86 57.507 57.507 50.947 6.560 19854 2428 1 3 . 1 1 86 86 ALA CB C 86 21.784 21.784 22.909 -1.125 19854 2429 1 3 . 1 1 86 86 ALA H H 86 6.897 6.897 8.649 -1.752 19854 2430 1 3 . 1 1 87 87 ILE N N 87 120.670 120.670 120.486 0.184 19854 2431 1 3 . 1 1 87 87 ILE C C 87 173.928 173.928 174.580 -0.652 19854 2432 1 3 . 1 1 87 87 ILE CA C 87 61.020 61.020 59.982 1.038 19854 2433 1 3 . 1 1 87 87 ILE CB C 87 39.938 39.938 41.578 -1.640 19854 2434 1 3 . 1 1 87 87 ILE H H 87 8.282 8.282 8.631 -0.349 19854 2435 1 3 . 1 1 88 88 ILE N N 88 120.205 120.205 127.383 -7.178 19854 2436 1 3 . 1 1 88 88 ILE C C 88 173.635 173.635 174.868 -1.233 19854 2437 1 3 . 1 1 88 88 ILE CA C 88 64.534 64.534 60.222 4.312 19854 2438 1 3 . 1 1 88 88 ILE CB C 88 37.596 37.596 39.892 -2.296 19854 2439 1 3 . 1 1 88 88 ILE H H 88 5.528 5.528 8.911 -3.383 19854 2440 1 3 . 1 1 89 89 MET N N 89 120.472 120.472 126.303 -5.831 19854 2441 1 3 . 1 1 89 89 MET C C 89 178.617 178.617 175.066 3.551 19854 2442 1 3 . 1 1 89 89 MET CA C 89 58.980 58.980 54.303 4.677 19854 2443 1 3 . 1 1 89 89 MET CB C 89 34.957 34.957 34.911 0.046 19854 2444 1 3 . 1 1 89 89 MET H H 89 8.176 8.176 8.712 -0.536 19854 2445 1 3 . 1 1 90 90 PHE N N 90 121.134 121.134 118.675 2.459 19854 2446 1 3 . 1 1 90 90 PHE C C 90 175.393 175.393 172.992 2.401 19854 2447 1 3 . 1 1 90 90 PHE CA C 90 60.435 60.435 55.333 5.102 19854 2448 1 3 . 1 1 90 90 PHE CB C 90 38.767 38.767 42.106 -3.339 19854 2449 1 3 . 1 1 90 90 PHE H H 90 9.334 9.334 8.704 0.630 19854 2450 1 3 . 1 1 91 91 ASP N N 91 120.273 120.273 120.765 -0.492 19854 2451 1 3 . 1 1 91 91 ASP C C 91 177.730 177.730 178.117 -0.387 19854 2452 1 3 . 1 1 91 91 ASP CA C 91 59.859 59.859 52.355 7.504 19854 2453 1 3 . 1 1 91 91 ASP CB C 91 44.039 44.039 42.697 1.342 19854 2454 1 3 . 1 1 91 91 ASP H H 91 7.597 7.597 8.896 -1.299 19854 2455 1 3 . 1 1 92 92 VAL N N 92 115.158 115.158 123.485 -8.327 19854 2456 1 3 . 1 1 92 92 VAL C C 92 173.342 173.342 176.544 -3.202 19854 2457 1 3 . 1 1 92 92 VAL CA C 92 64.534 64.534 64.960 -0.426 19854 2458 1 3 . 1 1 92 92 VAL CB C 92 37.596 37.596 31.325 6.271 19854 2459 1 3 . 1 1 92 92 VAL H H 92 7.738 7.738 8.502 -0.764 19854 2460 1 3 . 1 1 93 93 THR N N 93 127.179 127.179 110.109 17.070 19854 2461 1 3 . 1 1 93 93 THR C C 93 178.902 178.902 174.689 4.213 19854 2462 1 3 . 1 1 93 93 THR CA C 93 64.254 64.254 62.841 1.413 19854 2463 1 3 . 1 1 93 93 THR CB C 93 74.215 74.215 69.150 5.065 19854 2464 1 3 . 1 1 93 93 THR H H 93 7.636 7.636 8.189 -0.553 19854 2465 1 3 . 1 1 94 94 SER N N 94 122.263 122.263 116.499 5.764 19854 2466 1 3 . 1 1 94 94 SER C C 94 163.965 163.965 174.910 -10.945 19854 2467 1 3 . 1 1 94 94 SER CA C 94 59.849 59.849 55.486 4.362 19854 2468 1 3 . 1 1 94 94 SER CB C 94 62.192 62.192 64.160 -1.968 19854 2469 1 3 . 1 1 94 94 SER H H 94 7.628 7.628 7.919 -0.291 19854 2470 1 3 . 1 1 95 95 ARG N N 95 113.099 113.099 128.672 -15.573 19854 2471 1 3 . 1 1 95 95 ARG C C 95 176.273 176.273 177.872 -1.599 19854 2472 1 3 . 1 1 95 95 ARG CA C 95 53.407 53.407 59.690 -6.282 19854 2473 1 3 . 1 1 95 95 ARG CB C 95 31.154 31.154 30.007 1.147 19854 2474 1 3 . 1 1 95 95 ARG H H 95 8.102 8.102 9.065 -0.963 19854 2475 1 3 . 1 1 96 96 VAL N N 96 124.787 124.787 118.869 5.918 19854 2476 1 3 . 1 1 96 96 VAL C C 96 178.031 178.031 177.717 0.314 19854 2477 1 3 . 1 1 96 96 VAL CA C 96 68.634 68.634 66.395 2.239 19854 2478 1 3 . 1 1 96 96 VAL CB C 96 24.126 24.126 31.395 -7.269 19854 2479 1 3 . 1 1 96 96 VAL H H 96 9.146 9.146 8.146 1.000 19854 2480 1 3 . 1 1 97 97 THR N N 97 111.970 111.970 116.048 -4.078 19854 2481 1 3 . 1 1 97 97 THR C C 97 178.031 178.031 175.952 2.079 19854 2482 1 3 . 1 1 97 97 THR CA C 97 63.949 63.949 66.332 -2.383 19854 2483 1 3 . 1 1 97 97 THR CB C 97 70.390 70.390 68.997 1.393 19854 2484 1 3 . 1 1 97 97 THR H H 97 7.984 7.984 7.615 0.369 19854 2485 1 3 . 1 1 98 98 TYR N N 98 113.232 113.232 121.092 -7.860 19854 2486 1 3 . 1 1 98 98 TYR C C 98 176.273 176.273 177.519 -1.246 19854 2487 1 3 . 1 1 98 98 TYR H H 98 7.605 7.605 7.771 -0.166 19854 2488 1 3 . 1 1 99 99 LYS N N 99 123.726 123.726 118.656 5.070 19854 2489 1 3 . 1 1 99 99 LYS C C 99 178.316 178.316 178.310 0.006 19854 2490 1 3 . 1 1 99 99 LYS CA C 99 58.691 58.691 59.373 -0.682 19854 2491 1 3 . 1 1 99 99 LYS CB C 99 36.127 36.127 32.053 4.074 19854 2492 1 3 . 1 1 99 99 LYS H H 99 8.360 8.360 8.045 0.315 19854 2493 1 3 . 1 1 100 100 ASN N N 100 111.970 111.970 115.967 -3.997 19854 2494 1 3 . 1 1 100 100 ASN C C 100 175.979 175.979 176.617 -0.638 19854 2495 1 3 . 1 1 100 100 ASN CA C 100 53.407 53.407 54.488 -1.081 19854 2496 1 3 . 1 1 100 100 ASN CB C 100 37.596 37.596 38.476 -0.880 19854 2497 1 3 . 1 1 100 100 ASN H H 100 5.778 5.778 7.679 -1.901 19854 2498 1 3 . 1 1 101 101 VAL N N 101 118.877 118.877 121.890 -3.013 19854 2499 1 3 . 1 1 101 101 VAL C C 101 173.635 173.635 174.984 -1.349 19854 2500 1 3 . 1 1 101 101 VAL CA C 101 62.777 62.777 68.438 -5.661 19854 2501 1 3 . 1 1 101 101 VAL CB C 101 27.054 27.054 29.206 -2.152 19854 2502 1 3 . 1 1 101 101 VAL H H 101 7.370 7.370 7.544 -0.174 19854 2503 1 3 . 1 1 102 102 PRO C C 102 176.566 176.566 177.221 -0.655 19854 2504 1 3 . 1 1 102 102 PRO CA C 102 62.500 62.500 65.392 -2.892 19854 2505 1 3 . 1 1 102 102 PRO CB C 102 30.853 30.853 31.145 -0.292 19854 2506 1 3 . 1 1 103 103 ASN N N 103 122.728 122.728 114.996 7.732 19854 2507 1 3 . 1 1 103 103 ASN C C 103 175.100 175.100 176.798 -1.698 19854 2508 1 3 . 1 1 103 103 ASN CA C 103 54.579 54.579 54.823 -0.244 19854 2509 1 3 . 1 1 103 103 ASN CB C 103 38.767 38.767 37.246 1.521 19854 2510 1 3 . 1 1 103 103 ASN H H 103 7.879 7.879 7.445 0.434 19854 2511 1 3 . 1 1 104 104 TRP N N 104 122.730 122.730 119.732 2.998 19854 2512 1 3 . 1 1 104 104 TRP C C 104 174.215 174.215 176.765 -2.550 19854 2513 1 3 . 1 1 104 104 TRP CA C 104 59.273 59.273 60.452 -1.179 19854 2514 1 3 . 1 1 104 104 TRP CB C 104 35.250 35.250 30.031 5.219 19854 2515 1 3 . 1 1 104 104 TRP H H 104 7.902 7.902 7.833 0.069 19854 2516 1 3 . 1 1 105 105 HIS N N 105 120.869 120.869 117.144 3.725 19854 2517 1 3 . 1 1 105 105 HIS C C 105 177.738 177.738 174.423 3.315 19854 2518 1 3 . 1 1 105 105 HIS H H 105 6.971 6.971 8.434 -1.463 19854 2519 1 3 . 1 1 106 106 ARG N N 106 126.314 126.314 122.738 3.576 19854 2520 1 3 . 1 1 106 106 ARG C C 106 176.566 176.566 176.504 0.062 19854 2521 1 3 . 1 1 106 106 ARG CA C 106 62.777 62.777 57.579 5.198 19854 2522 1 3 . 1 1 106 106 ARG CB C 106 29.397 29.397 31.147 -1.750 19854 2523 1 3 . 1 1 106 106 ARG H H 106 7.507 7.507 7.910 -0.403 19854 2524 1 3 . 1 1 107 107 ASP N N 107 119.076 119.076 122.164 -3.088 19854 2525 1 3 . 1 1 107 107 ASP C C 107 176.566 176.566 178.636 -2.070 19854 2526 1 3 . 1 1 107 107 ASP CA C 107 55.164 55.164 57.577 -2.413 19854 2527 1 3 . 1 1 107 107 ASP CB C 107 41.695 41.695 40.748 0.947 19854 2528 1 3 . 1 1 107 107 ASP H H 107 9.076 9.076 7.883 1.193 19854 2529 1 3 . 1 1 108 108 LEU N N 108 113.299 113.299 119.535 -6.236 19854 2530 1 3 . 1 1 108 108 LEU C C 108 176.273 176.273 178.265 -1.992 19854 2531 1 3 . 1 1 108 108 LEU CA C 108 59.264 59.264 58.208 1.056 19854 2532 1 3 . 1 1 108 108 LEU CB C 108 48.722 48.722 41.191 7.531 19854 2533 1 3 . 1 1 108 108 LEU H H 108 6.725 6.725 7.874 -1.149 19854 2534 1 3 . 1 1 109 109 VAL N N 109 121.267 121.267 114.189 7.078 19854 2535 1 3 . 1 1 109 109 VAL C C 109 175.393 175.393 178.210 -2.817 19854 2536 1 3 . 1 1 109 109 VAL CA C 109 63.949 63.949 64.659 -0.710 19854 2537 1 3 . 1 1 109 109 VAL CB C 109 32.911 32.911 30.963 1.948 19854 2538 1 3 . 1 1 109 109 VAL H H 109 8.763 8.763 7.639 1.124 19854 2539 1 3 . 1 1 110 110 ARG N N 110 112.900 112.900 120.236 -7.336 19854 2540 1 3 . 1 1 110 110 ARG C C 110 176.273 176.273 177.826 -1.553 19854 2541 1 3 . 1 1 110 110 ARG CA C 110 57.507 57.507 59.298 -1.791 19854 2542 1 3 . 1 1 110 110 ARG CB C 110 30.568 30.568 30.168 0.400 19854 2543 1 3 . 1 1 110 110 ARG H H 110 7.241 7.241 7.989 -0.748 19854 2544 1 3 . 1 1 111 111 VAL N N 111 115.556 115.556 117.742 -2.186 19854 2545 1 3 . 1 1 111 111 VAL C C 111 177.445 177.445 176.907 0.538 19854 2546 1 3 . 1 1 111 111 VAL CA C 111 59.849 59.849 65.242 -5.393 19854 2547 1 3 . 1 1 111 111 VAL CB C 111 32.911 32.911 32.914 -0.003 19854 2548 1 3 . 1 1 111 111 VAL H H 111 7.566 7.566 7.714 -0.148 19854 2549 1 3 . 1 1 112 112 CYS N N 112 114.295 114.295 115.385 -1.090 19854 2550 1 3 . 1 1 112 112 CYS C C 112 169.826 169.826 174.536 -4.710 19854 2551 1 3 . 1 1 112 112 CYS CA C 112 57.507 57.507 58.956 -1.449 19854 2552 1 3 . 1 1 112 112 CYS CB C 112 35.839 35.839 28.972 6.867 19854 2553 1 3 . 1 1 112 112 CYS H H 112 7.425 7.425 8.278 -0.853 19854 2554 1 3 . 1 1 113 113 GLU N N 113 116.486 116.486 117.789 -1.303 19854 2555 1 3 . 1 1 113 113 GLU C C 113 176.566 176.566 175.798 0.768 19854 2556 1 3 . 1 1 113 113 GLU CA C 113 69.219 69.219 58.315 10.904 19854 2557 1 3 . 1 1 113 113 GLU CB C 113 30.568 30.568 28.289 2.279 19854 2558 1 3 . 1 1 113 113 GLU H H 113 7.241 7.241 8.147 -0.906 19854 2559 1 3 . 1 1 114 114 ASN N N 114 129.302 129.302 121.862 7.440 19854 2560 1 3 . 1 1 114 114 ASN C C 114 175.100 175.100 174.729 0.371 19854 2561 1 3 . 1 1 114 114 ASN CA C 114 52.236 52.236 52.991 -0.755 19854 2562 1 3 . 1 1 114 114 ASN CB C 114 39.938 39.938 38.117 1.821 19854 2563 1 3 . 1 1 114 114 ASN H H 114 8.919 8.919 8.241 0.678 19854 2564 1 3 . 1 1 115 115 ILE N N 115 110.443 110.443 122.210 -11.767 19854 2565 1 3 . 1 1 115 115 ILE C C 115 175.100 175.100 173.465 1.635 19854 2566 1 3 . 1 1 115 115 ILE CA C 115 65.705 65.705 57.831 7.874 19854 2567 1 3 . 1 1 115 115 ILE CB C 115 39.353 39.353 39.951 -0.598 19854 2568 1 3 . 1 1 115 115 ILE H H 115 9.287 9.287 7.876 1.411 19854 2569 1 3 . 1 1 116 116 PRO C C 116 175.979 175.979 175.639 0.340 19854 2570 1 3 . 1 1 116 116 PRO CA C 116 63.086 63.086 62.974 0.112 19854 2571 1 3 . 1 1 116 116 PRO CB C 116 29.681 29.681 32.274 -2.593 19854 2572 1 3 . 1 1 117 117 ILE N N 117 123.591 123.591 123.654 -0.063 19854 2573 1 3 . 1 1 117 117 ILE C C 117 174.807 174.807 175.015 -0.208 19854 2574 1 3 . 1 1 117 117 ILE CA C 117 66.291 66.291 60.296 5.995 19854 2575 1 3 . 1 1 117 117 ILE CB C 117 38.767 38.767 42.284 -3.517 19854 2576 1 3 . 1 1 117 117 ILE H H 117 7.781 7.781 8.508 -0.727 19854 2577 1 3 . 1 1 118 118 VAL N N 118 119.009 119.009 125.719 -6.710 19854 2578 1 3 . 1 1 118 118 VAL C C 118 178.324 178.324 174.789 3.535 19854 2579 1 3 . 1 1 118 118 VAL CA C 118 62.777 62.777 60.806 1.970 19854 2580 1 3 . 1 1 118 118 VAL CB C 118 31.154 31.154 33.997 -2.843 19854 2581 1 3 . 1 1 118 118 VAL H H 118 8.767 8.767 8.605 0.162 19854 2582 1 3 . 1 1 119 119 LEU N N 119 119.408 119.408 126.881 -7.473 19854 2583 1 3 . 1 1 119 119 LEU C C 119 178.031 178.031 176.063 1.968 19854 2584 1 3 . 1 1 119 119 LEU CA C 119 42.866 42.866 53.859 -10.993 19854 2585 1 3 . 1 1 119 119 LEU CB C 119 38.767 38.767 43.791 -5.024 19854 2586 1 3 . 1 1 119 119 LEU H H 119 7.734 7.734 9.248 -1.514 19854 2587 1 3 . 1 1 120 120 CYS N N 120 113.232 113.232 122.110 -8.878 19854 2588 1 3 . 1 1 120 120 CYS C C 120 178.031 178.031 174.231 3.800 19854 2589 1 3 . 1 1 120 120 CYS H H 120 8.317 8.317 9.133 -0.816 19854 2590 1 3 . 1 1 121 121 GLY N N 121 117.349 117.349 112.899 4.450 19854 2591 1 3 . 1 1 121 121 GLY C C 121 176.851 176.851 172.819 4.032 19854 2592 1 3 . 1 1 121 121 GLY CA C 121 41.109 41.109 43.621 -2.512 19854 2593 1 3 . 1 1 121 121 GLY H H 121 7.515 7.515 8.943 -1.428 19854 2594 1 3 . 1 1 122 122 ASN N N 122 125.318 125.318 125.793 -0.475 19854 2595 1 3 . 1 1 122 122 ASN C C 122 175.686 175.686 175.534 0.152 19854 2596 1 3 . 1 1 122 122 ASN CA C 122 50.479 50.479 52.714 -2.235 19854 2597 1 3 . 1 1 122 122 ASN CB C 122 39.353 39.353 39.773 -0.420 19854 2598 1 3 . 1 1 122 122 ASN H H 122 9.162 9.162 8.499 0.663 19854 2599 1 3 . 1 1 123 123 LYS N N 123 122.132 122.132 114.882 7.250 19854 2600 1 3 . 1 1 123 123 LYS C C 123 173.043 173.043 177.003 -3.960 19854 2601 1 3 . 1 1 123 123 LYS CA C 123 58.101 58.101 57.416 0.685 19854 2602 1 3 . 1 1 123 123 LYS CB C 123 35.543 35.543 29.893 5.650 19854 2603 1 3 . 1 1 123 123 LYS H H 123 7.953 7.953 8.804 -0.851 19854 2604 1 3 . 1 1 124 124 VAL N N 124 123.726 123.726 113.110 10.616 19854 2605 1 3 . 1 1 124 124 VAL C C 124 175.679 175.679 176.684 -1.005 19854 2606 1 3 . 1 1 124 124 VAL CA C 124 64.840 64.840 64.815 0.025 19854 2607 1 3 . 1 1 124 124 VAL CB C 124 42.574 42.574 31.320 11.254 19854 2608 1 3 . 1 1 124 124 VAL H H 124 8.555 8.555 7.575 0.980 19854 2609 1 3 . 1 1 125 125 ASP N N 125 119.607 119.607 120.181 -0.574 19854 2610 1 3 . 1 1 125 125 ASP C C 125 176.566 176.566 177.073 -0.507 19854 2611 1 3 . 1 1 125 125 ASP CA C 125 55.750 55.750 56.451 -0.701 19854 2612 1 3 . 1 1 125 125 ASP CB C 125 40.524 40.524 40.997 -0.473 19854 2613 1 3 . 1 1 125 125 ASP H H 125 7.875 7.875 8.201 -0.326 19854 2614 1 3 . 1 1 126 126 ILE N N 126 116.088 116.088 121.053 -4.965 19854 2615 1 3 . 1 1 126 126 ILE C C 126 177.152 177.152 177.041 0.111 19854 2616 1 3 . 1 1 126 126 ILE CA C 126 66.291 66.291 61.874 4.417 19854 2617 1 3 . 1 1 126 126 ILE CB C 126 39.353 39.353 38.142 1.211 19854 2618 1 3 . 1 1 126 126 ILE H H 126 7.511 7.511 7.541 -0.030 19854 2619 1 3 . 1 1 127 127 LYS N N 127 121.203 121.203 126.765 -5.562 19854 2620 1 3 . 1 1 127 127 LYS C C 127 175.979 175.979 177.075 -1.096 19854 2621 1 3 . 1 1 127 127 LYS CA C 127 58.101 58.101 59.054 -0.953 19854 2622 1 3 . 1 1 127 127 LYS CB C 127 35.834 35.834 32.483 3.351 19854 2623 1 3 . 1 1 127 127 LYS H H 127 8.113 8.113 8.625 -0.512 19854 2624 1 3 . 1 1 128 128 ASP N N 128 118.279 118.279 120.315 -2.036 19854 2625 1 3 . 1 1 128 128 ASP C C 128 176.566 176.566 175.024 1.542 19854 2626 1 3 . 1 1 128 128 ASP CA C 128 53.407 53.407 52.960 0.447 19854 2627 1 3 . 1 1 128 128 ASP CB C 128 40.524 40.524 39.610 0.914 19854 2628 1 3 . 1 1 128 128 ASP H H 128 7.241 7.241 8.221 -0.980 19854 2629 1 3 . 1 1 129 129 ARG N N 129 118.943 118.943 122.122 -3.179 19854 2630 1 3 . 1 1 129 129 ARG C C 129 177.738 177.738 176.605 1.133 19854 2631 1 3 . 1 1 129 129 ARG CA C 129 45.794 45.794 56.604 -10.810 19854 2632 1 3 . 1 1 129 129 ARG CB C 129 31.154 31.154 31.282 -0.128 19854 2633 1 3 . 1 1 129 129 ARG H H 129 8.423 8.423 7.822 0.601 19854 2634 1 3 . 1 1 130 130 LYS N N 130 109.381 109.381 121.868 -12.487 19854 2635 1 3 . 1 1 130 130 LYS C C 130 176.566 176.566 176.972 -0.406 19854 2636 1 3 . 1 1 130 130 LYS CA C 130 55.164 55.164 56.160 -0.996 19854 2637 1 3 . 1 1 130 130 LYS CB C 130 36.424 36.424 33.709 2.715 19854 2638 1 3 . 1 1 130 130 LYS H H 130 7.296 7.296 8.508 -1.212 19854 2639 1 3 . 1 1 131 131 VAL N N 131 110.377 110.377 121.683 -11.306 19854 2640 1 3 . 1 1 131 131 VAL C C 131 178.617 178.617 175.064 3.553 19854 2641 1 3 . 1 1 131 131 VAL CA C 131 65.705 65.705 62.038 3.667 19854 2642 1 3 . 1 1 131 131 VAL CB C 131 35.839 35.839 31.235 4.604 19854 2643 1 3 . 1 1 131 131 VAL H H 131 9.283 9.283 8.009 1.274 19854 2644 1 3 . 1 1 132 132 LYS N N 132 110.310 110.310 127.967 -17.657 19854 2645 1 3 . 1 1 132 132 LYS C C 132 176.273 176.273 177.449 -1.176 19854 2646 1 3 . 1 1 132 132 LYS CA C 132 59.849 59.849 55.499 4.350 19854 2647 1 3 . 1 1 132 132 LYS CB C 132 35.253 35.253 33.716 1.537 19854 2648 1 3 . 1 1 132 132 LYS H H 132 9.709 9.709 8.149 1.560 19854 2649 1 3 . 1 1 133 133 ALA N N 133 134.349 134.349 126.448 7.901 19854 2650 1 3 . 1 1 133 133 ALA CA C 133 51.065 51.065 54.916 -3.852 19854 2651 1 3 . 1 1 133 133 ALA CB C 133 12.999 12.999 18.604 -5.604 19854 2652 1 3 . 1 1 133 133 ALA H H 133 6.322 6.322 8.743 -2.421 19854 2653 1 3 . 1 1 134 134 LYS N N 134 117.615 117.615 118.116 -0.501 19854 2654 1 3 . 1 1 134 134 LYS C C 134 176.859 176.859 178.393 -1.534 19854 2655 1 3 . 1 1 134 134 LYS CA C 134 55.750 55.750 58.646 -2.896 19854 2656 1 3 . 1 1 134 134 LYS CB C 134 54.579 54.579 32.304 22.275 19854 2657 1 3 . 1 1 134 134 LYS H H 134 6.549 6.549 8.321 -1.772 19854 2658 1 3 . 1 1 135 135 SER N N 135 109.314 109.314 114.100 -4.786 19854 2659 1 3 . 1 1 135 135 SER C C 135 173.635 173.635 175.192 -1.557 19854 2660 1 3 . 1 1 135 135 SER CA C 135 56.336 56.336 59.999 -3.663 19854 2661 1 3 . 1 1 135 135 SER CB C 135 63.949 63.949 63.080 0.869 19854 2662 1 3 . 1 1 135 135 SER H H 135 7.840 7.840 7.453 0.387 19854 2663 1 3 . 1 1 136 136 ILE N N 136 124.123 124.123 121.753 2.370 19854 2664 1 3 . 1 1 136 136 ILE C C 136 175.100 175.100 175.896 -0.796 19854 2665 1 3 . 1 1 136 136 ILE CA C 136 68.634 68.634 62.850 5.784 19854 2666 1 3 . 1 1 136 136 ILE CB C 136 43.452 43.452 37.846 5.606 19854 2667 1 3 . 1 1 136 136 ILE H H 136 8.098 8.098 7.275 0.823 19854 2668 1 3 . 1 1 137 137 VAL N N 137 113.232 113.232 124.146 -10.914 19854 2669 1 3 . 1 1 137 137 VAL C C 137 176.859 176.859 176.180 0.679 19854 2670 1 3 . 1 1 137 137 VAL CA C 137 64.534 64.534 62.131 2.403 19854 2671 1 3 . 1 1 137 137 VAL CB C 137 34.082 34.082 32.452 1.630 19854 2672 1 3 . 1 1 137 137 VAL H H 137 7.711 7.711 8.072 -0.361 19854 2673 1 3 . 1 1 138 138 PHE N N 138 118.279 118.279 123.039 -4.760 19854 2674 1 3 . 1 1 138 138 PHE C C 138 175.393 175.393 176.280 -0.887 19854 2675 1 3 . 1 1 138 138 PHE CA C 138 58.092 58.092 62.670 -4.578 19854 2676 1 3 . 1 1 138 138 PHE CB C 138 39.353 39.353 39.188 0.165 19854 2677 1 3 . 1 1 138 138 PHE H H 138 8.317 8.317 7.639 0.678 19854 2678 1 3 . 1 1 139 139 HIS N N 139 120.605 120.605 115.408 5.197 19854 2679 1 3 . 1 1 139 139 HIS C C 139 175.979 175.979 176.988 -1.009 19854 2680 1 3 . 1 1 139 139 HIS CA C 139 67.775 67.775 59.155 8.620 19854 2681 1 3 . 1 1 139 139 HIS CB C 139 35.836 35.836 28.849 6.987 19854 2682 1 3 . 1 1 139 139 HIS H H 139 8.094 8.094 8.897 -0.803 19854 2683 1 3 . 1 1 140 140 ARG N N 140 120.140 120.140 120.144 -0.004 19854 2684 1 3 . 1 1 140 140 ARG C C 140 178.023 178.023 179.155 -1.132 19854 2685 1 3 . 1 1 140 140 ARG CA C 140 58.394 58.394 59.216 -0.822 19854 2686 1 3 . 1 1 140 140 ARG CB C 140 39.644 39.644 29.831 9.813 19854 2687 1 3 . 1 1 140 140 ARG H H 140 8.149 8.149 7.064 1.085 19854 2688 1 3 . 1 1 141 141 LYS N N 141 115.623 115.623 120.042 -4.419 19854 2689 1 3 . 1 1 141 141 LYS C C 141 173.635 173.635 178.124 -4.489 19854 2690 1 3 . 1 1 141 141 LYS CA C 141 58.092 58.092 58.674 -0.582 19854 2691 1 3 . 1 1 141 141 LYS CB C 141 33.496 33.496 32.321 1.175 19854 2692 1 3 . 1 1 141 141 LYS H H 141 7.449 7.449 7.388 0.061 19854 2693 1 3 . 1 1 142 142 LYS N N 142 114.162 114.162 115.329 -1.167 19854 2694 1 3 . 1 1 142 142 LYS C C 142 175.979 175.979 176.000 -0.021 19854 2695 1 3 . 1 1 142 142 LYS CA C 142 51.065 51.065 54.627 -3.562 19854 2696 1 3 . 1 1 142 142 LYS CB C 142 34.668 34.668 31.470 3.199 19854 2697 1 3 . 1 1 142 142 LYS H H 142 8.982 8.982 7.596 1.386 19854 2698 1 3 . 1 1 143 143 ASN N N 143 112.103 112.103 117.192 -5.089 19854 2699 1 3 . 1 1 143 143 ASN C C 143 175.100 175.100 173.988 1.112 19854 2700 1 3 . 1 1 143 143 ASN CA C 143 53.407 53.407 53.862 -0.455 19854 2701 1 3 . 1 1 143 143 ASN CB C 143 39.938 39.938 37.070 2.868 19854 2702 1 3 . 1 1 143 143 ASN H H 143 7.402 7.402 7.851 -0.449 19854 2703 1 3 . 1 1 144 144 LEU N N 144 118.810 118.810 116.400 2.410 19854 2704 1 3 . 1 1 144 144 LEU CA C 144 53.993 53.993 53.353 0.640 19854 2705 1 3 . 1 1 144 144 LEU CB C 144 42.866 42.866 44.539 -1.673 19854 2706 1 3 . 1 1 144 144 LEU H H 144 7.793 7.793 8.046 -0.253 19854 2707 1 3 . 1 1 145 145 GLN N N 145 119.607 119.607 118.083 1.524 19854 2708 1 3 . 1 1 145 145 GLN C C 145 176.859 176.859 174.241 2.618 19854 2709 1 3 . 1 1 145 145 GLN CA C 145 55.164 55.164 53.694 1.470 19854 2710 1 3 . 1 1 145 145 GLN CB C 145 29.983 29.983 31.093 -1.110 19854 2711 1 3 . 1 1 145 145 GLN H H 145 7.014 7.014 8.206 -1.192 19854 2712 1 3 . 1 1 146 146 TYR N N 146 119.275 119.275 124.486 -5.211 19854 2713 1 3 . 1 1 146 146 TYR C C 146 174.807 174.807 174.302 0.505 19854 2714 1 3 . 1 1 146 146 TYR CA C 146 62.777 62.777 56.098 6.679 19854 2715 1 3 . 1 1 146 146 TYR CB C 146 41.109 41.109 40.768 0.341 19854 2716 1 3 . 1 1 146 146 TYR H H 146 9.350 9.350 8.157 1.193 19854 2717 1 3 . 1 1 147 147 TYR N N 147 123.658 123.658 125.095 -1.437 19854 2718 1 3 . 1 1 147 147 TYR C C 147 177.738 177.738 173.691 4.047 19854 2719 1 3 . 1 1 147 147 TYR CA C 147 58.092 58.092 56.240 1.852 19854 2720 1 3 . 1 1 147 147 TYR CB C 147 39.938 39.938 42.118 -2.180 19854 2721 1 3 . 1 1 147 147 TYR H H 147 8.340 8.340 8.611 -0.271 19854 2722 1 3 . 1 1 148 148 ASP N N 148 121.267 121.267 123.157 -1.890 19854 2723 1 3 . 1 1 148 148 ASP C C 148 176.859 176.859 175.377 1.482 19854 2724 1 3 . 1 1 148 148 ASP CA C 148 54.579 54.579 54.343 0.236 19854 2725 1 3 . 1 1 148 148 ASP CB C 148 41.109 41.109 41.659 -0.550 19854 2726 1 3 . 1 1 148 148 ASP H H 148 8.911 8.911 8.392 0.519 19854 2727 1 3 . 1 1 149 149 ILE N N 149 119.607 119.607 116.953 2.654 19854 2728 1 3 . 1 1 149 149 ILE C C 149 174.807 174.807 174.222 0.585 19854 2729 1 3 . 1 1 149 149 ILE CA C 149 61.020 61.020 59.107 1.913 19854 2730 1 3 . 1 1 149 149 ILE CB C 149 39.353 39.353 42.665 -3.312 19854 2731 1 3 . 1 1 149 149 ILE H H 149 8.712 8.712 8.591 0.121 19854 2732 1 3 . 1 1 150 150 SER N N 150 117.349 117.349 116.664 0.685 19854 2733 1 3 . 1 1 150 150 SER C C 150 175.686 175.686 174.467 1.219 19854 2734 1 3 . 1 1 150 150 SER CA C 150 60.435 60.435 55.776 4.659 19854 2735 1 3 . 1 1 150 150 SER CB C 150 62.192 62.192 65.399 -3.207 19854 2736 1 3 . 1 1 150 150 SER H H 150 8.454 8.454 8.433 0.021 19854 2737 1 3 . 1 1 151 151 ALA N N 151 131.162 131.162 131.149 0.013 19854 2738 1 3 . 1 1 151 151 ALA C C 151 160.742 160.742 179.048 -18.306 19854 2739 1 3 . 1 1 151 151 ALA CA C 151 53.993 53.993 55.389 -1.396 19854 2740 1 3 . 1 1 151 151 ALA CB C 151 22.369 22.369 19.136 3.233 19854 2741 1 3 . 1 1 151 151 ALA H H 151 10.640 10.640 8.924 1.716 19854 2742 1 3 . 1 1 152 152 LYS N N 152 121.400 121.400 118.016 3.384 19854 2743 1 3 . 1 1 152 152 LYS C C 152 174.221 174.221 178.078 -3.857 19854 2744 1 3 . 1 1 152 152 LYS CA C 152 59.849 59.849 58.470 1.379 19854 2745 1 3 . 1 1 152 152 LYS CB C 152 34.668 34.668 32.504 2.164 19854 2746 1 3 . 1 1 152 152 LYS H H 152 9.099 9.099 8.174 0.925 19854 2747 1 3 . 1 1 153 153 SER N N 153 135.212 135.212 111.645 23.567 19854 2748 1 3 . 1 1 153 153 SER C C 153 177.152 177.152 174.060 3.092 19854 2749 1 3 . 1 1 153 153 SER CA C 153 62.192 62.192 58.731 3.461 19854 2750 1 3 . 1 1 153 153 SER CB C 153 66.291 66.291 63.941 2.349 19854 2751 1 3 . 1 1 153 153 SER H H 153 8.935 8.935 7.745 1.190 19854 2752 1 3 . 1 1 154 154 ASN N N 154 119.341 119.341 115.464 3.877 19854 2753 1 3 . 1 1 154 154 ASN C C 154 175.979 175.979 174.279 1.700 19854 2754 1 3 . 1 1 154 154 ASN CA C 154 49.894 49.894 54.501 -4.607 19854 2755 1 3 . 1 1 154 154 ASN CB C 154 39.353 39.353 36.255 3.098 19854 2756 1 3 . 1 1 154 154 ASN H H 154 7.488 7.488 8.311 -0.823 19854 2757 1 3 . 1 1 155 155 TYR N N 155 120.074 120.074 123.288 -3.214 19854 2758 1 3 . 1 1 155 155 TYR C C 155 177.144 177.144 175.246 1.898 19854 2759 1 3 . 1 1 155 155 TYR CA C 155 60.738 60.738 59.704 1.034 19854 2760 1 3 . 1 1 155 155 TYR CB C 155 41.402 41.402 38.553 2.849 19854 2761 1 3 . 1 1 155 155 TYR H H 155 7.945 7.945 7.583 0.362 19854 2762 1 3 . 1 1 156 156 ASN N N 156 124.058 124.058 122.771 1.287 19854 2763 1 3 . 1 1 156 156 ASN C C 156 175.679 175.679 176.431 -0.752 19854 2764 1 3 . 1 1 156 156 ASN CA C 156 53.121 53.121 54.664 -1.543 19854 2765 1 3 . 1 1 156 156 ASN CB C 156 38.179 38.179 35.783 2.396 19854 2766 1 3 . 1 1 156 156 ASN H H 156 8.192 8.192 8.857 -0.665 19854 2767 1 3 . 1 1 157 157 PHE N N 157 123.459 123.459 117.191 6.268 19854 2768 1 3 . 1 1 157 157 PHE C C 157 174.221 174.221 176.036 -1.815 19854 2769 1 3 . 1 1 157 157 PHE CA C 157 57.507 57.507 60.694 -3.187 19854 2770 1 3 . 1 1 157 157 PHE CB C 157 39.353 39.353 38.466 0.887 19854 2771 1 3 . 1 1 157 157 PHE H H 157 7.429 7.429 8.105 -0.676 19854 2772 1 3 . 1 1 158 158 GLU N N 158 112.568 112.568 117.241 -4.673 19854 2773 1 3 . 1 1 158 158 GLU C C 158 176.566 176.566 177.735 -1.169 19854 2774 1 3 . 1 1 158 158 GLU CA C 158 72.147 72.147 56.885 15.262 19854 2775 1 3 . 1 1 158 158 GLU CB C 158 27.640 27.640 28.721 -1.081 19854 2776 1 3 . 1 1 158 158 GLU H H 158 7.495 7.495 8.036 -0.541 19854 2777 1 3 . 1 1 159 159 LYS N N 159 113.232 113.232 119.771 -6.539 19854 2778 1 3 . 1 1 159 159 LYS C C 159 176.566 176.566 175.824 0.742 19854 2779 1 3 . 1 1 159 159 LYS CA C 159 53.993 53.993 61.543 -7.550 19854 2780 1 3 . 1 1 159 159 LYS CB C 159 33.496 33.496 30.116 3.381 19854 2781 1 3 . 1 1 159 159 LYS H H 159 6.862 6.862 7.367 -0.505 19854 2782 1 3 . 1 1 160 160 PRO C C 160 176.273 176.273 178.524 -2.251 19854 2783 1 3 . 1 1 160 160 PRO CA C 160 64.258 64.258 65.475 -1.218 19854 2784 1 3 . 1 1 160 160 PRO CB C 160 32.318 32.318 31.022 1.296 19854 2785 1 3 . 1 1 161 161 PHE N N 161 123.726 123.726 116.854 6.872 19854 2786 1 3 . 1 1 161 161 PHE C C 161 176.851 176.851 177.526 -0.675 19854 2787 1 3 . 1 1 161 161 PHE CA C 161 60.445 60.445 61.781 -1.336 19854 2788 1 3 . 1 1 161 161 PHE CB C 161 40.816 40.816 37.742 3.074 19854 2789 1 3 . 1 1 161 161 PHE H H 161 8.215 8.215 7.252 0.963 19854 2790 1 3 . 1 1 162 162 LEU N N 162 110.177 110.177 119.143 -8.966 19854 2791 1 3 . 1 1 162 162 LEU C C 162 176.273 176.273 178.727 -2.454 19854 2792 1 3 . 1 1 162 162 LEU CA C 162 55.750 55.750 57.881 -2.131 19854 2793 1 3 . 1 1 162 162 LEU CB C 162 44.037 44.037 41.467 2.570 19854 2794 1 3 . 1 1 162 162 LEU H H 162 7.527 7.527 7.742 -0.215 19854 2795 1 3 . 1 1 163 163 TRP N N 163 123.525 123.525 121.295 2.230 19854 2796 1 3 . 1 1 163 163 TRP C C 163 177.152 177.152 178.069 -0.917 19854 2797 1 3 . 1 1 163 163 TRP CA C 163 61.606 61.606 61.154 0.452 19854 2798 1 3 . 1 1 163 163 TRP CB C 163 28.811 28.811 29.788 -0.977 19854 2799 1 3 . 1 1 163 163 TRP H H 163 7.476 7.476 8.325 -0.849 19854 2800 1 3 . 1 1 164 164 LEU N N 164 119.740 119.740 118.819 0.921 19854 2801 1 3 . 1 1 164 164 LEU C C 164 175.686 175.686 178.830 -3.144 19854 2802 1 3 . 1 1 164 164 LEU CA C 164 61.020 61.020 57.796 3.224 19854 2803 1 3 . 1 1 164 164 LEU CB C 164 45.794 45.794 41.376 4.418 19854 2804 1 3 . 1 1 164 164 LEU H H 164 9.412 9.412 8.012 1.400 19854 2805 1 3 . 1 1 165 165 ALA N N 165 118.013 118.013 121.422 -3.409 19854 2806 1 3 . 1 1 165 165 ALA C C 165 165.723 165.723 179.525 -13.802 19854 2807 1 3 . 1 1 165 165 ALA CA C 165 52.236 52.236 55.167 -2.931 19854 2808 1 3 . 1 1 165 165 ALA CB C 165 21.784 21.784 18.056 3.728 19854 2809 1 3 . 1 1 165 165 ALA H H 165 7.707 7.707 8.204 -0.497 19854 2810 1 3 . 1 1 166 166 ARG N N 166 122.994 122.994 118.438 4.556 19854 2811 1 3 . 1 1 166 166 ARG C C 166 175.979 175.979 178.764 -2.785 19854 2812 1 3 . 1 1 166 166 ARG CA C 166 49.308 49.308 59.270 -9.962 19854 2813 1 3 . 1 1 166 166 ARG CB C 166 29.397 29.397 29.985 -0.588 19854 2814 1 3 . 1 1 166 166 ARG H H 166 8.692 8.692 8.033 0.659 19854 2815 1 3 . 1 1 167 167 LYS N N 167 112.568 112.568 120.250 -7.682 19854 2816 1 3 . 1 1 167 167 LYS C C 167 176.273 176.273 179.345 -3.072 19854 2817 1 3 . 1 1 167 167 LYS CA C 167 58.092 58.092 59.089 -0.997 19854 2818 1 3 . 1 1 167 167 LYS CB C 167 34.668 34.668 32.198 2.470 19854 2819 1 3 . 1 1 167 167 LYS H H 167 6.819 6.819 7.477 -0.658 19854 2820 1 3 . 1 1 168 168 LEU N N 168 114.959 114.959 119.751 -4.792 19854 2821 1 3 . 1 1 168 168 LEU C C 168 177.738 177.738 179.043 -1.305 19854 2822 1 3 . 1 1 168 168 LEU CA C 168 56.921 56.921 57.624 -0.703 19854 2823 1 3 . 1 1 168 168 LEU CB C 168 41.695 41.695 41.946 -0.251 19854 2824 1 3 . 1 1 168 168 LEU H H 168 7.269 7.269 7.877 -0.608 19854 2825 1 3 . 1 1 169 169 ILE N N 169 122.199 122.199 115.956 6.243 19854 2826 1 3 . 1 1 169 169 ILE C C 169 177.445 177.445 177.186 0.259 19854 2827 1 3 . 1 1 169 169 ILE CA C 169 63.375 63.375 63.271 0.104 19854 2828 1 3 . 1 1 169 169 ILE CB C 169 42.281 42.281 38.691 3.591 19854 2829 1 3 . 1 1 169 169 ILE H H 169 8.360 8.360 8.124 0.236 19854 2830 1 3 . 1 1 170 170 GLY N N 170 113.099 113.099 106.727 6.372 19854 2831 1 3 . 1 1 170 170 GLY C C 170 162.496 162.496 173.583 -11.087 19854 2832 1 3 . 1 1 170 170 GLY CA C 170 44.037 44.037 44.940 -0.903 19854 2833 1 3 . 1 1 170 170 GLY H H 170 6.686 6.686 7.884 -1.198 19854 2834 1 3 . 1 1 171 171 ASP N N 171 113.232 113.232 121.586 -8.354 19854 2835 1 3 . 1 1 171 171 ASP C C 171 178.910 178.910 175.542 3.368 19854 2836 1 3 . 1 1 171 171 ASP CA C 171 50.479 50.479 50.472 0.007 19854 2837 1 3 . 1 1 171 171 ASP CB C 171 41.109 41.109 41.763 -0.654 19854 2838 1 3 . 1 1 171 171 ASP H H 171 6.815 6.815 7.666 -0.851 19854 2839 1 3 . 1 1 172 172 PRO C C 172 176.566 176.566 177.137 -0.571 19854 2840 1 3 . 1 1 172 172 PRO CA C 172 63.965 63.965 64.295 -0.330 19854 2841 1 3 . 1 1 172 172 PRO CB C 172 31.732 31.732 32.124 -0.392 19854 2842 1 3 . 1 1 173 173 ASN N N 173 109.779 109.779 115.104 -5.325 19854 2843 1 3 . 1 1 173 173 ASN C C 173 175.979 175.979 174.949 1.030 19854 2844 1 3 . 1 1 173 173 ASN CA C 173 54.579 54.579 52.221 2.358 19854 2845 1 3 . 1 1 173 173 ASN CB C 173 36.424 36.424 39.158 -2.734 19854 2846 1 3 . 1 1 173 173 ASN H H 173 8.016 8.016 8.330 -0.314 19854 2847 1 3 . 1 1 174 174 LEU N N 174 109.248 109.248 122.901 -13.653 19854 2848 1 3 . 1 1 174 174 LEU C C 174 176.566 176.566 175.390 1.176 19854 2849 1 3 . 1 1 174 174 LEU CA C 174 56.336 56.336 56.008 0.327 19854 2850 1 3 . 1 1 174 174 LEU CB C 174 44.037 44.037 42.772 1.265 19854 2851 1 3 . 1 1 174 174 LEU H H 174 7.871 7.871 7.297 0.574 19854 2852 1 3 . 1 1 175 175 GLU N N 175 125.185 125.185 126.244 -1.059 19854 2853 1 3 . 1 1 175 175 GLU C C 175 177.445 177.445 174.851 2.594 19854 2854 1 3 . 1 1 175 175 GLU CA C 175 76.247 76.247 54.057 22.190 19854 2855 1 3 . 1 1 175 175 GLU CB C 175 28.811 28.811 34.027 -5.216 19854 2856 1 3 . 1 1 175 175 GLU H H 175 9.127 9.127 8.325 0.802 19854 2857 1 3 . 1 1 176 176 PHE N N 176 136.873 136.873 124.234 12.639 19854 2858 1 3 . 1 1 176 176 PHE C C 176 178.617 178.617 175.413 3.204 19854 2859 1 3 . 1 1 176 176 PHE CA C 176 59.264 59.264 58.235 1.029 19854 2860 1 3 . 1 1 176 176 PHE CB C 176 44.623 44.623 40.118 4.505 19854 2861 1 3 . 1 1 176 176 PHE H H 176 10.058 10.058 8.592 1.466 19854 2862 1 3 . 1 1 177 177 VAL N N 177 118.877 118.877 123.950 -5.073 19854 2863 1 3 . 1 1 177 177 VAL C C 177 177.445 177.445 174.241 3.204 19854 2864 1 3 . 1 1 177 177 VAL CA C 177 62.777 62.777 59.118 3.659 19854 2865 1 3 . 1 1 177 177 VAL CB C 177 34.668 34.668 33.950 0.718 19854 2866 1 3 . 1 1 177 177 VAL H H 177 7.789 7.789 7.958 -0.169 19854 2867 1 3 . 1 1 178 178 ALA N N 178 123.859 123.859 126.061 -2.202 19854 2868 1 3 . 1 1 178 178 ALA C C 178 177.144 177.144 177.169 -0.025 19854 2869 1 3 . 1 1 178 178 ALA CA C 178 54.000 54.000 54.788 -0.788 19854 2870 1 3 . 1 1 178 178 ALA CB C 178 15.035 15.035 18.922 -3.887 19854 2871 1 3 . 1 1 178 178 ALA H H 178 7.683 7.683 8.224 -0.541 19854 2872 1 3 . 1 1 179 179 MET N N 179 121.668 121.668 116.024 5.644 19854 2873 1 3 . 1 1 179 179 MET C C 179 177.144 177.144 173.542 3.602 19854 2874 1 3 . 1 1 179 179 MET CA C 179 60.445 60.445 53.045 7.400 19854 2875 1 3 . 1 1 179 179 MET CB C 179 39.351 39.351 34.201 5.150 19854 2876 1 3 . 1 1 179 179 MET H H 179 7.648 7.648 7.613 0.035 19854 2877 1 3 . 1 1 180 180 PRO C C 180 177.445 177.445 175.349 2.096 19854 2878 1 3 . 1 1 180 180 PRO CA C 180 64.844 64.844 62.653 2.191 19854 2879 1 3 . 1 1 180 180 PRO CB C 180 29.974 29.974 32.307 -2.333 19854 2880 1 3 . 1 1 181 181 ALA N N 181 128.439 128.439 127.150 1.289 19854 2881 1 3 . 1 1 181 181 ALA C C 181 176.273 176.273 176.797 -0.524 19854 2882 1 3 . 1 1 181 181 ALA CA C 181 58.092 58.092 51.425 6.667 19854 2883 1 3 . 1 1 181 181 ALA CB C 181 21.198 21.198 19.138 2.060 19854 2884 1 3 . 1 1 181 181 ALA H H 181 8.673 8.673 8.477 0.196 19854 2885 1 3 . 1 1 182 182 LEU N N 182 122.130 122.130 123.397 -1.267 19854 2886 1 3 . 1 1 182 182 LEU C C 182 177.445 177.445 176.871 0.574 19854 2887 1 3 . 1 1 182 182 LEU CA C 182 55.164 55.164 53.920 1.244 19854 2888 1 3 . 1 1 182 182 LEU CB C 182 42.866 42.866 43.552 -0.686 19854 2889 1 3 . 1 1 182 182 LEU H H 182 8.821 8.821 8.449 0.372 19854 2890 1 3 . 1 1 183 183 ALA N N 183 121.004 121.004 124.628 -3.624 19854 2891 1 3 . 1 1 183 183 ALA C C 183 178.617 178.617 175.584 3.033 19854 2892 1 3 . 1 1 183 183 ALA CA C 183 57.808 57.808 50.874 6.934 19854 2893 1 3 . 1 1 183 183 ALA CB C 183 24.117 24.117 18.343 5.774 19854 2894 1 3 . 1 1 183 183 ALA H H 183 8.356 8.356 8.461 -0.105 19854 2895 1 3 . 1 1 184 184 PRO C C 184 177.152 177.152 175.488 1.664 19854 2896 1 3 . 1 1 184 184 PRO CA C 184 64.258 64.258 62.003 2.255 19854 2897 1 3 . 1 1 184 184 PRO CB C 184 29.681 29.681 31.364 -1.683 19854 2898 1 3 . 1 1 185 185 PRO C C 185 175.686 175.686 176.802 -1.116 19854 2899 1 3 . 1 1 185 185 PRO CA C 185 63.379 63.379 62.531 0.848 19854 2900 1 3 . 1 1 185 185 PRO CB C 185 35.248 35.248 32.712 2.536 19854 2901 1 3 . 1 1 186 186 GLU N N 186 120.539 120.539 119.665 0.874 19854 2902 1 3 . 1 1 186 186 GLU C C 186 176.273 176.273 176.150 0.123 19854 2903 1 3 . 1 1 186 186 GLU CA C 186 58.101 58.101 57.513 0.588 19854 2904 1 3 . 1 1 186 186 GLU CB C 186 35.836 35.836 29.660 6.176 19854 2905 1 3 . 1 1 186 186 GLU H H 186 8.086 8.086 8.453 -0.367 19854 2906 1 3 . 1 1 187 187 VAL N N 187 124.455 124.455 119.127 5.328 19854 2907 1 3 . 1 1 187 187 VAL C C 187 178.910 178.910 174.941 3.969 19854 2908 1 3 . 1 1 187 187 VAL CA C 187 63.363 63.363 62.884 0.479 19854 2909 1 3 . 1 1 187 187 VAL CB C 187 34.082 34.082 31.456 2.626 19854 2910 1 3 . 1 1 187 187 VAL H H 187 8.622 8.622 7.762 0.860 19854 2911 1 3 . 1 1 188 188 VAL N N 188 128.572 128.572 127.437 1.135 19854 2912 1 3 . 1 1 188 188 VAL C C 188 178.324 178.324 177.122 1.202 19854 2913 1 3 . 1 1 188 188 VAL CA C 188 68.634 68.634 62.512 6.122 19854 2914 1 3 . 1 1 188 188 VAL CB C 188 31.154 31.154 31.976 -0.822 19854 2915 1 3 . 1 1 188 188 VAL H H 188 8.497 8.497 8.034 0.463 19854 2916 1 3 . 1 1 189 189 MET N N 189 122.795 122.795 118.468 4.327 19854 2917 1 3 . 1 1 189 189 MET C C 189 177.445 177.445 175.524 1.921 19854 2918 1 3 . 1 1 189 189 MET CA C 189 55.164 55.164 57.924 -2.760 19854 2919 1 3 . 1 1 189 189 MET CB C 189 35.253 35.253 31.685 3.568 19854 2920 1 3 . 1 1 189 189 MET H H 189 6.991 6.991 8.427 -1.436 19854 2921 1 3 . 1 1 190 190 ASP N N 190 114.959 114.959 113.555 1.404 19854 2922 1 3 . 1 1 190 190 ASP C C 190 175.686 175.686 175.879 -0.193 19854 2923 1 3 . 1 1 190 190 ASP CA C 190 51.065 51.065 55.001 -3.936 19854 2924 1 3 . 1 1 190 190 ASP CB C 190 41.695 41.695 38.584 3.111 19854 2925 1 3 . 1 1 190 190 ASP H H 190 7.210 7.210 8.659 -1.449 19854 2926 1 3 . 1 1 191 191 PRO C C 191 176.566 176.566 177.810 -1.244 19854 2927 1 3 . 1 1 191 191 PRO CA C 191 63.965 63.965 64.536 -0.571 19854 2928 1 3 . 1 1 191 191 PRO CB C 191 31.146 31.146 31.490 -0.344 19854 2929 1 3 . 1 1 192 192 ALA N N 192 109.513 109.513 120.727 -11.214 19854 2930 1 3 . 1 1 192 192 ALA CA C 192 53.993 53.993 54.298 -0.305 19854 2931 1 3 . 1 1 192 192 ALA CB C 192 19.441 19.441 18.239 1.202 19854 2932 1 3 . 1 1 192 192 ALA H H 192 7.394 7.394 7.963 -0.569 19854 2933 1 3 . 1 1 193 193 LEU N N 193 119.009 119.009 117.203 1.806 19854 2934 1 3 . 1 1 193 193 LEU C C 193 175.979 175.979 177.176 -1.197 19854 2935 1 3 . 1 1 193 193 LEU CA C 193 56.336 56.336 55.805 0.531 19854 2936 1 3 . 1 1 193 193 LEU CB C 193 42.866 42.866 41.907 0.959 19854 2937 1 3 . 1 1 193 193 LEU H H 193 8.340 8.340 7.848 0.492 19854 2938 1 3 . 1 1 194 194 ALA N N 194 121.666 121.666 119.274 2.392 19854 2939 1 3 . 1 1 194 194 ALA C C 194 166.896 166.896 177.839 -10.943 19854 2940 1 3 . 1 1 194 194 ALA CA C 194 55.164 55.164 52.508 2.656 19854 2941 1 3 . 1 1 194 194 ALA CB C 194 16.513 16.513 19.354 -2.841 19854 2942 1 3 . 1 1 194 194 ALA H H 194 8.176 8.176 7.429 0.747 19854 2943 1 3 . 1 1 195 195 ALA N N 195 119.541 119.541 119.634 -0.093 19854 2944 1 3 . 1 1 195 195 ALA C C 195 173.928 173.928 179.264 -5.336 19854 2945 1 3 . 1 1 195 195 ALA CA C 195 57.507 57.507 54.399 3.108 19854 2946 1 3 . 1 1 195 195 ALA CB C 195 19.441 19.441 17.190 2.251 19854 2947 1 3 . 1 1 195 195 ALA H H 195 8.364 8.364 8.694 -0.330 19854 2948 1 3 . 1 1 196 196 GLN N N 196 107.322 107.322 118.895 -11.573 19854 2949 1 3 . 1 1 196 196 GLN C C 196 176.273 176.273 178.003 -1.730 19854 2950 1 3 . 1 1 196 196 GLN CA C 196 56.921 56.921 58.660 -1.739 19854 2951 1 3 . 1 1 196 196 GLN CB C 196 29.983 29.983 28.733 1.250 19854 2952 1 3 . 1 1 196 196 GLN H H 196 7.910 7.910 7.806 0.104 19854 2953 1 3 . 1 1 197 197 TYR N N 197 119.277 119.277 117.938 1.339 19854 2954 1 3 . 1 1 197 197 TYR C C 197 178.316 178.316 178.355 -0.039 19854 2955 1 3 . 1 1 197 197 TYR CA C 197 56.343 56.343 60.635 -4.292 19854 2956 1 3 . 1 1 197 197 TYR CB C 197 43.453 43.453 37.576 5.877 19854 2957 1 3 . 1 1 197 197 TYR H H 197 8.180 8.180 8.286 -0.106 19854 2958 1 3 . 1 1 198 198 GLU N N 198 110.244 110.244 119.399 -9.155 19854 2959 1 3 . 1 1 198 198 GLU C C 198 176.273 176.273 178.895 -2.622 19854 2960 1 3 . 1 1 198 198 GLU CA C 198 53.407 53.407 59.312 -5.904 19854 2961 1 3 . 1 1 198 198 GLU CB C 198 30.568 30.568 29.250 1.318 19854 2962 1 3 . 1 1 198 198 GLU H H 198 7.523 7.523 7.955 -0.432 19854 2963 1 3 . 1 1 199 199 HIS N N 199 119.211 119.211 119.513 -0.302 19854 2964 1 3 . 1 1 199 199 HIS C C 199 178.902 178.902 177.246 1.656 19854 2965 1 3 . 1 1 199 199 HIS CA C 199 58.687 58.687 59.252 -0.565 19854 2966 1 3 . 1 1 199 199 HIS CB C 199 34.957 34.957 29.754 5.203 19854 2967 1 3 . 1 1 199 199 HIS H H 199 8.258 8.258 7.647 0.611 19854 2968 1 3 . 1 1 200 200 ASP N N 200 124.722 124.722 120.118 4.604 19854 2969 1 3 . 1 1 200 200 ASP C C 200 176.705 176.705 178.870 -2.165 19854 2970 1 3 . 1 1 200 200 ASP CA C 200 58.687 58.687 57.261 1.426 19854 2971 1 3 . 1 1 200 200 ASP CB C 200 39.644 39.644 40.457 -0.813 19854 2972 1 3 . 1 1 200 200 ASP H H 200 8.086 8.086 7.889 0.197 19854 2973 1 3 . 1 1 201 201 LEU N N 201 116.353 116.353 120.253 -3.900 19854 2974 1 3 . 1 1 201 201 LEU C C 201 178.910 178.910 179.001 -0.091 19854 2975 1 3 . 1 1 201 201 LEU CA C 201 61.606 61.606 58.237 3.369 19854 2976 1 3 . 1 1 201 201 LEU CB C 201 41.109 41.109 41.782 -0.673 19854 2977 1 3 . 1 1 201 201 LEU H H 201 7.722 7.722 8.055 -0.333 19854 2978 1 3 . 1 1 202 202 GLU N N 202 118.080 118.080 119.244 -1.164 19854 2979 1 3 . 1 1 202 202 GLU C C 202 176.566 176.566 179.090 -2.524 19854 2980 1 3 . 1 1 202 202 GLU CA C 202 56.921 56.921 59.673 -2.752 19854 2981 1 3 . 1 1 202 202 GLU CB C 202 30.568 30.568 29.543 1.025 19854 2982 1 3 . 1 1 202 202 GLU H H 202 8.857 8.857 7.875 0.982 19854 2983 1 3 . 1 1 203 203 VAL N N 203 129.369 129.369 117.338 12.031 19854 2984 1 3 . 1 1 203 203 VAL C C 203 178.617 178.617 177.503 1.114 19854 2985 1 3 . 1 1 203 203 VAL CA C 203 64.534 64.534 66.008 -1.474 19854 2986 1 3 . 1 1 203 203 VAL CB C 203 27.640 27.640 30.715 -3.075 19854 2987 1 3 . 1 1 203 203 VAL H H 203 9.283 9.283 7.516 1.767 19854 2988 1 3 . 1 1 204 204 ALA N N 204 109.580 109.580 122.750 -13.170 19854 2989 1 3 . 1 1 204 204 ALA C C 204 176.859 176.859 179.547 -2.688 19854 2990 1 3 . 1 1 204 204 ALA CA C 204 54.579 54.579 54.805 -0.226 19854 2991 1 3 . 1 1 204 204 ALA CB C 204 18.270 18.270 18.399 -0.129 19854 2992 1 3 . 1 1 204 204 ALA H H 204 8.528 8.528 7.992 0.536 19854 2993 1 3 . 1 1 205 205 GLN N N 205 123.328 123.328 116.340 6.988 19854 2994 1 3 . 1 1 205 205 GLN C C 205 177.418 177.418 178.180 -0.762 19854 2995 1 3 . 1 1 205 205 GLN CA C 205 57.515 57.515 58.458 -0.943 19854 2996 1 3 . 1 1 205 205 GLN CB C 205 33.785 33.785 29.057 4.728 19854 2997 1 3 . 1 1 205 205 GLN H H 205 8.160 8.160 8.009 0.151 19854 2998 1 3 . 1 1 206 206 THR N N 206 120.271 120.271 113.736 6.535 19854 2999 1 3 . 1 1 206 206 THR C C 206 176.273 176.273 175.356 0.917 19854 3000 1 3 . 1 1 206 206 THR CA C 206 67.462 67.462 64.586 2.876 19854 3001 1 3 . 1 1 206 206 THR CB C 206 70.390 70.390 69.120 1.270 19854 3002 1 3 . 1 1 206 206 THR H H 206 7.585 7.585 7.776 -0.191 19854 3003 1 3 . 1 1 207 207 THR N N 207 111.970 111.970 119.160 -7.190 19854 3004 1 3 . 1 1 207 207 THR C C 207 176.566 176.566 173.852 2.714 19854 3005 1 3 . 1 1 207 207 THR CA C 207 64.534 64.534 63.525 1.009 19854 3006 1 3 . 1 1 207 207 THR CB C 207 72.733 72.733 69.551 3.182 19854 3007 1 3 . 1 1 207 207 THR H H 207 7.468 7.468 7.551 -0.083 19854 3008 1 3 . 1 1 208 208 ALA N N 208 115.623 115.623 127.852 -12.229 19854 3009 1 3 . 1 1 208 208 ALA C C 208 168.947 168.947 177.187 -8.240 19854 3010 1 3 . 1 1 208 208 ALA CA C 208 55.164 55.164 51.925 3.239 19854 3011 1 3 . 1 1 208 208 ALA CB C 208 22.369 22.369 19.353 3.016 19854 3012 1 3 . 1 1 208 208 ALA H H 208 7.390 7.390 8.263 -0.873 19854 3013 1 3 . 1 1 209 209 LEU N N 209 117.814 117.814 124.716 -6.902 19854 3014 1 3 . 1 1 209 209 LEU C C 209 176.273 176.273 175.009 1.264 19854 3015 1 3 . 1 1 209 209 LEU CA C 209 58.678 58.678 52.846 5.832 19854 3016 1 3 . 1 1 209 209 LEU CB C 209 46.380 46.380 42.124 4.255 19854 3017 1 3 . 1 1 209 209 LEU H H 209 7.652 7.652 8.255 -0.603 19854 3018 1 3 . 1 1 210 210 PRO C C 210 176.566 176.566 175.605 0.961 19854 3019 1 3 . 1 1 210 210 PRO CA C 210 63.086 63.086 62.365 0.721 19854 3020 1 3 . 1 1 210 210 PRO CB C 210 31.146 31.146 32.443 -1.297 19854 3021 1 3 . 1 1 211 211 ASP N N 211 122.863 122.863 123.235 -0.372 19854 3022 1 3 . 1 1 211 211 ASP C C 211 175.686 175.686 176.311 -0.625 19854 3023 1 3 . 1 1 211 211 ASP CA C 211 56.343 56.343 54.019 2.324 19854 3024 1 3 . 1 1 211 211 ASP CB C 211 41.402 41.402 41.420 -0.018 19854 3025 1 3 . 1 1 211 211 ASP H H 211 8.360 8.360 8.421 -0.061 19854 3026 1 3 . 1 1 212 212 GLU N N 212 131.162 131.162 125.898 5.264 19854 3027 1 3 . 1 1 212 212 GLU C C 212 176.273 176.273 176.751 -0.478 19854 3028 1 3 . 1 1 212 212 GLU CA C 212 55.164 55.164 57.760 -2.596 19854 3029 1 3 . 1 1 212 212 GLU CB C 212 30.568 30.568 31.813 -1.245 19854 3030 1 3 . 1 1 212 212 GLU H H 212 8.399 8.399 8.376 0.023 19854 3031 1 3 . 1 1 213 213 ASP N N 213 122.797 122.797 117.520 5.277 19854 3032 1 3 . 1 1 213 213 ASP C C 213 177.152 177.152 177.426 -0.274 19854 3033 1 3 . 1 1 213 213 ASP CA C 213 61.914 61.914 53.536 8.378 19854 3034 1 3 . 1 1 213 213 ASP CB C 213 49.607 49.607 40.468 9.139 19854 3035 1 3 . 1 1 213 213 ASP H H 213 8.168 8.168 8.443 -0.275 19854 3036 1 3 . 1 1 214 214 ASP N N 214 112.369 112.369 121.752 -9.383 19854 3037 1 3 . 1 1 214 214 ASP C C 214 178.910 178.910 177.177 1.733 19854 3038 1 3 . 1 1 214 214 ASP CA C 214 54.579 54.579 56.845 -2.266 19854 3039 1 3 . 1 1 214 214 ASP CB C 214 39.353 39.353 40.252 -0.899 19854 3040 1 3 . 1 1 214 214 ASP H H 214 7.464 7.464 8.063 -0.599 19854 3041 1 3 . 1 1 215 215 ASP N N 215 127.244 127.244 118.850 8.394 19854 3042 1 3 . 1 1 215 215 ASP C C 215 176.859 176.859 177.084 -0.225 19854 3043 1 3 . 1 1 215 215 ASP CA C 215 54.579 54.579 55.955 -1.376 19854 3044 1 3 . 1 1 215 215 ASP CB C 215 40.524 40.524 40.926 -0.402 19854 3045 1 3 . 1 1 215 215 ASP H H 215 8.301 8.301 8.303 -0.002 19854 3046 1 4 . 1 1 2 2 ALA N N 2 131.228 131.228 123.340 7.888 19854 3047 1 4 . 1 1 2 2 ALA C C 2 187.031 187.031 179.449 7.582 19854 3048 1 4 . 1 1 2 2 ALA CA C 2 53.407 53.407 55.101 -1.694 19854 3049 1 4 . 1 1 2 2 ALA CB C 2 20.027 20.027 18.289 1.738 19854 3050 1 4 . 1 1 2 2 ALA H H 2 10.644 10.644 8.320 2.324 19854 3051 1 4 . 1 1 3 3 ALA N N 3 124.521 124.521 120.421 4.100 19854 3052 1 4 . 1 1 3 3 ALA C C 3 176.566 176.566 179.126 -2.560 19854 3053 1 4 . 1 1 3 3 ALA CA C 3 49.894 49.894 54.375 -4.481 19854 3054 1 4 . 1 1 3 3 ALA CB C 3 18.270 18.270 17.939 0.331 19854 3055 1 4 . 1 1 3 3 ALA H H 3 8.669 8.669 7.986 0.683 19854 3056 1 4 . 1 1 4 4 GLN N N 4 118.080 118.080 117.025 1.055 19854 3057 1 4 . 1 1 4 4 GLN C C 4 176.273 176.273 177.225 -0.952 19854 3058 1 4 . 1 1 4 4 GLN CA C 4 54.579 54.579 56.342 -1.763 19854 3059 1 4 . 1 1 4 4 GLN CB C 4 27.054 27.054 29.116 -2.062 19854 3060 1 4 . 1 1 4 4 GLN H H 4 8.919 8.919 8.056 0.863 19854 3061 1 4 . 1 1 5 5 GLY N N 5 121.002 121.002 106.436 14.566 19854 3062 1 4 . 1 1 5 5 GLY C C 5 181.877 181.877 173.747 8.130 19854 3063 1 4 . 1 1 5 5 GLY CA C 5 45.794 45.794 44.946 0.848 19854 3064 1 4 . 1 1 5 5 GLY H H 5 8.082 8.082 8.177 -0.095 19854 3065 1 4 . 1 1 6 6 GLU N N 6 129.435 129.435 120.838 8.597 19854 3066 1 4 . 1 1 6 6 GLU C C 6 176.566 176.566 174.438 2.128 19854 3067 1 4 . 1 1 6 6 GLU CA C 6 56.336 56.336 52.925 3.411 19854 3068 1 4 . 1 1 6 6 GLU CB C 6 28.811 28.811 29.835 -1.024 19854 3069 1 4 . 1 1 6 6 GLU H H 6 9.267 9.267 7.931 1.336 19854 3070 1 4 . 1 1 7 7 PRO C C 7 176.566 176.566 176.162 0.404 19854 3071 1 4 . 1 1 7 7 PRO CA C 7 63.672 63.672 62.680 0.992 19854 3072 1 4 . 1 1 7 7 PRO CB C 7 31.146 31.146 30.806 0.340 19854 3073 1 4 . 1 1 8 8 GLN N N 8 112.502 112.502 114.389 -1.887 19854 3074 1 4 . 1 1 8 8 GLN C C 8 177.445 177.445 174.690 2.755 19854 3075 1 4 . 1 1 8 8 GLN CA C 8 50.479 50.479 58.574 -8.095 19854 3076 1 4 . 1 1 8 8 GLN CB C 8 28.811 28.811 26.912 1.899 19854 3077 1 4 . 1 1 8 8 GLN H H 8 6.220 6.220 8.666 -2.446 19854 3078 1 4 . 1 1 9 9 VAL N N 9 117.416 117.416 122.574 -5.158 19854 3079 1 4 . 1 1 9 9 VAL C C 9 178.324 178.324 174.379 3.945 19854 3080 1 4 . 1 1 9 9 VAL CA C 9 63.363 63.363 62.188 1.175 19854 3081 1 4 . 1 1 9 9 VAL CB C 9 34.668 34.668 32.537 2.131 19854 3082 1 4 . 1 1 9 9 VAL H H 9 6.561 6.561 7.780 -1.219 19854 3083 1 4 . 1 1 10 10 GLN N N 10 113.896 113.896 125.544 -11.648 19854 3084 1 4 . 1 1 10 10 GLN C C 10 176.273 176.273 174.096 2.177 19854 3085 1 4 . 1 1 10 10 GLN CA C 10 55.164 55.164 53.779 1.385 19854 3086 1 4 . 1 1 10 10 GLN CB C 10 28.226 28.226 32.642 -4.416 19854 3087 1 4 . 1 1 10 10 GLN H H 10 7.847 7.847 8.130 -0.283 19854 3088 1 4 . 1 1 11 11 PHE N N 11 118.744 118.744 124.229 -5.485 19854 3089 1 4 . 1 1 11 11 PHE C C 11 176.566 176.566 174.647 1.919 19854 3090 1 4 . 1 1 11 11 PHE CA C 11 59.849 59.849 56.229 3.620 19854 3091 1 4 . 1 1 11 11 PHE CB C 11 41.109 41.109 42.864 -1.755 19854 3092 1 4 . 1 1 11 11 PHE H H 11 8.262 8.262 8.983 -0.721 19854 3093 1 4 . 1 1 12 12 LYS N N 12 129.437 129.437 125.684 3.753 19854 3094 1 4 . 1 1 12 12 LYS C C 12 178.609 178.609 174.893 3.716 19854 3095 1 4 . 1 1 12 12 LYS CA C 12 57.808 57.808 55.852 1.956 19854 3096 1 4 . 1 1 12 12 LYS H H 12 10.015 10.015 8.950 1.065 19854 3097 1 4 . 1 1 13 13 LEU N N 13 112.103 112.103 129.458 -17.355 19854 3098 1 4 . 1 1 13 13 LEU C C 13 177.738 177.738 174.646 3.092 19854 3099 1 4 . 1 1 13 13 LEU CA C 13 54.579 54.579 53.334 1.245 19854 3100 1 4 . 1 1 13 13 LEU CB C 13 42.866 42.866 46.374 -3.508 19854 3101 1 4 . 1 1 13 13 LEU H H 13 6.905 6.905 9.102 -2.197 19854 3102 1 4 . 1 1 14 14 VAL N N 14 127.310 127.310 126.232 1.078 19854 3103 1 4 . 1 1 14 14 VAL C C 14 175.393 175.393 174.510 0.883 19854 3104 1 4 . 1 1 14 14 VAL CA C 14 70.976 70.976 61.644 9.332 19854 3105 1 4 . 1 1 14 14 VAL CB C 14 28.811 28.811 33.560 -4.749 19854 3106 1 4 . 1 1 14 14 VAL H H 14 8.305 8.305 8.715 -0.410 19854 3107 1 4 . 1 1 15 15 LEU N N 15 128.640 128.640 130.147 -1.507 19854 3108 1 4 . 1 1 15 15 LEU C C 15 177.730 177.730 176.041 1.689 19854 3109 1 4 . 1 1 15 15 LEU CA C 15 55.758 55.758 54.121 1.637 19854 3110 1 4 . 1 1 15 15 LEU H H 15 7.718 7.718 8.915 -1.197 19854 3111 1 4 . 1 1 16 16 VAL N N 16 121.267 121.267 118.805 2.462 19854 3112 1 4 . 1 1 16 16 VAL C C 16 178.324 178.324 174.399 3.925 19854 3113 1 4 . 1 1 16 16 VAL CA C 16 63.363 63.363 58.605 4.758 19854 3114 1 4 . 1 1 16 16 VAL CB C 16 35.839 35.839 35.289 0.550 19854 3115 1 4 . 1 1 16 16 VAL H H 16 8.935 8.935 8.835 0.100 19854 3116 1 4 . 1 1 17 17 GLY N N 17 127.908 127.908 107.066 20.842 19854 3117 1 4 . 1 1 17 17 GLY C C 17 174.514 174.514 172.919 1.595 19854 3118 1 4 . 1 1 17 17 GLY CA C 17 42.281 42.281 44.553 -2.272 19854 3119 1 4 . 1 1 17 17 GLY H H 17 9.682 9.682 6.815 2.867 19854 3120 1 4 . 1 1 18 18 ASP N N 18 125.054 125.054 121.389 3.665 19854 3121 1 4 . 1 1 18 18 ASP C C 18 176.851 176.851 177.528 -0.677 19854 3122 1 4 . 1 1 18 18 ASP CA C 18 57.515 57.515 54.552 2.963 19854 3123 1 4 . 1 1 18 18 ASP CB C 18 46.090 46.090 42.024 4.066 19854 3124 1 4 . 1 1 18 18 ASP H H 18 8.282 8.282 8.350 -0.068 19854 3125 1 4 . 1 1 19 19 GLY N N 19 120.670 120.670 106.796 13.874 19854 3126 1 4 . 1 1 19 19 GLY C C 19 178.324 178.324 174.980 3.344 19854 3127 1 4 . 1 1 19 19 GLY CA C 19 42.281 42.281 45.944 -3.663 19854 3128 1 4 . 1 1 19 19 GLY H H 19 8.825 8.825 8.634 0.191 19854 3129 1 4 . 1 1 20 20 GLY N N 20 129.369 129.369 112.116 17.253 19854 3130 1 4 . 1 1 20 20 GLY C C 20 174.221 174.221 175.985 -1.764 19854 3131 1 4 . 1 1 20 20 GLY CA C 20 41.695 41.695 45.684 -3.989 19854 3132 1 4 . 1 1 20 20 GLY H H 20 8.477 8.477 8.587 -0.110 19854 3133 1 4 . 1 1 21 21 THR N N 21 122.199 122.199 114.051 8.148 19854 3134 1 4 . 1 1 21 21 THR C C 21 171.291 171.291 175.135 -3.844 19854 3135 1 4 . 1 1 21 21 THR CA C 21 61.914 61.914 64.599 -2.685 19854 3136 1 4 . 1 1 21 21 THR CB C 21 65.137 65.137 69.247 -4.110 19854 3137 1 4 . 1 1 21 21 THR H H 21 8.059 8.059 7.649 0.410 19854 3138 1 4 . 1 1 22 22 GLY N N 22 112.369 112.369 108.200 4.169 19854 3139 1 4 . 1 1 22 22 GLY C C 22 184.807 184.807 175.462 9.345 19854 3140 1 4 . 1 1 22 22 GLY CA C 22 45.209 45.209 45.050 0.159 19854 3141 1 4 . 1 1 22 22 GLY H H 22 6.772 6.772 8.296 -1.524 19854 3142 1 4 . 1 1 23 23 LYS N N 23 122.066 122.066 120.591 1.475 19854 3143 1 4 . 1 1 23 23 LYS C C 23 178.589 178.589 178.228 0.361 19854 3144 1 4 . 1 1 23 23 LYS CA C 23 58.101 58.101 59.864 -1.763 19854 3145 1 4 . 1 1 23 23 LYS CB C 23 40.230 40.230 32.409 7.821 19854 3146 1 4 . 1 1 23 23 LYS H H 23 7.441 7.441 7.586 -0.145 19854 3147 1 4 . 1 1 24 24 THR N N 24 114.627 114.627 114.063 0.564 19854 3148 1 4 . 1 1 24 24 THR C C 24 178.324 178.324 176.817 1.507 19854 3149 1 4 . 1 1 24 24 THR CA C 24 62.192 62.192 67.115 -4.923 19854 3150 1 4 . 1 1 24 24 THR CB C 24 71.562 71.562 68.146 3.416 19854 3151 1 4 . 1 1 24 24 THR H H 24 8.469 8.469 8.504 -0.035 19854 3152 1 4 . 1 1 25 25 THR N N 25 110.377 110.377 119.141 -8.764 19854 3153 1 4 . 1 1 25 25 THR C C 25 178.324 178.324 176.072 2.252 19854 3154 1 4 . 1 1 25 25 THR CA C 25 64.534 64.534 67.472 -2.938 19854 3155 1 4 . 1 1 25 25 THR CB C 25 71.562 71.562 68.398 3.164 19854 3156 1 4 . 1 1 25 25 THR H H 25 8.415 8.415 8.168 0.247 19854 3157 1 4 . 1 1 26 26 PHE N N 26 114.295 114.295 122.479 -8.184 19854 3158 1 4 . 1 1 26 26 PHE C C 26 174.514 174.514 176.957 -2.443 19854 3159 1 4 . 1 1 26 26 PHE CA C 26 53.407 53.407 61.943 -8.536 19854 3160 1 4 . 1 1 26 26 PHE CB C 26 40.524 40.524 39.188 1.336 19854 3161 1 4 . 1 1 26 26 PHE H H 26 7.707 7.707 8.431 -0.724 19854 3162 1 4 . 1 1 27 27 VAL N N 27 123.525 123.525 119.803 3.722 19854 3163 1 4 . 1 1 27 27 VAL C C 27 178.031 178.031 177.602 0.429 19854 3164 1 4 . 1 1 27 27 VAL CA C 27 67.462 67.462 67.250 0.212 19854 3165 1 4 . 1 1 27 27 VAL CB C 27 29.397 29.397 31.473 -2.076 19854 3166 1 4 . 1 1 27 27 VAL H H 27 6.967 6.967 8.234 -1.267 19854 3167 1 4 . 1 1 28 28 LYS N N 28 114.228 114.228 119.825 -5.597 19854 3168 1 4 . 1 1 28 28 LYS C C 28 176.566 176.566 178.252 -1.686 19854 3169 1 4 . 1 1 28 28 LYS CA C 28 58.092 58.092 59.731 -1.639 19854 3170 1 4 . 1 1 28 28 LYS CB C 28 34.082 34.082 32.188 1.894 19854 3171 1 4 . 1 1 28 28 LYS H H 28 7.429 7.429 8.183 -0.754 19854 3172 1 4 . 1 1 29 29 ARG N N 29 112.037 112.037 119.293 -7.256 19854 3173 1 4 . 1 1 29 29 ARG C C 29 174.221 174.221 179.055 -4.834 19854 3174 1 4 . 1 1 29 29 ARG CA C 29 72.147 72.147 58.969 13.178 19854 3175 1 4 . 1 1 29 29 ARG CB C 29 37.596 37.596 29.563 8.033 19854 3176 1 4 . 1 1 29 29 ARG H H 29 6.803 6.803 7.836 -1.033 19854 3177 1 4 . 1 1 30 30 HIS N N 30 122.396 122.396 117.231 5.165 19854 3178 1 4 . 1 1 30 30 HIS C C 30 172.170 172.170 177.114 -4.944 19854 3179 1 4 . 1 1 30 30 HIS CA C 30 51.651 51.651 59.272 -7.621 19854 3180 1 4 . 1 1 30 30 HIS CB C 30 30.568 30.568 29.865 0.703 19854 3181 1 4 . 1 1 30 30 HIS H H 30 7.644 7.644 7.631 0.013 19854 3182 1 4 . 1 1 31 31 LEU N N 31 110.377 110.377 119.472 -9.095 19854 3183 1 4 . 1 1 31 31 LEU C C 31 178.031 178.031 178.676 -0.645 19854 3184 1 4 . 1 1 31 31 LEU CA C 31 55.164 55.164 57.600 -2.436 19854 3185 1 4 . 1 1 31 31 LEU CB C 31 42.281 42.281 42.164 0.117 19854 3186 1 4 . 1 1 31 31 LEU H H 31 7.894 7.894 8.135 -0.241 19854 3187 1 4 . 1 1 32 32 THR N N 32 121.468 121.468 106.150 15.318 19854 3188 1 4 . 1 1 32 32 THR C C 32 170.705 170.705 175.589 -4.884 19854 3189 1 4 . 1 1 32 32 THR CA C 32 63.668 63.668 61.812 1.856 19854 3190 1 4 . 1 1 32 32 THR CB C 32 75.679 75.679 70.727 4.952 19854 3191 1 4 . 1 1 32 32 THR H H 32 8.372 8.372 8.194 0.178 19854 3192 1 4 . 1 1 33 33 GLY N N 33 127.841 127.841 110.761 17.080 19854 3193 1 4 . 1 1 33 33 GLY C C 33 161.914 161.914 174.144 -12.230 19854 3194 1 4 . 1 1 33 33 GLY CA C 33 42.866 42.866 44.827 -1.961 19854 3195 1 4 . 1 1 33 33 GLY H H 33 9.662 9.662 7.768 1.894 19854 3196 1 4 . 1 1 34 34 GLU N N 34 120.871 120.871 120.245 0.626 19854 3197 1 4 . 1 1 34 34 GLU C C 34 174.508 174.508 175.182 -0.674 19854 3198 1 4 . 1 1 34 34 GLU CA C 34 58.101 58.101 56.297 1.804 19854 3199 1 4 . 1 1 34 34 GLU CB C 34 34.371 34.371 30.747 3.624 19854 3200 1 4 . 1 1 34 34 GLU H H 34 8.211 8.211 7.416 0.795 19854 3201 1 4 . 1 1 35 35 PHE N N 35 111.838 111.838 119.240 -7.402 19854 3202 1 4 . 1 1 35 35 PHE C C 35 174.221 174.221 175.028 -0.807 19854 3203 1 4 . 1 1 35 35 PHE CA C 35 49.308 49.308 56.910 -7.602 19854 3204 1 4 . 1 1 35 35 PHE CB C 35 41.695 41.695 40.563 1.132 19854 3205 1 4 . 1 1 35 35 PHE H H 35 6.772 6.772 8.597 -1.825 19854 3206 1 4 . 1 1 36 36 GLU N N 36 120.672 120.672 124.951 -4.279 19854 3207 1 4 . 1 1 36 36 GLU C C 36 175.686 175.686 175.761 -0.075 19854 3208 1 4 . 1 1 36 36 GLU CA C 36 58.980 58.980 55.049 3.931 19854 3209 1 4 . 1 1 36 36 GLU CB C 36 48.140 48.140 30.477 17.663 19854 3210 1 4 . 1 1 36 36 GLU H H 36 8.293 8.293 8.677 -0.384 19854 3211 1 4 . 1 1 37 37 LYS N N 37 118.810 118.810 124.917 -6.107 19854 3212 1 4 . 1 1 37 37 LYS C C 37 172.756 172.756 175.947 -3.191 19854 3213 1 4 . 1 1 37 37 LYS CA C 37 48.137 48.137 56.584 -8.447 19854 3214 1 4 . 1 1 37 37 LYS CB C 37 37.010 37.010 33.076 3.934 19854 3215 1 4 . 1 1 37 37 LYS H H 37 8.509 8.509 8.451 0.058 19854 3216 1 4 . 1 1 38 38 LYS N N 38 108.052 108.052 120.214 -12.162 19854 3217 1 4 . 1 1 38 38 LYS C C 38 176.273 176.273 175.497 0.776 19854 3218 1 4 . 1 1 38 38 LYS CA C 38 59.849 59.849 55.588 4.261 19854 3219 1 4 . 1 1 38 38 LYS CB C 38 34.668 34.668 33.096 1.572 19854 3220 1 4 . 1 1 38 38 LYS H H 38 7.715 7.715 7.675 0.040 19854 3221 1 4 . 1 1 39 39 TYR N N 39 108.650 108.650 124.281 -15.631 19854 3222 1 4 . 1 1 39 39 TYR C C 39 175.686 175.686 175.767 -0.081 19854 3223 1 4 . 1 1 39 39 TYR CA C 39 61.020 61.020 58.191 2.829 19854 3224 1 4 . 1 1 39 39 TYR CB C 39 36.424 36.424 38.872 -2.448 19854 3225 1 4 . 1 1 39 39 TYR H H 39 7.362 7.362 8.695 -1.333 19854 3226 1 4 . 1 1 40 40 VAL N N 40 117.947 117.947 124.589 -6.642 19854 3227 1 4 . 1 1 40 40 VAL C C 40 175.393 175.393 175.659 -0.266 19854 3228 1 4 . 1 1 40 40 VAL CA C 40 61.020 61.020 61.544 -0.524 19854 3229 1 4 . 1 1 40 40 VAL CB C 40 31.154 31.154 33.677 -2.523 19854 3230 1 4 . 1 1 40 40 VAL H H 40 8.442 8.442 8.561 -0.119 19854 3231 1 4 . 1 1 42 42 THR N N 42 117.150 117.150 117.207 -0.057 19854 3232 1 4 . 1 1 42 42 THR C C 42 178.910 178.910 173.772 5.138 19854 3233 1 4 . 1 1 42 42 THR CA C 42 60.435 60.435 62.677 -2.242 19854 3234 1 4 . 1 1 42 42 THR CB C 42 70.390 70.390 69.711 0.679 19854 3235 1 4 . 1 1 42 42 THR H H 42 8.192 8.192 8.362 -0.170 19854 3236 1 4 . 1 1 43 43 LEU N N 43 119.209 119.209 127.827 -8.618 19854 3237 1 4 . 1 1 43 43 LEU C C 43 174.807 174.807 177.599 -2.792 19854 3238 1 4 . 1 1 43 43 LEU CA C 43 57.507 57.507 54.619 2.888 19854 3239 1 4 . 1 1 43 43 LEU CB C 43 42.866 42.866 42.763 0.103 19854 3240 1 4 . 1 1 43 43 LEU H H 43 9.260 9.260 8.523 0.737 19854 3241 1 4 . 1 1 44 44 GLY N N 44 114.361 114.361 113.345 1.016 19854 3242 1 4 . 1 1 44 44 GLY C C 44 178.910 178.910 172.716 6.194 19854 3243 1 4 . 1 1 44 44 GLY CA C 44 54.579 54.579 46.011 8.568 19854 3244 1 4 . 1 1 44 44 GLY H H 44 6.979 6.979 8.674 -1.695 19854 3245 1 4 . 1 1 45 45 VAL N N 45 110.244 110.244 123.480 -13.236 19854 3246 1 4 . 1 1 45 45 VAL C C 45 174.807 174.807 174.225 0.582 19854 3247 1 4 . 1 1 45 45 VAL CA C 45 63.363 63.363 60.237 3.126 19854 3248 1 4 . 1 1 45 45 VAL CB C 45 17.099 17.099 35.084 -17.985 19854 3249 1 4 . 1 1 45 45 VAL H H 45 8.309 8.309 8.180 0.129 19854 3250 1 4 . 1 1 46 46 GLU N N 46 130.365 130.365 129.368 0.997 19854 3251 1 4 . 1 1 46 46 GLU C C 46 176.859 176.859 174.398 2.461 19854 3252 1 4 . 1 1 46 46 GLU CA C 46 55.164 55.164 54.562 0.602 19854 3253 1 4 . 1 1 46 46 GLU CB C 46 32.325 32.325 32.873 -0.548 19854 3254 1 4 . 1 1 46 46 GLU H H 46 9.741 9.741 8.866 0.875 19854 3255 1 4 . 1 1 47 47 VAL N N 47 125.254 125.254 126.497 -1.243 19854 3256 1 4 . 1 1 47 47 VAL C C 47 175.661 175.661 175.712 -0.051 19854 3257 1 4 . 1 1 47 47 VAL CA C 47 63.375 63.375 61.160 2.215 19854 3258 1 4 . 1 1 47 47 VAL CB C 47 37.300 37.300 32.097 5.203 19854 3259 1 4 . 1 1 47 47 VAL H H 47 8.250 8.250 8.307 -0.057 19854 3260 1 4 . 1 1 48 48 HIS N N 48 129.236 129.236 127.395 1.841 19854 3261 1 4 . 1 1 48 48 HIS C C 48 169.240 169.240 173.116 -3.876 19854 3262 1 4 . 1 1 48 48 HIS CA C 48 49.894 49.894 53.448 -3.554 19854 3263 1 4 . 1 1 48 48 HIS CB C 48 27.640 27.640 32.048 -4.408 19854 3264 1 4 . 1 1 48 48 HIS H H 48 10.390 10.390 9.124 1.266 19854 3265 1 4 . 1 1 49 49 PRO C C 49 176.273 176.273 175.652 0.621 19854 3266 1 4 . 1 1 49 49 PRO CA C 49 62.500 62.500 62.487 0.013 19854 3267 1 4 . 1 1 49 49 PRO CB C 49 29.974 29.974 32.333 -2.359 19854 3268 1 4 . 1 1 50 50 LEU N N 50 119.408 119.408 127.510 -8.102 19854 3269 1 4 . 1 1 50 50 LEU C C 50 177.445 177.445 174.547 2.898 19854 3270 1 4 . 1 1 50 50 LEU CA C 50 59.264 59.264 54.516 4.748 19854 3271 1 4 . 1 1 50 50 LEU CB C 50 42.281 42.281 45.433 -3.152 19854 3272 1 4 . 1 1 50 50 LEU H H 50 7.492 7.492 9.058 -1.566 19854 3273 1 4 . 1 1 51 51 VAL N N 51 117.947 117.947 126.711 -8.764 19854 3274 1 4 . 1 1 51 51 VAL C C 51 174.514 174.514 175.484 -0.970 19854 3275 1 4 . 1 1 51 51 VAL CA C 51 64.534 64.534 61.133 3.401 19854 3276 1 4 . 1 1 51 51 VAL CB C 51 37.010 37.010 33.416 3.594 19854 3277 1 4 . 1 1 51 51 VAL H H 51 7.715 7.715 8.125 -0.410 19854 3278 1 4 . 1 1 52 52 PHE N N 52 124.853 124.853 125.203 -0.350 19854 3279 1 4 . 1 1 52 52 PHE C C 52 175.100 175.100 174.344 0.756 19854 3280 1 4 . 1 1 52 52 PHE CA C 52 56.336 56.336 56.504 -0.168 19854 3281 1 4 . 1 1 52 52 PHE CB C 52 39.938 39.938 43.577 -3.639 19854 3282 1 4 . 1 1 52 52 PHE H H 52 8.935 8.935 9.124 -0.189 19854 3283 1 4 . 1 1 53 53 HIS N N 53 120.603 120.603 122.247 -1.644 19854 3284 1 4 . 1 1 53 53 HIS C C 53 170.119 170.119 175.291 -5.172 19854 3285 1 4 . 1 1 53 53 HIS CA C 53 55.164 55.164 55.954 -0.790 19854 3286 1 4 . 1 1 53 53 HIS CB C 53 30.568 30.568 31.332 -0.764 19854 3287 1 4 . 1 1 53 53 HIS H H 53 8.356 8.356 9.318 -0.962 19854 3288 1 4 . 1 1 54 54 THR N N 54 112.634 112.634 116.131 -3.497 19854 3289 1 4 . 1 1 54 54 THR C C 54 178.910 178.910 176.264 2.646 19854 3290 1 4 . 1 1 54 54 THR CA C 54 63.363 63.363 59.407 3.956 19854 3291 1 4 . 1 1 54 54 THR CB C 54 72.733 72.733 71.617 1.116 19854 3292 1 4 . 1 1 54 54 THR H H 54 7.574 7.574 8.305 -0.731 19854 3293 1 4 . 1 1 55 55 ASN N N 55 131.095 131.095 120.102 10.993 19854 3294 1 4 . 1 1 55 55 ASN C C 55 176.273 176.273 176.528 -0.255 19854 3295 1 4 . 1 1 55 55 ASN CA C 55 51.065 51.065 55.825 -4.760 19854 3296 1 4 . 1 1 55 55 ASN CB C 55 37.010 37.010 38.438 -1.428 19854 3297 1 4 . 1 1 55 55 ASN H H 55 10.187 10.187 8.594 1.593 19854 3298 1 4 . 1 1 56 56 ARG N N 56 122.064 122.064 118.332 3.732 19854 3299 1 4 . 1 1 56 56 ARG C C 56 175.100 175.100 176.028 -0.928 19854 3300 1 4 . 1 1 56 56 ARG CA C 56 61.606 61.606 55.752 5.854 19854 3301 1 4 . 1 1 56 56 ARG CB C 56 32.911 32.911 30.397 2.514 19854 3302 1 4 . 1 1 56 56 ARG H H 56 7.433 7.433 7.747 -0.314 19854 3303 1 4 . 1 1 57 57 GLY N N 57 127.709 127.709 108.798 18.911 19854 3304 1 4 . 1 1 57 57 GLY C C 57 175.979 175.979 171.936 4.043 19854 3305 1 4 . 1 1 57 57 GLY CA C 57 42.281 42.281 44.236 -1.955 19854 3306 1 4 . 1 1 57 57 GLY H H 57 9.373 9.373 7.723 1.650 19854 3307 1 4 . 1 1 58 58 PRO C C 58 177.152 177.152 176.140 1.012 19854 3308 1 4 . 1 1 58 58 PRO CA C 58 65.137 65.137 62.893 2.244 19854 3309 1 4 . 1 1 58 58 PRO CB C 58 29.095 29.095 31.953 -2.858 19854 3310 1 4 . 1 1 59 59 ILE N N 59 128.638 128.638 115.146 13.492 19854 3311 1 4 . 1 1 59 59 ILE C C 59 175.979 175.979 173.901 2.078 19854 3312 1 4 . 1 1 59 59 ILE CA C 59 65.120 65.120 59.177 5.943 19854 3313 1 4 . 1 1 59 59 ILE CB C 59 40.524 40.524 42.095 -1.571 19854 3314 1 4 . 1 1 59 59 ILE H H 59 8.794 8.794 8.829 -0.035 19854 3315 1 4 . 1 1 60 60 LYS N N 60 127.711 127.711 124.172 3.539 19854 3316 1 4 . 1 1 60 60 LYS C C 60 178.902 178.902 174.785 4.117 19854 3317 1 4 . 1 1 60 60 LYS CA C 60 74.293 74.293 54.389 19.904 19854 3318 1 4 . 1 1 60 60 LYS CB C 60 32.027 32.027 36.239 -4.212 19854 3319 1 4 . 1 1 60 60 LYS H H 60 8.024 8.024 8.536 -0.512 19854 3320 1 4 . 1 1 61 61 PHE N N 61 120.670 120.670 124.534 -3.864 19854 3321 1 4 . 1 1 61 61 PHE C C 61 175.393 175.393 175.027 0.366 19854 3322 1 4 . 1 1 61 61 PHE CA C 61 57.507 57.507 57.010 0.497 19854 3323 1 4 . 1 1 61 61 PHE CB C 61 41.109 41.109 41.166 -0.057 19854 3324 1 4 . 1 1 61 61 PHE H H 61 7.515 7.515 9.514 -1.999 19854 3325 1 4 . 1 1 62 62 ASN N N 62 124.789 124.789 123.898 0.891 19854 3326 1 4 . 1 1 62 62 ASN C C 62 173.336 173.336 174.533 -1.197 19854 3327 1 4 . 1 1 62 62 ASN CA C 62 53.121 53.121 52.215 0.906 19854 3328 1 4 . 1 1 62 62 ASN CB C 62 41.695 41.695 39.124 2.571 19854 3329 1 4 . 1 1 62 62 ASN H H 62 8.325 8.325 9.398 -1.073 19854 3330 1 4 . 1 1 63 63 VAL N N 63 106.127 106.127 127.215 -21.088 19854 3331 1 4 . 1 1 63 63 VAL C C 63 175.100 175.100 175.400 -0.300 19854 3332 1 4 . 1 1 63 63 VAL CA C 63 61.020 61.020 63.156 -2.136 19854 3333 1 4 . 1 1 63 63 VAL CB C 63 31.154 31.154 32.680 -1.526 19854 3334 1 4 . 1 1 63 63 VAL H H 63 8.113 8.113 8.878 -0.765 19854 3335 1 4 . 1 1 64 64 TRP N N 64 129.302 129.302 130.016 -0.714 19854 3336 1 4 . 1 1 64 64 TRP C C 64 177.152 177.152 175.066 2.086 19854 3337 1 4 . 1 1 64 64 TRP CA C 64 59.264 59.264 55.909 3.355 19854 3338 1 4 . 1 1 64 64 TRP CB C 64 29.397 29.397 29.864 -0.467 19854 3339 1 4 . 1 1 64 64 TRP H H 64 8.970 8.970 9.606 -0.636 19854 3340 1 4 . 1 1 65 65 ASP N N 65 119.607 119.607 125.972 -6.365 19854 3341 1 4 . 1 1 65 65 ASP C C 65 174.514 174.514 175.736 -1.222 19854 3342 1 4 . 1 1 65 65 ASP CA C 65 55.164 55.164 53.219 1.945 19854 3343 1 4 . 1 1 65 65 ASP CB C 65 41.109 41.109 42.961 -1.852 19854 3344 1 4 . 1 1 65 65 ASP H H 65 8.638 8.638 8.944 -0.306 19854 3345 1 4 . 1 1 66 66 THR N N 66 122.463 122.463 118.232 4.231 19854 3346 1 4 . 1 1 66 66 THR C C 66 178.617 178.617 174.265 4.352 19854 3347 1 4 . 1 1 66 66 THR CA C 66 68.048 68.048 59.665 8.383 19854 3348 1 4 . 1 1 66 66 THR CB C 66 71.562 71.562 71.070 0.492 19854 3349 1 4 . 1 1 66 66 THR H H 66 8.293 8.293 8.351 -0.058 19854 3350 1 4 . 1 1 67 67 ALA N N 67 104.865 104.865 122.664 -17.799 19854 3351 1 4 . 1 1 67 67 ALA C C 67 177.738 177.738 178.071 -0.333 19854 3352 1 4 . 1 1 67 67 ALA CA C 67 48.722 48.722 51.421 -2.699 19854 3353 1 4 . 1 1 67 67 ALA CB C 67 14.171 14.171 20.183 -6.012 19854 3354 1 4 . 1 1 67 67 ALA H H 67 8.657 8.657 8.016 0.641 19854 3355 1 4 . 1 1 68 68 GLY N N 68 115.357 115.357 109.948 5.409 19854 3356 1 4 . 1 1 68 68 GLY C C 68 189.533 189.533 175.965 13.568 19854 3357 1 4 . 1 1 68 68 GLY CA C 68 45.209 45.209 45.989 -0.780 19854 3358 1 4 . 1 1 68 68 GLY H H 68 10.969 10.969 8.944 2.025 19854 3359 1 4 . 1 1 69 69 GLN N N 69 122.730 122.730 120.017 2.713 19854 3360 1 4 . 1 1 69 69 GLN C C 69 174.508 174.508 176.410 -1.902 19854 3361 1 4 . 1 1 69 69 GLN CA C 69 58.394 58.394 57.463 0.931 19854 3362 1 4 . 1 1 69 69 GLN CB C 69 31.441 31.441 28.780 2.661 19854 3363 1 4 . 1 1 69 69 GLN H H 69 8.336 8.336 8.477 -0.141 19854 3364 1 4 . 1 1 70 70 GLU N N 70 114.826 114.826 120.278 -5.452 19854 3365 1 4 . 1 1 70 70 GLU C C 70 176.273 176.273 175.652 0.621 19854 3366 1 4 . 1 1 70 70 GLU CA C 70 57.507 57.507 56.438 1.069 19854 3367 1 4 . 1 1 70 70 GLU CB C 70 28.811 28.811 30.332 -1.521 19854 3368 1 4 . 1 1 70 70 GLU H H 70 9.651 9.651 8.309 1.342 19854 3369 1 4 . 1 1 71 71 LYS N N 71 116.685 116.685 122.942 -6.257 19854 3370 1 4 . 1 1 71 71 LYS C C 71 175.979 175.979 176.392 -0.413 19854 3371 1 4 . 1 1 71 71 LYS CA C 71 48.722 48.722 56.084 -7.362 19854 3372 1 4 . 1 1 71 71 LYS CB C 71 37.010 37.010 32.910 4.100 19854 3373 1 4 . 1 1 71 71 LYS H H 71 8.712 8.712 8.290 0.422 19854 3374 1 4 . 1 1 72 72 PHE N N 72 114.959 114.959 120.117 -5.158 19854 3375 1 4 . 1 1 72 72 PHE C C 72 175.686 175.686 176.563 -0.877 19854 3376 1 4 . 1 1 72 72 PHE CA C 72 56.336 56.336 58.826 -2.490 19854 3377 1 4 . 1 1 72 72 PHE CB C 72 36.424 36.424 38.930 -2.506 19854 3378 1 4 . 1 1 72 72 PHE H H 72 7.965 7.965 8.016 -0.051 19854 3379 1 4 . 1 1 73 73 GLY N N 73 117.084 117.084 111.193 5.891 19854 3380 1 4 . 1 1 73 73 GLY C C 73 168.068 168.068 174.800 -6.732 19854 3381 1 4 . 1 1 73 73 GLY CA C 73 42.281 42.281 44.828 -2.546 19854 3382 1 4 . 1 1 73 73 GLY H H 73 7.609 7.609 7.821 -0.212 19854 3383 1 4 . 1 1 74 74 GLY N N 74 120.537 120.537 108.246 12.291 19854 3384 1 4 . 1 1 74 74 GLY C C 74 174.514 174.514 176.422 -1.908 19854 3385 1 4 . 1 1 74 74 GLY CA C 74 44.037 44.037 46.563 -2.526 19854 3386 1 4 . 1 1 74 74 GLY H H 74 9.326 9.326 8.770 0.556 19854 3387 1 4 . 1 1 75 75 LEU N N 75 127.177 127.177 120.888 6.289 19854 3388 1 4 . 1 1 75 75 LEU C C 75 178.617 178.617 178.322 0.295 19854 3389 1 4 . 1 1 75 75 LEU CA C 75 53.407 53.407 57.037 -3.630 19854 3390 1 4 . 1 1 75 75 LEU CB C 75 42.281 42.281 41.608 0.673 19854 3391 1 4 . 1 1 75 75 LEU H H 75 7.628 7.628 7.764 -0.136 19854 3392 1 4 . 1 1 76 76 ARG N N 76 116.486 116.486 116.389 0.097 19854 3393 1 4 . 1 1 76 76 ARG C C 76 176.859 176.859 176.828 0.031 19854 3394 1 4 . 1 1 76 76 ARG CA C 76 59.264 59.264 56.439 2.825 19854 3395 1 4 . 1 1 76 76 ARG CB C 76 31.154 31.154 29.825 1.329 19854 3396 1 4 . 1 1 76 76 ARG H H 76 7.143 7.143 7.481 -0.338 19854 3397 1 4 . 1 1 77 77 ASP N N 77 129.236 129.236 120.874 8.362 19854 3398 1 4 . 1 1 77 77 ASP C C 77 177.152 177.152 177.895 -0.743 19854 3399 1 4 . 1 1 77 77 ASP CA C 77 52.822 52.822 57.476 -4.654 19854 3400 1 4 . 1 1 77 77 ASP CB C 77 41.695 41.695 40.391 1.304 19854 3401 1 4 . 1 1 77 77 ASP H H 77 8.947 8.947 7.537 1.409 19854 3402 1 4 . 1 1 78 78 GLY N N 78 127.244 127.244 107.401 19.843 19854 3403 1 4 . 1 1 78 78 GLY C C 78 173.928 173.928 176.236 -2.308 19854 3404 1 4 . 1 1 78 78 GLY CA C 78 44.623 44.623 47.066 -2.443 19854 3405 1 4 . 1 1 78 78 GLY H H 78 8.219 8.219 8.470 -0.251 19854 3406 1 4 . 1 1 79 79 TYR N N 79 120.537 120.537 118.696 1.841 19854 3407 1 4 . 1 1 79 79 TYR C C 79 176.273 176.273 177.082 -0.809 19854 3408 1 4 . 1 1 79 79 TYR CA C 79 58.678 58.678 59.426 -0.748 19854 3409 1 4 . 1 1 79 79 TYR CB C 79 40.524 40.524 37.978 2.546 19854 3410 1 4 . 1 1 79 79 TYR H H 79 8.563 8.563 7.331 1.232 19854 3411 1 4 . 1 1 80 80 TYR N N 80 122.132 122.132 117.379 4.753 19854 3412 1 4 . 1 1 80 80 TYR C C 80 175.979 175.979 175.886 0.093 19854 3413 1 4 . 1 1 80 80 TYR CA C 80 62.203 62.203 58.971 3.232 19854 3414 1 4 . 1 1 80 80 TYR CB C 80 41.988 41.988 40.123 1.865 19854 3415 1 4 . 1 1 80 80 TYR H H 80 8.254 8.254 7.472 0.782 19854 3416 1 4 . 1 1 81 81 ILE N N 81 120.072 120.072 120.304 -0.232 19854 3417 1 4 . 1 1 81 81 ILE C C 81 177.445 177.445 176.026 1.419 19854 3418 1 4 . 1 1 81 81 ILE CA C 81 67.462 67.462 63.505 3.957 19854 3419 1 4 . 1 1 81 81 ILE CB C 81 41.109 41.109 37.987 3.122 19854 3420 1 4 . 1 1 81 81 ILE H H 81 8.837 8.837 8.305 0.532 19854 3421 1 4 . 1 1 82 82 GLN N N 82 121.601 121.601 119.129 2.472 19854 3422 1 4 . 1 1 82 82 GLN C C 82 173.342 173.342 174.553 -1.211 19854 3423 1 4 . 1 1 82 82 GLN CA C 82 59.859 59.859 56.511 3.348 19854 3424 1 4 . 1 1 82 82 GLN CB C 82 30.855 30.855 26.215 4.641 19854 3425 1 4 . 1 1 82 82 GLN H H 82 8.184 8.184 9.010 -0.826 19854 3426 1 4 . 1 1 83 83 ALA N N 83 109.713 109.713 120.034 -10.321 19854 3427 1 4 . 1 1 83 83 ALA C C 83 175.979 175.979 176.536 -0.557 19854 3428 1 4 . 1 1 83 83 ALA CA C 83 54.579 54.579 52.744 1.835 19854 3429 1 4 . 1 1 83 83 ALA CB C 83 16.513 16.513 19.023 -2.510 19854 3430 1 4 . 1 1 83 83 ALA H H 83 6.306 6.306 7.397 -1.091 19854 3431 1 4 . 1 1 84 84 GLN N N 84 121.203 121.203 120.742 0.461 19854 3432 1 4 . 1 1 84 84 GLN C C 84 177.144 177.144 175.718 1.426 19854 3433 1 4 . 1 1 84 84 GLN CA C 84 60.152 60.152 56.720 3.432 19854 3434 1 4 . 1 1 84 84 GLN CB C 84 34.957 34.957 31.193 3.764 19854 3435 1 4 . 1 1 84 84 GLN H H 84 8.180 8.180 8.791 -0.611 19854 3436 1 4 . 1 1 85 85 CYS N N 85 120.605 120.605 111.732 8.873 19854 3437 1 4 . 1 1 85 85 CYS C C 85 176.566 176.566 172.769 3.797 19854 3438 1 4 . 1 1 85 85 CYS CA C 85 65.430 65.430 56.380 9.050 19854 3439 1 4 . 1 1 85 85 CYS CB C 85 39.644 39.644 31.742 7.902 19854 3440 1 4 . 1 1 85 85 CYS H H 85 8.364 8.364 7.592 0.772 19854 3441 1 4 . 1 1 86 86 ALA N N 86 114.295 114.295 121.351 -7.056 19854 3442 1 4 . 1 1 86 86 ALA CA C 86 57.507 57.507 51.090 6.417 19854 3443 1 4 . 1 1 86 86 ALA CB C 86 21.784 21.784 22.948 -1.164 19854 3444 1 4 . 1 1 86 86 ALA H H 86 6.897 6.897 8.776 -1.879 19854 3445 1 4 . 1 1 87 87 ILE N N 87 120.670 120.670 120.353 0.317 19854 3446 1 4 . 1 1 87 87 ILE C C 87 173.928 173.928 174.597 -0.669 19854 3447 1 4 . 1 1 87 87 ILE CA C 87 61.020 61.020 59.998 1.022 19854 3448 1 4 . 1 1 87 87 ILE CB C 87 39.938 39.938 41.598 -1.660 19854 3449 1 4 . 1 1 87 87 ILE H H 87 8.282 8.282 8.652 -0.370 19854 3450 1 4 . 1 1 88 88 ILE N N 88 120.205 120.205 127.268 -7.063 19854 3451 1 4 . 1 1 88 88 ILE C C 88 173.635 173.635 174.871 -1.236 19854 3452 1 4 . 1 1 88 88 ILE CA C 88 64.534 64.534 60.159 4.375 19854 3453 1 4 . 1 1 88 88 ILE CB C 88 37.596 37.596 40.029 -2.433 19854 3454 1 4 . 1 1 88 88 ILE H H 88 5.528 5.528 8.954 -3.426 19854 3455 1 4 . 1 1 89 89 MET N N 89 120.472 120.472 126.184 -5.712 19854 3456 1 4 . 1 1 89 89 MET C C 89 178.617 178.617 175.011 3.606 19854 3457 1 4 . 1 1 89 89 MET CA C 89 58.980 58.980 54.311 4.669 19854 3458 1 4 . 1 1 89 89 MET CB C 89 34.957 34.957 35.107 -0.150 19854 3459 1 4 . 1 1 89 89 MET H H 89 8.176 8.176 8.718 -0.542 19854 3460 1 4 . 1 1 90 90 PHE N N 90 121.134 121.134 118.618 2.516 19854 3461 1 4 . 1 1 90 90 PHE C C 90 175.393 175.393 172.980 2.413 19854 3462 1 4 . 1 1 90 90 PHE CA C 90 60.435 60.435 55.348 5.087 19854 3463 1 4 . 1 1 90 90 PHE CB C 90 38.767 38.767 42.082 -3.315 19854 3464 1 4 . 1 1 90 90 PHE H H 90 9.334 9.334 8.676 0.658 19854 3465 1 4 . 1 1 91 91 ASP N N 91 120.273 120.273 120.592 -0.319 19854 3466 1 4 . 1 1 91 91 ASP C C 91 177.730 177.730 178.088 -0.358 19854 3467 1 4 . 1 1 91 91 ASP CA C 91 59.859 59.859 52.335 7.524 19854 3468 1 4 . 1 1 91 91 ASP CB C 91 44.039 44.039 42.828 1.211 19854 3469 1 4 . 1 1 91 91 ASP H H 91 7.597 7.597 8.921 -1.324 19854 3470 1 4 . 1 1 92 92 VAL N N 92 115.158 115.158 123.400 -8.242 19854 3471 1 4 . 1 1 92 92 VAL C C 92 173.342 173.342 176.527 -3.185 19854 3472 1 4 . 1 1 92 92 VAL CA C 92 64.534 64.534 64.912 -0.378 19854 3473 1 4 . 1 1 92 92 VAL CB C 92 37.596 37.596 31.327 6.269 19854 3474 1 4 . 1 1 92 92 VAL H H 92 7.738 7.738 8.508 -0.770 19854 3475 1 4 . 1 1 93 93 THR N N 93 127.179 127.179 110.284 16.895 19854 3476 1 4 . 1 1 93 93 THR C C 93 178.902 178.902 174.712 4.190 19854 3477 1 4 . 1 1 93 93 THR CA C 93 64.254 64.254 62.910 1.344 19854 3478 1 4 . 1 1 93 93 THR CB C 93 74.215 74.215 69.166 5.049 19854 3479 1 4 . 1 1 93 93 THR H H 93 7.636 7.636 8.183 -0.547 19854 3480 1 4 . 1 1 94 94 SER N N 94 122.263 122.263 116.469 5.794 19854 3481 1 4 . 1 1 94 94 SER C C 94 163.965 163.965 174.858 -10.893 19854 3482 1 4 . 1 1 94 94 SER CA C 94 59.849 59.849 55.548 4.301 19854 3483 1 4 . 1 1 94 94 SER CB C 94 62.192 62.192 64.175 -1.983 19854 3484 1 4 . 1 1 94 94 SER H H 94 7.628 7.628 7.939 -0.311 19854 3485 1 4 . 1 1 95 95 ARG N N 95 113.099 113.099 128.562 -15.463 19854 3486 1 4 . 1 1 95 95 ARG C C 95 176.273 176.273 178.120 -1.847 19854 3487 1 4 . 1 1 95 95 ARG CA C 95 53.407 53.407 59.605 -6.198 19854 3488 1 4 . 1 1 95 95 ARG CB C 95 31.154 31.154 30.104 1.050 19854 3489 1 4 . 1 1 95 95 ARG H H 95 8.102 8.102 9.073 -0.971 19854 3490 1 4 . 1 1 96 96 VAL N N 96 124.787 124.787 119.271 5.516 19854 3491 1 4 . 1 1 96 96 VAL C C 96 178.031 178.031 177.746 0.285 19854 3492 1 4 . 1 1 96 96 VAL CA C 96 68.634 68.634 66.416 2.218 19854 3493 1 4 . 1 1 96 96 VAL CB C 96 24.126 24.126 31.357 -7.231 19854 3494 1 4 . 1 1 96 96 VAL H H 96 9.146 9.146 8.138 1.008 19854 3495 1 4 . 1 1 97 97 THR N N 97 111.970 111.970 116.219 -4.249 19854 3496 1 4 . 1 1 97 97 THR C C 97 178.031 178.031 176.026 2.005 19854 3497 1 4 . 1 1 97 97 THR CA C 97 63.949 63.949 66.386 -2.437 19854 3498 1 4 . 1 1 97 97 THR CB C 97 70.390 70.390 69.005 1.385 19854 3499 1 4 . 1 1 97 97 THR H H 97 7.984 7.984 7.651 0.333 19854 3500 1 4 . 1 1 98 98 TYR N N 98 113.232 113.232 121.183 -7.951 19854 3501 1 4 . 1 1 98 98 TYR C C 98 176.273 176.273 177.493 -1.220 19854 3502 1 4 . 1 1 98 98 TYR H H 98 7.605 7.605 7.763 -0.158 19854 3503 1 4 . 1 1 99 99 LYS N N 99 123.726 123.726 118.669 5.057 19854 3504 1 4 . 1 1 99 99 LYS C C 99 178.316 178.316 178.461 -0.145 19854 3505 1 4 . 1 1 99 99 LYS CA C 99 58.691 58.691 59.404 -0.713 19854 3506 1 4 . 1 1 99 99 LYS CB C 99 36.127 36.127 32.016 4.111 19854 3507 1 4 . 1 1 99 99 LYS H H 99 8.360 8.360 8.063 0.297 19854 3508 1 4 . 1 1 100 100 ASN N N 100 111.970 111.970 116.149 -4.179 19854 3509 1 4 . 1 1 100 100 ASN C C 100 175.979 175.979 176.781 -0.802 19854 3510 1 4 . 1 1 100 100 ASN CA C 100 53.407 53.407 55.109 -1.702 19854 3511 1 4 . 1 1 100 100 ASN CB C 100 37.596 37.596 38.734 -1.138 19854 3512 1 4 . 1 1 100 100 ASN H H 100 5.778 5.778 7.779 -2.001 19854 3513 1 4 . 1 1 101 101 VAL N N 101 118.877 118.877 121.658 -2.781 19854 3514 1 4 . 1 1 101 101 VAL C C 101 173.635 173.635 174.979 -1.344 19854 3515 1 4 . 1 1 101 101 VAL CA C 101 62.777 62.777 68.479 -5.702 19854 3516 1 4 . 1 1 101 101 VAL CB C 101 27.054 27.054 29.255 -2.201 19854 3517 1 4 . 1 1 101 101 VAL H H 101 7.370 7.370 7.619 -0.249 19854 3518 1 4 . 1 1 102 102 PRO C C 102 176.566 176.566 177.162 -0.596 19854 3519 1 4 . 1 1 102 102 PRO CA C 102 62.500 62.500 65.315 -2.815 19854 3520 1 4 . 1 1 102 102 PRO CB C 102 30.853 30.853 31.069 -0.216 19854 3521 1 4 . 1 1 103 103 ASN N N 103 122.728 122.728 114.764 7.964 19854 3522 1 4 . 1 1 103 103 ASN C C 103 175.100 175.100 176.845 -1.745 19854 3523 1 4 . 1 1 103 103 ASN CA C 103 54.579 54.579 54.464 0.115 19854 3524 1 4 . 1 1 103 103 ASN CB C 103 38.767 38.767 37.571 1.196 19854 3525 1 4 . 1 1 103 103 ASN H H 103 7.879 7.879 7.416 0.463 19854 3526 1 4 . 1 1 104 104 TRP N N 104 122.730 122.730 120.132 2.598 19854 3527 1 4 . 1 1 104 104 TRP C C 104 174.215 174.215 177.503 -3.288 19854 3528 1 4 . 1 1 104 104 TRP CA C 104 59.273 59.273 60.584 -1.312 19854 3529 1 4 . 1 1 104 104 TRP CB C 104 35.250 35.250 30.032 5.218 19854 3530 1 4 . 1 1 104 104 TRP H H 104 7.902 7.902 7.622 0.280 19854 3531 1 4 . 1 1 105 105 HIS N N 105 120.869 120.869 116.939 3.930 19854 3532 1 4 . 1 1 105 105 HIS C C 105 177.738 177.738 174.300 3.438 19854 3533 1 4 . 1 1 105 105 HIS H H 105 6.971 6.971 8.438 -1.467 19854 3534 1 4 . 1 1 106 106 ARG N N 106 126.314 126.314 123.252 3.062 19854 3535 1 4 . 1 1 106 106 ARG C C 106 176.566 176.566 176.440 0.126 19854 3536 1 4 . 1 1 106 106 ARG CA C 106 62.777 62.777 57.685 5.092 19854 3537 1 4 . 1 1 106 106 ARG CB C 106 29.397 29.397 31.035 -1.638 19854 3538 1 4 . 1 1 106 106 ARG H H 106 7.507 7.507 7.887 -0.380 19854 3539 1 4 . 1 1 107 107 ASP N N 107 119.076 119.076 121.639 -2.563 19854 3540 1 4 . 1 1 107 107 ASP C C 107 176.566 176.566 178.442 -1.876 19854 3541 1 4 . 1 1 107 107 ASP CA C 107 55.164 55.164 57.720 -2.556 19854 3542 1 4 . 1 1 107 107 ASP CB C 107 41.695 41.695 41.041 0.654 19854 3543 1 4 . 1 1 107 107 ASP H H 107 9.076 9.076 7.909 1.167 19854 3544 1 4 . 1 1 108 108 LEU N N 108 113.299 113.299 119.300 -6.001 19854 3545 1 4 . 1 1 108 108 LEU C C 108 176.273 176.273 178.498 -2.225 19854 3546 1 4 . 1 1 108 108 LEU CA C 108 59.264 59.264 58.374 0.889 19854 3547 1 4 . 1 1 108 108 LEU CB C 108 48.722 48.722 41.444 7.278 19854 3548 1 4 . 1 1 108 108 LEU H H 108 6.725 6.725 7.887 -1.162 19854 3549 1 4 . 1 1 109 109 VAL N N 109 121.267 121.267 113.959 7.308 19854 3550 1 4 . 1 1 109 109 VAL C C 109 175.393 175.393 178.101 -2.708 19854 3551 1 4 . 1 1 109 109 VAL CA C 109 63.949 63.949 64.649 -0.700 19854 3552 1 4 . 1 1 109 109 VAL CB C 109 32.911 32.911 30.989 1.922 19854 3553 1 4 . 1 1 109 109 VAL H H 109 8.763 8.763 7.632 1.131 19854 3554 1 4 . 1 1 110 110 ARG N N 110 112.900 112.900 120.438 -7.538 19854 3555 1 4 . 1 1 110 110 ARG C C 110 176.273 176.273 177.503 -1.230 19854 3556 1 4 . 1 1 110 110 ARG CA C 110 57.507 57.507 59.202 -1.695 19854 3557 1 4 . 1 1 110 110 ARG CB C 110 30.568 30.568 30.430 0.138 19854 3558 1 4 . 1 1 110 110 ARG H H 110 7.241 7.241 7.825 -0.584 19854 3559 1 4 . 1 1 111 111 VAL N N 111 115.556 115.556 113.628 1.928 19854 3560 1 4 . 1 1 111 111 VAL C C 111 177.445 177.445 176.854 0.591 19854 3561 1 4 . 1 1 111 111 VAL CA C 111 59.849 59.849 64.001 -4.152 19854 3562 1 4 . 1 1 111 111 VAL CB C 111 32.911 32.911 33.083 -0.172 19854 3563 1 4 . 1 1 111 111 VAL H H 111 7.566 7.566 7.725 -0.159 19854 3564 1 4 . 1 1 112 112 CYS N N 112 114.295 114.295 117.006 -2.711 19854 3565 1 4 . 1 1 112 112 CYS C C 112 169.826 169.826 174.870 -5.044 19854 3566 1 4 . 1 1 112 112 CYS CA C 112 57.507 57.507 59.352 -1.845 19854 3567 1 4 . 1 1 112 112 CYS CB C 112 35.839 35.839 29.229 6.610 19854 3568 1 4 . 1 1 112 112 CYS H H 112 7.425 7.425 8.284 -0.859 19854 3569 1 4 . 1 1 113 113 GLU N N 113 116.486 116.486 117.737 -1.251 19854 3570 1 4 . 1 1 113 113 GLU C C 113 176.566 176.566 175.826 0.740 19854 3571 1 4 . 1 1 113 113 GLU CA C 113 69.219 69.219 58.356 10.863 19854 3572 1 4 . 1 1 113 113 GLU CB C 113 30.568 30.568 28.246 2.322 19854 3573 1 4 . 1 1 113 113 GLU H H 113 7.241 7.241 8.034 -0.793 19854 3574 1 4 . 1 1 114 114 ASN N N 114 129.302 129.302 121.959 7.343 19854 3575 1 4 . 1 1 114 114 ASN C C 114 175.100 175.100 174.754 0.346 19854 3576 1 4 . 1 1 114 114 ASN CA C 114 52.236 52.236 53.029 -0.793 19854 3577 1 4 . 1 1 114 114 ASN CB C 114 39.938 39.938 38.112 1.826 19854 3578 1 4 . 1 1 114 114 ASN H H 114 8.919 8.919 8.241 0.678 19854 3579 1 4 . 1 1 115 115 ILE N N 115 110.443 110.443 121.149 -10.706 19854 3580 1 4 . 1 1 115 115 ILE C C 115 175.100 175.100 173.180 1.920 19854 3581 1 4 . 1 1 115 115 ILE CA C 115 65.705 65.705 58.028 7.678 19854 3582 1 4 . 1 1 115 115 ILE CB C 115 39.353 39.353 39.841 -0.488 19854 3583 1 4 . 1 1 115 115 ILE H H 115 9.287 9.287 7.806 1.481 19854 3584 1 4 . 1 1 116 116 PRO C C 116 175.979 175.979 175.545 0.434 19854 3585 1 4 . 1 1 116 116 PRO CA C 116 63.086 63.086 63.280 -0.194 19854 3586 1 4 . 1 1 116 116 PRO CB C 116 29.681 29.681 32.196 -2.515 19854 3587 1 4 . 1 1 117 117 ILE N N 117 123.591 123.591 124.415 -0.824 19854 3588 1 4 . 1 1 117 117 ILE C C 117 174.807 174.807 174.913 -0.106 19854 3589 1 4 . 1 1 117 117 ILE CA C 117 66.291 66.291 60.365 5.926 19854 3590 1 4 . 1 1 117 117 ILE CB C 117 38.767 38.767 42.273 -3.506 19854 3591 1 4 . 1 1 117 117 ILE H H 117 7.781 7.781 8.496 -0.715 19854 3592 1 4 . 1 1 118 118 VAL N N 118 119.009 119.009 125.884 -6.875 19854 3593 1 4 . 1 1 118 118 VAL C C 118 178.324 178.324 174.743 3.581 19854 3594 1 4 . 1 1 118 118 VAL CA C 118 62.777 62.777 60.888 1.889 19854 3595 1 4 . 1 1 118 118 VAL CB C 118 31.154 31.154 34.079 -2.925 19854 3596 1 4 . 1 1 118 118 VAL H H 118 8.767 8.767 8.651 0.116 19854 3597 1 4 . 1 1 119 119 LEU N N 119 119.408 119.408 126.873 -7.465 19854 3598 1 4 . 1 1 119 119 LEU C C 119 178.031 178.031 176.068 1.963 19854 3599 1 4 . 1 1 119 119 LEU CA C 119 42.866 42.866 53.807 -10.941 19854 3600 1 4 . 1 1 119 119 LEU CB C 119 38.767 38.767 43.830 -5.063 19854 3601 1 4 . 1 1 119 119 LEU H H 119 7.734 7.734 9.255 -1.521 19854 3602 1 4 . 1 1 120 120 CYS N N 120 113.232 113.232 122.185 -8.953 19854 3603 1 4 . 1 1 120 120 CYS C C 120 178.031 178.031 174.199 3.832 19854 3604 1 4 . 1 1 120 120 CYS H H 120 8.317 8.317 9.142 -0.825 19854 3605 1 4 . 1 1 121 121 GLY N N 121 117.349 117.349 112.976 4.373 19854 3606 1 4 . 1 1 121 121 GLY C C 121 176.851 176.851 173.151 3.700 19854 3607 1 4 . 1 1 121 121 GLY CA C 121 41.109 41.109 43.588 -2.479 19854 3608 1 4 . 1 1 121 121 GLY H H 121 7.515 7.515 8.975 -1.460 19854 3609 1 4 . 1 1 122 122 ASN N N 122 125.318 125.318 125.662 -0.344 19854 3610 1 4 . 1 1 122 122 ASN C C 122 175.686 175.686 175.575 0.111 19854 3611 1 4 . 1 1 122 122 ASN CA C 122 50.479 50.479 52.790 -2.311 19854 3612 1 4 . 1 1 122 122 ASN CB C 122 39.353 39.353 40.517 -1.164 19854 3613 1 4 . 1 1 122 122 ASN H H 122 9.162 9.162 8.509 0.653 19854 3614 1 4 . 1 1 123 123 LYS N N 123 122.132 122.132 114.054 8.078 19854 3615 1 4 . 1 1 123 123 LYS C C 123 173.043 173.043 177.277 -4.234 19854 3616 1 4 . 1 1 123 123 LYS CA C 123 58.101 58.101 57.370 0.731 19854 3617 1 4 . 1 1 123 123 LYS CB C 123 35.543 35.543 30.146 5.397 19854 3618 1 4 . 1 1 123 123 LYS H H 123 7.953 7.953 8.846 -0.893 19854 3619 1 4 . 1 1 124 124 VAL N N 124 123.726 123.726 112.907 10.819 19854 3620 1 4 . 1 1 124 124 VAL C C 124 175.679 175.679 175.889 -0.210 19854 3621 1 4 . 1 1 124 124 VAL CA C 124 64.840 64.840 64.005 0.835 19854 3622 1 4 . 1 1 124 124 VAL CB C 124 42.574 42.574 31.463 11.111 19854 3623 1 4 . 1 1 124 124 VAL H H 124 8.555 8.555 7.587 0.968 19854 3624 1 4 . 1 1 125 125 ASP N N 125 119.607 119.607 119.324 0.283 19854 3625 1 4 . 1 1 125 125 ASP C C 125 176.566 176.566 176.918 -0.352 19854 3626 1 4 . 1 1 125 125 ASP CA C 125 55.750 55.750 56.149 -0.399 19854 3627 1 4 . 1 1 125 125 ASP CB C 125 40.524 40.524 41.122 -0.598 19854 3628 1 4 . 1 1 125 125 ASP H H 125 7.875 7.875 8.086 -0.211 19854 3629 1 4 . 1 1 126 126 ILE N N 126 116.088 116.088 120.488 -4.400 19854 3630 1 4 . 1 1 126 126 ILE C C 126 177.152 177.152 176.425 0.727 19854 3631 1 4 . 1 1 126 126 ILE CA C 126 66.291 66.291 61.763 4.528 19854 3632 1 4 . 1 1 126 126 ILE CB C 126 39.353 39.353 38.412 0.941 19854 3633 1 4 . 1 1 126 126 ILE H H 126 7.511 7.511 7.530 -0.019 19854 3634 1 4 . 1 1 127 127 LYS N N 127 121.203 121.203 127.044 -5.841 19854 3635 1 4 . 1 1 127 127 LYS C C 127 175.979 175.979 177.150 -1.171 19854 3636 1 4 . 1 1 127 127 LYS CA C 127 58.101 58.101 58.714 -0.612 19854 3637 1 4 . 1 1 127 127 LYS CB C 127 35.834 35.834 32.644 3.190 19854 3638 1 4 . 1 1 127 127 LYS H H 127 8.113 8.113 8.477 -0.364 19854 3639 1 4 . 1 1 128 128 ASP N N 128 118.279 118.279 119.576 -1.297 19854 3640 1 4 . 1 1 128 128 ASP C C 128 176.566 176.566 175.214 1.352 19854 3641 1 4 . 1 1 128 128 ASP CA C 128 53.407 53.407 53.039 0.368 19854 3642 1 4 . 1 1 128 128 ASP CB C 128 40.524 40.524 39.706 0.818 19854 3643 1 4 . 1 1 128 128 ASP H H 128 7.241 7.241 8.261 -1.020 19854 3644 1 4 . 1 1 129 129 ARG N N 129 118.943 118.943 123.003 -4.060 19854 3645 1 4 . 1 1 129 129 ARG C C 129 177.738 177.738 176.646 1.092 19854 3646 1 4 . 1 1 129 129 ARG CA C 129 45.794 45.794 56.478 -10.684 19854 3647 1 4 . 1 1 129 129 ARG CB C 129 31.154 31.154 30.794 0.360 19854 3648 1 4 . 1 1 129 129 ARG H H 129 8.423 8.423 7.782 0.641 19854 3649 1 4 . 1 1 130 130 LYS N N 130 109.381 109.381 122.049 -12.668 19854 3650 1 4 . 1 1 130 130 LYS C C 130 176.566 176.566 176.842 -0.276 19854 3651 1 4 . 1 1 130 130 LYS CA C 130 55.164 55.164 57.379 -2.215 19854 3652 1 4 . 1 1 130 130 LYS CB C 130 36.424 36.424 33.713 2.711 19854 3653 1 4 . 1 1 130 130 LYS H H 130 7.296 7.296 8.289 -0.993 19854 3654 1 4 . 1 1 131 131 VAL N N 131 110.377 110.377 121.234 -10.857 19854 3655 1 4 . 1 1 131 131 VAL C C 131 178.617 178.617 175.015 3.602 19854 3656 1 4 . 1 1 131 131 VAL CA C 131 65.705 65.705 61.892 3.813 19854 3657 1 4 . 1 1 131 131 VAL CB C 131 35.839 35.839 31.461 4.378 19854 3658 1 4 . 1 1 131 131 VAL H H 131 9.283 9.283 7.941 1.342 19854 3659 1 4 . 1 1 132 132 LYS N N 132 110.310 110.310 128.028 -17.718 19854 3660 1 4 . 1 1 132 132 LYS C C 132 176.273 176.273 177.530 -1.257 19854 3661 1 4 . 1 1 132 132 LYS CA C 132 59.849 59.849 55.769 4.080 19854 3662 1 4 . 1 1 132 132 LYS CB C 132 35.253 35.253 33.572 1.681 19854 3663 1 4 . 1 1 132 132 LYS H H 132 9.709 9.709 8.209 1.500 19854 3664 1 4 . 1 1 133 133 ALA N N 133 134.349 134.349 127.249 7.100 19854 3665 1 4 . 1 1 133 133 ALA CA C 133 51.065 51.065 54.807 -3.742 19854 3666 1 4 . 1 1 133 133 ALA CB C 133 12.999 12.999 18.606 -5.607 19854 3667 1 4 . 1 1 133 133 ALA H H 133 6.322 6.322 8.747 -2.425 19854 3668 1 4 . 1 1 134 134 LYS N N 134 117.615 117.615 117.197 0.418 19854 3669 1 4 . 1 1 134 134 LYS C C 134 176.859 176.859 177.387 -0.528 19854 3670 1 4 . 1 1 134 134 LYS CA C 134 55.750 55.750 58.329 -2.579 19854 3671 1 4 . 1 1 134 134 LYS CB C 134 54.579 54.579 32.419 22.160 19854 3672 1 4 . 1 1 134 134 LYS H H 134 6.549 6.549 8.240 -1.691 19854 3673 1 4 . 1 1 135 135 SER N N 135 109.314 109.314 112.730 -3.416 19854 3674 1 4 . 1 1 135 135 SER C C 135 173.635 173.635 175.052 -1.417 19854 3675 1 4 . 1 1 135 135 SER CA C 135 56.336 56.336 59.716 -3.380 19854 3676 1 4 . 1 1 135 135 SER CB C 135 63.949 63.949 63.238 0.711 19854 3677 1 4 . 1 1 135 135 SER H H 135 7.840 7.840 7.496 0.344 19854 3678 1 4 . 1 1 136 136 ILE N N 136 124.123 124.123 121.983 2.140 19854 3679 1 4 . 1 1 136 136 ILE C C 136 175.100 175.100 176.056 -0.956 19854 3680 1 4 . 1 1 136 136 ILE CA C 136 68.634 68.634 62.789 5.845 19854 3681 1 4 . 1 1 136 136 ILE CB C 136 43.452 43.452 37.933 5.519 19854 3682 1 4 . 1 1 136 136 ILE H H 136 8.098 8.098 7.286 0.812 19854 3683 1 4 . 1 1 137 137 VAL N N 137 113.232 113.232 122.058 -8.826 19854 3684 1 4 . 1 1 137 137 VAL C C 137 176.859 176.859 176.186 0.673 19854 3685 1 4 . 1 1 137 137 VAL CA C 137 64.534 64.534 61.534 3.000 19854 3686 1 4 . 1 1 137 137 VAL CB C 137 34.082 34.082 33.010 1.072 19854 3687 1 4 . 1 1 137 137 VAL H H 137 7.711 7.711 8.079 -0.368 19854 3688 1 4 . 1 1 138 138 PHE N N 138 118.279 118.279 123.290 -5.011 19854 3689 1 4 . 1 1 138 138 PHE C C 138 175.393 175.393 176.267 -0.874 19854 3690 1 4 . 1 1 138 138 PHE CA C 138 58.092 58.092 62.552 -4.460 19854 3691 1 4 . 1 1 138 138 PHE CB C 138 39.353 39.353 39.233 0.120 19854 3692 1 4 . 1 1 138 138 PHE H H 138 8.317 8.317 7.625 0.692 19854 3693 1 4 . 1 1 139 139 HIS N N 139 120.605 120.605 115.513 5.092 19854 3694 1 4 . 1 1 139 139 HIS C C 139 175.979 175.979 176.989 -1.010 19854 3695 1 4 . 1 1 139 139 HIS CA C 139 67.775 67.775 59.224 8.551 19854 3696 1 4 . 1 1 139 139 HIS CB C 139 35.836 35.836 28.855 6.981 19854 3697 1 4 . 1 1 139 139 HIS H H 139 8.094 8.094 8.906 -0.812 19854 3698 1 4 . 1 1 140 140 ARG N N 140 120.140 120.140 120.072 0.068 19854 3699 1 4 . 1 1 140 140 ARG C C 140 178.023 178.023 179.135 -1.112 19854 3700 1 4 . 1 1 140 140 ARG CA C 140 58.394 58.394 59.147 -0.753 19854 3701 1 4 . 1 1 140 140 ARG CB C 140 39.644 39.644 29.778 9.866 19854 3702 1 4 . 1 1 140 140 ARG H H 140 8.149 8.149 6.986 1.163 19854 3703 1 4 . 1 1 141 141 LYS N N 141 115.623 115.623 119.641 -4.018 19854 3704 1 4 . 1 1 141 141 LYS C C 141 173.635 173.635 178.009 -4.374 19854 3705 1 4 . 1 1 141 141 LYS CA C 141 58.092 58.092 58.796 -0.704 19854 3706 1 4 . 1 1 141 141 LYS CB C 141 33.496 33.496 32.253 1.243 19854 3707 1 4 . 1 1 141 141 LYS H H 141 7.449 7.449 7.380 0.069 19854 3708 1 4 . 1 1 142 142 LYS N N 142 114.162 114.162 115.253 -1.091 19854 3709 1 4 . 1 1 142 142 LYS C C 142 175.979 175.979 175.714 0.265 19854 3710 1 4 . 1 1 142 142 LYS CA C 142 51.065 51.065 54.938 -3.873 19854 3711 1 4 . 1 1 142 142 LYS CB C 142 34.668 34.668 32.008 2.660 19854 3712 1 4 . 1 1 142 142 LYS H H 142 8.982 8.982 7.589 1.393 19854 3713 1 4 . 1 1 143 143 ASN N N 143 112.103 112.103 115.536 -3.433 19854 3714 1 4 . 1 1 143 143 ASN C C 143 175.100 175.100 174.197 0.903 19854 3715 1 4 . 1 1 143 143 ASN CA C 143 53.407 53.407 54.080 -0.673 19854 3716 1 4 . 1 1 143 143 ASN CB C 143 39.938 39.938 36.318 3.620 19854 3717 1 4 . 1 1 143 143 ASN H H 143 7.402 7.402 7.764 -0.362 19854 3718 1 4 . 1 1 144 144 LEU N N 144 118.810 118.810 117.111 1.699 19854 3719 1 4 . 1 1 144 144 LEU CA C 144 53.993 53.993 53.488 0.505 19854 3720 1 4 . 1 1 144 144 LEU CB C 144 42.866 42.866 44.075 -1.209 19854 3721 1 4 . 1 1 144 144 LEU H H 144 7.793 7.793 8.028 -0.235 19854 3722 1 4 . 1 1 145 145 GLN N N 145 119.607 119.607 118.136 1.471 19854 3723 1 4 . 1 1 145 145 GLN C C 145 176.859 176.859 174.278 2.581 19854 3724 1 4 . 1 1 145 145 GLN CA C 145 55.164 55.164 53.678 1.486 19854 3725 1 4 . 1 1 145 145 GLN CB C 145 29.983 29.983 30.931 -0.949 19854 3726 1 4 . 1 1 145 145 GLN H H 145 7.014 7.014 8.181 -1.167 19854 3727 1 4 . 1 1 146 146 TYR N N 146 119.275 119.275 124.304 -5.029 19854 3728 1 4 . 1 1 146 146 TYR C C 146 174.807 174.807 174.318 0.489 19854 3729 1 4 . 1 1 146 146 TYR CA C 146 62.777 62.777 56.027 6.750 19854 3730 1 4 . 1 1 146 146 TYR CB C 146 41.109 41.109 40.800 0.309 19854 3731 1 4 . 1 1 146 146 TYR H H 146 9.350 9.350 8.128 1.222 19854 3732 1 4 . 1 1 147 147 TYR N N 147 123.658 123.658 125.246 -1.588 19854 3733 1 4 . 1 1 147 147 TYR C C 147 177.738 177.738 173.742 3.996 19854 3734 1 4 . 1 1 147 147 TYR CA C 147 58.092 58.092 56.278 1.814 19854 3735 1 4 . 1 1 147 147 TYR CB C 147 39.938 39.938 42.098 -2.160 19854 3736 1 4 . 1 1 147 147 TYR H H 147 8.340 8.340 8.626 -0.286 19854 3737 1 4 . 1 1 148 148 ASP N N 148 121.267 121.267 123.635 -2.368 19854 3738 1 4 . 1 1 148 148 ASP C C 148 176.859 176.859 175.271 1.588 19854 3739 1 4 . 1 1 148 148 ASP CA C 148 54.579 54.579 54.462 0.117 19854 3740 1 4 . 1 1 148 148 ASP CB C 148 41.109 41.109 41.763 -0.654 19854 3741 1 4 . 1 1 148 148 ASP H H 148 8.911 8.911 8.333 0.578 19854 3742 1 4 . 1 1 149 149 ILE N N 149 119.607 119.607 118.467 1.140 19854 3743 1 4 . 1 1 149 149 ILE C C 149 174.807 174.807 174.181 0.626 19854 3744 1 4 . 1 1 149 149 ILE CA C 149 61.020 61.020 59.168 1.852 19854 3745 1 4 . 1 1 149 149 ILE CB C 149 39.353 39.353 42.688 -3.335 19854 3746 1 4 . 1 1 149 149 ILE H H 149 8.712 8.712 8.712 -0.000 19854 3747 1 4 . 1 1 150 150 SER N N 150 117.349 117.349 116.111 1.238 19854 3748 1 4 . 1 1 150 150 SER C C 150 175.686 175.686 174.457 1.229 19854 3749 1 4 . 1 1 150 150 SER CA C 150 60.435 60.435 55.690 4.745 19854 3750 1 4 . 1 1 150 150 SER CB C 150 62.192 62.192 65.278 -3.086 19854 3751 1 4 . 1 1 150 150 SER H H 150 8.454 8.454 8.577 -0.123 19854 3752 1 4 . 1 1 151 151 ALA N N 151 131.162 131.162 131.386 -0.224 19854 3753 1 4 . 1 1 151 151 ALA C C 151 160.742 160.742 178.737 -17.995 19854 3754 1 4 . 1 1 151 151 ALA CA C 151 53.993 53.993 54.871 -0.878 19854 3755 1 4 . 1 1 151 151 ALA CB C 151 22.369 22.369 18.970 3.399 19854 3756 1 4 . 1 1 151 151 ALA H H 151 10.640 10.640 9.005 1.635 19854 3757 1 4 . 1 1 152 152 LYS N N 152 121.400 121.400 116.370 5.030 19854 3758 1 4 . 1 1 152 152 LYS C C 152 174.221 174.221 177.595 -3.374 19854 3759 1 4 . 1 1 152 152 LYS CA C 152 59.849 59.849 58.812 1.037 19854 3760 1 4 . 1 1 152 152 LYS CB C 152 34.668 34.668 32.811 1.857 19854 3761 1 4 . 1 1 152 152 LYS H H 152 9.099 9.099 8.331 0.768 19854 3762 1 4 . 1 1 153 153 SER N N 153 135.212 135.212 110.100 25.112 19854 3763 1 4 . 1 1 153 153 SER C C 153 177.152 177.152 174.159 2.993 19854 3764 1 4 . 1 1 153 153 SER CA C 153 62.192 62.192 58.090 4.102 19854 3765 1 4 . 1 1 153 153 SER CB C 153 66.291 66.291 64.718 1.573 19854 3766 1 4 . 1 1 153 153 SER H H 153 8.935 8.935 7.792 1.143 19854 3767 1 4 . 1 1 154 154 ASN N N 154 119.341 119.341 114.236 5.105 19854 3768 1 4 . 1 1 154 154 ASN C C 154 175.979 175.979 174.199 1.780 19854 3769 1 4 . 1 1 154 154 ASN CA C 154 49.894 49.894 54.819 -4.925 19854 3770 1 4 . 1 1 154 154 ASN CB C 154 39.353 39.353 36.859 2.494 19854 3771 1 4 . 1 1 154 154 ASN H H 154 7.488 7.488 8.470 -0.982 19854 3772 1 4 . 1 1 155 155 TYR N N 155 120.074 120.074 123.192 -3.118 19854 3773 1 4 . 1 1 155 155 TYR C C 155 177.144 177.144 175.273 1.871 19854 3774 1 4 . 1 1 155 155 TYR CA C 155 60.738 60.738 60.109 0.629 19854 3775 1 4 . 1 1 155 155 TYR CB C 155 41.402 41.402 38.228 3.174 19854 3776 1 4 . 1 1 155 155 TYR H H 155 7.945 7.945 7.509 0.436 19854 3777 1 4 . 1 1 156 156 ASN N N 156 124.058 124.058 122.592 1.466 19854 3778 1 4 . 1 1 156 156 ASN C C 156 175.679 175.679 176.360 -0.681 19854 3779 1 4 . 1 1 156 156 ASN CA C 156 53.121 53.121 54.613 -1.492 19854 3780 1 4 . 1 1 156 156 ASN CB C 156 38.179 38.179 35.724 2.455 19854 3781 1 4 . 1 1 156 156 ASN H H 156 8.192 8.192 8.535 -0.343 19854 3782 1 4 . 1 1 157 157 PHE N N 157 123.459 123.459 117.008 6.451 19854 3783 1 4 . 1 1 157 157 PHE C C 157 174.221 174.221 176.691 -2.470 19854 3784 1 4 . 1 1 157 157 PHE CA C 157 57.507 57.507 60.973 -3.466 19854 3785 1 4 . 1 1 157 157 PHE CB C 157 39.353 39.353 38.139 1.214 19854 3786 1 4 . 1 1 157 157 PHE H H 157 7.429 7.429 8.469 -1.040 19854 3787 1 4 . 1 1 158 158 GLU N N 158 112.568 112.568 117.345 -4.777 19854 3788 1 4 . 1 1 158 158 GLU C C 158 176.566 176.566 177.796 -1.230 19854 3789 1 4 . 1 1 158 158 GLU CA C 158 72.147 72.147 56.579 15.568 19854 3790 1 4 . 1 1 158 158 GLU CB C 158 27.640 27.640 28.515 -0.875 19854 3791 1 4 . 1 1 158 158 GLU H H 158 7.495 7.495 7.875 -0.380 19854 3792 1 4 . 1 1 159 159 LYS N N 159 113.232 113.232 120.289 -7.057 19854 3793 1 4 . 1 1 159 159 LYS C C 159 176.566 176.566 175.656 0.910 19854 3794 1 4 . 1 1 159 159 LYS CA C 159 53.993 53.993 61.517 -7.524 19854 3795 1 4 . 1 1 159 159 LYS CB C 159 33.496 33.496 30.067 3.429 19854 3796 1 4 . 1 1 159 159 LYS H H 159 6.862 6.862 7.326 -0.464 19854 3797 1 4 . 1 1 160 160 PRO C C 160 176.273 176.273 178.573 -2.300 19854 3798 1 4 . 1 1 160 160 PRO CA C 160 64.258 64.258 65.703 -1.445 19854 3799 1 4 . 1 1 160 160 PRO CB C 160 32.318 32.318 31.152 1.166 19854 3800 1 4 . 1 1 161 161 PHE N N 161 123.726 123.726 116.016 7.710 19854 3801 1 4 . 1 1 161 161 PHE C C 161 176.851 176.851 177.558 -0.707 19854 3802 1 4 . 1 1 161 161 PHE CA C 161 60.445 60.445 61.938 -1.493 19854 3803 1 4 . 1 1 161 161 PHE CB C 161 40.816 40.816 37.820 2.996 19854 3804 1 4 . 1 1 161 161 PHE H H 161 8.215 8.215 7.328 0.887 19854 3805 1 4 . 1 1 162 162 LEU N N 162 110.177 110.177 119.220 -9.043 19854 3806 1 4 . 1 1 162 162 LEU C C 162 176.273 176.273 178.728 -2.455 19854 3807 1 4 . 1 1 162 162 LEU CA C 162 55.750 55.750 57.921 -2.171 19854 3808 1 4 . 1 1 162 162 LEU CB C 162 44.037 44.037 41.486 2.551 19854 3809 1 4 . 1 1 162 162 LEU H H 162 7.527 7.527 7.968 -0.441 19854 3810 1 4 . 1 1 163 163 TRP N N 163 123.525 123.525 121.388 2.137 19854 3811 1 4 . 1 1 163 163 TRP C C 163 177.152 177.152 177.923 -0.771 19854 3812 1 4 . 1 1 163 163 TRP CA C 163 61.606 61.606 60.882 0.724 19854 3813 1 4 . 1 1 163 163 TRP CB C 163 28.811 28.811 29.780 -0.969 19854 3814 1 4 . 1 1 163 163 TRP H H 163 7.476 7.476 8.371 -0.895 19854 3815 1 4 . 1 1 164 164 LEU N N 164 119.740 119.740 118.833 0.907 19854 3816 1 4 . 1 1 164 164 LEU C C 164 175.686 175.686 178.797 -3.111 19854 3817 1 4 . 1 1 164 164 LEU CA C 164 61.020 61.020 57.637 3.383 19854 3818 1 4 . 1 1 164 164 LEU CB C 164 45.794 45.794 41.330 4.464 19854 3819 1 4 . 1 1 164 164 LEU H H 164 9.412 9.412 7.978 1.434 19854 3820 1 4 . 1 1 165 165 ALA N N 165 118.013 118.013 121.544 -3.531 19854 3821 1 4 . 1 1 165 165 ALA C C 165 165.723 165.723 179.244 -13.521 19854 3822 1 4 . 1 1 165 165 ALA CA C 165 52.236 52.236 55.193 -2.957 19854 3823 1 4 . 1 1 165 165 ALA CB C 165 21.784 21.784 18.317 3.467 19854 3824 1 4 . 1 1 165 165 ALA H H 165 7.707 7.707 8.284 -0.577 19854 3825 1 4 . 1 1 166 166 ARG N N 166 122.994 122.994 118.369 4.625 19854 3826 1 4 . 1 1 166 166 ARG C C 166 175.979 175.979 178.739 -2.760 19854 3827 1 4 . 1 1 166 166 ARG CA C 166 49.308 49.308 59.254 -9.946 19854 3828 1 4 . 1 1 166 166 ARG CB C 166 29.397 29.397 30.066 -0.669 19854 3829 1 4 . 1 1 166 166 ARG H H 166 8.692 8.692 8.044 0.648 19854 3830 1 4 . 1 1 167 167 LYS N N 167 112.568 112.568 120.152 -7.584 19854 3831 1 4 . 1 1 167 167 LYS C C 167 176.273 176.273 179.284 -3.011 19854 3832 1 4 . 1 1 167 167 LYS CA C 167 58.092 58.092 58.969 -0.877 19854 3833 1 4 . 1 1 167 167 LYS CB C 167 34.668 34.668 31.992 2.676 19854 3834 1 4 . 1 1 167 167 LYS H H 167 6.819 6.819 7.349 -0.530 19854 3835 1 4 . 1 1 168 168 LEU N N 168 114.959 114.959 119.689 -4.730 19854 3836 1 4 . 1 1 168 168 LEU C C 168 177.738 177.738 179.025 -1.287 19854 3837 1 4 . 1 1 168 168 LEU CA C 168 56.921 56.921 57.569 -0.648 19854 3838 1 4 . 1 1 168 168 LEU CB C 168 41.695 41.695 41.883 -0.188 19854 3839 1 4 . 1 1 168 168 LEU H H 168 7.269 7.269 7.765 -0.496 19854 3840 1 4 . 1 1 169 169 ILE N N 169 122.199 122.199 116.202 5.997 19854 3841 1 4 . 1 1 169 169 ILE C C 169 177.445 177.445 177.142 0.303 19854 3842 1 4 . 1 1 169 169 ILE CA C 169 63.375 63.375 63.449 -0.074 19854 3843 1 4 . 1 1 169 169 ILE CB C 169 42.281 42.281 38.673 3.607 19854 3844 1 4 . 1 1 169 169 ILE H H 169 8.360 8.360 8.113 0.247 19854 3845 1 4 . 1 1 170 170 GLY N N 170 113.099 113.099 106.340 6.759 19854 3846 1 4 . 1 1 170 170 GLY C C 170 162.496 162.496 173.828 -11.332 19854 3847 1 4 . 1 1 170 170 GLY CA C 170 44.037 44.037 44.918 -0.881 19854 3848 1 4 . 1 1 170 170 GLY H H 170 6.686 6.686 8.023 -1.337 19854 3849 1 4 . 1 1 171 171 ASP N N 171 113.232 113.232 121.525 -8.293 19854 3850 1 4 . 1 1 171 171 ASP C C 171 178.910 178.910 176.072 2.838 19854 3851 1 4 . 1 1 171 171 ASP CA C 171 50.479 50.479 50.498 -0.019 19854 3852 1 4 . 1 1 171 171 ASP CB C 171 41.109 41.109 42.145 -1.036 19854 3853 1 4 . 1 1 171 171 ASP H H 171 6.815 6.815 7.554 -0.739 19854 3854 1 4 . 1 1 172 172 PRO C C 172 176.566 176.566 177.166 -0.600 19854 3855 1 4 . 1 1 172 172 PRO CA C 172 63.965 63.965 64.343 -0.378 19854 3856 1 4 . 1 1 172 172 PRO CB C 172 31.732 31.732 32.184 -0.452 19854 3857 1 4 . 1 1 173 173 ASN N N 173 109.779 109.779 114.982 -5.203 19854 3858 1 4 . 1 1 173 173 ASN C C 173 175.979 175.979 175.050 0.929 19854 3859 1 4 . 1 1 173 173 ASN CA C 173 54.579 54.579 52.603 1.976 19854 3860 1 4 . 1 1 173 173 ASN CB C 173 36.424 36.424 39.563 -3.139 19854 3861 1 4 . 1 1 173 173 ASN H H 173 8.016 8.016 8.358 -0.342 19854 3862 1 4 . 1 1 174 174 LEU N N 174 109.248 109.248 123.029 -13.781 19854 3863 1 4 . 1 1 174 174 LEU C C 174 176.566 176.566 175.144 1.422 19854 3864 1 4 . 1 1 174 174 LEU CA C 174 56.336 56.336 55.949 0.387 19854 3865 1 4 . 1 1 174 174 LEU CB C 174 44.037 44.037 42.838 1.199 19854 3866 1 4 . 1 1 174 174 LEU H H 174 7.871 7.871 7.276 0.595 19854 3867 1 4 . 1 1 175 175 GLU N N 175 125.185 125.185 124.435 0.750 19854 3868 1 4 . 1 1 175 175 GLU C C 175 177.445 177.445 174.925 2.520 19854 3869 1 4 . 1 1 175 175 GLU CA C 175 76.247 76.247 54.072 22.175 19854 3870 1 4 . 1 1 175 175 GLU CB C 175 28.811 28.811 33.929 -5.118 19854 3871 1 4 . 1 1 175 175 GLU H H 175 9.127 9.127 8.318 0.809 19854 3872 1 4 . 1 1 176 176 PHE N N 176 136.873 136.873 123.293 13.580 19854 3873 1 4 . 1 1 176 176 PHE C C 176 178.617 178.617 175.818 2.799 19854 3874 1 4 . 1 1 176 176 PHE CA C 176 59.264 59.264 58.481 0.783 19854 3875 1 4 . 1 1 176 176 PHE CB C 176 44.623 44.623 39.840 4.783 19854 3876 1 4 . 1 1 176 176 PHE H H 176 10.058 10.058 8.615 1.443 19854 3877 1 4 . 1 1 177 177 VAL N N 177 118.877 118.877 122.131 -3.254 19854 3878 1 4 . 1 1 177 177 VAL C C 177 177.445 177.445 174.664 2.781 19854 3879 1 4 . 1 1 177 177 VAL CA C 177 62.777 62.777 59.568 3.209 19854 3880 1 4 . 1 1 177 177 VAL CB C 177 34.668 34.668 34.313 0.355 19854 3881 1 4 . 1 1 177 177 VAL H H 177 7.789 7.789 8.116 -0.327 19854 3882 1 4 . 1 1 178 178 ALA N N 178 123.859 123.859 128.528 -4.669 19854 3883 1 4 . 1 1 178 178 ALA C C 178 177.144 177.144 177.459 -0.315 19854 3884 1 4 . 1 1 178 178 ALA CA C 178 54.000 54.000 53.900 0.100 19854 3885 1 4 . 1 1 178 178 ALA CB C 178 15.035 15.035 18.355 -3.320 19854 3886 1 4 . 1 1 178 178 ALA H H 178 7.683 7.683 7.999 -0.316 19854 3887 1 4 . 1 1 179 179 MET N N 179 121.668 121.668 115.633 6.035 19854 3888 1 4 . 1 1 179 179 MET C C 179 177.144 177.144 173.244 3.900 19854 3889 1 4 . 1 1 179 179 MET CA C 179 60.445 60.445 54.723 5.722 19854 3890 1 4 . 1 1 179 179 MET CB C 179 39.351 39.351 32.756 6.595 19854 3891 1 4 . 1 1 179 179 MET H H 179 7.648 7.648 7.848 -0.200 19854 3892 1 4 . 1 1 180 180 PRO C C 180 177.445 177.445 175.707 1.738 19854 3893 1 4 . 1 1 180 180 PRO CA C 180 64.844 64.844 62.789 2.055 19854 3894 1 4 . 1 1 180 180 PRO CB C 180 29.974 29.974 32.032 -2.058 19854 3895 1 4 . 1 1 181 181 ALA N N 181 128.439 128.439 126.213 2.226 19854 3896 1 4 . 1 1 181 181 ALA C C 181 176.273 176.273 178.061 -1.788 19854 3897 1 4 . 1 1 181 181 ALA CA C 181 58.092 58.092 52.228 5.864 19854 3898 1 4 . 1 1 181 181 ALA CB C 181 21.198 21.198 19.440 1.758 19854 3899 1 4 . 1 1 181 181 ALA H H 181 8.673 8.673 8.120 0.553 19854 3900 1 4 . 1 1 182 182 LEU N N 182 122.130 122.130 122.381 -0.251 19854 3901 1 4 . 1 1 182 182 LEU C C 182 177.445 177.445 177.549 -0.104 19854 3902 1 4 . 1 1 182 182 LEU CA C 182 55.164 55.164 54.370 0.794 19854 3903 1 4 . 1 1 182 182 LEU CB C 182 42.866 42.866 42.354 0.512 19854 3904 1 4 . 1 1 182 182 LEU H H 182 8.821 8.821 8.172 0.649 19854 3905 1 4 . 1 1 183 183 ALA N N 183 121.004 121.004 127.244 -6.240 19854 3906 1 4 . 1 1 183 183 ALA C C 183 178.617 178.617 176.079 2.538 19854 3907 1 4 . 1 1 183 183 ALA CA C 183 57.808 57.808 50.904 6.904 19854 3908 1 4 . 1 1 183 183 ALA CB C 183 24.117 24.117 18.326 5.791 19854 3909 1 4 . 1 1 183 183 ALA H H 183 8.356 8.356 8.357 -0.001 19854 3910 1 4 . 1 1 184 184 PRO C C 184 177.152 177.152 174.890 2.262 19854 3911 1 4 . 1 1 184 184 PRO CA C 184 64.258 64.258 61.684 2.574 19854 3912 1 4 . 1 1 184 184 PRO CB C 184 29.681 29.681 31.580 -1.899 19854 3913 1 4 . 1 1 185 185 PRO C C 185 175.686 175.686 176.767 -1.081 19854 3914 1 4 . 1 1 185 185 PRO CA C 185 63.379 63.379 62.799 0.580 19854 3915 1 4 . 1 1 185 185 PRO CB C 185 35.248 35.248 32.322 2.925 19854 3916 1 4 . 1 1 186 186 GLU N N 186 120.539 120.539 123.672 -3.133 19854 3917 1 4 . 1 1 186 186 GLU C C 186 176.273 176.273 176.297 -0.024 19854 3918 1 4 . 1 1 186 186 GLU CA C 186 58.101 58.101 57.226 0.875 19854 3919 1 4 . 1 1 186 186 GLU CB C 186 35.836 35.836 29.648 6.189 19854 3920 1 4 . 1 1 186 186 GLU H H 186 8.086 8.086 8.508 -0.422 19854 3921 1 4 . 1 1 187 187 VAL N N 187 124.455 124.455 115.268 9.187 19854 3922 1 4 . 1 1 187 187 VAL C C 187 178.910 178.910 175.094 3.816 19854 3923 1 4 . 1 1 187 187 VAL CA C 187 63.363 63.363 62.776 0.587 19854 3924 1 4 . 1 1 187 187 VAL CB C 187 34.082 34.082 30.910 3.172 19854 3925 1 4 . 1 1 187 187 VAL H H 187 8.622 8.622 7.607 1.015 19854 3926 1 4 . 1 1 188 188 VAL N N 188 128.572 128.572 123.105 5.467 19854 3927 1 4 . 1 1 188 188 VAL C C 188 178.324 178.324 177.199 1.125 19854 3928 1 4 . 1 1 188 188 VAL CA C 188 68.634 68.634 63.358 5.277 19854 3929 1 4 . 1 1 188 188 VAL CB C 188 31.154 31.154 31.905 -0.751 19854 3930 1 4 . 1 1 188 188 VAL H H 188 8.497 8.497 7.975 0.522 19854 3931 1 4 . 1 1 189 189 MET N N 189 122.795 122.795 119.325 3.470 19854 3932 1 4 . 1 1 189 189 MET C C 189 177.445 177.445 175.821 1.624 19854 3933 1 4 . 1 1 189 189 MET CA C 189 55.164 55.164 55.889 -0.725 19854 3934 1 4 . 1 1 189 189 MET CB C 189 35.253 35.253 33.190 2.063 19854 3935 1 4 . 1 1 189 189 MET H H 189 6.991 6.991 7.568 -0.577 19854 3936 1 4 . 1 1 190 190 ASP N N 190 114.959 114.959 119.878 -4.919 19854 3937 1 4 . 1 1 190 190 ASP C C 190 175.686 175.686 175.819 -0.133 19854 3938 1 4 . 1 1 190 190 ASP CA C 190 51.065 51.065 55.872 -4.807 19854 3939 1 4 . 1 1 190 190 ASP CB C 190 41.695 41.695 40.325 1.370 19854 3940 1 4 . 1 1 190 190 ASP H H 190 7.210 7.210 8.556 -1.346 19854 3941 1 4 . 1 1 191 191 PRO C C 191 176.566 176.566 178.091 -1.525 19854 3942 1 4 . 1 1 191 191 PRO CA C 191 63.965 63.965 65.142 -1.177 19854 3943 1 4 . 1 1 191 191 PRO CB C 191 31.146 31.146 31.349 -0.202 19854 3944 1 4 . 1 1 192 192 ALA N N 192 109.513 109.513 120.586 -11.073 19854 3945 1 4 . 1 1 192 192 ALA CA C 192 53.993 53.993 54.233 -0.240 19854 3946 1 4 . 1 1 192 192 ALA CB C 192 19.441 19.441 18.303 1.138 19854 3947 1 4 . 1 1 192 192 ALA H H 192 7.394 7.394 7.870 -0.475 19854 3948 1 4 . 1 1 193 193 LEU N N 193 119.009 119.009 118.107 0.902 19854 3949 1 4 . 1 1 193 193 LEU C C 193 175.979 175.979 177.292 -1.313 19854 3950 1 4 . 1 1 193 193 LEU CA C 193 56.336 56.336 55.429 0.906 19854 3951 1 4 . 1 1 193 193 LEU CB C 193 42.866 42.866 41.776 1.090 19854 3952 1 4 . 1 1 193 193 LEU H H 193 8.340 8.340 7.759 0.581 19854 3953 1 4 . 1 1 194 194 ALA N N 194 121.666 121.666 119.761 1.905 19854 3954 1 4 . 1 1 194 194 ALA C C 194 166.896 166.896 178.132 -11.236 19854 3955 1 4 . 1 1 194 194 ALA CA C 194 55.164 55.164 52.980 2.184 19854 3956 1 4 . 1 1 194 194 ALA CB C 194 16.513 16.513 19.354 -2.841 19854 3957 1 4 . 1 1 194 194 ALA H H 194 8.176 8.176 7.793 0.383 19854 3958 1 4 . 1 1 195 195 ALA N N 195 119.541 119.541 121.337 -1.796 19854 3959 1 4 . 1 1 195 195 ALA C C 195 173.928 173.928 179.128 -5.200 19854 3960 1 4 . 1 1 195 195 ALA CA C 195 57.507 57.507 54.456 3.051 19854 3961 1 4 . 1 1 195 195 ALA CB C 195 19.441 19.441 17.423 2.018 19854 3962 1 4 . 1 1 195 195 ALA H H 195 8.364 8.364 8.871 -0.507 19854 3963 1 4 . 1 1 196 196 GLN N N 196 107.322 107.322 119.448 -12.126 19854 3964 1 4 . 1 1 196 196 GLN C C 196 176.273 176.273 177.704 -1.431 19854 3965 1 4 . 1 1 196 196 GLN CA C 196 56.921 56.921 58.183 -1.262 19854 3966 1 4 . 1 1 196 196 GLN CB C 196 29.983 29.983 28.725 1.258 19854 3967 1 4 . 1 1 196 196 GLN H H 196 7.910 7.910 7.937 -0.027 19854 3968 1 4 . 1 1 197 197 TYR N N 197 119.277 119.277 121.938 -2.661 19854 3969 1 4 . 1 1 197 197 TYR C C 197 178.316 178.316 177.283 1.033 19854 3970 1 4 . 1 1 197 197 TYR CA C 197 56.343 56.343 60.495 -4.152 19854 3971 1 4 . 1 1 197 197 TYR CB C 197 43.453 43.453 38.430 5.023 19854 3972 1 4 . 1 1 197 197 TYR H H 197 8.180 8.180 8.151 0.029 19854 3973 1 4 . 1 1 198 198 GLU N N 198 110.244 110.244 118.083 -7.839 19854 3974 1 4 . 1 1 198 198 GLU C C 198 176.273 176.273 178.565 -2.292 19854 3975 1 4 . 1 1 198 198 GLU CA C 198 53.407 53.407 59.430 -6.023 19854 3976 1 4 . 1 1 198 198 GLU CB C 198 30.568 30.568 29.113 1.455 19854 3977 1 4 . 1 1 198 198 GLU H H 198 7.523 7.523 8.138 -0.615 19854 3978 1 4 . 1 1 199 199 HIS N N 199 119.211 119.211 118.454 0.757 19854 3979 1 4 . 1 1 199 199 HIS C C 199 178.902 178.902 176.964 1.938 19854 3980 1 4 . 1 1 199 199 HIS CA C 199 58.687 58.687 60.042 -1.355 19854 3981 1 4 . 1 1 199 199 HIS CB C 199 34.957 34.957 29.647 5.310 19854 3982 1 4 . 1 1 199 199 HIS H H 199 8.258 8.258 7.807 0.451 19854 3983 1 4 . 1 1 200 200 ASP N N 200 124.722 124.722 119.354 5.368 19854 3984 1 4 . 1 1 200 200 ASP C C 200 176.705 176.705 178.583 -1.878 19854 3985 1 4 . 1 1 200 200 ASP CA C 200 58.687 58.687 57.100 1.587 19854 3986 1 4 . 1 1 200 200 ASP CB C 200 39.644 39.644 40.297 -0.653 19854 3987 1 4 . 1 1 200 200 ASP H H 200 8.086 8.086 7.778 0.308 19854 3988 1 4 . 1 1 201 201 LEU N N 201 116.353 116.353 120.170 -3.817 19854 3989 1 4 . 1 1 201 201 LEU C C 201 178.910 178.910 179.104 -0.194 19854 3990 1 4 . 1 1 201 201 LEU CA C 201 61.606 61.606 58.137 3.469 19854 3991 1 4 . 1 1 201 201 LEU CB C 201 41.109 41.109 41.597 -0.488 19854 3992 1 4 . 1 1 201 201 LEU H H 201 7.722 7.722 7.882 -0.160 19854 3993 1 4 . 1 1 202 202 GLU N N 202 118.080 118.080 118.937 -0.857 19854 3994 1 4 . 1 1 202 202 GLU C C 202 176.566 176.566 179.101 -2.535 19854 3995 1 4 . 1 1 202 202 GLU CA C 202 56.921 56.921 59.585 -2.664 19854 3996 1 4 . 1 1 202 202 GLU CB C 202 30.568 30.568 29.651 0.917 19854 3997 1 4 . 1 1 202 202 GLU H H 202 8.857 8.857 7.997 0.860 19854 3998 1 4 . 1 1 203 203 VAL N N 203 129.369 129.369 117.165 12.204 19854 3999 1 4 . 1 1 203 203 VAL C C 203 178.617 178.617 177.420 1.197 19854 4000 1 4 . 1 1 203 203 VAL CA C 203 64.534 64.534 66.133 -1.599 19854 4001 1 4 . 1 1 203 203 VAL CB C 203 27.640 27.640 30.792 -3.152 19854 4002 1 4 . 1 1 203 203 VAL H H 203 9.283 9.283 7.256 2.027 19854 4003 1 4 . 1 1 204 204 ALA N N 204 109.580 109.580 121.969 -12.389 19854 4004 1 4 . 1 1 204 204 ALA C C 204 176.859 176.859 179.699 -2.840 19854 4005 1 4 . 1 1 204 204 ALA CA C 204 54.579 54.579 54.680 -0.101 19854 4006 1 4 . 1 1 204 204 ALA CB C 204 18.270 18.270 18.600 -0.330 19854 4007 1 4 . 1 1 204 204 ALA H H 204 8.528 8.528 7.834 0.694 19854 4008 1 4 . 1 1 205 205 GLN N N 205 123.328 123.328 116.592 6.736 19854 4009 1 4 . 1 1 205 205 GLN C C 205 177.418 177.418 178.265 -0.847 19854 4010 1 4 . 1 1 205 205 GLN CA C 205 57.515 57.515 58.513 -0.998 19854 4011 1 4 . 1 1 205 205 GLN CB C 205 33.785 33.785 29.078 4.707 19854 4012 1 4 . 1 1 205 205 GLN H H 205 8.160 8.160 8.113 0.047 19854 4013 1 4 . 1 1 206 206 THR N N 206 120.271 120.271 113.834 6.437 19854 4014 1 4 . 1 1 206 206 THR C C 206 176.273 176.273 175.145 1.128 19854 4015 1 4 . 1 1 206 206 THR CA C 206 67.462 67.462 64.758 2.704 19854 4016 1 4 . 1 1 206 206 THR CB C 206 70.390 70.390 69.105 1.285 19854 4017 1 4 . 1 1 206 206 THR H H 206 7.585 7.585 7.753 -0.168 19854 4018 1 4 . 1 1 207 207 THR N N 207 111.970 111.970 119.496 -7.526 19854 4019 1 4 . 1 1 207 207 THR C C 207 176.566 176.566 173.444 3.122 19854 4020 1 4 . 1 1 207 207 THR CA C 207 64.534 64.534 63.614 0.920 19854 4021 1 4 . 1 1 207 207 THR CB C 207 72.733 72.733 69.254 3.479 19854 4022 1 4 . 1 1 207 207 THR H H 207 7.468 7.468 7.502 -0.034 19854 4023 1 4 . 1 1 208 208 ALA N N 208 115.623 115.623 128.903 -13.280 19854 4024 1 4 . 1 1 208 208 ALA C C 208 168.947 168.947 176.745 -7.798 19854 4025 1 4 . 1 1 208 208 ALA CA C 208 55.164 55.164 51.612 3.552 19854 4026 1 4 . 1 1 208 208 ALA CB C 208 22.369 22.369 19.791 2.578 19854 4027 1 4 . 1 1 208 208 ALA H H 208 7.390 7.390 8.144 -0.754 19854 4028 1 4 . 1 1 209 209 LEU N N 209 117.814 117.814 121.982 -4.168 19854 4029 1 4 . 1 1 209 209 LEU C C 209 176.273 176.273 174.925 1.348 19854 4030 1 4 . 1 1 209 209 LEU CA C 209 58.678 58.678 52.026 6.652 19854 4031 1 4 . 1 1 209 209 LEU CB C 209 46.380 46.380 41.888 4.492 19854 4032 1 4 . 1 1 209 209 LEU H H 209 7.652 7.652 8.150 -0.498 19854 4033 1 4 . 1 1 210 210 PRO C C 210 176.566 176.566 175.328 1.238 19854 4034 1 4 . 1 1 210 210 PRO CA C 210 63.086 63.086 62.283 0.803 19854 4035 1 4 . 1 1 210 210 PRO CB C 210 31.146 31.146 32.016 -0.870 19854 4036 1 4 . 1 1 211 211 ASP N N 211 122.863 122.863 124.833 -1.970 19854 4037 1 4 . 1 1 211 211 ASP C C 211 175.686 175.686 175.552 0.134 19854 4038 1 4 . 1 1 211 211 ASP CA C 211 56.343 56.343 53.990 2.353 19854 4039 1 4 . 1 1 211 211 ASP CB C 211 41.402 41.402 41.504 -0.102 19854 4040 1 4 . 1 1 211 211 ASP H H 211 8.360 8.360 8.370 -0.010 19854 4041 1 4 . 1 1 212 212 GLU N N 212 131.162 131.162 126.389 4.773 19854 4042 1 4 . 1 1 212 212 GLU C C 212 176.273 176.273 176.202 0.071 19854 4043 1 4 . 1 1 212 212 GLU CA C 212 55.164 55.164 57.417 -2.253 19854 4044 1 4 . 1 1 212 212 GLU CB C 212 30.568 30.568 31.099 -0.531 19854 4045 1 4 . 1 1 212 212 GLU H H 212 8.399 8.399 8.784 -0.385 19854 4046 1 4 . 1 1 213 213 ASP N N 213 122.797 122.797 116.062 6.735 19854 4047 1 4 . 1 1 213 213 ASP C C 213 177.152 177.152 176.240 0.912 19854 4048 1 4 . 1 1 213 213 ASP CA C 213 61.914 61.914 53.064 8.850 19854 4049 1 4 . 1 1 213 213 ASP CB C 213 49.607 49.607 40.246 9.361 19854 4050 1 4 . 1 1 213 213 ASP H H 213 8.168 8.168 8.208 -0.040 19854 4051 1 4 . 1 1 214 214 ASP N N 214 112.369 112.369 122.060 -9.691 19854 4052 1 4 . 1 1 214 214 ASP C C 214 178.910 178.910 177.001 1.909 19854 4053 1 4 . 1 1 214 214 ASP CA C 214 54.579 54.579 56.753 -2.174 19854 4054 1 4 . 1 1 214 214 ASP CB C 214 39.353 39.353 40.411 -1.058 19854 4055 1 4 . 1 1 214 214 ASP H H 214 7.464 7.464 8.398 -0.934 19854 4056 1 4 . 1 1 215 215 ASP N N 215 127.244 127.244 119.255 7.989 19854 4057 1 4 . 1 1 215 215 ASP C C 215 176.859 176.859 177.330 -0.471 19854 4058 1 4 . 1 1 215 215 ASP CA C 215 54.579 54.579 55.942 -1.363 19854 4059 1 4 . 1 1 215 215 ASP CB C 215 40.524 40.524 41.025 -0.501 19854 4060 1 4 . 1 1 215 215 ASP H H 215 8.301 8.301 8.382 -0.081 19854 4061 1 5 . 1 1 2 2 ALA N N 2 131.228 131.228 122.363 8.865 19854 4062 1 5 . 1 1 2 2 ALA C C 2 187.031 187.031 179.116 7.915 19854 4063 1 5 . 1 1 2 2 ALA CA C 2 53.407 53.407 55.306 -1.899 19854 4064 1 5 . 1 1 2 2 ALA CB C 2 20.027 20.027 18.229 1.798 19854 4065 1 5 . 1 1 2 2 ALA H H 2 10.644 10.644 8.316 2.328 19854 4066 1 5 . 1 1 3 3 ALA N N 3 124.521 124.521 120.321 4.200 19854 4067 1 5 . 1 1 3 3 ALA C C 3 176.566 176.566 179.363 -2.797 19854 4068 1 5 . 1 1 3 3 ALA CA C 3 49.894 49.894 54.344 -4.450 19854 4069 1 5 . 1 1 3 3 ALA CB C 3 18.270 18.270 18.015 0.255 19854 4070 1 5 . 1 1 3 3 ALA H H 3 8.669 8.669 8.149 0.520 19854 4071 1 5 . 1 1 4 4 GLN N N 4 118.080 118.080 117.052 1.028 19854 4072 1 5 . 1 1 4 4 GLN C C 4 176.273 176.273 176.834 -0.561 19854 4073 1 5 . 1 1 4 4 GLN CA C 4 54.579 54.579 56.309 -1.730 19854 4074 1 5 . 1 1 4 4 GLN CB C 4 27.054 27.054 29.249 -2.195 19854 4075 1 5 . 1 1 4 4 GLN H H 4 8.919 8.919 7.906 1.013 19854 4076 1 5 . 1 1 5 5 GLY N N 5 121.002 121.002 106.830 14.172 19854 4077 1 5 . 1 1 5 5 GLY C C 5 181.877 181.877 173.579 8.298 19854 4078 1 5 . 1 1 5 5 GLY CA C 5 45.794 45.794 44.892 0.902 19854 4079 1 5 . 1 1 5 5 GLY H H 5 8.082 8.082 7.945 0.137 19854 4080 1 5 . 1 1 6 6 GLU N N 6 129.435 129.435 121.775 7.660 19854 4081 1 5 . 1 1 6 6 GLU C C 6 176.566 176.566 174.891 1.675 19854 4082 1 5 . 1 1 6 6 GLU CA C 6 56.336 56.336 52.556 3.780 19854 4083 1 5 . 1 1 6 6 GLU CB C 6 28.811 28.811 30.539 -1.728 19854 4084 1 5 . 1 1 6 6 GLU H H 6 9.267 9.267 7.971 1.296 19854 4085 1 5 . 1 1 7 7 PRO C C 7 176.566 176.566 176.525 0.041 19854 4086 1 5 . 1 1 7 7 PRO CA C 7 63.672 63.672 62.976 0.696 19854 4087 1 5 . 1 1 7 7 PRO CB C 7 31.146 31.146 31.173 -0.027 19854 4088 1 5 . 1 1 8 8 GLN N N 8 112.502 112.502 115.261 -2.759 19854 4089 1 5 . 1 1 8 8 GLN C C 8 177.445 177.445 174.852 2.593 19854 4090 1 5 . 1 1 8 8 GLN CA C 8 50.479 50.479 58.572 -8.094 19854 4091 1 5 . 1 1 8 8 GLN CB C 8 28.811 28.811 27.078 1.733 19854 4092 1 5 . 1 1 8 8 GLN H H 8 6.220 6.220 8.570 -2.350 19854 4093 1 5 . 1 1 9 9 VAL N N 9 117.416 117.416 122.080 -4.664 19854 4094 1 5 . 1 1 9 9 VAL C C 9 178.324 178.324 174.080 4.244 19854 4095 1 5 . 1 1 9 9 VAL CA C 9 63.363 63.363 61.488 1.875 19854 4096 1 5 . 1 1 9 9 VAL CB C 9 34.668 34.668 32.903 1.765 19854 4097 1 5 . 1 1 9 9 VAL H H 9 6.561 6.561 7.765 -1.204 19854 4098 1 5 . 1 1 10 10 GLN N N 10 113.896 113.896 124.946 -11.050 19854 4099 1 5 . 1 1 10 10 GLN C C 10 176.273 176.273 174.267 2.006 19854 4100 1 5 . 1 1 10 10 GLN CA C 10 55.164 55.164 54.051 1.113 19854 4101 1 5 . 1 1 10 10 GLN CB C 10 28.226 28.226 32.463 -4.237 19854 4102 1 5 . 1 1 10 10 GLN H H 10 7.847 7.847 8.211 -0.364 19854 4103 1 5 . 1 1 11 11 PHE N N 11 118.744 118.744 124.580 -5.836 19854 4104 1 5 . 1 1 11 11 PHE C C 11 176.566 176.566 174.990 1.576 19854 4105 1 5 . 1 1 11 11 PHE CA C 11 59.849 59.849 56.669 3.180 19854 4106 1 5 . 1 1 11 11 PHE CB C 11 41.109 41.109 42.264 -1.155 19854 4107 1 5 . 1 1 11 11 PHE H H 11 8.262 8.262 9.139 -0.877 19854 4108 1 5 . 1 1 12 12 LYS N N 12 129.437 129.437 124.546 4.891 19854 4109 1 5 . 1 1 12 12 LYS C C 12 178.609 178.609 175.585 3.024 19854 4110 1 5 . 1 1 12 12 LYS CA C 12 57.808 57.808 56.241 1.567 19854 4111 1 5 . 1 1 12 12 LYS H H 12 10.015 10.015 8.901 1.114 19854 4112 1 5 . 1 1 13 13 LEU N N 13 112.103 112.103 126.413 -14.310 19854 4113 1 5 . 1 1 13 13 LEU C C 13 177.738 177.738 175.626 2.112 19854 4114 1 5 . 1 1 13 13 LEU CA C 13 54.579 54.579 53.510 1.069 19854 4115 1 5 . 1 1 13 13 LEU CB C 13 42.866 42.866 44.303 -1.437 19854 4116 1 5 . 1 1 13 13 LEU H H 13 6.905 6.905 9.140 -2.235 19854 4117 1 5 . 1 1 14 14 VAL N N 14 127.310 127.310 122.919 4.391 19854 4118 1 5 . 1 1 14 14 VAL C C 14 175.393 175.393 174.357 1.036 19854 4119 1 5 . 1 1 14 14 VAL CA C 14 70.976 70.976 61.569 9.407 19854 4120 1 5 . 1 1 14 14 VAL CB C 14 28.811 28.811 33.121 -4.310 19854 4121 1 5 . 1 1 14 14 VAL H H 14 8.305 8.305 8.616 -0.311 19854 4122 1 5 . 1 1 15 15 LEU N N 15 128.640 128.640 130.746 -2.106 19854 4123 1 5 . 1 1 15 15 LEU C C 15 177.730 177.730 175.178 2.552 19854 4124 1 5 . 1 1 15 15 LEU CA C 15 55.758 55.758 53.347 2.410 19854 4125 1 5 . 1 1 15 15 LEU H H 15 7.718 7.718 8.858 -1.140 19854 4126 1 5 . 1 1 16 16 VAL N N 16 121.267 121.267 121.710 -0.443 19854 4127 1 5 . 1 1 16 16 VAL C C 16 178.324 178.324 174.480 3.844 19854 4128 1 5 . 1 1 16 16 VAL CA C 16 63.363 63.363 58.630 4.733 19854 4129 1 5 . 1 1 16 16 VAL CB C 16 35.839 35.839 35.263 0.576 19854 4130 1 5 . 1 1 16 16 VAL H H 16 8.935 8.935 8.957 -0.022 19854 4131 1 5 . 1 1 17 17 GLY N N 17 127.908 127.908 107.041 20.867 19854 4132 1 5 . 1 1 17 17 GLY C C 17 174.514 174.514 173.121 1.393 19854 4133 1 5 . 1 1 17 17 GLY CA C 17 42.281 42.281 44.532 -2.252 19854 4134 1 5 . 1 1 17 17 GLY H H 17 9.682 9.682 6.780 2.902 19854 4135 1 5 . 1 1 18 18 ASP N N 18 125.054 125.054 121.309 3.745 19854 4136 1 5 . 1 1 18 18 ASP C C 18 176.851 176.851 177.562 -0.711 19854 4137 1 5 . 1 1 18 18 ASP CA C 18 57.515 57.515 54.619 2.896 19854 4138 1 5 . 1 1 18 18 ASP CB C 18 46.090 46.090 41.989 4.101 19854 4139 1 5 . 1 1 18 18 ASP H H 18 8.282 8.282 8.370 -0.088 19854 4140 1 5 . 1 1 19 19 GLY N N 19 120.670 120.670 107.543 13.127 19854 4141 1 5 . 1 1 19 19 GLY C C 19 178.324 178.324 174.976 3.348 19854 4142 1 5 . 1 1 19 19 GLY CA C 19 42.281 42.281 45.434 -3.153 19854 4143 1 5 . 1 1 19 19 GLY H H 19 8.825 8.825 8.651 0.174 19854 4144 1 5 . 1 1 20 20 GLY N N 20 129.369 129.369 111.707 17.662 19854 4145 1 5 . 1 1 20 20 GLY C C 20 174.221 174.221 175.851 -1.630 19854 4146 1 5 . 1 1 20 20 GLY CA C 20 41.695 41.695 45.407 -3.712 19854 4147 1 5 . 1 1 20 20 GLY H H 20 8.477 8.477 8.648 -0.171 19854 4148 1 5 . 1 1 21 21 THR N N 21 122.199 122.199 113.953 8.246 19854 4149 1 5 . 1 1 21 21 THR C C 21 171.291 171.291 175.110 -3.819 19854 4150 1 5 . 1 1 21 21 THR CA C 21 61.914 61.914 64.573 -2.659 19854 4151 1 5 . 1 1 21 21 THR CB C 21 65.137 65.137 69.274 -4.137 19854 4152 1 5 . 1 1 21 21 THR H H 21 8.059 8.059 7.648 0.411 19854 4153 1 5 . 1 1 22 22 GLY N N 22 112.369 112.369 108.253 4.116 19854 4154 1 5 . 1 1 22 22 GLY C C 22 184.807 184.807 175.442 9.365 19854 4155 1 5 . 1 1 22 22 GLY CA C 22 45.209 45.209 45.071 0.138 19854 4156 1 5 . 1 1 22 22 GLY H H 22 6.772 6.772 8.315 -1.543 19854 4157 1 5 . 1 1 23 23 LYS N N 23 122.066 122.066 120.632 1.434 19854 4158 1 5 . 1 1 23 23 LYS C C 23 178.589 178.589 178.135 0.454 19854 4159 1 5 . 1 1 23 23 LYS CA C 23 58.101 58.101 59.989 -1.888 19854 4160 1 5 . 1 1 23 23 LYS CB C 23 40.230 40.230 32.425 7.805 19854 4161 1 5 . 1 1 23 23 LYS H H 23 7.441 7.441 7.631 -0.190 19854 4162 1 5 . 1 1 24 24 THR N N 24 114.627 114.627 113.871 0.756 19854 4163 1 5 . 1 1 24 24 THR C C 24 178.324 178.324 176.785 1.539 19854 4164 1 5 . 1 1 24 24 THR CA C 24 62.192 62.192 67.105 -4.913 19854 4165 1 5 . 1 1 24 24 THR CB C 24 71.562 71.562 68.127 3.435 19854 4166 1 5 . 1 1 24 24 THR H H 24 8.469 8.469 8.494 -0.025 19854 4167 1 5 . 1 1 25 25 THR N N 25 110.377 110.377 119.473 -9.096 19854 4168 1 5 . 1 1 25 25 THR C C 25 178.324 178.324 176.123 2.201 19854 4169 1 5 . 1 1 25 25 THR CA C 25 64.534 64.534 67.296 -2.762 19854 4170 1 5 . 1 1 25 25 THR CB C 25 71.562 71.562 68.424 3.138 19854 4171 1 5 . 1 1 25 25 THR H H 25 8.415 8.415 8.157 0.258 19854 4172 1 5 . 1 1 26 26 PHE N N 26 114.295 114.295 123.035 -8.740 19854 4173 1 5 . 1 1 26 26 PHE C C 26 174.514 174.514 176.833 -2.319 19854 4174 1 5 . 1 1 26 26 PHE CA C 26 53.407 53.407 61.794 -8.387 19854 4175 1 5 . 1 1 26 26 PHE CB C 26 40.524 40.524 38.886 1.638 19854 4176 1 5 . 1 1 26 26 PHE H H 26 7.707 7.707 8.458 -0.751 19854 4177 1 5 . 1 1 27 27 VAL N N 27 123.525 123.525 119.866 3.659 19854 4178 1 5 . 1 1 27 27 VAL C C 27 178.031 178.031 177.609 0.422 19854 4179 1 5 . 1 1 27 27 VAL CA C 27 67.462 67.462 66.984 0.478 19854 4180 1 5 . 1 1 27 27 VAL CB C 27 29.397 29.397 31.428 -2.031 19854 4181 1 5 . 1 1 27 27 VAL H H 27 6.967 6.967 8.133 -1.166 19854 4182 1 5 . 1 1 28 28 LYS N N 28 114.228 114.228 120.146 -5.918 19854 4183 1 5 . 1 1 28 28 LYS C C 28 176.566 176.566 178.132 -1.566 19854 4184 1 5 . 1 1 28 28 LYS CA C 28 58.092 58.092 59.917 -1.825 19854 4185 1 5 . 1 1 28 28 LYS CB C 28 34.082 34.082 32.333 1.750 19854 4186 1 5 . 1 1 28 28 LYS H H 28 7.429 7.429 8.246 -0.817 19854 4187 1 5 . 1 1 29 29 ARG N N 29 112.037 112.037 119.489 -7.452 19854 4188 1 5 . 1 1 29 29 ARG C C 29 174.221 174.221 179.050 -4.829 19854 4189 1 5 . 1 1 29 29 ARG CA C 29 72.147 72.147 58.019 14.128 19854 4190 1 5 . 1 1 29 29 ARG CB C 29 37.596 37.596 28.823 8.774 19854 4191 1 5 . 1 1 29 29 ARG H H 29 6.803 6.803 7.808 -1.005 19854 4192 1 5 . 1 1 30 30 HIS N N 30 122.396 122.396 117.457 4.939 19854 4193 1 5 . 1 1 30 30 HIS C C 30 172.170 172.170 176.788 -4.618 19854 4194 1 5 . 1 1 30 30 HIS CA C 30 51.651 51.651 59.490 -7.839 19854 4195 1 5 . 1 1 30 30 HIS CB C 30 30.568 30.568 29.624 0.944 19854 4196 1 5 . 1 1 30 30 HIS H H 30 7.644 7.644 7.411 0.233 19854 4197 1 5 . 1 1 31 31 LEU N N 31 110.377 110.377 117.020 -6.643 19854 4198 1 5 . 1 1 31 31 LEU C C 31 178.031 178.031 178.469 -0.438 19854 4199 1 5 . 1 1 31 31 LEU CA C 31 55.164 55.164 57.233 -2.069 19854 4200 1 5 . 1 1 31 31 LEU CB C 31 42.281 42.281 42.243 0.038 19854 4201 1 5 . 1 1 31 31 LEU H H 31 7.894 7.894 8.005 -0.111 19854 4202 1 5 . 1 1 32 32 THR N N 32 121.468 121.468 106.463 15.005 19854 4203 1 5 . 1 1 32 32 THR C C 32 170.705 170.705 175.528 -4.823 19854 4204 1 5 . 1 1 32 32 THR CA C 32 63.668 63.668 61.780 1.888 19854 4205 1 5 . 1 1 32 32 THR CB C 32 75.679 75.679 71.178 4.501 19854 4206 1 5 . 1 1 32 32 THR H H 32 8.372 8.372 8.188 0.184 19854 4207 1 5 . 1 1 33 33 GLY N N 33 127.841 127.841 109.972 17.869 19854 4208 1 5 . 1 1 33 33 GLY C C 33 161.914 161.914 173.996 -12.082 19854 4209 1 5 . 1 1 33 33 GLY CA C 33 42.866 42.866 45.062 -2.196 19854 4210 1 5 . 1 1 33 33 GLY H H 33 9.662 9.662 7.736 1.926 19854 4211 1 5 . 1 1 34 34 GLU N N 34 120.871 120.871 120.297 0.574 19854 4212 1 5 . 1 1 34 34 GLU C C 34 174.508 174.508 174.853 -0.345 19854 4213 1 5 . 1 1 34 34 GLU CA C 34 58.101 58.101 55.782 2.320 19854 4214 1 5 . 1 1 34 34 GLU CB C 34 34.371 34.371 30.524 3.847 19854 4215 1 5 . 1 1 34 34 GLU H H 34 8.211 8.211 7.488 0.723 19854 4216 1 5 . 1 1 35 35 PHE N N 35 111.838 111.838 119.046 -7.208 19854 4217 1 5 . 1 1 35 35 PHE C C 35 174.221 174.221 175.245 -1.024 19854 4218 1 5 . 1 1 35 35 PHE CA C 35 49.308 49.308 56.937 -7.629 19854 4219 1 5 . 1 1 35 35 PHE CB C 35 41.695 41.695 40.240 1.455 19854 4220 1 5 . 1 1 35 35 PHE H H 35 6.772 6.772 8.580 -1.808 19854 4221 1 5 . 1 1 36 36 GLU N N 36 120.672 120.672 125.805 -5.133 19854 4222 1 5 . 1 1 36 36 GLU C C 36 175.686 175.686 176.025 -0.339 19854 4223 1 5 . 1 1 36 36 GLU CA C 36 58.980 58.980 55.660 3.320 19854 4224 1 5 . 1 1 36 36 GLU CB C 36 48.140 48.140 30.308 17.832 19854 4225 1 5 . 1 1 36 36 GLU H H 36 8.293 8.293 8.702 -0.409 19854 4226 1 5 . 1 1 37 37 LYS N N 37 118.810 118.810 124.228 -5.418 19854 4227 1 5 . 1 1 37 37 LYS C C 37 172.756 172.756 176.326 -3.570 19854 4228 1 5 . 1 1 37 37 LYS CA C 37 48.137 48.137 56.406 -8.269 19854 4229 1 5 . 1 1 37 37 LYS CB C 37 37.010 37.010 33.148 3.861 19854 4230 1 5 . 1 1 37 37 LYS H H 37 8.509 8.509 8.472 0.037 19854 4231 1 5 . 1 1 38 38 LYS N N 38 108.052 108.052 120.713 -12.661 19854 4232 1 5 . 1 1 38 38 LYS C C 38 176.273 176.273 175.090 1.183 19854 4233 1 5 . 1 1 38 38 LYS CA C 38 59.849 59.849 55.483 4.366 19854 4234 1 5 . 1 1 38 38 LYS CB C 38 34.668 34.668 33.258 1.410 19854 4235 1 5 . 1 1 38 38 LYS H H 38 7.715 7.715 7.465 0.250 19854 4236 1 5 . 1 1 39 39 TYR N N 39 108.650 108.650 124.302 -15.652 19854 4237 1 5 . 1 1 39 39 TYR C C 39 175.686 175.686 175.633 0.053 19854 4238 1 5 . 1 1 39 39 TYR CA C 39 61.020 61.020 58.330 2.690 19854 4239 1 5 . 1 1 39 39 TYR CB C 39 36.424 36.424 39.255 -2.831 19854 4240 1 5 . 1 1 39 39 TYR H H 39 7.362 7.362 8.709 -1.347 19854 4241 1 5 . 1 1 40 40 VAL N N 40 117.947 117.947 126.963 -9.016 19854 4242 1 5 . 1 1 40 40 VAL C C 40 175.393 175.393 175.238 0.155 19854 4243 1 5 . 1 1 40 40 VAL CA C 40 61.020 61.020 61.224 -0.204 19854 4244 1 5 . 1 1 40 40 VAL CB C 40 31.154 31.154 34.019 -2.865 19854 4245 1 5 . 1 1 40 40 VAL H H 40 8.442 8.442 8.447 -0.005 19854 4246 1 5 . 1 1 42 42 THR N N 42 117.150 117.150 117.249 -0.099 19854 4247 1 5 . 1 1 42 42 THR C C 42 178.910 178.910 173.964 4.946 19854 4248 1 5 . 1 1 42 42 THR CA C 42 60.435 60.435 62.569 -2.134 19854 4249 1 5 . 1 1 42 42 THR CB C 42 70.390 70.390 69.855 0.535 19854 4250 1 5 . 1 1 42 42 THR H H 42 8.192 8.192 8.363 -0.171 19854 4251 1 5 . 1 1 43 43 LEU N N 43 119.209 119.209 127.025 -7.816 19854 4252 1 5 . 1 1 43 43 LEU C C 43 174.807 174.807 177.659 -2.852 19854 4253 1 5 . 1 1 43 43 LEU CA C 43 57.507 57.507 54.796 2.711 19854 4254 1 5 . 1 1 43 43 LEU CB C 43 42.866 42.866 42.743 0.123 19854 4255 1 5 . 1 1 43 43 LEU H H 43 9.260 9.260 8.506 0.754 19854 4256 1 5 . 1 1 44 44 GLY N N 44 114.361 114.361 114.303 0.058 19854 4257 1 5 . 1 1 44 44 GLY C C 44 178.910 178.910 172.809 6.101 19854 4258 1 5 . 1 1 44 44 GLY CA C 44 54.579 54.579 45.945 8.634 19854 4259 1 5 . 1 1 44 44 GLY H H 44 6.979 6.979 8.660 -1.681 19854 4260 1 5 . 1 1 45 45 VAL N N 45 110.244 110.244 123.375 -13.131 19854 4261 1 5 . 1 1 45 45 VAL C C 45 174.807 174.807 174.220 0.587 19854 4262 1 5 . 1 1 45 45 VAL CA C 45 63.363 63.363 60.181 3.182 19854 4263 1 5 . 1 1 45 45 VAL CB C 45 17.099 17.099 35.137 -18.038 19854 4264 1 5 . 1 1 45 45 VAL H H 45 8.309 8.309 8.192 0.117 19854 4265 1 5 . 1 1 46 46 GLU N N 46 130.365 130.365 129.315 1.050 19854 4266 1 5 . 1 1 46 46 GLU C C 46 176.859 176.859 174.388 2.471 19854 4267 1 5 . 1 1 46 46 GLU CA C 46 55.164 55.164 54.639 0.525 19854 4268 1 5 . 1 1 46 46 GLU CB C 46 32.325 32.325 32.944 -0.619 19854 4269 1 5 . 1 1 46 46 GLU H H 46 9.741 9.741 8.808 0.933 19854 4270 1 5 . 1 1 47 47 VAL N N 47 125.254 125.254 126.464 -1.210 19854 4271 1 5 . 1 1 47 47 VAL C C 47 175.661 175.661 175.827 -0.166 19854 4272 1 5 . 1 1 47 47 VAL CA C 47 63.375 63.375 61.100 2.275 19854 4273 1 5 . 1 1 47 47 VAL CB C 47 37.300 37.300 32.365 4.934 19854 4274 1 5 . 1 1 47 47 VAL H H 47 8.250 8.250 8.337 -0.087 19854 4275 1 5 . 1 1 48 48 HIS N N 48 129.236 129.236 127.209 2.027 19854 4276 1 5 . 1 1 48 48 HIS C C 48 169.240 169.240 172.963 -3.723 19854 4277 1 5 . 1 1 48 48 HIS CA C 48 49.894 49.894 53.271 -3.377 19854 4278 1 5 . 1 1 48 48 HIS CB C 48 27.640 27.640 32.938 -5.298 19854 4279 1 5 . 1 1 48 48 HIS H H 48 10.390 10.390 9.254 1.136 19854 4280 1 5 . 1 1 49 49 PRO C C 49 176.273 176.273 175.625 0.648 19854 4281 1 5 . 1 1 49 49 PRO CA C 49 62.500 62.500 62.511 -0.011 19854 4282 1 5 . 1 1 49 49 PRO CB C 49 29.974 29.974 32.278 -2.304 19854 4283 1 5 . 1 1 50 50 LEU N N 50 119.408 119.408 127.479 -8.071 19854 4284 1 5 . 1 1 50 50 LEU C C 50 177.445 177.445 174.522 2.923 19854 4285 1 5 . 1 1 50 50 LEU CA C 50 59.264 59.264 54.599 4.665 19854 4286 1 5 . 1 1 50 50 LEU CB C 50 42.281 42.281 45.776 -3.495 19854 4287 1 5 . 1 1 50 50 LEU H H 50 7.492 7.492 9.079 -1.587 19854 4288 1 5 . 1 1 51 51 VAL N N 51 117.947 117.947 125.914 -7.967 19854 4289 1 5 . 1 1 51 51 VAL C C 51 174.514 174.514 175.193 -0.679 19854 4290 1 5 . 1 1 51 51 VAL CA C 51 64.534 64.534 61.401 3.133 19854 4291 1 5 . 1 1 51 51 VAL CB C 51 37.010 37.010 33.889 3.121 19854 4292 1 5 . 1 1 51 51 VAL H H 51 7.715 7.715 8.115 -0.400 19854 4293 1 5 . 1 1 52 52 PHE N N 52 124.853 124.853 125.086 -0.233 19854 4294 1 5 . 1 1 52 52 PHE C C 52 175.100 175.100 174.673 0.427 19854 4295 1 5 . 1 1 52 52 PHE CA C 52 56.336 56.336 56.397 -0.061 19854 4296 1 5 . 1 1 52 52 PHE CB C 52 39.938 39.938 43.706 -3.768 19854 4297 1 5 . 1 1 52 52 PHE H H 52 8.935 8.935 9.153 -0.218 19854 4298 1 5 . 1 1 53 53 HIS N N 53 120.603 120.603 121.341 -0.738 19854 4299 1 5 . 1 1 53 53 HIS C C 53 170.119 170.119 175.400 -5.281 19854 4300 1 5 . 1 1 53 53 HIS CA C 53 55.164 55.164 56.104 -0.940 19854 4301 1 5 . 1 1 53 53 HIS CB C 53 30.568 30.568 31.052 -0.484 19854 4302 1 5 . 1 1 53 53 HIS H H 53 8.356 8.356 9.373 -1.017 19854 4303 1 5 . 1 1 54 54 THR N N 54 112.634 112.634 116.222 -3.588 19854 4304 1 5 . 1 1 54 54 THR C C 54 178.910 178.910 176.304 2.606 19854 4305 1 5 . 1 1 54 54 THR CA C 54 63.363 63.363 59.056 4.307 19854 4306 1 5 . 1 1 54 54 THR CB C 54 72.733 72.733 71.597 1.135 19854 4307 1 5 . 1 1 54 54 THR H H 54 7.574 7.574 8.412 -0.838 19854 4308 1 5 . 1 1 55 55 ASN N N 55 131.095 131.095 120.173 10.922 19854 4309 1 5 . 1 1 55 55 ASN C C 55 176.273 176.273 176.453 -0.180 19854 4310 1 5 . 1 1 55 55 ASN CA C 55 51.065 51.065 55.774 -4.709 19854 4311 1 5 . 1 1 55 55 ASN CB C 55 37.010 37.010 38.282 -1.272 19854 4312 1 5 . 1 1 55 55 ASN H H 55 10.187 10.187 8.628 1.559 19854 4313 1 5 . 1 1 56 56 ARG N N 56 122.064 122.064 118.143 3.921 19854 4314 1 5 . 1 1 56 56 ARG C C 56 175.100 175.100 176.324 -1.224 19854 4315 1 5 . 1 1 56 56 ARG CA C 56 61.606 61.606 55.216 6.390 19854 4316 1 5 . 1 1 56 56 ARG CB C 56 32.911 32.911 29.885 3.026 19854 4317 1 5 . 1 1 56 56 ARG H H 56 7.433 7.433 7.756 -0.323 19854 4318 1 5 . 1 1 57 57 GLY N N 57 127.709 127.709 108.639 19.070 19854 4319 1 5 . 1 1 57 57 GLY C C 57 175.979 175.979 172.230 3.749 19854 4320 1 5 . 1 1 57 57 GLY CA C 57 42.281 42.281 44.267 -1.986 19854 4321 1 5 . 1 1 57 57 GLY H H 57 9.373 9.373 7.692 1.681 19854 4322 1 5 . 1 1 58 58 PRO C C 58 177.152 177.152 176.033 1.119 19854 4323 1 5 . 1 1 58 58 PRO CA C 58 65.137 65.137 62.887 2.250 19854 4324 1 5 . 1 1 58 58 PRO CB C 58 29.095 29.095 31.802 -2.707 19854 4325 1 5 . 1 1 59 59 ILE N N 59 128.638 128.638 114.842 13.796 19854 4326 1 5 . 1 1 59 59 ILE C C 59 175.979 175.979 173.802 2.177 19854 4327 1 5 . 1 1 59 59 ILE CA C 59 65.120 65.120 59.201 5.919 19854 4328 1 5 . 1 1 59 59 ILE CB C 59 40.524 40.524 41.878 -1.354 19854 4329 1 5 . 1 1 59 59 ILE H H 59 8.794 8.794 8.791 0.003 19854 4330 1 5 . 1 1 60 60 LYS N N 60 127.711 127.711 124.932 2.779 19854 4331 1 5 . 1 1 60 60 LYS C C 60 178.902 178.902 174.794 4.108 19854 4332 1 5 . 1 1 60 60 LYS CA C 60 74.293 74.293 54.362 19.931 19854 4333 1 5 . 1 1 60 60 LYS CB C 60 32.027 32.027 35.806 -3.779 19854 4334 1 5 . 1 1 60 60 LYS H H 60 8.024 8.024 8.524 -0.500 19854 4335 1 5 . 1 1 61 61 PHE N N 61 120.670 120.670 125.032 -4.362 19854 4336 1 5 . 1 1 61 61 PHE C C 61 175.393 175.393 174.987 0.406 19854 4337 1 5 . 1 1 61 61 PHE CA C 61 57.507 57.507 56.697 0.810 19854 4338 1 5 . 1 1 61 61 PHE CB C 61 41.109 41.109 41.009 0.100 19854 4339 1 5 . 1 1 61 61 PHE H H 61 7.515 7.515 9.526 -2.011 19854 4340 1 5 . 1 1 62 62 ASN N N 62 124.789 124.789 123.971 0.818 19854 4341 1 5 . 1 1 62 62 ASN C C 62 173.336 173.336 174.265 -0.929 19854 4342 1 5 . 1 1 62 62 ASN CA C 62 53.121 53.121 52.879 0.242 19854 4343 1 5 . 1 1 62 62 ASN CB C 62 41.695 41.695 39.690 2.005 19854 4344 1 5 . 1 1 62 62 ASN H H 62 8.325 8.325 9.281 -0.956 19854 4345 1 5 . 1 1 63 63 VAL N N 63 106.127 106.127 127.106 -20.979 19854 4346 1 5 . 1 1 63 63 VAL C C 63 175.100 175.100 175.300 -0.200 19854 4347 1 5 . 1 1 63 63 VAL CA C 63 61.020 61.020 62.808 -1.788 19854 4348 1 5 . 1 1 63 63 VAL CB C 63 31.154 31.154 32.460 -1.306 19854 4349 1 5 . 1 1 63 63 VAL H H 63 8.113 8.113 9.018 -0.905 19854 4350 1 5 . 1 1 64 64 TRP N N 64 129.302 129.302 129.801 -0.499 19854 4351 1 5 . 1 1 64 64 TRP C C 64 177.152 177.152 175.002 2.150 19854 4352 1 5 . 1 1 64 64 TRP CA C 64 59.264 59.264 55.917 3.347 19854 4353 1 5 . 1 1 64 64 TRP CB C 64 29.397 29.397 29.432 -0.035 19854 4354 1 5 . 1 1 64 64 TRP H H 64 8.970 8.970 9.567 -0.597 19854 4355 1 5 . 1 1 65 65 ASP N N 65 119.607 119.607 125.913 -6.306 19854 4356 1 5 . 1 1 65 65 ASP C C 65 174.514 174.514 175.791 -1.277 19854 4357 1 5 . 1 1 65 65 ASP CA C 65 55.164 55.164 53.232 1.932 19854 4358 1 5 . 1 1 65 65 ASP CB C 65 41.109 41.109 42.965 -1.857 19854 4359 1 5 . 1 1 65 65 ASP H H 65 8.638 8.638 8.927 -0.289 19854 4360 1 5 . 1 1 66 66 THR N N 66 122.463 122.463 117.340 5.123 19854 4361 1 5 . 1 1 66 66 THR C C 66 178.617 178.617 173.939 4.678 19854 4362 1 5 . 1 1 66 66 THR CA C 66 68.048 68.048 59.660 8.388 19854 4363 1 5 . 1 1 66 66 THR CB C 66 71.562 71.562 71.048 0.514 19854 4364 1 5 . 1 1 66 66 THR H H 66 8.293 8.293 8.275 0.018 19854 4365 1 5 . 1 1 67 67 ALA N N 67 104.865 104.865 122.201 -17.336 19854 4366 1 5 . 1 1 67 67 ALA C C 67 177.738 177.738 178.039 -0.301 19854 4367 1 5 . 1 1 67 67 ALA CA C 67 48.722 48.722 51.339 -2.617 19854 4368 1 5 . 1 1 67 67 ALA CB C 67 14.171 14.171 20.316 -6.145 19854 4369 1 5 . 1 1 67 67 ALA H H 67 8.657 8.657 7.899 0.758 19854 4370 1 5 . 1 1 68 68 GLY N N 68 115.357 115.357 110.032 5.325 19854 4371 1 5 . 1 1 68 68 GLY C C 68 189.533 189.533 176.239 13.294 19854 4372 1 5 . 1 1 68 68 GLY CA C 68 45.209 45.209 46.016 -0.807 19854 4373 1 5 . 1 1 68 68 GLY H H 68 10.969 10.969 9.019 1.950 19854 4374 1 5 . 1 1 69 69 GLN N N 69 122.730 122.730 119.774 2.956 19854 4375 1 5 . 1 1 69 69 GLN C C 69 174.508 174.508 176.455 -1.947 19854 4376 1 5 . 1 1 69 69 GLN CA C 69 58.394 58.394 57.108 1.286 19854 4377 1 5 . 1 1 69 69 GLN CB C 69 31.441 31.441 28.482 2.959 19854 4378 1 5 . 1 1 69 69 GLN H H 69 8.336 8.336 8.626 -0.290 19854 4379 1 5 . 1 1 70 70 GLU N N 70 114.826 114.826 120.762 -5.936 19854 4380 1 5 . 1 1 70 70 GLU C C 70 176.273 176.273 175.574 0.699 19854 4381 1 5 . 1 1 70 70 GLU CA C 70 57.507 57.507 56.562 0.945 19854 4382 1 5 . 1 1 70 70 GLU CB C 70 28.811 28.811 30.221 -1.411 19854 4383 1 5 . 1 1 70 70 GLU H H 70 9.651 9.651 8.309 1.342 19854 4384 1 5 . 1 1 71 71 LYS N N 71 116.685 116.685 123.286 -6.601 19854 4385 1 5 . 1 1 71 71 LYS C C 71 175.979 175.979 176.412 -0.433 19854 4386 1 5 . 1 1 71 71 LYS CA C 71 48.722 48.722 55.925 -7.203 19854 4387 1 5 . 1 1 71 71 LYS CB C 71 37.010 37.010 32.944 4.066 19854 4388 1 5 . 1 1 71 71 LYS H H 71 8.712 8.712 8.268 0.444 19854 4389 1 5 . 1 1 72 72 PHE N N 72 114.959 114.959 119.755 -4.796 19854 4390 1 5 . 1 1 72 72 PHE C C 72 175.686 175.686 176.993 -1.307 19854 4391 1 5 . 1 1 72 72 PHE CA C 72 56.336 56.336 58.743 -2.407 19854 4392 1 5 . 1 1 72 72 PHE CB C 72 36.424 36.424 38.917 -2.493 19854 4393 1 5 . 1 1 72 72 PHE H H 72 7.965 7.965 7.989 -0.024 19854 4394 1 5 . 1 1 73 73 GLY N N 73 117.084 117.084 112.371 4.713 19854 4395 1 5 . 1 1 73 73 GLY C C 73 168.068 168.068 174.582 -6.514 19854 4396 1 5 . 1 1 73 73 GLY CA C 73 42.281 42.281 44.920 -2.639 19854 4397 1 5 . 1 1 73 73 GLY H H 73 7.609 7.609 7.662 -0.053 19854 4398 1 5 . 1 1 74 74 GLY N N 74 120.537 120.537 107.691 12.846 19854 4399 1 5 . 1 1 74 74 GLY C C 74 174.514 174.514 176.361 -1.847 19854 4400 1 5 . 1 1 74 74 GLY CA C 74 44.037 44.037 46.575 -2.538 19854 4401 1 5 . 1 1 74 74 GLY H H 74 9.326 9.326 8.407 0.919 19854 4402 1 5 . 1 1 75 75 LEU N N 75 127.177 127.177 118.535 8.642 19854 4403 1 5 . 1 1 75 75 LEU C C 75 178.617 178.617 177.559 1.058 19854 4404 1 5 . 1 1 75 75 LEU CA C 75 53.407 53.407 56.606 -3.199 19854 4405 1 5 . 1 1 75 75 LEU CB C 75 42.281 42.281 41.301 0.980 19854 4406 1 5 . 1 1 75 75 LEU H H 75 7.628 7.628 7.659 -0.031 19854 4407 1 5 . 1 1 76 76 ARG N N 76 116.486 116.486 117.382 -0.896 19854 4408 1 5 . 1 1 76 76 ARG C C 76 176.859 176.859 176.583 0.276 19854 4409 1 5 . 1 1 76 76 ARG CA C 76 59.264 59.264 56.181 3.083 19854 4410 1 5 . 1 1 76 76 ARG CB C 76 31.154 31.154 29.884 1.270 19854 4411 1 5 . 1 1 76 76 ARG H H 76 7.143 7.143 7.465 -0.322 19854 4412 1 5 . 1 1 77 77 ASP N N 77 129.236 129.236 121.006 8.230 19854 4413 1 5 . 1 1 77 77 ASP C C 77 177.152 177.152 177.929 -0.777 19854 4414 1 5 . 1 1 77 77 ASP CA C 77 52.822 52.822 57.689 -4.867 19854 4415 1 5 . 1 1 77 77 ASP CB C 77 41.695 41.695 40.370 1.325 19854 4416 1 5 . 1 1 77 77 ASP H H 77 8.947 8.947 7.610 1.337 19854 4417 1 5 . 1 1 78 78 GLY N N 78 127.244 127.244 107.528 19.716 19854 4418 1 5 . 1 1 78 78 GLY C C 78 173.928 173.928 175.407 -1.479 19854 4419 1 5 . 1 1 78 78 GLY CA C 78 44.623 44.623 46.771 -2.148 19854 4420 1 5 . 1 1 78 78 GLY H H 78 8.219 8.219 8.396 -0.177 19854 4421 1 5 . 1 1 79 79 TYR N N 79 120.537 120.537 118.409 2.128 19854 4422 1 5 . 1 1 79 79 TYR C C 79 176.273 176.273 176.354 -0.081 19854 4423 1 5 . 1 1 79 79 TYR CA C 79 58.678 58.678 58.807 -0.129 19854 4424 1 5 . 1 1 79 79 TYR CB C 79 40.524 40.524 37.778 2.746 19854 4425 1 5 . 1 1 79 79 TYR H H 79 8.563 8.563 7.226 1.337 19854 4426 1 5 . 1 1 80 80 TYR N N 80 122.132 122.132 114.970 7.162 19854 4427 1 5 . 1 1 80 80 TYR C C 80 175.979 175.979 176.906 -0.927 19854 4428 1 5 . 1 1 80 80 TYR CA C 80 62.203 62.203 60.113 2.090 19854 4429 1 5 . 1 1 80 80 TYR CB C 80 41.988 41.988 38.792 3.196 19854 4430 1 5 . 1 1 80 80 TYR H H 80 8.254 8.254 7.428 0.826 19854 4431 1 5 . 1 1 81 81 ILE N N 81 120.072 120.072 118.728 1.344 19854 4432 1 5 . 1 1 81 81 ILE C C 81 177.445 177.445 175.325 2.120 19854 4433 1 5 . 1 1 81 81 ILE CA C 81 67.462 67.462 63.810 3.652 19854 4434 1 5 . 1 1 81 81 ILE CB C 81 41.109 41.109 37.955 3.154 19854 4435 1 5 . 1 1 81 81 ILE H H 81 8.837 8.837 7.732 1.105 19854 4436 1 5 . 1 1 82 82 GLN N N 82 121.601 121.601 119.808 1.793 19854 4437 1 5 . 1 1 82 82 GLN C C 82 173.342 173.342 175.036 -1.694 19854 4438 1 5 . 1 1 82 82 GLN CA C 82 59.859 59.859 56.557 3.302 19854 4439 1 5 . 1 1 82 82 GLN CB C 82 30.855 30.855 27.066 3.789 19854 4440 1 5 . 1 1 82 82 GLN H H 82 8.184 8.184 8.642 -0.458 19854 4441 1 5 . 1 1 83 83 ALA N N 83 109.713 109.713 121.096 -11.383 19854 4442 1 5 . 1 1 83 83 ALA C C 83 175.979 175.979 176.763 -0.784 19854 4443 1 5 . 1 1 83 83 ALA CA C 83 54.579 54.579 53.110 1.469 19854 4444 1 5 . 1 1 83 83 ALA CB C 83 16.513 16.513 19.543 -3.030 19854 4445 1 5 . 1 1 83 83 ALA H H 83 6.306 6.306 7.758 -1.452 19854 4446 1 5 . 1 1 84 84 GLN N N 84 121.203 121.203 120.361 0.842 19854 4447 1 5 . 1 1 84 84 GLN C C 84 177.144 177.144 176.052 1.092 19854 4448 1 5 . 1 1 84 84 GLN CA C 84 60.152 60.152 56.663 3.489 19854 4449 1 5 . 1 1 84 84 GLN CB C 84 34.957 34.957 31.432 3.525 19854 4450 1 5 . 1 1 84 84 GLN H H 84 8.180 8.180 8.686 -0.506 19854 4451 1 5 . 1 1 85 85 CYS N N 85 120.605 120.605 111.750 8.855 19854 4452 1 5 . 1 1 85 85 CYS C C 85 176.566 176.566 172.612 3.954 19854 4453 1 5 . 1 1 85 85 CYS CA C 85 65.430 65.430 56.414 9.016 19854 4454 1 5 . 1 1 85 85 CYS CB C 85 39.644 39.644 31.103 8.541 19854 4455 1 5 . 1 1 85 85 CYS H H 85 8.364 8.364 7.647 0.717 19854 4456 1 5 . 1 1 86 86 ALA N N 86 114.295 114.295 120.973 -6.678 19854 4457 1 5 . 1 1 86 86 ALA CA C 86 57.507 57.507 50.874 6.633 19854 4458 1 5 . 1 1 86 86 ALA CB C 86 21.784 21.784 22.832 -1.048 19854 4459 1 5 . 1 1 86 86 ALA H H 86 6.897 6.897 8.674 -1.777 19854 4460 1 5 . 1 1 87 87 ILE N N 87 120.670 120.670 120.214 0.456 19854 4461 1 5 . 1 1 87 87 ILE C C 87 173.928 173.928 174.677 -0.749 19854 4462 1 5 . 1 1 87 87 ILE CA C 87 61.020 61.020 60.089 0.931 19854 4463 1 5 . 1 1 87 87 ILE CB C 87 39.938 39.938 41.440 -1.502 19854 4464 1 5 . 1 1 87 87 ILE H H 87 8.282 8.282 8.592 -0.310 19854 4465 1 5 . 1 1 88 88 ILE N N 88 120.205 120.205 127.378 -7.173 19854 4466 1 5 . 1 1 88 88 ILE C C 88 173.635 173.635 174.908 -1.273 19854 4467 1 5 . 1 1 88 88 ILE CA C 88 64.534 64.534 60.261 4.273 19854 4468 1 5 . 1 1 88 88 ILE CB C 88 37.596 37.596 39.959 -2.363 19854 4469 1 5 . 1 1 88 88 ILE H H 88 5.528 5.528 8.962 -3.434 19854 4470 1 5 . 1 1 89 89 MET N N 89 120.472 120.472 126.132 -5.660 19854 4471 1 5 . 1 1 89 89 MET C C 89 178.617 178.617 175.065 3.552 19854 4472 1 5 . 1 1 89 89 MET CA C 89 58.980 58.980 54.262 4.718 19854 4473 1 5 . 1 1 89 89 MET CB C 89 34.957 34.957 35.089 -0.132 19854 4474 1 5 . 1 1 89 89 MET H H 89 8.176 8.176 8.648 -0.472 19854 4475 1 5 . 1 1 90 90 PHE N N 90 121.134 121.134 118.539 2.595 19854 4476 1 5 . 1 1 90 90 PHE C C 90 175.393 175.393 172.999 2.394 19854 4477 1 5 . 1 1 90 90 PHE CA C 90 60.435 60.435 55.391 5.044 19854 4478 1 5 . 1 1 90 90 PHE CB C 90 38.767 38.767 42.073 -3.306 19854 4479 1 5 . 1 1 90 90 PHE H H 90 9.334 9.334 8.675 0.659 19854 4480 1 5 . 1 1 91 91 ASP N N 91 120.273 120.273 120.834 -0.561 19854 4481 1 5 . 1 1 91 91 ASP C C 91 177.730 177.730 178.124 -0.394 19854 4482 1 5 . 1 1 91 91 ASP CA C 91 59.859 59.859 52.409 7.450 19854 4483 1 5 . 1 1 91 91 ASP CB C 91 44.039 44.039 42.738 1.301 19854 4484 1 5 . 1 1 91 91 ASP H H 91 7.597 7.597 8.908 -1.311 19854 4485 1 5 . 1 1 92 92 VAL N N 92 115.158 115.158 123.563 -8.405 19854 4486 1 5 . 1 1 92 92 VAL C C 92 173.342 173.342 176.610 -3.268 19854 4487 1 5 . 1 1 92 92 VAL CA C 92 64.534 64.534 64.977 -0.443 19854 4488 1 5 . 1 1 92 92 VAL CB C 92 37.596 37.596 31.338 6.258 19854 4489 1 5 . 1 1 92 92 VAL H H 92 7.738 7.738 8.538 -0.800 19854 4490 1 5 . 1 1 93 93 THR N N 93 127.179 127.179 110.381 16.798 19854 4491 1 5 . 1 1 93 93 THR C C 93 178.902 178.902 174.790 4.112 19854 4492 1 5 . 1 1 93 93 THR CA C 93 64.254 64.254 63.129 1.125 19854 4493 1 5 . 1 1 93 93 THR CB C 93 74.215 74.215 69.185 5.030 19854 4494 1 5 . 1 1 93 93 THR H H 93 7.636 7.636 8.172 -0.536 19854 4495 1 5 . 1 1 94 94 SER N N 94 122.263 122.263 116.486 5.777 19854 4496 1 5 . 1 1 94 94 SER C C 94 163.965 163.965 174.883 -10.918 19854 4497 1 5 . 1 1 94 94 SER CA C 94 59.849 59.849 55.558 4.291 19854 4498 1 5 . 1 1 94 94 SER CB C 94 62.192 62.192 64.133 -1.941 19854 4499 1 5 . 1 1 94 94 SER H H 94 7.628 7.628 7.939 -0.311 19854 4500 1 5 . 1 1 95 95 ARG N N 95 113.099 113.099 128.577 -15.478 19854 4501 1 5 . 1 1 95 95 ARG C C 95 176.273 176.273 178.121 -1.848 19854 4502 1 5 . 1 1 95 95 ARG CA C 95 53.407 53.407 59.578 -6.171 19854 4503 1 5 . 1 1 95 95 ARG CB C 95 31.154 31.154 30.116 1.038 19854 4504 1 5 . 1 1 95 95 ARG H H 95 8.102 8.102 9.081 -0.979 19854 4505 1 5 . 1 1 96 96 VAL N N 96 124.787 124.787 119.303 5.484 19854 4506 1 5 . 1 1 96 96 VAL C C 96 178.031 178.031 177.756 0.275 19854 4507 1 5 . 1 1 96 96 VAL CA C 96 68.634 68.634 66.431 2.203 19854 4508 1 5 . 1 1 96 96 VAL CB C 96 24.126 24.126 31.358 -7.232 19854 4509 1 5 . 1 1 96 96 VAL H H 96 9.146 9.146 8.127 1.019 19854 4510 1 5 . 1 1 97 97 THR N N 97 111.970 111.970 116.100 -4.130 19854 4511 1 5 . 1 1 97 97 THR C C 97 178.031 178.031 175.953 2.078 19854 4512 1 5 . 1 1 97 97 THR CA C 97 63.949 63.949 66.296 -2.347 19854 4513 1 5 . 1 1 97 97 THR CB C 97 70.390 70.390 69.001 1.389 19854 4514 1 5 . 1 1 97 97 THR H H 97 7.984 7.984 7.625 0.359 19854 4515 1 5 . 1 1 98 98 TYR N N 98 113.232 113.232 121.092 -7.860 19854 4516 1 5 . 1 1 98 98 TYR C C 98 176.273 176.273 177.472 -1.199 19854 4517 1 5 . 1 1 98 98 TYR H H 98 7.605 7.605 7.689 -0.084 19854 4518 1 5 . 1 1 99 99 LYS N N 99 123.726 123.726 118.690 5.036 19854 4519 1 5 . 1 1 99 99 LYS C C 99 178.316 178.316 178.438 -0.122 19854 4520 1 5 . 1 1 99 99 LYS CA C 99 58.691 58.691 59.414 -0.723 19854 4521 1 5 . 1 1 99 99 LYS CB C 99 36.127 36.127 32.021 4.106 19854 4522 1 5 . 1 1 99 99 LYS H H 99 8.360 8.360 8.083 0.277 19854 4523 1 5 . 1 1 100 100 ASN N N 100 111.970 111.970 116.101 -4.131 19854 4524 1 5 . 1 1 100 100 ASN C C 100 175.979 175.979 176.774 -0.795 19854 4525 1 5 . 1 1 100 100 ASN CA C 100 53.407 53.407 55.096 -1.689 19854 4526 1 5 . 1 1 100 100 ASN CB C 100 37.596 37.596 38.750 -1.154 19854 4527 1 5 . 1 1 100 100 ASN H H 100 5.778 5.778 7.745 -1.967 19854 4528 1 5 . 1 1 101 101 VAL N N 101 118.877 118.877 121.710 -2.833 19854 4529 1 5 . 1 1 101 101 VAL C C 101 173.635 173.635 174.977 -1.342 19854 4530 1 5 . 1 1 101 101 VAL CA C 101 62.777 62.777 68.500 -5.723 19854 4531 1 5 . 1 1 101 101 VAL CB C 101 27.054 27.054 29.261 -2.207 19854 4532 1 5 . 1 1 101 101 VAL H H 101 7.370 7.370 7.630 -0.260 19854 4533 1 5 . 1 1 102 102 PRO C C 102 176.566 176.566 177.145 -0.579 19854 4534 1 5 . 1 1 102 102 PRO CA C 102 62.500 62.500 65.247 -2.747 19854 4535 1 5 . 1 1 102 102 PRO CB C 102 30.853 30.853 31.043 -0.190 19854 4536 1 5 . 1 1 103 103 ASN N N 103 122.728 122.728 115.671 7.057 19854 4537 1 5 . 1 1 103 103 ASN C C 103 175.100 175.100 176.758 -1.658 19854 4538 1 5 . 1 1 103 103 ASN CA C 103 54.579 54.579 54.792 -0.213 19854 4539 1 5 . 1 1 103 103 ASN CB C 103 38.767 38.767 37.306 1.461 19854 4540 1 5 . 1 1 103 103 ASN H H 103 7.879 7.879 7.469 0.410 19854 4541 1 5 . 1 1 104 104 TRP N N 104 122.730 122.730 120.178 2.552 19854 4542 1 5 . 1 1 104 104 TRP C C 104 174.215 174.215 177.490 -3.275 19854 4543 1 5 . 1 1 104 104 TRP CA C 104 59.273 59.273 60.578 -1.305 19854 4544 1 5 . 1 1 104 104 TRP CB C 104 35.250 35.250 30.054 5.196 19854 4545 1 5 . 1 1 104 104 TRP H H 104 7.902 7.902 7.681 0.221 19854 4546 1 5 . 1 1 105 105 HIS N N 105 120.869 120.869 117.138 3.731 19854 4547 1 5 . 1 1 105 105 HIS C C 105 177.738 177.738 174.450 3.288 19854 4548 1 5 . 1 1 105 105 HIS H H 105 6.971 6.971 8.409 -1.438 19854 4549 1 5 . 1 1 106 106 ARG N N 106 126.314 126.314 123.458 2.856 19854 4550 1 5 . 1 1 106 106 ARG C C 106 176.566 176.566 176.225 0.341 19854 4551 1 5 . 1 1 106 106 ARG CA C 106 62.777 62.777 57.467 5.310 19854 4552 1 5 . 1 1 106 106 ARG CB C 106 29.397 29.397 31.126 -1.729 19854 4553 1 5 . 1 1 106 106 ARG H H 106 7.507 7.507 7.944 -0.437 19854 4554 1 5 . 1 1 107 107 ASP N N 107 119.076 119.076 121.563 -2.487 19854 4555 1 5 . 1 1 107 107 ASP C C 107 176.566 176.566 178.394 -1.828 19854 4556 1 5 . 1 1 107 107 ASP CA C 107 55.164 55.164 57.532 -2.368 19854 4557 1 5 . 1 1 107 107 ASP CB C 107 41.695 41.695 41.048 0.647 19854 4558 1 5 . 1 1 107 107 ASP H H 107 9.076 9.076 7.861 1.215 19854 4559 1 5 . 1 1 108 108 LEU N N 108 113.299 113.299 119.046 -5.747 19854 4560 1 5 . 1 1 108 108 LEU C C 108 176.273 176.273 178.377 -2.104 19854 4561 1 5 . 1 1 108 108 LEU CA C 108 59.264 59.264 58.127 1.137 19854 4562 1 5 . 1 1 108 108 LEU CB C 108 48.722 48.722 41.566 7.156 19854 4563 1 5 . 1 1 108 108 LEU H H 108 6.725 6.725 7.904 -1.179 19854 4564 1 5 . 1 1 109 109 VAL N N 109 121.267 121.267 113.437 7.830 19854 4565 1 5 . 1 1 109 109 VAL C C 109 175.393 175.393 178.197 -2.804 19854 4566 1 5 . 1 1 109 109 VAL CA C 109 63.949 63.949 64.387 -0.438 19854 4567 1 5 . 1 1 109 109 VAL CB C 109 32.911 32.911 30.920 1.991 19854 4568 1 5 . 1 1 109 109 VAL H H 109 8.763 8.763 7.687 1.076 19854 4569 1 5 . 1 1 110 110 ARG N N 110 112.900 112.900 119.830 -6.930 19854 4570 1 5 . 1 1 110 110 ARG C C 110 176.273 176.273 177.572 -1.299 19854 4571 1 5 . 1 1 110 110 ARG CA C 110 57.507 57.507 59.103 -1.596 19854 4572 1 5 . 1 1 110 110 ARG CB C 110 30.568 30.568 30.342 0.226 19854 4573 1 5 . 1 1 110 110 ARG H H 110 7.241 7.241 7.548 -0.307 19854 4574 1 5 . 1 1 111 111 VAL N N 111 115.556 115.556 117.418 -1.862 19854 4575 1 5 . 1 1 111 111 VAL C C 111 177.445 177.445 177.226 0.219 19854 4576 1 5 . 1 1 111 111 VAL CA C 111 59.849 59.849 64.579 -4.730 19854 4577 1 5 . 1 1 111 111 VAL CB C 111 32.911 32.911 32.876 0.035 19854 4578 1 5 . 1 1 111 111 VAL H H 111 7.566 7.566 7.518 0.048 19854 4579 1 5 . 1 1 112 112 CYS N N 112 114.295 114.295 116.086 -1.791 19854 4580 1 5 . 1 1 112 112 CYS C C 112 169.826 169.826 174.825 -4.999 19854 4581 1 5 . 1 1 112 112 CYS CA C 112 57.507 57.507 60.870 -3.363 19854 4582 1 5 . 1 1 112 112 CYS CB C 112 35.839 35.839 28.689 7.150 19854 4583 1 5 . 1 1 112 112 CYS H H 112 7.425 7.425 7.953 -0.528 19854 4584 1 5 . 1 1 113 113 GLU N N 113 116.486 116.486 116.151 0.335 19854 4585 1 5 . 1 1 113 113 GLU C C 113 176.566 176.566 175.648 0.918 19854 4586 1 5 . 1 1 113 113 GLU CA C 113 69.219 69.219 58.026 11.193 19854 4587 1 5 . 1 1 113 113 GLU CB C 113 30.568 30.568 28.175 2.393 19854 4588 1 5 . 1 1 113 113 GLU H H 113 7.241 7.241 7.902 -0.661 19854 4589 1 5 . 1 1 114 114 ASN N N 114 129.302 129.302 122.532 6.770 19854 4590 1 5 . 1 1 114 114 ASN C C 114 175.100 175.100 174.598 0.502 19854 4591 1 5 . 1 1 114 114 ASN CA C 114 52.236 52.236 52.967 -0.731 19854 4592 1 5 . 1 1 114 114 ASN CB C 114 39.938 39.938 38.640 1.298 19854 4593 1 5 . 1 1 114 114 ASN H H 114 8.919 8.919 8.415 0.504 19854 4594 1 5 . 1 1 115 115 ILE N N 115 110.443 110.443 120.907 -10.464 19854 4595 1 5 . 1 1 115 115 ILE C C 115 175.100 175.100 173.590 1.510 19854 4596 1 5 . 1 1 115 115 ILE CA C 115 65.705 65.705 57.990 7.715 19854 4597 1 5 . 1 1 115 115 ILE CB C 115 39.353 39.353 39.568 -0.214 19854 4598 1 5 . 1 1 115 115 ILE H H 115 9.287 9.287 7.902 1.385 19854 4599 1 5 . 1 1 116 116 PRO C C 116 175.979 175.979 175.643 0.336 19854 4600 1 5 . 1 1 116 116 PRO CA C 116 63.086 63.086 63.023 0.063 19854 4601 1 5 . 1 1 116 116 PRO CB C 116 29.681 29.681 32.537 -2.856 19854 4602 1 5 . 1 1 117 117 ILE N N 117 123.591 123.591 123.777 -0.186 19854 4603 1 5 . 1 1 117 117 ILE C C 117 174.807 174.807 175.107 -0.300 19854 4604 1 5 . 1 1 117 117 ILE CA C 117 66.291 66.291 60.304 5.987 19854 4605 1 5 . 1 1 117 117 ILE CB C 117 38.767 38.767 42.221 -3.454 19854 4606 1 5 . 1 1 117 117 ILE H H 117 7.781 7.781 8.525 -0.744 19854 4607 1 5 . 1 1 118 118 VAL N N 118 119.009 119.009 125.813 -6.804 19854 4608 1 5 . 1 1 118 118 VAL C C 118 178.324 178.324 174.850 3.474 19854 4609 1 5 . 1 1 118 118 VAL CA C 118 62.777 62.777 60.864 1.913 19854 4610 1 5 . 1 1 118 118 VAL CB C 118 31.154 31.154 34.154 -3.000 19854 4611 1 5 . 1 1 118 118 VAL H H 118 8.767 8.767 8.613 0.154 19854 4612 1 5 . 1 1 119 119 LEU N N 119 119.408 119.408 126.942 -7.534 19854 4613 1 5 . 1 1 119 119 LEU C C 119 178.031 178.031 176.076 1.955 19854 4614 1 5 . 1 1 119 119 LEU CA C 119 42.866 42.866 53.931 -11.065 19854 4615 1 5 . 1 1 119 119 LEU CB C 119 38.767 38.767 43.691 -4.924 19854 4616 1 5 . 1 1 119 119 LEU H H 119 7.734 7.734 9.254 -1.520 19854 4617 1 5 . 1 1 120 120 CYS N N 120 113.232 113.232 122.120 -8.888 19854 4618 1 5 . 1 1 120 120 CYS C C 120 178.031 178.031 174.143 3.888 19854 4619 1 5 . 1 1 120 120 CYS H H 120 8.317 8.317 9.146 -0.829 19854 4620 1 5 . 1 1 121 121 GLY N N 121 117.349 117.349 112.810 4.539 19854 4621 1 5 . 1 1 121 121 GLY C C 121 176.851 176.851 172.851 4.000 19854 4622 1 5 . 1 1 121 121 GLY CA C 121 41.109 41.109 43.685 -2.576 19854 4623 1 5 . 1 1 121 121 GLY H H 121 7.515 7.515 8.955 -1.440 19854 4624 1 5 . 1 1 122 122 ASN N N 122 125.318 125.318 126.006 -0.688 19854 4625 1 5 . 1 1 122 122 ASN C C 122 175.686 175.686 175.596 0.090 19854 4626 1 5 . 1 1 122 122 ASN CA C 122 50.479 50.479 52.917 -2.438 19854 4627 1 5 . 1 1 122 122 ASN CB C 122 39.353 39.353 40.008 -0.655 19854 4628 1 5 . 1 1 122 122 ASN H H 122 9.162 9.162 8.622 0.540 19854 4629 1 5 . 1 1 123 123 LYS N N 123 122.132 122.132 114.581 7.551 19854 4630 1 5 . 1 1 123 123 LYS C C 123 173.043 173.043 177.072 -4.029 19854 4631 1 5 . 1 1 123 123 LYS CA C 123 58.101 58.101 57.556 0.545 19854 4632 1 5 . 1 1 123 123 LYS CB C 123 35.543 35.543 29.813 5.730 19854 4633 1 5 . 1 1 123 123 LYS H H 123 7.953 7.953 8.787 -0.834 19854 4634 1 5 . 1 1 124 124 VAL N N 124 123.726 123.726 113.205 10.521 19854 4635 1 5 . 1 1 124 124 VAL C C 124 175.679 175.679 176.559 -0.880 19854 4636 1 5 . 1 1 124 124 VAL CA C 124 64.840 64.840 64.657 0.183 19854 4637 1 5 . 1 1 124 124 VAL CB C 124 42.574 42.574 31.338 11.236 19854 4638 1 5 . 1 1 124 124 VAL H H 124 8.555 8.555 7.605 0.950 19854 4639 1 5 . 1 1 125 125 ASP N N 125 119.607 119.607 119.992 -0.385 19854 4640 1 5 . 1 1 125 125 ASP C C 125 176.566 176.566 176.960 -0.394 19854 4641 1 5 . 1 1 125 125 ASP CA C 125 55.750 55.750 56.495 -0.745 19854 4642 1 5 . 1 1 125 125 ASP CB C 125 40.524 40.524 40.989 -0.466 19854 4643 1 5 . 1 1 125 125 ASP H H 125 7.875 7.875 8.283 -0.408 19854 4644 1 5 . 1 1 126 126 ILE N N 126 116.088 116.088 120.598 -4.510 19854 4645 1 5 . 1 1 126 126 ILE C C 126 177.152 177.152 176.478 0.674 19854 4646 1 5 . 1 1 126 126 ILE CA C 126 66.291 66.291 61.928 4.363 19854 4647 1 5 . 1 1 126 126 ILE CB C 126 39.353 39.353 38.288 1.065 19854 4648 1 5 . 1 1 126 126 ILE H H 126 7.511 7.511 7.526 -0.015 19854 4649 1 5 . 1 1 127 127 LYS N N 127 121.203 121.203 125.418 -4.215 19854 4650 1 5 . 1 1 127 127 LYS C C 127 175.979 175.979 177.149 -1.170 19854 4651 1 5 . 1 1 127 127 LYS CA C 127 58.101 58.101 58.741 -0.640 19854 4652 1 5 . 1 1 127 127 LYS CB C 127 35.834 35.834 32.565 3.269 19854 4653 1 5 . 1 1 127 127 LYS H H 127 8.113 8.113 8.452 -0.339 19854 4654 1 5 . 1 1 128 128 ASP N N 128 118.279 118.279 120.234 -1.955 19854 4655 1 5 . 1 1 128 128 ASP C C 128 176.566 176.566 175.061 1.505 19854 4656 1 5 . 1 1 128 128 ASP CA C 128 53.407 53.407 52.947 0.461 19854 4657 1 5 . 1 1 128 128 ASP CB C 128 40.524 40.524 39.658 0.866 19854 4658 1 5 . 1 1 128 128 ASP H H 128 7.241 7.241 8.218 -0.977 19854 4659 1 5 . 1 1 129 129 ARG N N 129 118.943 118.943 122.472 -3.529 19854 4660 1 5 . 1 1 129 129 ARG C C 129 177.738 177.738 176.608 1.130 19854 4661 1 5 . 1 1 129 129 ARG CA C 129 45.794 45.794 56.586 -10.792 19854 4662 1 5 . 1 1 129 129 ARG CB C 129 31.154 31.154 31.201 -0.047 19854 4663 1 5 . 1 1 129 129 ARG H H 129 8.423 8.423 7.808 0.615 19854 4664 1 5 . 1 1 130 130 LYS N N 130 109.381 109.381 121.346 -11.965 19854 4665 1 5 . 1 1 130 130 LYS C C 130 176.566 176.566 176.744 -0.178 19854 4666 1 5 . 1 1 130 130 LYS CA C 130 55.164 55.164 56.157 -0.993 19854 4667 1 5 . 1 1 130 130 LYS CB C 130 36.424 36.424 33.975 2.449 19854 4668 1 5 . 1 1 130 130 LYS H H 130 7.296 7.296 8.610 -1.314 19854 4669 1 5 . 1 1 131 131 VAL N N 131 110.377 110.377 121.292 -10.915 19854 4670 1 5 . 1 1 131 131 VAL C C 131 178.617 178.617 174.930 3.687 19854 4671 1 5 . 1 1 131 131 VAL CA C 131 65.705 65.705 61.879 3.826 19854 4672 1 5 . 1 1 131 131 VAL CB C 131 35.839 35.839 31.231 4.608 19854 4673 1 5 . 1 1 131 131 VAL H H 131 9.283 9.283 7.929 1.354 19854 4674 1 5 . 1 1 132 132 LYS N N 132 110.310 110.310 128.009 -17.699 19854 4675 1 5 . 1 1 132 132 LYS C C 132 176.273 176.273 177.527 -1.254 19854 4676 1 5 . 1 1 132 132 LYS CA C 132 59.849 59.849 55.742 4.107 19854 4677 1 5 . 1 1 132 132 LYS CB C 132 35.253 35.253 33.567 1.686 19854 4678 1 5 . 1 1 132 132 LYS H H 132 9.709 9.709 8.237 1.472 19854 4679 1 5 . 1 1 133 133 ALA N N 133 134.349 134.349 126.739 7.610 19854 4680 1 5 . 1 1 133 133 ALA CA C 133 51.065 51.065 54.818 -3.753 19854 4681 1 5 . 1 1 133 133 ALA CB C 133 12.999 12.999 18.600 -5.601 19854 4682 1 5 . 1 1 133 133 ALA H H 133 6.322 6.322 8.740 -2.418 19854 4683 1 5 . 1 1 134 134 LYS N N 134 117.615 117.615 118.025 -0.410 19854 4684 1 5 . 1 1 134 134 LYS C C 134 176.859 176.859 178.166 -1.307 19854 4685 1 5 . 1 1 134 134 LYS CA C 134 55.750 55.750 58.563 -2.813 19854 4686 1 5 . 1 1 134 134 LYS CB C 134 54.579 54.579 32.223 22.356 19854 4687 1 5 . 1 1 134 134 LYS H H 134 6.549 6.549 8.317 -1.768 19854 4688 1 5 . 1 1 135 135 SER N N 135 109.314 109.314 113.694 -4.380 19854 4689 1 5 . 1 1 135 135 SER C C 135 173.635 173.635 175.346 -1.711 19854 4690 1 5 . 1 1 135 135 SER CA C 135 56.336 56.336 59.977 -3.640 19854 4691 1 5 . 1 1 135 135 SER CB C 135 63.949 63.949 63.015 0.934 19854 4692 1 5 . 1 1 135 135 SER H H 135 7.840 7.840 7.718 0.122 19854 4693 1 5 . 1 1 136 136 ILE N N 136 124.123 124.123 122.022 2.101 19854 4694 1 5 . 1 1 136 136 ILE C C 136 175.100 175.100 175.760 -0.660 19854 4695 1 5 . 1 1 136 136 ILE CA C 136 68.634 68.634 62.789 5.845 19854 4696 1 5 . 1 1 136 136 ILE CB C 136 43.452 43.452 37.905 5.547 19854 4697 1 5 . 1 1 136 136 ILE H H 136 8.098 8.098 7.319 0.779 19854 4698 1 5 . 1 1 137 137 VAL N N 137 113.232 113.232 123.791 -10.559 19854 4699 1 5 . 1 1 137 137 VAL C C 137 176.859 176.859 176.325 0.534 19854 4700 1 5 . 1 1 137 137 VAL CA C 137 64.534 64.534 62.162 2.372 19854 4701 1 5 . 1 1 137 137 VAL CB C 137 34.082 34.082 32.457 1.625 19854 4702 1 5 . 1 1 137 137 VAL H H 137 7.711 7.711 8.073 -0.362 19854 4703 1 5 . 1 1 138 138 PHE N N 138 118.279 118.279 123.129 -4.850 19854 4704 1 5 . 1 1 138 138 PHE C C 138 175.393 175.393 176.305 -0.912 19854 4705 1 5 . 1 1 138 138 PHE CA C 138 58.092 58.092 62.568 -4.476 19854 4706 1 5 . 1 1 138 138 PHE CB C 138 39.353 39.353 39.207 0.146 19854 4707 1 5 . 1 1 138 138 PHE H H 138 8.317 8.317 7.633 0.684 19854 4708 1 5 . 1 1 139 139 HIS N N 139 120.605 120.605 115.512 5.093 19854 4709 1 5 . 1 1 139 139 HIS C C 139 175.979 175.979 176.990 -1.011 19854 4710 1 5 . 1 1 139 139 HIS CA C 139 67.775 67.775 59.174 8.601 19854 4711 1 5 . 1 1 139 139 HIS CB C 139 35.836 35.836 28.875 6.962 19854 4712 1 5 . 1 1 139 139 HIS H H 139 8.094 8.094 8.920 -0.826 19854 4713 1 5 . 1 1 140 140 ARG N N 140 120.140 120.140 120.110 0.030 19854 4714 1 5 . 1 1 140 140 ARG C C 140 178.023 178.023 179.122 -1.099 19854 4715 1 5 . 1 1 140 140 ARG CA C 140 58.394 58.394 59.184 -0.790 19854 4716 1 5 . 1 1 140 140 ARG CB C 140 39.644 39.644 29.806 9.838 19854 4717 1 5 . 1 1 140 140 ARG H H 140 8.149 8.149 7.043 1.106 19854 4718 1 5 . 1 1 141 141 LYS N N 141 115.623 115.623 119.967 -4.344 19854 4719 1 5 . 1 1 141 141 LYS C C 141 173.635 173.635 178.123 -4.488 19854 4720 1 5 . 1 1 141 141 LYS CA C 141 58.092 58.092 58.702 -0.610 19854 4721 1 5 . 1 1 141 141 LYS CB C 141 33.496 33.496 32.331 1.165 19854 4722 1 5 . 1 1 141 141 LYS H H 141 7.449 7.449 7.386 0.063 19854 4723 1 5 . 1 1 142 142 LYS N N 142 114.162 114.162 115.230 -1.068 19854 4724 1 5 . 1 1 142 142 LYS C C 142 175.979 175.979 175.674 0.305 19854 4725 1 5 . 1 1 142 142 LYS CA C 142 51.065 51.065 54.844 -3.779 19854 4726 1 5 . 1 1 142 142 LYS CB C 142 34.668 34.668 31.860 2.808 19854 4727 1 5 . 1 1 142 142 LYS H H 142 8.982 8.982 7.518 1.464 19854 4728 1 5 . 1 1 143 143 ASN N N 143 112.103 112.103 115.922 -3.819 19854 4729 1 5 . 1 1 143 143 ASN C C 143 175.100 175.100 174.198 0.902 19854 4730 1 5 . 1 1 143 143 ASN CA C 143 53.407 53.407 54.113 -0.706 19854 4731 1 5 . 1 1 143 143 ASN CB C 143 39.938 39.938 36.133 3.805 19854 4732 1 5 . 1 1 143 143 ASN H H 143 7.402 7.402 7.760 -0.358 19854 4733 1 5 . 1 1 144 144 LEU N N 144 118.810 118.810 117.135 1.675 19854 4734 1 5 . 1 1 144 144 LEU CA C 144 53.993 53.993 53.434 0.558 19854 4735 1 5 . 1 1 144 144 LEU CB C 144 42.866 42.866 44.381 -1.515 19854 4736 1 5 . 1 1 144 144 LEU H H 144 7.793 7.793 8.047 -0.254 19854 4737 1 5 . 1 1 145 145 GLN N N 145 119.607 119.607 118.057 1.550 19854 4738 1 5 . 1 1 145 145 GLN C C 145 176.859 176.859 174.343 2.516 19854 4739 1 5 . 1 1 145 145 GLN CA C 145 55.164 55.164 53.590 1.574 19854 4740 1 5 . 1 1 145 145 GLN CB C 145 29.983 29.983 31.138 -1.155 19854 4741 1 5 . 1 1 145 145 GLN H H 145 7.014 7.014 8.217 -1.203 19854 4742 1 5 . 1 1 146 146 TYR N N 146 119.275 119.275 123.915 -4.640 19854 4743 1 5 . 1 1 146 146 TYR C C 146 174.807 174.807 174.389 0.418 19854 4744 1 5 . 1 1 146 146 TYR CA C 146 62.777 62.777 56.115 6.662 19854 4745 1 5 . 1 1 146 146 TYR CB C 146 41.109 41.109 40.926 0.183 19854 4746 1 5 . 1 1 146 146 TYR H H 146 9.350 9.350 8.168 1.182 19854 4747 1 5 . 1 1 147 147 TYR N N 147 123.658 123.658 124.927 -1.269 19854 4748 1 5 . 1 1 147 147 TYR C C 147 177.738 177.738 173.644 4.094 19854 4749 1 5 . 1 1 147 147 TYR CA C 147 58.092 58.092 56.246 1.846 19854 4750 1 5 . 1 1 147 147 TYR CB C 147 39.938 39.938 42.235 -2.297 19854 4751 1 5 . 1 1 147 147 TYR H H 147 8.340 8.340 8.561 -0.221 19854 4752 1 5 . 1 1 148 148 ASP N N 148 121.267 121.267 123.320 -2.053 19854 4753 1 5 . 1 1 148 148 ASP C C 148 176.859 176.859 175.186 1.673 19854 4754 1 5 . 1 1 148 148 ASP CA C 148 54.579 54.579 54.411 0.168 19854 4755 1 5 . 1 1 148 148 ASP CB C 148 41.109 41.109 41.800 -0.691 19854 4756 1 5 . 1 1 148 148 ASP H H 148 8.911 8.911 8.302 0.609 19854 4757 1 5 . 1 1 149 149 ILE N N 149 119.607 119.607 118.393 1.214 19854 4758 1 5 . 1 1 149 149 ILE C C 149 174.807 174.807 174.154 0.653 19854 4759 1 5 . 1 1 149 149 ILE CA C 149 61.020 61.020 59.089 1.931 19854 4760 1 5 . 1 1 149 149 ILE CB C 149 39.353 39.353 42.619 -3.266 19854 4761 1 5 . 1 1 149 149 ILE H H 149 8.712 8.712 8.674 0.038 19854 4762 1 5 . 1 1 150 150 SER N N 150 117.349 117.349 116.698 0.651 19854 4763 1 5 . 1 1 150 150 SER C C 150 175.686 175.686 174.340 1.346 19854 4764 1 5 . 1 1 150 150 SER CA C 150 60.435 60.435 55.886 4.549 19854 4765 1 5 . 1 1 150 150 SER CB C 150 62.192 62.192 65.323 -3.131 19854 4766 1 5 . 1 1 150 150 SER H H 150 8.454 8.454 8.596 -0.142 19854 4767 1 5 . 1 1 151 151 ALA N N 151 131.162 131.162 131.505 -0.343 19854 4768 1 5 . 1 1 151 151 ALA C C 151 160.742 160.742 178.460 -17.718 19854 4769 1 5 . 1 1 151 151 ALA CA C 151 53.993 53.993 54.760 -0.767 19854 4770 1 5 . 1 1 151 151 ALA CB C 151 22.369 22.369 18.980 3.389 19854 4771 1 5 . 1 1 151 151 ALA H H 151 10.640 10.640 8.849 1.791 19854 4772 1 5 . 1 1 152 152 LYS N N 152 121.400 121.400 116.922 4.478 19854 4773 1 5 . 1 1 152 152 LYS C C 152 174.221 174.221 177.728 -3.507 19854 4774 1 5 . 1 1 152 152 LYS CA C 152 59.849 59.849 58.750 1.099 19854 4775 1 5 . 1 1 152 152 LYS CB C 152 34.668 34.668 32.673 1.995 19854 4776 1 5 . 1 1 152 152 LYS H H 152 9.099 9.099 8.290 0.809 19854 4777 1 5 . 1 1 153 153 SER N N 153 135.212 135.212 111.373 23.839 19854 4778 1 5 . 1 1 153 153 SER C C 153 177.152 177.152 174.979 2.173 19854 4779 1 5 . 1 1 153 153 SER CA C 153 62.192 62.192 58.246 3.946 19854 4780 1 5 . 1 1 153 153 SER CB C 153 66.291 66.291 64.802 1.489 19854 4781 1 5 . 1 1 153 153 SER H H 153 8.935 8.935 7.933 1.002 19854 4782 1 5 . 1 1 154 154 ASN N N 154 119.341 119.341 115.110 4.231 19854 4783 1 5 . 1 1 154 154 ASN C C 154 175.979 175.979 174.628 1.351 19854 4784 1 5 . 1 1 154 154 ASN CA C 154 49.894 49.894 54.946 -5.052 19854 4785 1 5 . 1 1 154 154 ASN CB C 154 39.353 39.353 37.053 2.300 19854 4786 1 5 . 1 1 154 154 ASN H H 154 7.488 7.488 8.583 -1.095 19854 4787 1 5 . 1 1 155 155 TYR N N 155 120.074 120.074 122.789 -2.715 19854 4788 1 5 . 1 1 155 155 TYR C C 155 177.144 177.144 175.839 1.305 19854 4789 1 5 . 1 1 155 155 TYR CA C 155 60.738 60.738 59.645 1.093 19854 4790 1 5 . 1 1 155 155 TYR CB C 155 41.402 41.402 38.339 3.063 19854 4791 1 5 . 1 1 155 155 TYR H H 155 7.945 7.945 7.468 0.477 19854 4792 1 5 . 1 1 156 156 ASN N N 156 124.058 124.058 122.857 1.201 19854 4793 1 5 . 1 1 156 156 ASN C C 156 175.679 175.679 175.999 -0.320 19854 4794 1 5 . 1 1 156 156 ASN CA C 156 53.121 53.121 54.443 -1.322 19854 4795 1 5 . 1 1 156 156 ASN CB C 156 38.179 38.179 36.239 1.940 19854 4796 1 5 . 1 1 156 156 ASN H H 156 8.192 8.192 8.723 -0.531 19854 4797 1 5 . 1 1 157 157 PHE N N 157 123.459 123.459 117.248 6.211 19854 4798 1 5 . 1 1 157 157 PHE C C 157 174.221 174.221 175.915 -1.694 19854 4799 1 5 . 1 1 157 157 PHE CA C 157 57.507 57.507 60.902 -3.395 19854 4800 1 5 . 1 1 157 157 PHE CB C 157 39.353 39.353 38.435 0.918 19854 4801 1 5 . 1 1 157 157 PHE H H 157 7.429 7.429 8.016 -0.587 19854 4802 1 5 . 1 1 158 158 GLU N N 158 112.568 112.568 117.466 -4.898 19854 4803 1 5 . 1 1 158 158 GLU C C 158 176.566 176.566 177.841 -1.275 19854 4804 1 5 . 1 1 158 158 GLU CA C 158 72.147 72.147 57.131 15.016 19854 4805 1 5 . 1 1 158 158 GLU CB C 158 27.640 27.640 28.865 -1.225 19854 4806 1 5 . 1 1 158 158 GLU H H 158 7.495 7.495 7.965 -0.470 19854 4807 1 5 . 1 1 159 159 LYS N N 159 113.232 113.232 119.777 -6.545 19854 4808 1 5 . 1 1 159 159 LYS C C 159 176.566 176.566 176.123 0.443 19854 4809 1 5 . 1 1 159 159 LYS CA C 159 53.993 53.993 61.798 -7.805 19854 4810 1 5 . 1 1 159 159 LYS CB C 159 33.496 33.496 30.011 3.485 19854 4811 1 5 . 1 1 159 159 LYS H H 159 6.862 6.862 7.476 -0.614 19854 4812 1 5 . 1 1 160 160 PRO C C 160 176.273 176.273 178.707 -2.434 19854 4813 1 5 . 1 1 160 160 PRO CA C 160 64.258 64.258 65.636 -1.378 19854 4814 1 5 . 1 1 160 160 PRO CB C 160 32.318 32.318 31.221 1.097 19854 4815 1 5 . 1 1 161 161 PHE N N 161 123.726 123.726 117.166 6.560 19854 4816 1 5 . 1 1 161 161 PHE C C 161 176.851 176.851 177.941 -1.090 19854 4817 1 5 . 1 1 161 161 PHE CA C 161 60.445 60.445 62.221 -1.776 19854 4818 1 5 . 1 1 161 161 PHE CB C 161 40.816 40.816 38.127 2.689 19854 4819 1 5 . 1 1 161 161 PHE H H 161 8.215 8.215 7.477 0.738 19854 4820 1 5 . 1 1 162 162 LEU N N 162 110.177 110.177 119.377 -9.200 19854 4821 1 5 . 1 1 162 162 LEU C C 162 176.273 176.273 178.552 -2.279 19854 4822 1 5 . 1 1 162 162 LEU CA C 162 55.750 55.750 58.060 -2.310 19854 4823 1 5 . 1 1 162 162 LEU CB C 162 44.037 44.037 41.506 2.531 19854 4824 1 5 . 1 1 162 162 LEU H H 162 7.527 7.527 7.958 -0.431 19854 4825 1 5 . 1 1 163 163 TRP N N 163 123.525 123.525 121.456 2.069 19854 4826 1 5 . 1 1 163 163 TRP C C 163 177.152 177.152 178.007 -0.855 19854 4827 1 5 . 1 1 163 163 TRP CA C 163 61.606 61.606 60.809 0.797 19854 4828 1 5 . 1 1 163 163 TRP CB C 163 28.811 28.811 29.886 -1.075 19854 4829 1 5 . 1 1 163 163 TRP H H 163 7.476 7.476 8.380 -0.904 19854 4830 1 5 . 1 1 164 164 LEU N N 164 119.740 119.740 118.821 0.919 19854 4831 1 5 . 1 1 164 164 LEU C C 164 175.686 175.686 178.763 -3.077 19854 4832 1 5 . 1 1 164 164 LEU CA C 164 61.020 61.020 57.651 3.369 19854 4833 1 5 . 1 1 164 164 LEU CB C 164 45.794 45.794 41.330 4.464 19854 4834 1 5 . 1 1 164 164 LEU H H 164 9.412 9.412 8.132 1.280 19854 4835 1 5 . 1 1 165 165 ALA N N 165 118.013 118.013 121.400 -3.387 19854 4836 1 5 . 1 1 165 165 ALA C C 165 165.723 165.723 179.542 -13.819 19854 4837 1 5 . 1 1 165 165 ALA CA C 165 52.236 52.236 55.136 -2.900 19854 4838 1 5 . 1 1 165 165 ALA CB C 165 21.784 21.784 18.118 3.666 19854 4839 1 5 . 1 1 165 165 ALA H H 165 7.707 7.707 8.192 -0.485 19854 4840 1 5 . 1 1 166 166 ARG N N 166 122.994 122.994 118.424 4.570 19854 4841 1 5 . 1 1 166 166 ARG C C 166 175.979 175.979 178.785 -2.806 19854 4842 1 5 . 1 1 166 166 ARG CA C 166 49.308 49.308 59.278 -9.970 19854 4843 1 5 . 1 1 166 166 ARG CB C 166 29.397 29.397 30.101 -0.704 19854 4844 1 5 . 1 1 166 166 ARG H H 166 8.692 8.692 8.087 0.605 19854 4845 1 5 . 1 1 167 167 LYS N N 167 112.568 112.568 120.215 -7.647 19854 4846 1 5 . 1 1 167 167 LYS C C 167 176.273 176.273 179.323 -3.050 19854 4847 1 5 . 1 1 167 167 LYS CA C 167 58.092 58.092 59.005 -0.913 19854 4848 1 5 . 1 1 167 167 LYS CB C 167 34.668 34.668 31.972 2.696 19854 4849 1 5 . 1 1 167 167 LYS H H 167 6.819 6.819 7.376 -0.557 19854 4850 1 5 . 1 1 168 168 LEU N N 168 114.959 114.959 119.698 -4.739 19854 4851 1 5 . 1 1 168 168 LEU C C 168 177.738 177.738 179.067 -1.329 19854 4852 1 5 . 1 1 168 168 LEU CA C 168 56.921 56.921 57.643 -0.722 19854 4853 1 5 . 1 1 168 168 LEU CB C 168 41.695 41.695 42.018 -0.323 19854 4854 1 5 . 1 1 168 168 LEU H H 168 7.269 7.269 7.823 -0.554 19854 4855 1 5 . 1 1 169 169 ILE N N 169 122.199 122.199 115.946 6.253 19854 4856 1 5 . 1 1 169 169 ILE C C 169 177.445 177.445 177.298 0.147 19854 4857 1 5 . 1 1 169 169 ILE CA C 169 63.375 63.375 63.179 0.196 19854 4858 1 5 . 1 1 169 169 ILE CB C 169 42.281 42.281 38.721 3.560 19854 4859 1 5 . 1 1 169 169 ILE H H 169 8.360 8.360 8.166 0.194 19854 4860 1 5 . 1 1 170 170 GLY N N 170 113.099 113.099 106.924 6.175 19854 4861 1 5 . 1 1 170 170 GLY C C 170 162.496 162.496 173.618 -11.122 19854 4862 1 5 . 1 1 170 170 GLY CA C 170 44.037 44.037 44.908 -0.871 19854 4863 1 5 . 1 1 170 170 GLY H H 170 6.686 6.686 7.915 -1.229 19854 4864 1 5 . 1 1 171 171 ASP N N 171 113.232 113.232 121.507 -8.275 19854 4865 1 5 . 1 1 171 171 ASP C C 171 178.910 178.910 175.484 3.426 19854 4866 1 5 . 1 1 171 171 ASP CA C 171 50.479 50.479 50.450 0.029 19854 4867 1 5 . 1 1 171 171 ASP CB C 171 41.109 41.109 41.912 -0.803 19854 4868 1 5 . 1 1 171 171 ASP H H 171 6.815 6.815 7.711 -0.896 19854 4869 1 5 . 1 1 172 172 PRO C C 172 176.566 176.566 176.849 -0.283 19854 4870 1 5 . 1 1 172 172 PRO CA C 172 63.965 63.965 64.083 -0.118 19854 4871 1 5 . 1 1 172 172 PRO CB C 172 31.732 31.732 32.215 -0.483 19854 4872 1 5 . 1 1 173 173 ASN N N 173 109.779 109.779 115.964 -6.185 19854 4873 1 5 . 1 1 173 173 ASN C C 173 175.979 175.979 175.244 0.735 19854 4874 1 5 . 1 1 173 173 ASN CA C 173 54.579 54.579 52.965 1.614 19854 4875 1 5 . 1 1 173 173 ASN CB C 173 36.424 36.424 39.206 -2.782 19854 4876 1 5 . 1 1 173 173 ASN H H 173 8.016 8.016 8.525 -0.509 19854 4877 1 5 . 1 1 174 174 LEU N N 174 109.248 109.248 121.108 -11.860 19854 4878 1 5 . 1 1 174 174 LEU C C 174 176.566 176.566 175.405 1.161 19854 4879 1 5 . 1 1 174 174 LEU CA C 174 56.336 56.336 56.260 0.076 19854 4880 1 5 . 1 1 174 174 LEU CB C 174 44.037 44.037 42.093 1.944 19854 4881 1 5 . 1 1 174 174 LEU H H 174 7.871 7.871 7.313 0.558 19854 4882 1 5 . 1 1 175 175 GLU N N 175 125.185 125.185 120.074 5.111 19854 4883 1 5 . 1 1 175 175 GLU C C 175 177.445 177.445 175.217 2.228 19854 4884 1 5 . 1 1 175 175 GLU CA C 175 76.247 76.247 54.236 22.011 19854 4885 1 5 . 1 1 175 175 GLU CB C 175 28.811 28.811 34.084 -5.272 19854 4886 1 5 . 1 1 175 175 GLU H H 175 9.127 9.127 8.174 0.953 19854 4887 1 5 . 1 1 176 176 PHE N N 176 136.873 136.873 124.630 12.243 19854 4888 1 5 . 1 1 176 176 PHE C C 176 178.617 178.617 175.383 3.234 19854 4889 1 5 . 1 1 176 176 PHE CA C 176 59.264 59.264 58.753 0.511 19854 4890 1 5 . 1 1 176 176 PHE CB C 176 44.623 44.623 39.833 4.790 19854 4891 1 5 . 1 1 176 176 PHE H H 176 10.058 10.058 8.731 1.327 19854 4892 1 5 . 1 1 177 177 VAL N N 177 118.877 118.877 122.949 -4.072 19854 4893 1 5 . 1 1 177 177 VAL C C 177 177.445 177.445 174.462 2.983 19854 4894 1 5 . 1 1 177 177 VAL CA C 177 62.777 62.777 59.769 3.009 19854 4895 1 5 . 1 1 177 177 VAL CB C 177 34.668 34.668 34.356 0.312 19854 4896 1 5 . 1 1 177 177 VAL H H 177 7.789 7.789 8.199 -0.410 19854 4897 1 5 . 1 1 178 178 ALA N N 178 123.859 123.859 130.283 -6.424 19854 4898 1 5 . 1 1 178 178 ALA C C 178 177.144 177.144 176.036 1.108 19854 4899 1 5 . 1 1 178 178 ALA CA C 178 54.000 54.000 53.391 0.609 19854 4900 1 5 . 1 1 178 178 ALA CB C 178 15.035 15.035 18.323 -3.288 19854 4901 1 5 . 1 1 178 178 ALA H H 178 7.683 7.683 7.975 -0.292 19854 4902 1 5 . 1 1 179 179 MET N N 179 121.668 121.668 116.092 5.576 19854 4903 1 5 . 1 1 179 179 MET C C 179 177.144 177.144 173.406 3.738 19854 4904 1 5 . 1 1 179 179 MET CA C 179 60.445 60.445 54.883 5.562 19854 4905 1 5 . 1 1 179 179 MET CB C 179 39.351 39.351 33.214 6.137 19854 4906 1 5 . 1 1 179 179 MET H H 179 7.648 7.648 7.959 -0.311 19854 4907 1 5 . 1 1 180 180 PRO C C 180 177.445 177.445 175.525 1.920 19854 4908 1 5 . 1 1 180 180 PRO CA C 180 64.844 64.844 63.028 1.816 19854 4909 1 5 . 1 1 180 180 PRO CB C 180 29.974 29.974 32.145 -2.171 19854 4910 1 5 . 1 1 181 181 ALA N N 181 128.439 128.439 126.993 1.446 19854 4911 1 5 . 1 1 181 181 ALA C C 181 176.273 176.273 177.202 -0.929 19854 4912 1 5 . 1 1 181 181 ALA CA C 181 58.092 58.092 51.556 6.536 19854 4913 1 5 . 1 1 181 181 ALA CB C 181 21.198 21.198 19.926 1.272 19854 4914 1 5 . 1 1 181 181 ALA H H 181 8.673 8.673 8.259 0.414 19854 4915 1 5 . 1 1 182 182 LEU N N 182 122.130 122.130 123.963 -1.833 19854 4916 1 5 . 1 1 182 182 LEU C C 182 177.445 177.445 176.136 1.309 19854 4917 1 5 . 1 1 182 182 LEU CA C 182 55.164 55.164 54.495 0.669 19854 4918 1 5 . 1 1 182 182 LEU CB C 182 42.866 42.866 41.684 1.182 19854 4919 1 5 . 1 1 182 182 LEU H H 182 8.821 8.821 8.488 0.333 19854 4920 1 5 . 1 1 183 183 ALA N N 183 121.004 121.004 128.931 -7.927 19854 4921 1 5 . 1 1 183 183 ALA C C 183 178.617 178.617 174.905 3.712 19854 4922 1 5 . 1 1 183 183 ALA CA C 183 57.808 57.808 49.663 8.145 19854 4923 1 5 . 1 1 183 183 ALA CB C 183 24.117 24.117 20.152 3.965 19854 4924 1 5 . 1 1 183 183 ALA H H 183 8.356 8.356 8.207 0.149 19854 4925 1 5 . 1 1 184 184 PRO C C 184 177.152 177.152 175.512 1.640 19854 4926 1 5 . 1 1 184 184 PRO CA C 184 64.258 64.258 61.927 2.331 19854 4927 1 5 . 1 1 184 184 PRO CB C 184 29.681 29.681 31.654 -1.973 19854 4928 1 5 . 1 1 185 185 PRO C C 185 175.686 175.686 177.730 -2.044 19854 4929 1 5 . 1 1 185 185 PRO CA C 185 63.379 63.379 62.656 0.723 19854 4930 1 5 . 1 1 185 185 PRO CB C 185 35.248 35.248 32.718 2.530 19854 4931 1 5 . 1 1 186 186 GLU N N 186 120.539 120.539 121.536 -0.997 19854 4932 1 5 . 1 1 186 186 GLU C C 186 176.273 176.273 176.955 -0.682 19854 4933 1 5 . 1 1 186 186 GLU CA C 186 58.101 58.101 58.159 -0.058 19854 4934 1 5 . 1 1 186 186 GLU CB C 186 35.836 35.836 29.950 5.886 19854 4935 1 5 . 1 1 186 186 GLU H H 186 8.086 8.086 8.586 -0.500 19854 4936 1 5 . 1 1 187 187 VAL N N 187 124.455 124.455 113.622 10.833 19854 4937 1 5 . 1 1 187 187 VAL C C 187 178.910 178.910 175.203 3.707 19854 4938 1 5 . 1 1 187 187 VAL CA C 187 63.363 63.363 63.476 -0.113 19854 4939 1 5 . 1 1 187 187 VAL CB C 187 34.082 34.082 31.521 2.561 19854 4940 1 5 . 1 1 187 187 VAL H H 187 8.622 8.622 7.785 0.837 19854 4941 1 5 . 1 1 188 188 VAL N N 188 128.572 128.572 120.351 8.221 19854 4942 1 5 . 1 1 188 188 VAL C C 188 178.324 178.324 176.991 1.333 19854 4943 1 5 . 1 1 188 188 VAL CA C 188 68.634 68.634 62.901 5.733 19854 4944 1 5 . 1 1 188 188 VAL CB C 188 31.154 31.154 31.944 -0.790 19854 4945 1 5 . 1 1 188 188 VAL H H 188 8.497 8.497 8.079 0.418 19854 4946 1 5 . 1 1 189 189 MET N N 189 122.795 122.795 119.241 3.554 19854 4947 1 5 . 1 1 189 189 MET C C 189 177.445 177.445 175.206 2.239 19854 4948 1 5 . 1 1 189 189 MET CA C 189 55.164 55.164 56.407 -1.243 19854 4949 1 5 . 1 1 189 189 MET CB C 189 35.253 35.253 33.418 1.835 19854 4950 1 5 . 1 1 189 189 MET H H 189 6.991 6.991 7.767 -0.776 19854 4951 1 5 . 1 1 190 190 ASP N N 190 114.959 114.959 121.538 -6.579 19854 4952 1 5 . 1 1 190 190 ASP C C 190 175.686 175.686 175.447 0.239 19854 4953 1 5 . 1 1 190 190 ASP CA C 190 51.065 51.065 55.938 -4.873 19854 4954 1 5 . 1 1 190 190 ASP CB C 190 41.695 41.695 40.758 0.937 19854 4955 1 5 . 1 1 190 190 ASP H H 190 7.210 7.210 8.730 -1.520 19854 4956 1 5 . 1 1 191 191 PRO C C 191 176.566 176.566 179.057 -2.491 19854 4957 1 5 . 1 1 191 191 PRO CA C 191 63.965 63.965 65.151 -1.186 19854 4958 1 5 . 1 1 191 191 PRO CB C 191 31.146 31.146 31.415 -0.269 19854 4959 1 5 . 1 1 192 192 ALA N N 192 109.513 109.513 121.048 -11.535 19854 4960 1 5 . 1 1 192 192 ALA CA C 192 53.993 53.993 54.290 -0.297 19854 4961 1 5 . 1 1 192 192 ALA CB C 192 19.441 19.441 18.338 1.103 19854 4962 1 5 . 1 1 192 192 ALA H H 192 7.394 7.394 8.094 -0.700 19854 4963 1 5 . 1 1 193 193 LEU N N 193 119.009 119.009 119.053 -0.044 19854 4964 1 5 . 1 1 193 193 LEU C C 193 175.979 175.979 176.707 -0.728 19854 4965 1 5 . 1 1 193 193 LEU CA C 193 56.336 56.336 54.781 1.555 19854 4966 1 5 . 1 1 193 193 LEU CB C 193 42.866 42.866 41.942 0.924 19854 4967 1 5 . 1 1 193 193 LEU H H 193 8.340 8.340 7.891 0.449 19854 4968 1 5 . 1 1 194 194 ALA N N 194 121.666 121.666 120.940 0.726 19854 4969 1 5 . 1 1 194 194 ALA C C 194 166.896 166.896 177.888 -10.992 19854 4970 1 5 . 1 1 194 194 ALA CA C 194 55.164 55.164 52.876 2.288 19854 4971 1 5 . 1 1 194 194 ALA CB C 194 16.513 16.513 19.269 -2.756 19854 4972 1 5 . 1 1 194 194 ALA H H 194 8.176 8.176 7.478 0.698 19854 4973 1 5 . 1 1 195 195 ALA N N 195 119.541 119.541 118.858 0.683 19854 4974 1 5 . 1 1 195 195 ALA C C 195 173.928 173.928 179.282 -5.354 19854 4975 1 5 . 1 1 195 195 ALA CA C 195 57.507 57.507 54.036 3.471 19854 4976 1 5 . 1 1 195 195 ALA CB C 195 19.441 19.441 17.119 2.322 19854 4977 1 5 . 1 1 195 195 ALA H H 195 8.364 8.364 8.781 -0.417 19854 4978 1 5 . 1 1 196 196 GLN N N 196 107.322 107.322 119.787 -12.465 19854 4979 1 5 . 1 1 196 196 GLN C C 196 176.273 176.273 177.420 -1.147 19854 4980 1 5 . 1 1 196 196 GLN CA C 196 56.921 56.921 57.979 -1.058 19854 4981 1 5 . 1 1 196 196 GLN CB C 196 29.983 29.983 28.474 1.508 19854 4982 1 5 . 1 1 196 196 GLN H H 196 7.910 7.910 7.961 -0.051 19854 4983 1 5 . 1 1 197 197 TYR N N 197 119.277 119.277 118.130 1.147 19854 4984 1 5 . 1 1 197 197 TYR C C 197 178.316 178.316 178.249 0.067 19854 4985 1 5 . 1 1 197 197 TYR CA C 197 56.343 56.343 61.226 -4.883 19854 4986 1 5 . 1 1 197 197 TYR CB C 197 43.453 43.453 37.764 5.689 19854 4987 1 5 . 1 1 197 197 TYR H H 197 8.180 8.180 8.421 -0.241 19854 4988 1 5 . 1 1 198 198 GLU N N 198 110.244 110.244 118.773 -8.529 19854 4989 1 5 . 1 1 198 198 GLU C C 198 176.273 176.273 178.786 -2.513 19854 4990 1 5 . 1 1 198 198 GLU CA C 198 53.407 53.407 59.710 -6.303 19854 4991 1 5 . 1 1 198 198 GLU CB C 198 30.568 30.568 29.299 1.269 19854 4992 1 5 . 1 1 198 198 GLU H H 198 7.523 7.523 7.915 -0.392 19854 4993 1 5 . 1 1 199 199 HIS N N 199 119.211 119.211 119.182 0.029 19854 4994 1 5 . 1 1 199 199 HIS C C 199 178.902 178.902 177.218 1.684 19854 4995 1 5 . 1 1 199 199 HIS CA C 199 58.687 58.687 59.454 -0.767 19854 4996 1 5 . 1 1 199 199 HIS CB C 199 34.957 34.957 29.572 5.385 19854 4997 1 5 . 1 1 199 199 HIS H H 199 8.258 8.258 7.751 0.507 19854 4998 1 5 . 1 1 200 200 ASP N N 200 124.722 124.722 119.974 4.748 19854 4999 1 5 . 1 1 200 200 ASP C C 200 176.705 176.705 178.844 -2.139 19854 5000 1 5 . 1 1 200 200 ASP CA C 200 58.687 58.687 57.178 1.509 19854 5001 1 5 . 1 1 200 200 ASP CB C 200 39.644 39.644 40.422 -0.778 19854 5002 1 5 . 1 1 200 200 ASP H H 200 8.086 8.086 7.775 0.311 19854 5003 1 5 . 1 1 201 201 LEU N N 201 116.353 116.353 120.283 -3.930 19854 5004 1 5 . 1 1 201 201 LEU C C 201 178.910 178.910 179.148 -0.238 19854 5005 1 5 . 1 1 201 201 LEU CA C 201 61.606 61.606 58.276 3.330 19854 5006 1 5 . 1 1 201 201 LEU CB C 201 41.109 41.109 41.752 -0.643 19854 5007 1 5 . 1 1 201 201 LEU H H 201 7.722 7.722 8.140 -0.418 19854 5008 1 5 . 1 1 202 202 GLU N N 202 118.080 118.080 119.854 -1.774 19854 5009 1 5 . 1 1 202 202 GLU C C 202 176.566 176.566 179.398 -2.832 19854 5010 1 5 . 1 1 202 202 GLU CA C 202 56.921 56.921 59.345 -2.424 19854 5011 1 5 . 1 1 202 202 GLU CB C 202 30.568 30.568 29.589 0.979 19854 5012 1 5 . 1 1 202 202 GLU H H 202 8.857 8.857 8.006 0.851 19854 5013 1 5 . 1 1 203 203 VAL N N 203 129.369 129.369 120.070 9.299 19854 5014 1 5 . 1 1 203 203 VAL C C 203 178.617 178.617 177.594 1.023 19854 5015 1 5 . 1 1 203 203 VAL CA C 203 64.534 64.534 66.904 -2.370 19854 5016 1 5 . 1 1 203 203 VAL CB C 203 27.640 27.640 31.194 -3.554 19854 5017 1 5 . 1 1 203 203 VAL H H 203 9.283 9.283 7.472 1.811 19854 5018 1 5 . 1 1 204 204 ALA N N 204 109.580 109.580 121.752 -12.172 19854 5019 1 5 . 1 1 204 204 ALA C C 204 176.859 176.859 178.939 -2.080 19854 5020 1 5 . 1 1 204 204 ALA CA C 204 54.579 54.579 54.947 -0.368 19854 5021 1 5 . 1 1 204 204 ALA CB C 204 18.270 18.270 18.499 -0.229 19854 5022 1 5 . 1 1 204 204 ALA H H 204 8.528 8.528 7.778 0.750 19854 5023 1 5 . 1 1 205 205 GLN N N 205 123.328 123.328 116.411 6.917 19854 5024 1 5 . 1 1 205 205 GLN C C 205 177.418 177.418 178.049 -0.631 19854 5025 1 5 . 1 1 205 205 GLN CA C 205 57.515 57.515 58.084 -0.569 19854 5026 1 5 . 1 1 205 205 GLN CB C 205 33.785 33.785 29.126 4.659 19854 5027 1 5 . 1 1 205 205 GLN H H 205 8.160 8.160 7.937 0.223 19854 5028 1 5 . 1 1 206 206 THR N N 206 120.271 120.271 114.647 5.624 19854 5029 1 5 . 1 1 206 206 THR C C 206 176.273 176.273 175.249 1.024 19854 5030 1 5 . 1 1 206 206 THR CA C 206 67.462 67.462 65.307 2.155 19854 5031 1 5 . 1 1 206 206 THR CB C 206 70.390 70.390 68.997 1.393 19854 5032 1 5 . 1 1 206 206 THR H H 206 7.585 7.585 7.907 -0.322 19854 5033 1 5 . 1 1 207 207 THR N N 207 111.970 111.970 119.207 -7.237 19854 5034 1 5 . 1 1 207 207 THR C C 207 176.566 176.566 173.634 2.932 19854 5035 1 5 . 1 1 207 207 THR CA C 207 64.534 64.534 63.922 0.612 19854 5036 1 5 . 1 1 207 207 THR CB C 207 72.733 72.733 69.206 3.527 19854 5037 1 5 . 1 1 207 207 THR H H 207 7.468 7.468 7.545 -0.077 19854 5038 1 5 . 1 1 208 208 ALA N N 208 115.623 115.623 129.979 -14.356 19854 5039 1 5 . 1 1 208 208 ALA C C 208 168.947 168.947 176.882 -7.935 19854 5040 1 5 . 1 1 208 208 ALA CA C 208 55.164 55.164 50.824 4.340 19854 5041 1 5 . 1 1 208 208 ALA CB C 208 22.369 22.369 20.653 1.716 19854 5042 1 5 . 1 1 208 208 ALA H H 208 7.390 7.390 8.257 -0.867 19854 5043 1 5 . 1 1 209 209 LEU N N 209 117.814 117.814 123.422 -5.608 19854 5044 1 5 . 1 1 209 209 LEU C C 209 176.273 176.273 175.660 0.613 19854 5045 1 5 . 1 1 209 209 LEU CA C 209 58.678 58.678 52.701 5.977 19854 5046 1 5 . 1 1 209 209 LEU CB C 209 46.380 46.380 41.627 4.753 19854 5047 1 5 . 1 1 209 209 LEU H H 209 7.652 7.652 8.634 -0.982 19854 5048 1 5 . 1 1 210 210 PRO C C 210 176.566 176.566 175.039 1.527 19854 5049 1 5 . 1 1 210 210 PRO CA C 210 63.086 63.086 63.355 -0.269 19854 5050 1 5 . 1 1 210 210 PRO CB C 210 31.146 31.146 31.709 -0.563 19854 5051 1 5 . 1 1 211 211 ASP N N 211 122.863 122.863 124.843 -1.980 19854 5052 1 5 . 1 1 211 211 ASP C C 211 175.686 175.686 176.321 -0.635 19854 5053 1 5 . 1 1 211 211 ASP CA C 211 56.343 56.343 52.483 3.860 19854 5054 1 5 . 1 1 211 211 ASP CB C 211 41.402 41.402 43.211 -1.809 19854 5055 1 5 . 1 1 211 211 ASP H H 211 8.360 8.360 8.564 -0.204 19854 5056 1 5 . 1 1 212 212 GLU N N 212 131.162 131.162 123.653 7.509 19854 5057 1 5 . 1 1 212 212 GLU C C 212 176.273 176.273 175.463 0.810 19854 5058 1 5 . 1 1 212 212 GLU CA C 212 55.164 55.164 58.906 -3.742 19854 5059 1 5 . 1 1 212 212 GLU CB C 212 30.568 30.568 30.922 -0.354 19854 5060 1 5 . 1 1 212 212 GLU H H 212 8.399 8.399 8.710 -0.311 19854 5061 1 5 . 1 1 213 213 ASP N N 213 122.797 122.797 113.288 9.509 19854 5062 1 5 . 1 1 213 213 ASP C C 213 177.152 177.152 176.176 0.976 19854 5063 1 5 . 1 1 213 213 ASP CA C 213 61.914 61.914 52.767 9.147 19854 5064 1 5 . 1 1 213 213 ASP CB C 213 49.607 49.607 40.520 9.087 19854 5065 1 5 . 1 1 213 213 ASP H H 213 8.168 8.168 8.078 0.090 19854 5066 1 5 . 1 1 214 214 ASP N N 214 112.369 112.369 121.889 -9.520 19854 5067 1 5 . 1 1 214 214 ASP C C 214 178.910 178.910 177.065 1.845 19854 5068 1 5 . 1 1 214 214 ASP CA C 214 54.579 54.579 56.896 -2.317 19854 5069 1 5 . 1 1 214 214 ASP CB C 214 39.353 39.353 40.550 -1.197 19854 5070 1 5 . 1 1 214 214 ASP H H 214 7.464 7.464 8.590 -1.126 19854 5071 1 5 . 1 1 215 215 ASP N N 215 127.244 127.244 119.251 7.993 19854 5072 1 5 . 1 1 215 215 ASP C C 215 176.859 176.859 177.155 -0.296 19854 5073 1 5 . 1 1 215 215 ASP CA C 215 54.579 54.579 55.790 -1.211 19854 5074 1 5 . 1 1 215 215 ASP CB C 215 40.524 40.524 40.988 -0.464 19854 5075 1 5 . 1 1 215 215 ASP H H 215 8.301 8.301 8.300 0.001 19854 5076 1 6 . 1 1 2 2 ALA N N 2 131.228 131.228 123.604 7.624 19854 5077 1 6 . 1 1 2 2 ALA C C 2 187.031 187.031 179.018 8.013 19854 5078 1 6 . 1 1 2 2 ALA CA C 2 53.407 53.407 54.993 -1.586 19854 5079 1 6 . 1 1 2 2 ALA CB C 2 20.027 20.027 18.065 1.962 19854 5080 1 6 . 1 1 2 2 ALA H H 2 10.644 10.644 8.346 2.298 19854 5081 1 6 . 1 1 3 3 ALA N N 3 124.521 124.521 121.051 3.470 19854 5082 1 6 . 1 1 3 3 ALA C C 3 176.566 176.566 179.247 -2.681 19854 5083 1 6 . 1 1 3 3 ALA CA C 3 49.894 49.894 54.271 -4.377 19854 5084 1 6 . 1 1 3 3 ALA CB C 3 18.270 18.270 17.831 0.439 19854 5085 1 6 . 1 1 3 3 ALA H H 3 8.669 8.669 8.281 0.388 19854 5086 1 6 . 1 1 4 4 GLN N N 4 118.080 118.080 117.191 0.889 19854 5087 1 6 . 1 1 4 4 GLN C C 4 176.273 176.273 176.896 -0.623 19854 5088 1 6 . 1 1 4 4 GLN CA C 4 54.579 54.579 55.921 -1.342 19854 5089 1 6 . 1 1 4 4 GLN CB C 4 27.054 27.054 29.004 -1.950 19854 5090 1 6 . 1 1 4 4 GLN H H 4 8.919 8.919 8.162 0.757 19854 5091 1 6 . 1 1 5 5 GLY N N 5 121.002 121.002 106.372 14.630 19854 5092 1 6 . 1 1 5 5 GLY C C 5 181.877 181.877 173.870 8.007 19854 5093 1 6 . 1 1 5 5 GLY CA C 5 45.794 45.794 44.940 0.854 19854 5094 1 6 . 1 1 5 5 GLY H H 5 8.082 8.082 7.847 0.235 19854 5095 1 6 . 1 1 6 6 GLU N N 6 129.435 129.435 122.354 7.081 19854 5096 1 6 . 1 1 6 6 GLU C C 6 176.566 176.566 175.579 0.987 19854 5097 1 6 . 1 1 6 6 GLU CA C 6 56.336 56.336 53.017 3.319 19854 5098 1 6 . 1 1 6 6 GLU CB C 6 28.811 28.811 30.429 -1.618 19854 5099 1 6 . 1 1 6 6 GLU H H 6 9.267 9.267 7.905 1.362 19854 5100 1 6 . 1 1 7 7 PRO C C 7 176.566 176.566 176.856 -0.290 19854 5101 1 6 . 1 1 7 7 PRO CA C 7 63.672 63.672 65.109 -1.437 19854 5102 1 6 . 1 1 7 7 PRO CB C 7 31.146 31.146 32.202 -1.056 19854 5103 1 6 . 1 1 8 8 GLN N N 8 112.502 112.502 113.918 -1.416 19854 5104 1 6 . 1 1 8 8 GLN C C 8 177.445 177.445 175.314 2.131 19854 5105 1 6 . 1 1 8 8 GLN CA C 8 50.479 50.479 56.174 -5.695 19854 5106 1 6 . 1 1 8 8 GLN CB C 8 28.811 28.811 31.902 -3.091 19854 5107 1 6 . 1 1 8 8 GLN H H 8 6.220 6.220 8.270 -2.050 19854 5108 1 6 . 1 1 9 9 VAL N N 9 117.416 117.416 113.664 3.752 19854 5109 1 6 . 1 1 9 9 VAL C C 9 178.324 178.324 173.696 4.628 19854 5110 1 6 . 1 1 9 9 VAL CA C 9 63.363 63.363 59.781 3.583 19854 5111 1 6 . 1 1 9 9 VAL CB C 9 34.668 34.668 34.879 -0.211 19854 5112 1 6 . 1 1 9 9 VAL H H 9 6.561 6.561 7.533 -0.972 19854 5113 1 6 . 1 1 10 10 GLN N N 10 113.896 113.896 123.114 -9.218 19854 5114 1 6 . 1 1 10 10 GLN C C 10 176.273 176.273 174.309 1.964 19854 5115 1 6 . 1 1 10 10 GLN CA C 10 55.164 55.164 53.950 1.214 19854 5116 1 6 . 1 1 10 10 GLN CB C 10 28.226 28.226 32.297 -4.071 19854 5117 1 6 . 1 1 10 10 GLN H H 10 7.847 7.847 7.794 0.053 19854 5118 1 6 . 1 1 11 11 PHE N N 11 118.744 118.744 124.533 -5.789 19854 5119 1 6 . 1 1 11 11 PHE C C 11 176.566 176.566 174.740 1.826 19854 5120 1 6 . 1 1 11 11 PHE CA C 11 59.849 59.849 56.551 3.297 19854 5121 1 6 . 1 1 11 11 PHE CB C 11 41.109 41.109 42.679 -1.570 19854 5122 1 6 . 1 1 11 11 PHE H H 11 8.262 8.262 9.002 -0.740 19854 5123 1 6 . 1 1 12 12 LYS N N 12 129.437 129.437 125.320 4.117 19854 5124 1 6 . 1 1 12 12 LYS C C 12 178.609 178.609 175.193 3.416 19854 5125 1 6 . 1 1 12 12 LYS CA C 12 57.808 57.808 55.842 1.966 19854 5126 1 6 . 1 1 12 12 LYS H H 12 10.015 10.015 8.799 1.216 19854 5127 1 6 . 1 1 13 13 LEU N N 13 112.103 112.103 128.440 -16.337 19854 5128 1 6 . 1 1 13 13 LEU C C 13 177.738 177.738 175.530 2.208 19854 5129 1 6 . 1 1 13 13 LEU CA C 13 54.579 54.579 53.437 1.142 19854 5130 1 6 . 1 1 13 13 LEU CB C 13 42.866 42.866 44.675 -1.808 19854 5131 1 6 . 1 1 13 13 LEU H H 13 6.905 6.905 8.995 -2.090 19854 5132 1 6 . 1 1 14 14 VAL N N 14 127.310 127.310 123.414 3.896 19854 5133 1 6 . 1 1 14 14 VAL C C 14 175.393 175.393 174.410 0.983 19854 5134 1 6 . 1 1 14 14 VAL CA C 14 70.976 70.976 61.737 9.239 19854 5135 1 6 . 1 1 14 14 VAL CB C 14 28.811 28.811 33.341 -4.530 19854 5136 1 6 . 1 1 14 14 VAL H H 14 8.305 8.305 8.712 -0.407 19854 5137 1 6 . 1 1 15 15 LEU N N 15 128.640 128.640 131.177 -2.537 19854 5138 1 6 . 1 1 15 15 LEU C C 15 177.730 177.730 174.895 2.835 19854 5139 1 6 . 1 1 15 15 LEU CA C 15 55.758 55.758 53.283 2.474 19854 5140 1 6 . 1 1 15 15 LEU H H 15 7.718 7.718 9.074 -1.356 19854 5141 1 6 . 1 1 16 16 VAL N N 16 121.267 121.267 121.185 0.082 19854 5142 1 6 . 1 1 16 16 VAL C C 16 178.324 178.324 174.529 3.795 19854 5143 1 6 . 1 1 16 16 VAL CA C 16 63.363 63.363 58.433 4.930 19854 5144 1 6 . 1 1 16 16 VAL CB C 16 35.839 35.839 35.039 0.800 19854 5145 1 6 . 1 1 16 16 VAL H H 16 8.935 8.935 8.834 0.101 19854 5146 1 6 . 1 1 17 17 GLY N N 17 127.908 127.908 107.145 20.763 19854 5147 1 6 . 1 1 17 17 GLY C C 17 174.514 174.514 173.319 1.195 19854 5148 1 6 . 1 1 17 17 GLY CA C 17 42.281 42.281 44.698 -2.417 19854 5149 1 6 . 1 1 17 17 GLY H H 17 9.682 9.682 6.884 2.798 19854 5150 1 6 . 1 1 18 18 ASP N N 18 125.054 125.054 121.368 3.686 19854 5151 1 6 . 1 1 18 18 ASP C C 18 176.851 176.851 177.538 -0.687 19854 5152 1 6 . 1 1 18 18 ASP CA C 18 57.515 57.515 54.423 3.092 19854 5153 1 6 . 1 1 18 18 ASP CB C 18 46.090 46.090 42.060 4.030 19854 5154 1 6 . 1 1 18 18 ASP H H 18 8.282 8.282 8.455 -0.173 19854 5155 1 6 . 1 1 19 19 GLY N N 19 120.670 120.670 106.287 14.383 19854 5156 1 6 . 1 1 19 19 GLY C C 19 178.324 178.324 174.625 3.699 19854 5157 1 6 . 1 1 19 19 GLY CA C 19 42.281 42.281 45.471 -3.190 19854 5158 1 6 . 1 1 19 19 GLY H H 19 8.825 8.825 8.757 0.068 19854 5159 1 6 . 1 1 20 20 GLY N N 20 129.369 129.369 113.389 15.980 19854 5160 1 6 . 1 1 20 20 GLY C C 20 174.221 174.221 175.963 -1.742 19854 5161 1 6 . 1 1 20 20 GLY CA C 20 41.695 41.695 45.365 -3.671 19854 5162 1 6 . 1 1 20 20 GLY H H 20 8.477 8.477 7.772 0.705 19854 5163 1 6 . 1 1 21 21 THR N N 21 122.199 122.199 117.934 4.265 19854 5164 1 6 . 1 1 21 21 THR C C 21 171.291 171.291 175.009 -3.718 19854 5165 1 6 . 1 1 21 21 THR CA C 21 61.914 61.914 66.623 -4.709 19854 5166 1 6 . 1 1 21 21 THR CB C 21 65.137 65.137 69.214 -4.077 19854 5167 1 6 . 1 1 21 21 THR H H 21 8.059 8.059 7.703 0.356 19854 5168 1 6 . 1 1 22 22 GLY N N 22 112.369 112.369 106.407 5.962 19854 5169 1 6 . 1 1 22 22 GLY C C 22 184.807 184.807 175.229 9.578 19854 5170 1 6 . 1 1 22 22 GLY CA C 22 45.209 45.209 45.291 -0.082 19854 5171 1 6 . 1 1 22 22 GLY H H 22 6.772 6.772 8.409 -1.637 19854 5172 1 6 . 1 1 23 23 LYS N N 23 122.066 122.066 120.350 1.716 19854 5173 1 6 . 1 1 23 23 LYS C C 23 178.589 178.589 177.949 0.640 19854 5174 1 6 . 1 1 23 23 LYS CA C 23 58.101 58.101 59.101 -1.000 19854 5175 1 6 . 1 1 23 23 LYS CB C 23 40.230 40.230 31.952 8.278 19854 5176 1 6 . 1 1 23 23 LYS H H 23 7.441 7.441 8.393 -0.952 19854 5177 1 6 . 1 1 24 24 THR N N 24 114.627 114.627 115.084 -0.457 19854 5178 1 6 . 1 1 24 24 THR C C 24 178.324 178.324 176.667 1.657 19854 5179 1 6 . 1 1 24 24 THR CA C 24 62.192 62.192 67.159 -4.968 19854 5180 1 6 . 1 1 24 24 THR CB C 24 71.562 71.562 68.123 3.439 19854 5181 1 6 . 1 1 24 24 THR H H 24 8.469 8.469 8.508 -0.039 19854 5182 1 6 . 1 1 25 25 THR N N 25 110.377 110.377 119.254 -8.877 19854 5183 1 6 . 1 1 25 25 THR C C 25 178.324 178.324 176.156 2.168 19854 5184 1 6 . 1 1 25 25 THR CA C 25 64.534 64.534 67.572 -3.038 19854 5185 1 6 . 1 1 25 25 THR CB C 25 71.562 71.562 68.483 3.079 19854 5186 1 6 . 1 1 25 25 THR H H 25 8.415 8.415 8.150 0.265 19854 5187 1 6 . 1 1 26 26 PHE N N 26 114.295 114.295 123.159 -8.864 19854 5188 1 6 . 1 1 26 26 PHE C C 26 174.514 174.514 177.088 -2.574 19854 5189 1 6 . 1 1 26 26 PHE CA C 26 53.407 53.407 62.114 -8.707 19854 5190 1 6 . 1 1 26 26 PHE CB C 26 40.524 40.524 38.953 1.571 19854 5191 1 6 . 1 1 26 26 PHE H H 26 7.707 7.707 8.543 -0.836 19854 5192 1 6 . 1 1 27 27 VAL N N 27 123.525 123.525 121.149 2.376 19854 5193 1 6 . 1 1 27 27 VAL C C 27 178.031 178.031 177.871 0.160 19854 5194 1 6 . 1 1 27 27 VAL CA C 27 67.462 67.462 66.898 0.564 19854 5195 1 6 . 1 1 27 27 VAL CB C 27 29.397 29.397 31.631 -2.234 19854 5196 1 6 . 1 1 27 27 VAL H H 27 6.967 6.967 8.374 -1.407 19854 5197 1 6 . 1 1 28 28 LYS N N 28 114.228 114.228 119.698 -5.470 19854 5198 1 6 . 1 1 28 28 LYS C C 28 176.566 176.566 178.605 -2.039 19854 5199 1 6 . 1 1 28 28 LYS CA C 28 58.092 58.092 59.965 -1.873 19854 5200 1 6 . 1 1 28 28 LYS CB C 28 34.082 34.082 31.981 2.101 19854 5201 1 6 . 1 1 28 28 LYS H H 28 7.429 7.429 8.240 -0.811 19854 5202 1 6 . 1 1 29 29 ARG N N 29 112.037 112.037 119.967 -7.930 19854 5203 1 6 . 1 1 29 29 ARG C C 29 174.221 174.221 179.241 -5.020 19854 5204 1 6 . 1 1 29 29 ARG CA C 29 72.147 72.147 59.107 13.040 19854 5205 1 6 . 1 1 29 29 ARG CB C 29 37.596 37.596 29.890 7.706 19854 5206 1 6 . 1 1 29 29 ARG H H 29 6.803 6.803 8.159 -1.356 19854 5207 1 6 . 1 1 30 30 HIS N N 30 122.396 122.396 117.768 4.628 19854 5208 1 6 . 1 1 30 30 HIS C C 30 172.170 172.170 177.088 -4.918 19854 5209 1 6 . 1 1 30 30 HIS CA C 30 51.651 51.651 59.379 -7.728 19854 5210 1 6 . 1 1 30 30 HIS CB C 30 30.568 30.568 29.458 1.110 19854 5211 1 6 . 1 1 30 30 HIS H H 30 7.644 7.644 7.880 -0.236 19854 5212 1 6 . 1 1 31 31 LEU N N 31 110.377 110.377 117.938 -7.561 19854 5213 1 6 . 1 1 31 31 LEU C C 31 178.031 178.031 178.492 -0.461 19854 5214 1 6 . 1 1 31 31 LEU CA C 31 55.164 55.164 57.257 -2.093 19854 5215 1 6 . 1 1 31 31 LEU CB C 31 42.281 42.281 42.272 0.009 19854 5216 1 6 . 1 1 31 31 LEU H H 31 7.894 7.894 8.134 -0.240 19854 5217 1 6 . 1 1 32 32 THR N N 32 121.468 121.468 105.909 15.559 19854 5218 1 6 . 1 1 32 32 THR C C 32 170.705 170.705 175.502 -4.797 19854 5219 1 6 . 1 1 32 32 THR CA C 32 63.668 63.668 61.812 1.856 19854 5220 1 6 . 1 1 32 32 THR CB C 32 75.679 75.679 70.783 4.896 19854 5221 1 6 . 1 1 32 32 THR H H 32 8.372 8.372 8.223 0.149 19854 5222 1 6 . 1 1 33 33 GLY N N 33 127.841 127.841 110.084 17.757 19854 5223 1 6 . 1 1 33 33 GLY C C 33 161.914 161.914 173.984 -12.070 19854 5224 1 6 . 1 1 33 33 GLY CA C 33 42.866 42.866 44.788 -1.922 19854 5225 1 6 . 1 1 33 33 GLY H H 33 9.662 9.662 7.708 1.954 19854 5226 1 6 . 1 1 34 34 GLU N N 34 120.871 120.871 120.250 0.621 19854 5227 1 6 . 1 1 34 34 GLU C C 34 174.508 174.508 174.997 -0.489 19854 5228 1 6 . 1 1 34 34 GLU CA C 34 58.101 58.101 55.824 2.277 19854 5229 1 6 . 1 1 34 34 GLU CB C 34 34.371 34.371 30.677 3.694 19854 5230 1 6 . 1 1 34 34 GLU H H 34 8.211 8.211 7.417 0.794 19854 5231 1 6 . 1 1 35 35 PHE N N 35 111.838 111.838 119.377 -7.539 19854 5232 1 6 . 1 1 35 35 PHE C C 35 174.221 174.221 175.235 -1.014 19854 5233 1 6 . 1 1 35 35 PHE CA C 35 49.308 49.308 57.031 -7.723 19854 5234 1 6 . 1 1 35 35 PHE CB C 35 41.695 41.695 40.895 0.800 19854 5235 1 6 . 1 1 35 35 PHE H H 35 6.772 6.772 8.271 -1.499 19854 5236 1 6 . 1 1 36 36 GLU N N 36 120.672 120.672 125.311 -4.639 19854 5237 1 6 . 1 1 36 36 GLU C C 36 175.686 175.686 176.231 -0.545 19854 5238 1 6 . 1 1 36 36 GLU CA C 36 58.980 58.980 54.831 4.149 19854 5239 1 6 . 1 1 36 36 GLU CB C 36 48.140 48.140 30.512 17.628 19854 5240 1 6 . 1 1 36 36 GLU H H 36 8.293 8.293 8.783 -0.490 19854 5241 1 6 . 1 1 37 37 LYS N N 37 118.810 118.810 126.265 -7.455 19854 5242 1 6 . 1 1 37 37 LYS C C 37 172.756 172.756 177.035 -4.279 19854 5243 1 6 . 1 1 37 37 LYS CA C 37 48.137 48.137 58.165 -10.028 19854 5244 1 6 . 1 1 37 37 LYS CB C 37 37.010 37.010 32.894 4.116 19854 5245 1 6 . 1 1 37 37 LYS H H 37 8.509 8.509 8.601 -0.092 19854 5246 1 6 . 1 1 38 38 LYS N N 38 108.052 108.052 119.904 -11.852 19854 5247 1 6 . 1 1 38 38 LYS C C 38 176.273 176.273 175.750 0.523 19854 5248 1 6 . 1 1 38 38 LYS CA C 38 59.849 59.849 56.186 3.663 19854 5249 1 6 . 1 1 38 38 LYS CB C 38 34.668 34.668 33.005 1.663 19854 5250 1 6 . 1 1 38 38 LYS H H 38 7.715 7.715 8.000 -0.285 19854 5251 1 6 . 1 1 39 39 TYR N N 39 108.650 108.650 124.655 -16.005 19854 5252 1 6 . 1 1 39 39 TYR C C 39 175.686 175.686 175.031 0.655 19854 5253 1 6 . 1 1 39 39 TYR CA C 39 61.020 61.020 57.836 3.184 19854 5254 1 6 . 1 1 39 39 TYR CB C 39 36.424 36.424 39.147 -2.723 19854 5255 1 6 . 1 1 39 39 TYR H H 39 7.362 7.362 8.452 -1.090 19854 5256 1 6 . 1 1 40 40 VAL N N 40 117.947 117.947 127.743 -9.796 19854 5257 1 6 . 1 1 40 40 VAL C C 40 175.393 175.393 174.550 0.843 19854 5258 1 6 . 1 1 40 40 VAL CA C 40 61.020 61.020 60.326 0.694 19854 5259 1 6 . 1 1 40 40 VAL CB C 40 31.154 31.154 34.448 -3.294 19854 5260 1 6 . 1 1 40 40 VAL H H 40 8.442 8.442 7.845 0.597 19854 5261 1 6 . 1 1 42 42 THR N N 42 117.150 117.150 119.288 -2.138 19854 5262 1 6 . 1 1 42 42 THR C C 42 178.910 178.910 173.691 5.219 19854 5263 1 6 . 1 1 42 42 THR CA C 42 60.435 60.435 62.480 -2.045 19854 5264 1 6 . 1 1 42 42 THR CB C 42 70.390 70.390 69.607 0.783 19854 5265 1 6 . 1 1 42 42 THR H H 42 8.192 8.192 8.452 -0.260 19854 5266 1 6 . 1 1 43 43 LEU N N 43 119.209 119.209 127.859 -8.650 19854 5267 1 6 . 1 1 43 43 LEU C C 43 174.807 174.807 177.321 -2.514 19854 5268 1 6 . 1 1 43 43 LEU CA C 43 57.507 57.507 54.550 2.957 19854 5269 1 6 . 1 1 43 43 LEU CB C 43 42.866 42.866 42.950 -0.083 19854 5270 1 6 . 1 1 43 43 LEU H H 43 9.260 9.260 8.495 0.765 19854 5271 1 6 . 1 1 44 44 GLY N N 44 114.361 114.361 112.800 1.561 19854 5272 1 6 . 1 1 44 44 GLY C C 44 178.910 178.910 172.725 6.185 19854 5273 1 6 . 1 1 44 44 GLY CA C 44 54.579 54.579 45.836 8.743 19854 5274 1 6 . 1 1 44 44 GLY H H 44 6.979 6.979 8.615 -1.636 19854 5275 1 6 . 1 1 45 45 VAL N N 45 110.244 110.244 122.635 -12.391 19854 5276 1 6 . 1 1 45 45 VAL C C 45 174.807 174.807 175.145 -0.338 19854 5277 1 6 . 1 1 45 45 VAL CA C 45 63.363 63.363 60.731 2.632 19854 5278 1 6 . 1 1 45 45 VAL CB C 45 17.099 17.099 34.642 -17.543 19854 5279 1 6 . 1 1 45 45 VAL H H 45 8.309 8.309 7.978 0.331 19854 5280 1 6 . 1 1 46 46 GLU N N 46 130.365 130.365 127.476 2.889 19854 5281 1 6 . 1 1 46 46 GLU C C 46 176.859 176.859 174.501 2.358 19854 5282 1 6 . 1 1 46 46 GLU CA C 46 55.164 55.164 53.788 1.376 19854 5283 1 6 . 1 1 46 46 GLU CB C 46 32.325 32.325 31.892 0.433 19854 5284 1 6 . 1 1 46 46 GLU H H 46 9.741 9.741 8.903 0.838 19854 5285 1 6 . 1 1 47 47 VAL N N 47 125.254 125.254 125.261 -0.007 19854 5286 1 6 . 1 1 47 47 VAL C C 47 175.661 175.661 175.819 -0.158 19854 5287 1 6 . 1 1 47 47 VAL CA C 47 63.375 63.375 61.311 2.064 19854 5288 1 6 . 1 1 47 47 VAL CB C 47 37.300 37.300 32.507 4.793 19854 5289 1 6 . 1 1 47 47 VAL H H 47 8.250 8.250 8.251 -0.001 19854 5290 1 6 . 1 1 48 48 HIS N N 48 129.236 129.236 127.515 1.721 19854 5291 1 6 . 1 1 48 48 HIS C C 48 169.240 169.240 173.257 -4.017 19854 5292 1 6 . 1 1 48 48 HIS CA C 48 49.894 49.894 53.573 -3.679 19854 5293 1 6 . 1 1 48 48 HIS CB C 48 27.640 27.640 32.083 -4.443 19854 5294 1 6 . 1 1 48 48 HIS H H 48 10.390 10.390 9.264 1.126 19854 5295 1 6 . 1 1 49 49 PRO C C 49 176.273 176.273 175.915 0.358 19854 5296 1 6 . 1 1 49 49 PRO CA C 49 62.500 62.500 62.683 -0.183 19854 5297 1 6 . 1 1 49 49 PRO CB C 49 29.974 29.974 32.589 -2.615 19854 5298 1 6 . 1 1 50 50 LEU N N 50 119.408 119.408 126.975 -7.567 19854 5299 1 6 . 1 1 50 50 LEU C C 50 177.445 177.445 175.568 1.877 19854 5300 1 6 . 1 1 50 50 LEU CA C 50 59.264 59.264 54.228 5.036 19854 5301 1 6 . 1 1 50 50 LEU CB C 50 42.281 42.281 45.369 -3.088 19854 5302 1 6 . 1 1 50 50 LEU H H 50 7.492 7.492 9.045 -1.553 19854 5303 1 6 . 1 1 51 51 VAL N N 51 117.947 117.947 122.931 -4.984 19854 5304 1 6 . 1 1 51 51 VAL C C 51 174.514 174.514 175.236 -0.722 19854 5305 1 6 . 1 1 51 51 VAL CA C 51 64.534 64.534 61.529 3.005 19854 5306 1 6 . 1 1 51 51 VAL CB C 51 37.010 37.010 33.127 3.883 19854 5307 1 6 . 1 1 51 51 VAL H H 51 7.715 7.715 8.277 -0.562 19854 5308 1 6 . 1 1 52 52 PHE N N 52 124.853 124.853 126.811 -1.958 19854 5309 1 6 . 1 1 52 52 PHE C C 52 175.100 175.100 174.398 0.702 19854 5310 1 6 . 1 1 52 52 PHE CA C 52 56.336 56.336 56.697 -0.361 19854 5311 1 6 . 1 1 52 52 PHE CB C 52 39.938 39.938 42.392 -2.454 19854 5312 1 6 . 1 1 52 52 PHE H H 52 8.935 8.935 9.302 -0.367 19854 5313 1 6 . 1 1 53 53 HIS N N 53 120.603 120.603 123.169 -2.566 19854 5314 1 6 . 1 1 53 53 HIS C C 53 170.119 170.119 175.087 -4.968 19854 5315 1 6 . 1 1 53 53 HIS CA C 53 55.164 55.164 55.555 -0.391 19854 5316 1 6 . 1 1 53 53 HIS CB C 53 30.568 30.568 30.919 -0.351 19854 5317 1 6 . 1 1 53 53 HIS H H 53 8.356 8.356 9.292 -0.936 19854 5318 1 6 . 1 1 54 54 THR N N 54 112.634 112.634 116.384 -3.750 19854 5319 1 6 . 1 1 54 54 THR C C 54 178.910 178.910 176.323 2.587 19854 5320 1 6 . 1 1 54 54 THR CA C 54 63.363 63.363 59.424 3.939 19854 5321 1 6 . 1 1 54 54 THR CB C 54 72.733 72.733 71.600 1.133 19854 5322 1 6 . 1 1 54 54 THR H H 54 7.574 7.574 8.458 -0.884 19854 5323 1 6 . 1 1 55 55 ASN N N 55 131.095 131.095 120.385 10.710 19854 5324 1 6 . 1 1 55 55 ASN C C 55 176.273 176.273 176.542 -0.269 19854 5325 1 6 . 1 1 55 55 ASN CA C 55 51.065 51.065 55.888 -4.823 19854 5326 1 6 . 1 1 55 55 ASN CB C 55 37.010 37.010 38.365 -1.355 19854 5327 1 6 . 1 1 55 55 ASN H H 55 10.187 10.187 8.624 1.563 19854 5328 1 6 . 1 1 56 56 ARG N N 56 122.064 122.064 118.938 3.126 19854 5329 1 6 . 1 1 56 56 ARG C C 56 175.100 175.100 176.058 -0.958 19854 5330 1 6 . 1 1 56 56 ARG CA C 56 61.606 61.606 55.858 5.748 19854 5331 1 6 . 1 1 56 56 ARG CB C 56 32.911 32.911 30.426 2.485 19854 5332 1 6 . 1 1 56 56 ARG H H 56 7.433 7.433 7.934 -0.501 19854 5333 1 6 . 1 1 57 57 GLY N N 57 127.709 127.709 107.892 19.817 19854 5334 1 6 . 1 1 57 57 GLY C C 57 175.979 175.979 172.186 3.793 19854 5335 1 6 . 1 1 57 57 GLY CA C 57 42.281 42.281 44.230 -1.949 19854 5336 1 6 . 1 1 57 57 GLY H H 57 9.373 9.373 7.726 1.647 19854 5337 1 6 . 1 1 58 58 PRO C C 58 177.152 177.152 175.782 1.370 19854 5338 1 6 . 1 1 58 58 PRO CA C 58 65.137 65.137 63.015 2.122 19854 5339 1 6 . 1 1 58 58 PRO CB C 58 29.095 29.095 32.292 -3.197 19854 5340 1 6 . 1 1 59 59 ILE N N 59 128.638 128.638 121.370 7.268 19854 5341 1 6 . 1 1 59 59 ILE C C 59 175.979 175.979 174.091 1.888 19854 5342 1 6 . 1 1 59 59 ILE CA C 59 65.120 65.120 60.225 4.895 19854 5343 1 6 . 1 1 59 59 ILE CB C 59 40.524 40.524 42.458 -1.934 19854 5344 1 6 . 1 1 59 59 ILE H H 59 8.794 8.794 8.949 -0.155 19854 5345 1 6 . 1 1 60 60 LYS N N 60 127.711 127.711 125.461 2.250 19854 5346 1 6 . 1 1 60 60 LYS C C 60 178.902 178.902 174.781 4.121 19854 5347 1 6 . 1 1 60 60 LYS CA C 60 74.293 74.293 54.319 19.974 19854 5348 1 6 . 1 1 60 60 LYS CB C 60 32.027 32.027 35.885 -3.858 19854 5349 1 6 . 1 1 60 60 LYS H H 60 8.024 8.024 8.607 -0.583 19854 5350 1 6 . 1 1 61 61 PHE N N 61 120.670 120.670 125.648 -4.978 19854 5351 1 6 . 1 1 61 61 PHE C C 61 175.393 175.393 175.257 0.136 19854 5352 1 6 . 1 1 61 61 PHE CA C 61 57.507 57.507 56.489 1.018 19854 5353 1 6 . 1 1 61 61 PHE CB C 61 41.109 41.109 41.016 0.093 19854 5354 1 6 . 1 1 61 61 PHE H H 61 7.515 7.515 9.583 -2.068 19854 5355 1 6 . 1 1 62 62 ASN N N 62 124.789 124.789 124.228 0.561 19854 5356 1 6 . 1 1 62 62 ASN C C 62 173.336 173.336 174.623 -1.287 19854 5357 1 6 . 1 1 62 62 ASN CA C 62 53.121 53.121 52.690 0.431 19854 5358 1 6 . 1 1 62 62 ASN CB C 62 41.695 41.695 38.974 2.721 19854 5359 1 6 . 1 1 62 62 ASN H H 62 8.325 8.325 9.202 -0.877 19854 5360 1 6 . 1 1 63 63 VAL N N 63 106.127 106.127 125.345 -19.218 19854 5361 1 6 . 1 1 63 63 VAL C C 63 175.100 175.100 175.469 -0.369 19854 5362 1 6 . 1 1 63 63 VAL CA C 63 61.020 61.020 62.695 -1.675 19854 5363 1 6 . 1 1 63 63 VAL CB C 63 31.154 31.154 32.905 -1.751 19854 5364 1 6 . 1 1 63 63 VAL H H 63 8.113 8.113 9.029 -0.916 19854 5365 1 6 . 1 1 64 64 TRP N N 64 129.302 129.302 129.639 -0.337 19854 5366 1 6 . 1 1 64 64 TRP C C 64 177.152 177.152 175.397 1.755 19854 5367 1 6 . 1 1 64 64 TRP CA C 64 59.264 59.264 54.517 4.747 19854 5368 1 6 . 1 1 64 64 TRP CB C 64 29.397 29.397 29.646 -0.249 19854 5369 1 6 . 1 1 64 64 TRP H H 64 8.970 8.970 9.533 -0.563 19854 5370 1 6 . 1 1 65 65 ASP N N 65 119.607 119.607 126.196 -6.589 19854 5371 1 6 . 1 1 65 65 ASP C C 65 174.514 174.514 175.775 -1.261 19854 5372 1 6 . 1 1 65 65 ASP CA C 65 55.164 55.164 53.184 1.980 19854 5373 1 6 . 1 1 65 65 ASP CB C 65 41.109 41.109 43.020 -1.911 19854 5374 1 6 . 1 1 65 65 ASP H H 65 8.638 8.638 9.183 -0.545 19854 5375 1 6 . 1 1 66 66 THR N N 66 122.463 122.463 118.106 4.357 19854 5376 1 6 . 1 1 66 66 THR C C 66 178.617 178.617 174.383 4.234 19854 5377 1 6 . 1 1 66 66 THR CA C 66 68.048 68.048 59.808 8.240 19854 5378 1 6 . 1 1 66 66 THR CB C 66 71.562 71.562 71.080 0.482 19854 5379 1 6 . 1 1 66 66 THR H H 66 8.293 8.293 8.360 -0.067 19854 5380 1 6 . 1 1 67 67 ALA N N 67 104.865 104.865 122.675 -17.810 19854 5381 1 6 . 1 1 67 67 ALA C C 67 177.738 177.738 178.002 -0.264 19854 5382 1 6 . 1 1 67 67 ALA CA C 67 48.722 48.722 51.370 -2.648 19854 5383 1 6 . 1 1 67 67 ALA CB C 67 14.171 14.171 19.952 -5.781 19854 5384 1 6 . 1 1 67 67 ALA H H 67 8.657 8.657 7.956 0.701 19854 5385 1 6 . 1 1 68 68 GLY N N 68 115.357 115.357 110.092 5.265 19854 5386 1 6 . 1 1 68 68 GLY C C 68 189.533 189.533 176.003 13.530 19854 5387 1 6 . 1 1 68 68 GLY CA C 68 45.209 45.209 46.194 -0.985 19854 5388 1 6 . 1 1 68 68 GLY H H 68 10.969 10.969 9.025 1.944 19854 5389 1 6 . 1 1 69 69 GLN N N 69 122.730 122.730 119.899 2.831 19854 5390 1 6 . 1 1 69 69 GLN C C 69 174.508 174.508 176.314 -1.806 19854 5391 1 6 . 1 1 69 69 GLN CA C 69 58.394 58.394 57.580 0.814 19854 5392 1 6 . 1 1 69 69 GLN CB C 69 31.441 31.441 28.785 2.656 19854 5393 1 6 . 1 1 69 69 GLN H H 69 8.336 8.336 8.547 -0.211 19854 5394 1 6 . 1 1 70 70 GLU N N 70 114.826 114.826 120.172 -5.346 19854 5395 1 6 . 1 1 70 70 GLU C C 70 176.273 176.273 175.671 0.602 19854 5396 1 6 . 1 1 70 70 GLU CA C 70 57.507 57.507 56.506 1.001 19854 5397 1 6 . 1 1 70 70 GLU CB C 70 28.811 28.811 30.339 -1.528 19854 5398 1 6 . 1 1 70 70 GLU H H 70 9.651 9.651 8.293 1.358 19854 5399 1 6 . 1 1 71 71 LYS N N 71 116.685 116.685 122.693 -6.008 19854 5400 1 6 . 1 1 71 71 LYS C C 71 175.979 175.979 176.106 -0.127 19854 5401 1 6 . 1 1 71 71 LYS CA C 71 48.722 48.722 56.136 -7.414 19854 5402 1 6 . 1 1 71 71 LYS CB C 71 37.010 37.010 32.935 4.075 19854 5403 1 6 . 1 1 71 71 LYS H H 71 8.712 8.712 8.297 0.415 19854 5404 1 6 . 1 1 72 72 PHE N N 72 114.959 114.959 120.243 -5.284 19854 5405 1 6 . 1 1 72 72 PHE C C 72 175.686 175.686 176.548 -0.862 19854 5406 1 6 . 1 1 72 72 PHE CA C 72 56.336 56.336 58.575 -2.239 19854 5407 1 6 . 1 1 72 72 PHE CB C 72 36.424 36.424 39.028 -2.604 19854 5408 1 6 . 1 1 72 72 PHE H H 72 7.965 7.965 8.130 -0.165 19854 5409 1 6 . 1 1 73 73 GLY N N 73 117.084 117.084 111.016 6.068 19854 5410 1 6 . 1 1 73 73 GLY C C 73 168.068 168.068 174.655 -6.587 19854 5411 1 6 . 1 1 73 73 GLY CA C 73 42.281 42.281 44.776 -2.495 19854 5412 1 6 . 1 1 73 73 GLY H H 73 7.609 7.609 7.861 -0.252 19854 5413 1 6 . 1 1 74 74 GLY N N 74 120.537 120.537 108.301 12.236 19854 5414 1 6 . 1 1 74 74 GLY C C 74 174.514 174.514 176.545 -2.031 19854 5415 1 6 . 1 1 74 74 GLY CA C 74 44.037 44.037 46.446 -2.409 19854 5416 1 6 . 1 1 74 74 GLY H H 74 9.326 9.326 8.731 0.595 19854 5417 1 6 . 1 1 75 75 LEU N N 75 127.177 127.177 121.912 5.265 19854 5418 1 6 . 1 1 75 75 LEU C C 75 178.617 178.617 177.698 0.919 19854 5419 1 6 . 1 1 75 75 LEU CA C 75 53.407 53.407 56.911 -3.504 19854 5420 1 6 . 1 1 75 75 LEU CB C 75 42.281 42.281 41.922 0.359 19854 5421 1 6 . 1 1 75 75 LEU H H 75 7.628 7.628 7.745 -0.117 19854 5422 1 6 . 1 1 76 76 ARG N N 76 116.486 116.486 116.129 0.357 19854 5423 1 6 . 1 1 76 76 ARG C C 76 176.859 176.859 176.988 -0.129 19854 5424 1 6 . 1 1 76 76 ARG CA C 76 59.264 59.264 55.976 3.288 19854 5425 1 6 . 1 1 76 76 ARG CB C 76 31.154 31.154 29.506 1.648 19854 5426 1 6 . 1 1 76 76 ARG H H 76 7.143 7.143 7.535 -0.392 19854 5427 1 6 . 1 1 77 77 ASP N N 77 129.236 129.236 120.277 8.959 19854 5428 1 6 . 1 1 77 77 ASP C C 77 177.152 177.152 177.978 -0.826 19854 5429 1 6 . 1 1 77 77 ASP CA C 77 52.822 52.822 57.562 -4.740 19854 5430 1 6 . 1 1 77 77 ASP CB C 77 41.695 41.695 40.295 1.400 19854 5431 1 6 . 1 1 77 77 ASP H H 77 8.947 8.947 7.540 1.407 19854 5432 1 6 . 1 1 78 78 GLY N N 78 127.244 127.244 107.264 19.980 19854 5433 1 6 . 1 1 78 78 GLY C C 78 173.928 173.928 176.504 -2.576 19854 5434 1 6 . 1 1 78 78 GLY CA C 78 44.623 44.623 47.113 -2.490 19854 5435 1 6 . 1 1 78 78 GLY H H 78 8.219 8.219 8.450 -0.231 19854 5436 1 6 . 1 1 79 79 TYR N N 79 120.537 120.537 119.246 1.291 19854 5437 1 6 . 1 1 79 79 TYR C C 79 176.273 176.273 177.661 -1.388 19854 5438 1 6 . 1 1 79 79 TYR CA C 79 58.678 58.678 58.877 -0.199 19854 5439 1 6 . 1 1 79 79 TYR CB C 79 40.524 40.524 38.042 2.482 19854 5440 1 6 . 1 1 79 79 TYR H H 79 8.563 8.563 7.477 1.086 19854 5441 1 6 . 1 1 80 80 TYR N N 80 122.132 122.132 118.310 3.822 19854 5442 1 6 . 1 1 80 80 TYR C C 80 175.979 175.979 175.664 0.315 19854 5443 1 6 . 1 1 80 80 TYR CA C 80 62.203 62.203 59.040 3.163 19854 5444 1 6 . 1 1 80 80 TYR CB C 80 41.988 41.988 39.385 2.603 19854 5445 1 6 . 1 1 80 80 TYR H H 80 8.254 8.254 7.659 0.595 19854 5446 1 6 . 1 1 81 81 ILE N N 81 120.072 120.072 120.881 -0.809 19854 5447 1 6 . 1 1 81 81 ILE C C 81 177.445 177.445 175.947 1.498 19854 5448 1 6 . 1 1 81 81 ILE CA C 81 67.462 67.462 63.494 3.968 19854 5449 1 6 . 1 1 81 81 ILE CB C 81 41.109 41.109 37.959 3.150 19854 5450 1 6 . 1 1 81 81 ILE H H 81 8.837 8.837 7.940 0.897 19854 5451 1 6 . 1 1 82 82 GLN N N 82 121.601 121.601 121.004 0.597 19854 5452 1 6 . 1 1 82 82 GLN C C 82 173.342 173.342 174.334 -0.992 19854 5453 1 6 . 1 1 82 82 GLN CA C 82 59.859 59.859 56.746 3.113 19854 5454 1 6 . 1 1 82 82 GLN CB C 82 30.855 30.855 26.281 4.574 19854 5455 1 6 . 1 1 82 82 GLN H H 82 8.184 8.184 9.017 -0.833 19854 5456 1 6 . 1 1 83 83 ALA N N 83 109.713 109.713 119.991 -10.278 19854 5457 1 6 . 1 1 83 83 ALA C C 83 175.979 175.979 177.177 -1.198 19854 5458 1 6 . 1 1 83 83 ALA CA C 83 54.579 54.579 52.369 2.210 19854 5459 1 6 . 1 1 83 83 ALA CB C 83 16.513 16.513 19.080 -2.567 19854 5460 1 6 . 1 1 83 83 ALA H H 83 6.306 6.306 7.349 -1.043 19854 5461 1 6 . 1 1 84 84 GLN N N 84 121.203 121.203 121.053 0.150 19854 5462 1 6 . 1 1 84 84 GLN C C 84 177.144 177.144 176.087 1.057 19854 5463 1 6 . 1 1 84 84 GLN CA C 84 60.152 60.152 56.725 3.427 19854 5464 1 6 . 1 1 84 84 GLN CB C 84 34.957 34.957 30.288 4.669 19854 5465 1 6 . 1 1 84 84 GLN H H 84 8.180 8.180 8.610 -0.430 19854 5466 1 6 . 1 1 85 85 CYS N N 85 120.605 120.605 114.604 6.001 19854 5467 1 6 . 1 1 85 85 CYS C C 85 176.566 176.566 172.652 3.914 19854 5468 1 6 . 1 1 85 85 CYS CA C 85 65.430 65.430 57.375 8.055 19854 5469 1 6 . 1 1 85 85 CYS CB C 85 39.644 39.644 31.895 7.750 19854 5470 1 6 . 1 1 85 85 CYS H H 85 8.364 8.364 7.766 0.598 19854 5471 1 6 . 1 1 86 86 ALA N N 86 114.295 114.295 122.462 -8.167 19854 5472 1 6 . 1 1 86 86 ALA CA C 86 57.507 57.507 50.385 7.122 19854 5473 1 6 . 1 1 86 86 ALA CB C 86 21.784 21.784 22.950 -1.166 19854 5474 1 6 . 1 1 86 86 ALA H H 86 6.897 6.897 8.897 -2.000 19854 5475 1 6 . 1 1 87 87 ILE N N 87 120.670 120.670 120.827 -0.157 19854 5476 1 6 . 1 1 87 87 ILE C C 87 173.928 173.928 174.632 -0.704 19854 5477 1 6 . 1 1 87 87 ILE CA C 87 61.020 61.020 60.062 0.958 19854 5478 1 6 . 1 1 87 87 ILE CB C 87 39.938 39.938 41.022 -1.084 19854 5479 1 6 . 1 1 87 87 ILE H H 87 8.282 8.282 8.693 -0.411 19854 5480 1 6 . 1 1 88 88 ILE N N 88 120.205 120.205 127.545 -7.340 19854 5481 1 6 . 1 1 88 88 ILE C C 88 173.635 173.635 174.857 -1.222 19854 5482 1 6 . 1 1 88 88 ILE CA C 88 64.534 64.534 60.203 4.331 19854 5483 1 6 . 1 1 88 88 ILE CB C 88 37.596 37.596 39.863 -2.267 19854 5484 1 6 . 1 1 88 88 ILE H H 88 5.528 5.528 8.991 -3.463 19854 5485 1 6 . 1 1 89 89 MET N N 89 120.472 120.472 125.956 -5.484 19854 5486 1 6 . 1 1 89 89 MET C C 89 178.617 178.617 175.868 2.749 19854 5487 1 6 . 1 1 89 89 MET CA C 89 58.980 58.980 54.281 4.699 19854 5488 1 6 . 1 1 89 89 MET CB C 89 34.957 34.957 34.928 0.028 19854 5489 1 6 . 1 1 89 89 MET H H 89 8.176 8.176 8.591 -0.415 19854 5490 1 6 . 1 1 90 90 PHE N N 90 121.134 121.134 119.082 2.052 19854 5491 1 6 . 1 1 90 90 PHE C C 90 175.393 175.393 173.300 2.093 19854 5492 1 6 . 1 1 90 90 PHE CA C 90 60.435 60.435 55.732 4.703 19854 5493 1 6 . 1 1 90 90 PHE CB C 90 38.767 38.767 42.481 -3.714 19854 5494 1 6 . 1 1 90 90 PHE H H 90 9.334 9.334 8.847 0.487 19854 5495 1 6 . 1 1 91 91 ASP N N 91 120.273 120.273 121.324 -1.051 19854 5496 1 6 . 1 1 91 91 ASP C C 91 177.730 177.730 177.977 -0.247 19854 5497 1 6 . 1 1 91 91 ASP CA C 91 59.859 59.859 52.255 7.604 19854 5498 1 6 . 1 1 91 91 ASP CB C 91 44.039 44.039 42.625 1.414 19854 5499 1 6 . 1 1 91 91 ASP H H 91 7.597 7.597 8.839 -1.242 19854 5500 1 6 . 1 1 92 92 VAL N N 92 115.158 115.158 123.627 -8.469 19854 5501 1 6 . 1 1 92 92 VAL C C 92 173.342 173.342 176.610 -3.268 19854 5502 1 6 . 1 1 92 92 VAL CA C 92 64.534 64.534 65.024 -0.490 19854 5503 1 6 . 1 1 92 92 VAL CB C 92 37.596 37.596 31.352 6.244 19854 5504 1 6 . 1 1 92 92 VAL H H 92 7.738 7.738 8.494 -0.756 19854 5505 1 6 . 1 1 93 93 THR N N 93 127.179 127.179 110.205 16.974 19854 5506 1 6 . 1 1 93 93 THR C C 93 178.902 178.902 174.081 4.821 19854 5507 1 6 . 1 1 93 93 THR CA C 93 64.254 64.254 62.942 1.312 19854 5508 1 6 . 1 1 93 93 THR CB C 93 74.215 74.215 68.968 5.247 19854 5509 1 6 . 1 1 93 93 THR H H 93 7.636 7.636 8.298 -0.662 19854 5510 1 6 . 1 1 94 94 SER N N 94 122.263 122.263 115.657 6.606 19854 5511 1 6 . 1 1 94 94 SER C C 94 163.965 163.965 175.226 -11.261 19854 5512 1 6 . 1 1 94 94 SER CA C 94 59.849 59.849 55.252 4.597 19854 5513 1 6 . 1 1 94 94 SER CB C 94 62.192 62.192 64.387 -2.195 19854 5514 1 6 . 1 1 94 94 SER H H 94 7.628 7.628 7.828 -0.200 19854 5515 1 6 . 1 1 95 95 ARG N N 95 113.099 113.099 128.161 -15.062 19854 5516 1 6 . 1 1 95 95 ARG C C 95 176.273 176.273 177.976 -1.703 19854 5517 1 6 . 1 1 95 95 ARG CA C 95 53.407 53.407 59.571 -6.164 19854 5518 1 6 . 1 1 95 95 ARG CB C 95 31.154 31.154 30.104 1.050 19854 5519 1 6 . 1 1 95 95 ARG H H 95 8.102 8.102 9.033 -0.931 19854 5520 1 6 . 1 1 96 96 VAL N N 96 124.787 124.787 119.422 5.365 19854 5521 1 6 . 1 1 96 96 VAL C C 96 178.031 178.031 177.775 0.256 19854 5522 1 6 . 1 1 96 96 VAL CA C 96 68.634 68.634 66.464 2.170 19854 5523 1 6 . 1 1 96 96 VAL CB C 96 24.126 24.126 31.354 -7.228 19854 5524 1 6 . 1 1 96 96 VAL H H 96 9.146 9.146 8.051 1.095 19854 5525 1 6 . 1 1 97 97 THR N N 97 111.970 111.970 116.367 -4.397 19854 5526 1 6 . 1 1 97 97 THR C C 97 178.031 178.031 176.288 1.743 19854 5527 1 6 . 1 1 97 97 THR CA C 97 63.949 63.949 66.421 -2.472 19854 5528 1 6 . 1 1 97 97 THR CB C 97 70.390 70.390 68.982 1.408 19854 5529 1 6 . 1 1 97 97 THR H H 97 7.984 7.984 7.669 0.315 19854 5530 1 6 . 1 1 98 98 TYR N N 98 113.232 113.232 121.481 -8.249 19854 5531 1 6 . 1 1 98 98 TYR C C 98 176.273 176.273 177.681 -1.408 19854 5532 1 6 . 1 1 98 98 TYR H H 98 7.605 7.605 7.836 -0.231 19854 5533 1 6 . 1 1 99 99 LYS N N 99 123.726 123.726 118.693 5.033 19854 5534 1 6 . 1 1 99 99 LYS C C 99 178.316 178.316 178.542 -0.226 19854 5535 1 6 . 1 1 99 99 LYS CA C 99 58.691 58.691 59.430 -0.739 19854 5536 1 6 . 1 1 99 99 LYS CB C 99 36.127 36.127 32.041 4.087 19854 5537 1 6 . 1 1 99 99 LYS H H 99 8.360 8.360 8.102 0.258 19854 5538 1 6 . 1 1 100 100 ASN N N 100 111.970 111.970 116.310 -4.340 19854 5539 1 6 . 1 1 100 100 ASN C C 100 175.979 175.979 176.774 -0.795 19854 5540 1 6 . 1 1 100 100 ASN CA C 100 53.407 53.407 55.185 -1.778 19854 5541 1 6 . 1 1 100 100 ASN CB C 100 37.596 37.596 38.695 -1.099 19854 5542 1 6 . 1 1 100 100 ASN H H 100 5.778 5.778 7.725 -1.947 19854 5543 1 6 . 1 1 101 101 VAL N N 101 118.877 118.877 121.589 -2.712 19854 5544 1 6 . 1 1 101 101 VAL C C 101 173.635 173.635 174.968 -1.333 19854 5545 1 6 . 1 1 101 101 VAL CA C 101 62.777 62.777 68.422 -5.645 19854 5546 1 6 . 1 1 101 101 VAL CB C 101 27.054 27.054 29.235 -2.182 19854 5547 1 6 . 1 1 101 101 VAL H H 101 7.370 7.370 7.512 -0.142 19854 5548 1 6 . 1 1 102 102 PRO C C 102 176.566 176.566 176.859 -0.293 19854 5549 1 6 . 1 1 102 102 PRO CA C 102 62.500 62.500 65.198 -2.698 19854 5550 1 6 . 1 1 102 102 PRO CB C 102 30.853 30.853 31.172 -0.319 19854 5551 1 6 . 1 1 103 103 ASN N N 103 122.728 122.728 114.891 7.837 19854 5552 1 6 . 1 1 103 103 ASN C C 103 175.100 175.100 177.001 -1.901 19854 5553 1 6 . 1 1 103 103 ASN CA C 103 54.579 54.579 54.470 0.109 19854 5554 1 6 . 1 1 103 103 ASN CB C 103 38.767 38.767 37.217 1.550 19854 5555 1 6 . 1 1 103 103 ASN H H 103 7.879 7.879 7.302 0.577 19854 5556 1 6 . 1 1 104 104 TRP N N 104 122.730 122.730 120.192 2.538 19854 5557 1 6 . 1 1 104 104 TRP C C 104 174.215 174.215 177.709 -3.494 19854 5558 1 6 . 1 1 104 104 TRP CA C 104 59.273 59.273 60.395 -1.122 19854 5559 1 6 . 1 1 104 104 TRP CB C 104 35.250 35.250 30.006 5.245 19854 5560 1 6 . 1 1 104 104 TRP H H 104 7.902 7.902 7.738 0.164 19854 5561 1 6 . 1 1 105 105 HIS N N 105 120.869 120.869 116.845 4.024 19854 5562 1 6 . 1 1 105 105 HIS C C 105 177.738 177.738 174.475 3.263 19854 5563 1 6 . 1 1 105 105 HIS H H 105 6.971 6.971 8.426 -1.455 19854 5564 1 6 . 1 1 106 106 ARG N N 106 126.314 126.314 122.284 4.030 19854 5565 1 6 . 1 1 106 106 ARG C C 106 176.566 176.566 176.484 0.082 19854 5566 1 6 . 1 1 106 106 ARG CA C 106 62.777 62.777 57.550 5.227 19854 5567 1 6 . 1 1 106 106 ARG CB C 106 29.397 29.397 31.408 -2.011 19854 5568 1 6 . 1 1 106 106 ARG H H 106 7.507 7.507 7.773 -0.266 19854 5569 1 6 . 1 1 107 107 ASP N N 107 119.076 119.076 121.759 -2.683 19854 5570 1 6 . 1 1 107 107 ASP C C 107 176.566 176.566 178.477 -1.911 19854 5571 1 6 . 1 1 107 107 ASP CA C 107 55.164 55.164 57.718 -2.554 19854 5572 1 6 . 1 1 107 107 ASP CB C 107 41.695 41.695 40.956 0.739 19854 5573 1 6 . 1 1 107 107 ASP H H 107 9.076 9.076 7.887 1.189 19854 5574 1 6 . 1 1 108 108 LEU N N 108 113.299 113.299 119.942 -6.643 19854 5575 1 6 . 1 1 108 108 LEU C C 108 176.273 176.273 178.376 -2.103 19854 5576 1 6 . 1 1 108 108 LEU CA C 108 59.264 59.264 58.243 1.021 19854 5577 1 6 . 1 1 108 108 LEU CB C 108 48.722 48.722 41.362 7.360 19854 5578 1 6 . 1 1 108 108 LEU H H 108 6.725 6.725 7.865 -1.140 19854 5579 1 6 . 1 1 109 109 VAL N N 109 121.267 121.267 118.799 2.468 19854 5580 1 6 . 1 1 109 109 VAL C C 109 175.393 175.393 178.622 -3.229 19854 5581 1 6 . 1 1 109 109 VAL CA C 109 63.949 63.949 66.328 -2.379 19854 5582 1 6 . 1 1 109 109 VAL CB C 109 32.911 32.911 31.171 1.740 19854 5583 1 6 . 1 1 109 109 VAL H H 109 8.763 8.763 7.783 0.980 19854 5584 1 6 . 1 1 110 110 ARG N N 110 112.900 112.900 119.828 -6.928 19854 5585 1 6 . 1 1 110 110 ARG C C 110 176.273 176.273 178.425 -2.152 19854 5586 1 6 . 1 1 110 110 ARG CA C 110 57.507 57.507 59.530 -2.023 19854 5587 1 6 . 1 1 110 110 ARG CB C 110 30.568 30.568 30.080 0.488 19854 5588 1 6 . 1 1 110 110 ARG H H 110 7.241 7.241 7.896 -0.655 19854 5589 1 6 . 1 1 111 111 VAL N N 111 115.556 115.556 117.877 -2.321 19854 5590 1 6 . 1 1 111 111 VAL C C 111 177.445 177.445 177.042 0.403 19854 5591 1 6 . 1 1 111 111 VAL CA C 111 59.849 59.849 65.868 -6.019 19854 5592 1 6 . 1 1 111 111 VAL CB C 111 32.911 32.911 32.575 0.336 19854 5593 1 6 . 1 1 111 111 VAL H H 111 7.566 7.566 7.741 -0.175 19854 5594 1 6 . 1 1 112 112 CYS N N 112 114.295 114.295 115.135 -0.840 19854 5595 1 6 . 1 1 112 112 CYS C C 112 169.826 169.826 174.425 -4.599 19854 5596 1 6 . 1 1 112 112 CYS CA C 112 57.507 57.507 58.686 -1.179 19854 5597 1 6 . 1 1 112 112 CYS CB C 112 35.839 35.839 28.820 7.019 19854 5598 1 6 . 1 1 112 112 CYS H H 112 7.425 7.425 8.247 -0.822 19854 5599 1 6 . 1 1 113 113 GLU N N 113 116.486 116.486 117.932 -1.446 19854 5600 1 6 . 1 1 113 113 GLU C C 113 176.566 176.566 175.670 0.896 19854 5601 1 6 . 1 1 113 113 GLU CA C 113 69.219 69.219 58.341 10.878 19854 5602 1 6 . 1 1 113 113 GLU CB C 113 30.568 30.568 28.296 2.272 19854 5603 1 6 . 1 1 113 113 GLU H H 113 7.241 7.241 8.249 -1.008 19854 5604 1 6 . 1 1 114 114 ASN N N 114 129.302 129.302 121.698 7.604 19854 5605 1 6 . 1 1 114 114 ASN C C 114 175.100 175.100 174.606 0.494 19854 5606 1 6 . 1 1 114 114 ASN CA C 114 52.236 52.236 52.776 -0.540 19854 5607 1 6 . 1 1 114 114 ASN CB C 114 39.938 39.938 38.252 1.686 19854 5608 1 6 . 1 1 114 114 ASN H H 114 8.919 8.919 8.277 0.642 19854 5609 1 6 . 1 1 115 115 ILE N N 115 110.443 110.443 121.189 -10.746 19854 5610 1 6 . 1 1 115 115 ILE C C 115 175.100 175.100 173.245 1.855 19854 5611 1 6 . 1 1 115 115 ILE CA C 115 65.705 65.705 57.887 7.818 19854 5612 1 6 . 1 1 115 115 ILE CB C 115 39.353 39.353 39.705 -0.352 19854 5613 1 6 . 1 1 115 115 ILE H H 115 9.287 9.287 8.001 1.286 19854 5614 1 6 . 1 1 116 116 PRO C C 116 175.979 175.979 175.638 0.341 19854 5615 1 6 . 1 1 116 116 PRO CA C 116 63.086 63.086 63.226 -0.140 19854 5616 1 6 . 1 1 116 116 PRO CB C 116 29.681 29.681 32.179 -2.498 19854 5617 1 6 . 1 1 117 117 ILE N N 117 123.591 123.591 124.384 -0.793 19854 5618 1 6 . 1 1 117 117 ILE C C 117 174.807 174.807 174.919 -0.112 19854 5619 1 6 . 1 1 117 117 ILE CA C 117 66.291 66.291 60.330 5.962 19854 5620 1 6 . 1 1 117 117 ILE CB C 117 38.767 38.767 42.256 -3.489 19854 5621 1 6 . 1 1 117 117 ILE H H 117 7.781 7.781 8.551 -0.770 19854 5622 1 6 . 1 1 118 118 VAL N N 118 119.009 119.009 125.733 -6.724 19854 5623 1 6 . 1 1 118 118 VAL C C 118 178.324 178.324 174.704 3.620 19854 5624 1 6 . 1 1 118 118 VAL CA C 118 62.777 62.777 60.681 2.096 19854 5625 1 6 . 1 1 118 118 VAL CB C 118 31.154 31.154 33.948 -2.794 19854 5626 1 6 . 1 1 118 118 VAL H H 118 8.767 8.767 8.748 0.019 19854 5627 1 6 . 1 1 119 119 LEU N N 119 119.408 119.408 126.785 -7.377 19854 5628 1 6 . 1 1 119 119 LEU C C 119 178.031 178.031 176.057 1.974 19854 5629 1 6 . 1 1 119 119 LEU CA C 119 42.866 42.866 53.726 -10.860 19854 5630 1 6 . 1 1 119 119 LEU CB C 119 38.767 38.767 43.648 -4.881 19854 5631 1 6 . 1 1 119 119 LEU H H 119 7.734 7.734 9.112 -1.378 19854 5632 1 6 . 1 1 120 120 CYS N N 120 113.232 113.232 122.338 -9.106 19854 5633 1 6 . 1 1 120 120 CYS C C 120 178.031 178.031 174.292 3.739 19854 5634 1 6 . 1 1 120 120 CYS H H 120 8.317 8.317 9.100 -0.783 19854 5635 1 6 . 1 1 121 121 GLY N N 121 117.349 117.349 113.219 4.130 19854 5636 1 6 . 1 1 121 121 GLY C C 121 176.851 176.851 172.502 4.349 19854 5637 1 6 . 1 1 121 121 GLY CA C 121 41.109 41.109 43.692 -2.583 19854 5638 1 6 . 1 1 121 121 GLY H H 121 7.515 7.515 8.894 -1.379 19854 5639 1 6 . 1 1 122 122 ASN N N 122 125.318 125.318 124.594 0.724 19854 5640 1 6 . 1 1 122 122 ASN C C 122 175.686 175.686 175.541 0.145 19854 5641 1 6 . 1 1 122 122 ASN CA C 122 50.479 50.479 51.605 -1.126 19854 5642 1 6 . 1 1 122 122 ASN CB C 122 39.353 39.353 41.124 -1.771 19854 5643 1 6 . 1 1 122 122 ASN H H 122 9.162 9.162 8.549 0.613 19854 5644 1 6 . 1 1 123 123 LYS N N 123 122.132 122.132 115.474 6.658 19854 5645 1 6 . 1 1 123 123 LYS C C 123 173.043 173.043 176.846 -3.803 19854 5646 1 6 . 1 1 123 123 LYS CA C 123 58.101 58.101 57.637 0.464 19854 5647 1 6 . 1 1 123 123 LYS CB C 123 35.543 35.543 29.858 5.684 19854 5648 1 6 . 1 1 123 123 LYS H H 123 7.953 7.953 8.725 -0.772 19854 5649 1 6 . 1 1 124 124 VAL N N 124 123.726 123.726 113.292 10.434 19854 5650 1 6 . 1 1 124 124 VAL C C 124 175.679 175.679 176.655 -0.976 19854 5651 1 6 . 1 1 124 124 VAL CA C 124 64.840 64.840 64.967 -0.127 19854 5652 1 6 . 1 1 124 124 VAL CB C 124 42.574 42.574 31.490 11.084 19854 5653 1 6 . 1 1 124 124 VAL H H 124 8.555 8.555 7.546 1.009 19854 5654 1 6 . 1 1 125 125 ASP N N 125 119.607 119.607 120.205 -0.598 19854 5655 1 6 . 1 1 125 125 ASP C C 125 176.566 176.566 177.027 -0.461 19854 5656 1 6 . 1 1 125 125 ASP CA C 125 55.750 55.750 56.526 -0.776 19854 5657 1 6 . 1 1 125 125 ASP CB C 125 40.524 40.524 40.962 -0.438 19854 5658 1 6 . 1 1 125 125 ASP H H 125 7.875 7.875 8.312 -0.437 19854 5659 1 6 . 1 1 126 126 ILE N N 126 116.088 116.088 120.971 -4.883 19854 5660 1 6 . 1 1 126 126 ILE C C 126 177.152 177.152 177.056 0.096 19854 5661 1 6 . 1 1 126 126 ILE CA C 126 66.291 66.291 61.853 4.438 19854 5662 1 6 . 1 1 126 126 ILE CB C 126 39.353 39.353 38.195 1.158 19854 5663 1 6 . 1 1 126 126 ILE H H 126 7.511 7.511 7.463 0.048 19854 5664 1 6 . 1 1 127 127 LYS N N 127 121.203 121.203 126.706 -5.503 19854 5665 1 6 . 1 1 127 127 LYS C C 127 175.979 175.979 176.904 -0.925 19854 5666 1 6 . 1 1 127 127 LYS CA C 127 58.101 58.101 58.963 -0.862 19854 5667 1 6 . 1 1 127 127 LYS CB C 127 35.834 35.834 32.492 3.342 19854 5668 1 6 . 1 1 127 127 LYS H H 127 8.113 8.113 8.598 -0.485 19854 5669 1 6 . 1 1 128 128 ASP N N 128 118.279 118.279 120.355 -2.076 19854 5670 1 6 . 1 1 128 128 ASP C C 128 176.566 176.566 174.956 1.610 19854 5671 1 6 . 1 1 128 128 ASP CA C 128 53.407 53.407 53.061 0.346 19854 5672 1 6 . 1 1 128 128 ASP CB C 128 40.524 40.524 39.648 0.876 19854 5673 1 6 . 1 1 128 128 ASP H H 128 7.241 7.241 8.204 -0.963 19854 5674 1 6 . 1 1 129 129 ARG N N 129 118.943 118.943 123.056 -4.113 19854 5675 1 6 . 1 1 129 129 ARG C C 129 177.738 177.738 176.406 1.332 19854 5676 1 6 . 1 1 129 129 ARG CA C 129 45.794 45.794 56.390 -10.596 19854 5677 1 6 . 1 1 129 129 ARG CB C 129 31.154 31.154 30.875 0.279 19854 5678 1 6 . 1 1 129 129 ARG H H 129 8.423 8.423 7.823 0.600 19854 5679 1 6 . 1 1 130 130 LYS N N 130 109.381 109.381 122.342 -12.961 19854 5680 1 6 . 1 1 130 130 LYS C C 130 176.566 176.566 176.598 -0.032 19854 5681 1 6 . 1 1 130 130 LYS CA C 130 55.164 55.164 57.391 -2.227 19854 5682 1 6 . 1 1 130 130 LYS CB C 130 36.424 36.424 33.726 2.698 19854 5683 1 6 . 1 1 130 130 LYS H H 130 7.296 7.296 8.336 -1.040 19854 5684 1 6 . 1 1 131 131 VAL N N 131 110.377 110.377 120.561 -10.184 19854 5685 1 6 . 1 1 131 131 VAL C C 131 178.617 178.617 175.007 3.610 19854 5686 1 6 . 1 1 131 131 VAL CA C 131 65.705 65.705 62.011 3.694 19854 5687 1 6 . 1 1 131 131 VAL CB C 131 35.839 35.839 31.365 4.474 19854 5688 1 6 . 1 1 131 131 VAL H H 131 9.283 9.283 7.994 1.289 19854 5689 1 6 . 1 1 132 132 LYS N N 132 110.310 110.310 127.678 -17.368 19854 5690 1 6 . 1 1 132 132 LYS C C 132 176.273 176.273 177.413 -1.140 19854 5691 1 6 . 1 1 132 132 LYS CA C 132 59.849 59.849 55.197 4.652 19854 5692 1 6 . 1 1 132 132 LYS CB C 132 35.253 35.253 34.164 1.089 19854 5693 1 6 . 1 1 132 132 LYS H H 132 9.709 9.709 8.213 1.496 19854 5694 1 6 . 1 1 133 133 ALA N N 133 134.349 134.349 126.992 7.357 19854 5695 1 6 . 1 1 133 133 ALA CA C 133 51.065 51.065 54.793 -3.728 19854 5696 1 6 . 1 1 133 133 ALA CB C 133 12.999 12.999 18.437 -5.438 19854 5697 1 6 . 1 1 133 133 ALA H H 133 6.322 6.322 8.801 -2.479 19854 5698 1 6 . 1 1 134 134 LYS N N 134 117.615 117.615 118.017 -0.402 19854 5699 1 6 . 1 1 134 134 LYS C C 134 176.859 176.859 178.329 -1.470 19854 5700 1 6 . 1 1 134 134 LYS CA C 134 55.750 55.750 58.792 -3.042 19854 5701 1 6 . 1 1 134 134 LYS CB C 134 54.579 54.579 32.316 22.262 19854 5702 1 6 . 1 1 134 134 LYS H H 134 6.549 6.549 8.232 -1.683 19854 5703 1 6 . 1 1 135 135 SER N N 135 109.314 109.314 114.596 -5.282 19854 5704 1 6 . 1 1 135 135 SER C C 135 173.635 173.635 174.978 -1.343 19854 5705 1 6 . 1 1 135 135 SER CA C 135 56.336 56.336 59.974 -3.638 19854 5706 1 6 . 1 1 135 135 SER CB C 135 63.949 63.949 63.059 0.890 19854 5707 1 6 . 1 1 135 135 SER H H 135 7.840 7.840 7.893 -0.053 19854 5708 1 6 . 1 1 136 136 ILE N N 136 124.123 124.123 122.160 1.963 19854 5709 1 6 . 1 1 136 136 ILE C C 136 175.100 175.100 176.055 -0.955 19854 5710 1 6 . 1 1 136 136 ILE CA C 136 68.634 68.634 62.833 5.801 19854 5711 1 6 . 1 1 136 136 ILE CB C 136 43.452 43.452 38.074 5.378 19854 5712 1 6 . 1 1 136 136 ILE H H 136 8.098 8.098 7.406 0.692 19854 5713 1 6 . 1 1 137 137 VAL N N 137 113.232 113.232 121.826 -8.594 19854 5714 1 6 . 1 1 137 137 VAL C C 137 176.859 176.859 176.208 0.651 19854 5715 1 6 . 1 1 137 137 VAL CA C 137 64.534 64.534 61.608 2.926 19854 5716 1 6 . 1 1 137 137 VAL CB C 137 34.082 34.082 32.914 1.167 19854 5717 1 6 . 1 1 137 137 VAL H H 137 7.711 7.711 8.064 -0.353 19854 5718 1 6 . 1 1 138 138 PHE N N 138 118.279 118.279 123.221 -4.942 19854 5719 1 6 . 1 1 138 138 PHE C C 138 175.393 175.393 176.332 -0.939 19854 5720 1 6 . 1 1 138 138 PHE CA C 138 58.092 58.092 62.865 -4.773 19854 5721 1 6 . 1 1 138 138 PHE CB C 138 39.353 39.353 39.186 0.167 19854 5722 1 6 . 1 1 138 138 PHE H H 138 8.317 8.317 7.623 0.694 19854 5723 1 6 . 1 1 139 139 HIS N N 139 120.605 120.605 116.398 4.207 19854 5724 1 6 . 1 1 139 139 HIS C C 139 175.979 175.979 177.152 -1.173 19854 5725 1 6 . 1 1 139 139 HIS CA C 139 67.775 67.775 59.425 8.350 19854 5726 1 6 . 1 1 139 139 HIS CB C 139 35.836 35.836 29.022 6.814 19854 5727 1 6 . 1 1 139 139 HIS H H 139 8.094 8.094 8.872 -0.778 19854 5728 1 6 . 1 1 140 140 ARG N N 140 120.140 120.140 120.439 -0.299 19854 5729 1 6 . 1 1 140 140 ARG C C 140 178.023 178.023 179.245 -1.222 19854 5730 1 6 . 1 1 140 140 ARG CA C 140 58.394 58.394 59.379 -0.985 19854 5731 1 6 . 1 1 140 140 ARG CB C 140 39.644 39.644 29.652 9.992 19854 5732 1 6 . 1 1 140 140 ARG H H 140 8.149 8.149 7.147 1.002 19854 5733 1 6 . 1 1 141 141 LYS N N 141 115.623 115.623 119.607 -3.984 19854 5734 1 6 . 1 1 141 141 LYS C C 141 173.635 173.635 178.069 -4.434 19854 5735 1 6 . 1 1 141 141 LYS CA C 141 58.092 58.092 58.821 -0.729 19854 5736 1 6 . 1 1 141 141 LYS CB C 141 33.496 33.496 32.228 1.268 19854 5737 1 6 . 1 1 141 141 LYS H H 141 7.449 7.449 7.653 -0.204 19854 5738 1 6 . 1 1 142 142 LYS N N 142 114.162 114.162 116.132 -1.970 19854 5739 1 6 . 1 1 142 142 LYS C C 142 175.979 175.979 176.017 -0.038 19854 5740 1 6 . 1 1 142 142 LYS CA C 142 51.065 51.065 55.090 -4.025 19854 5741 1 6 . 1 1 142 142 LYS CB C 142 34.668 34.668 32.144 2.524 19854 5742 1 6 . 1 1 142 142 LYS H H 142 8.982 8.982 7.791 1.191 19854 5743 1 6 . 1 1 143 143 ASN N N 143 112.103 112.103 114.719 -2.616 19854 5744 1 6 . 1 1 143 143 ASN C C 143 175.100 175.100 174.300 0.800 19854 5745 1 6 . 1 1 143 143 ASN CA C 143 53.407 53.407 53.837 -0.430 19854 5746 1 6 . 1 1 143 143 ASN CB C 143 39.938 39.938 36.406 3.532 19854 5747 1 6 . 1 1 143 143 ASN H H 143 7.402 7.402 7.683 -0.281 19854 5748 1 6 . 1 1 144 144 LEU N N 144 118.810 118.810 116.535 2.275 19854 5749 1 6 . 1 1 144 144 LEU CA C 144 53.993 53.993 53.436 0.557 19854 5750 1 6 . 1 1 144 144 LEU CB C 144 42.866 42.866 43.995 -1.129 19854 5751 1 6 . 1 1 144 144 LEU H H 144 7.793 7.793 7.989 -0.196 19854 5752 1 6 . 1 1 145 145 GLN N N 145 119.607 119.607 119.124 0.483 19854 5753 1 6 . 1 1 145 145 GLN C C 145 176.859 176.859 173.692 3.167 19854 5754 1 6 . 1 1 145 145 GLN CA C 145 55.164 55.164 53.857 1.307 19854 5755 1 6 . 1 1 145 145 GLN CB C 145 29.983 29.983 30.785 -0.802 19854 5756 1 6 . 1 1 145 145 GLN H H 145 7.014 7.014 7.923 -0.909 19854 5757 1 6 . 1 1 146 146 TYR N N 146 119.275 119.275 126.096 -6.821 19854 5758 1 6 . 1 1 146 146 TYR C C 146 174.807 174.807 174.142 0.665 19854 5759 1 6 . 1 1 146 146 TYR CA C 146 62.777 62.777 55.799 6.978 19854 5760 1 6 . 1 1 146 146 TYR CB C 146 41.109 41.109 40.597 0.512 19854 5761 1 6 . 1 1 146 146 TYR H H 146 9.350 9.350 8.058 1.292 19854 5762 1 6 . 1 1 147 147 TYR N N 147 123.658 123.658 125.512 -1.854 19854 5763 1 6 . 1 1 147 147 TYR C C 147 177.738 177.738 173.792 3.946 19854 5764 1 6 . 1 1 147 147 TYR CA C 147 58.092 58.092 56.194 1.898 19854 5765 1 6 . 1 1 147 147 TYR CB C 147 39.938 39.938 42.075 -2.137 19854 5766 1 6 . 1 1 147 147 TYR H H 147 8.340 8.340 8.617 -0.277 19854 5767 1 6 . 1 1 148 148 ASP N N 148 121.267 121.267 123.331 -2.064 19854 5768 1 6 . 1 1 148 148 ASP C C 148 176.859 176.859 175.214 1.645 19854 5769 1 6 . 1 1 148 148 ASP CA C 148 54.579 54.579 54.415 0.164 19854 5770 1 6 . 1 1 148 148 ASP CB C 148 41.109 41.109 41.627 -0.518 19854 5771 1 6 . 1 1 148 148 ASP H H 148 8.911 8.911 8.384 0.527 19854 5772 1 6 . 1 1 149 149 ILE N N 149 119.607 119.607 118.719 0.888 19854 5773 1 6 . 1 1 149 149 ILE C C 149 174.807 174.807 174.282 0.525 19854 5774 1 6 . 1 1 149 149 ILE CA C 149 61.020 61.020 59.158 1.862 19854 5775 1 6 . 1 1 149 149 ILE CB C 149 39.353 39.353 42.569 -3.216 19854 5776 1 6 . 1 1 149 149 ILE H H 149 8.712 8.712 8.661 0.051 19854 5777 1 6 . 1 1 150 150 SER N N 150 117.349 117.349 117.227 0.122 19854 5778 1 6 . 1 1 150 150 SER C C 150 175.686 175.686 174.359 1.327 19854 5779 1 6 . 1 1 150 150 SER CA C 150 60.435 60.435 55.704 4.731 19854 5780 1 6 . 1 1 150 150 SER CB C 150 62.192 62.192 65.463 -3.271 19854 5781 1 6 . 1 1 150 150 SER H H 150 8.454 8.454 8.466 -0.012 19854 5782 1 6 . 1 1 151 151 ALA N N 151 131.162 131.162 131.262 -0.100 19854 5783 1 6 . 1 1 151 151 ALA C C 151 160.742 160.742 179.333 -18.591 19854 5784 1 6 . 1 1 151 151 ALA CA C 151 53.993 53.993 55.439 -1.446 19854 5785 1 6 . 1 1 151 151 ALA CB C 151 22.369 22.369 19.025 3.344 19854 5786 1 6 . 1 1 151 151 ALA H H 151 10.640 10.640 8.841 1.799 19854 5787 1 6 . 1 1 152 152 LYS N N 152 121.400 121.400 118.454 2.946 19854 5788 1 6 . 1 1 152 152 LYS C C 152 174.221 174.221 178.048 -3.827 19854 5789 1 6 . 1 1 152 152 LYS CA C 152 59.849 59.849 58.390 1.459 19854 5790 1 6 . 1 1 152 152 LYS CB C 152 34.668 34.668 32.466 2.202 19854 5791 1 6 . 1 1 152 152 LYS H H 152 9.099 9.099 8.428 0.671 19854 5792 1 6 . 1 1 153 153 SER N N 153 135.212 135.212 111.610 23.602 19854 5793 1 6 . 1 1 153 153 SER C C 153 177.152 177.152 173.981 3.171 19854 5794 1 6 . 1 1 153 153 SER CA C 153 62.192 62.192 58.737 3.454 19854 5795 1 6 . 1 1 153 153 SER CB C 153 66.291 66.291 63.829 2.462 19854 5796 1 6 . 1 1 153 153 SER H H 153 8.935 8.935 7.831 1.104 19854 5797 1 6 . 1 1 154 154 ASN N N 154 119.341 119.341 115.511 3.830 19854 5798 1 6 . 1 1 154 154 ASN C C 154 175.979 175.979 174.081 1.898 19854 5799 1 6 . 1 1 154 154 ASN CA C 154 49.894 49.894 54.583 -4.689 19854 5800 1 6 . 1 1 154 154 ASN CB C 154 39.353 39.353 36.618 2.735 19854 5801 1 6 . 1 1 154 154 ASN H H 154 7.488 7.488 8.090 -0.602 19854 5802 1 6 . 1 1 155 155 TYR N N 155 120.074 120.074 123.022 -2.948 19854 5803 1 6 . 1 1 155 155 TYR C C 155 177.144 177.144 175.198 1.946 19854 5804 1 6 . 1 1 155 155 TYR CA C 155 60.738 60.738 59.608 1.130 19854 5805 1 6 . 1 1 155 155 TYR CB C 155 41.402 41.402 38.822 2.580 19854 5806 1 6 . 1 1 155 155 TYR H H 155 7.945 7.945 7.568 0.377 19854 5807 1 6 . 1 1 156 156 ASN N N 156 124.058 124.058 122.772 1.286 19854 5808 1 6 . 1 1 156 156 ASN C C 156 175.679 175.679 175.165 0.514 19854 5809 1 6 . 1 1 156 156 ASN CA C 156 53.121 53.121 54.178 -1.057 19854 5810 1 6 . 1 1 156 156 ASN CB C 156 38.179 38.179 35.961 2.218 19854 5811 1 6 . 1 1 156 156 ASN H H 156 8.192 8.192 8.871 -0.679 19854 5812 1 6 . 1 1 157 157 PHE N N 157 123.459 123.459 119.179 4.280 19854 5813 1 6 . 1 1 157 157 PHE C C 157 174.221 174.221 175.774 -1.553 19854 5814 1 6 . 1 1 157 157 PHE CA C 157 57.507 57.507 61.019 -3.512 19854 5815 1 6 . 1 1 157 157 PHE CB C 157 39.353 39.353 39.286 0.067 19854 5816 1 6 . 1 1 157 157 PHE H H 157 7.429 7.429 7.692 -0.263 19854 5817 1 6 . 1 1 158 158 GLU N N 158 112.568 112.568 114.885 -2.317 19854 5818 1 6 . 1 1 158 158 GLU C C 158 176.566 176.566 177.470 -0.904 19854 5819 1 6 . 1 1 158 158 GLU CA C 158 72.147 72.147 56.750 15.397 19854 5820 1 6 . 1 1 158 158 GLU CB C 158 27.640 27.640 29.113 -1.473 19854 5821 1 6 . 1 1 158 158 GLU H H 158 7.495 7.495 8.485 -0.990 19854 5822 1 6 . 1 1 159 159 LYS N N 159 113.232 113.232 120.032 -6.800 19854 5823 1 6 . 1 1 159 159 LYS C C 159 176.566 176.566 175.894 0.672 19854 5824 1 6 . 1 1 159 159 LYS CA C 159 53.993 53.993 61.507 -7.514 19854 5825 1 6 . 1 1 159 159 LYS CB C 159 33.496 33.496 29.801 3.695 19854 5826 1 6 . 1 1 159 159 LYS H H 159 6.862 6.862 7.233 -0.371 19854 5827 1 6 . 1 1 160 160 PRO C C 160 176.273 176.273 178.622 -2.349 19854 5828 1 6 . 1 1 160 160 PRO CA C 160 64.258 64.258 65.631 -1.373 19854 5829 1 6 . 1 1 160 160 PRO CB C 160 32.318 32.318 31.168 1.150 19854 5830 1 6 . 1 1 161 161 PHE N N 161 123.726 123.726 117.377 6.349 19854 5831 1 6 . 1 1 161 161 PHE C C 161 176.851 176.851 177.725 -0.874 19854 5832 1 6 . 1 1 161 161 PHE CA C 161 60.445 60.445 61.820 -1.375 19854 5833 1 6 . 1 1 161 161 PHE CB C 161 40.816 40.816 37.893 2.923 19854 5834 1 6 . 1 1 161 161 PHE H H 161 8.215 8.215 7.278 0.937 19854 5835 1 6 . 1 1 162 162 LEU N N 162 110.177 110.177 119.115 -8.938 19854 5836 1 6 . 1 1 162 162 LEU C C 162 176.273 176.273 178.708 -2.435 19854 5837 1 6 . 1 1 162 162 LEU CA C 162 55.750 55.750 57.945 -2.195 19854 5838 1 6 . 1 1 162 162 LEU CB C 162 44.037 44.037 41.528 2.509 19854 5839 1 6 . 1 1 162 162 LEU H H 162 7.527 7.527 8.026 -0.499 19854 5840 1 6 . 1 1 163 163 TRP N N 163 123.525 123.525 121.421 2.104 19854 5841 1 6 . 1 1 163 163 TRP C C 163 177.152 177.152 178.057 -0.905 19854 5842 1 6 . 1 1 163 163 TRP CA C 163 61.606 61.606 62.199 -0.593 19854 5843 1 6 . 1 1 163 163 TRP CB C 163 28.811 28.811 29.633 -0.822 19854 5844 1 6 . 1 1 163 163 TRP H H 163 7.476 7.476 8.323 -0.847 19854 5845 1 6 . 1 1 164 164 LEU N N 164 119.740 119.740 118.967 0.773 19854 5846 1 6 . 1 1 164 164 LEU C C 164 175.686 175.686 178.981 -3.295 19854 5847 1 6 . 1 1 164 164 LEU CA C 164 61.020 61.020 57.869 3.151 19854 5848 1 6 . 1 1 164 164 LEU CB C 164 45.794 45.794 41.397 4.397 19854 5849 1 6 . 1 1 164 164 LEU H H 164 9.412 9.412 8.171 1.241 19854 5850 1 6 . 1 1 165 165 ALA N N 165 118.013 118.013 121.395 -3.382 19854 5851 1 6 . 1 1 165 165 ALA C C 165 165.723 165.723 179.582 -13.859 19854 5852 1 6 . 1 1 165 165 ALA CA C 165 52.236 52.236 55.241 -3.005 19854 5853 1 6 . 1 1 165 165 ALA CB C 165 21.784 21.784 18.165 3.619 19854 5854 1 6 . 1 1 165 165 ALA H H 165 7.707 7.707 8.216 -0.509 19854 5855 1 6 . 1 1 166 166 ARG N N 166 122.994 122.994 118.162 4.832 19854 5856 1 6 . 1 1 166 166 ARG C C 166 175.979 175.979 179.103 -3.124 19854 5857 1 6 . 1 1 166 166 ARG CA C 166 49.308 49.308 59.296 -9.988 19854 5858 1 6 . 1 1 166 166 ARG CB C 166 29.397 29.397 30.086 -0.689 19854 5859 1 6 . 1 1 166 166 ARG H H 166 8.692 8.692 8.144 0.548 19854 5860 1 6 . 1 1 167 167 LYS N N 167 112.568 112.568 119.433 -6.865 19854 5861 1 6 . 1 1 167 167 LYS C C 167 176.273 176.273 179.262 -2.989 19854 5862 1 6 . 1 1 167 167 LYS CA C 167 58.092 58.092 58.409 -0.317 19854 5863 1 6 . 1 1 167 167 LYS CB C 167 34.668 34.668 31.618 3.050 19854 5864 1 6 . 1 1 167 167 LYS H H 167 6.819 6.819 7.551 -0.732 19854 5865 1 6 . 1 1 168 168 LEU N N 168 114.959 114.959 119.917 -4.958 19854 5866 1 6 . 1 1 168 168 LEU C C 168 177.738 177.738 179.031 -1.293 19854 5867 1 6 . 1 1 168 168 LEU CA C 168 56.921 56.921 57.469 -0.548 19854 5868 1 6 . 1 1 168 168 LEU CB C 168 41.695 41.695 41.525 0.170 19854 5869 1 6 . 1 1 168 168 LEU H H 168 7.269 7.269 7.816 -0.547 19854 5870 1 6 . 1 1 169 169 ILE N N 169 122.199 122.199 115.992 6.207 19854 5871 1 6 . 1 1 169 169 ILE C C 169 177.445 177.445 177.166 0.279 19854 5872 1 6 . 1 1 169 169 ILE CA C 169 63.375 63.375 63.265 0.110 19854 5873 1 6 . 1 1 169 169 ILE CB C 169 42.281 42.281 38.707 3.574 19854 5874 1 6 . 1 1 169 169 ILE H H 169 8.360 8.360 7.993 0.367 19854 5875 1 6 . 1 1 170 170 GLY N N 170 113.099 113.099 106.539 6.560 19854 5876 1 6 . 1 1 170 170 GLY C C 170 162.496 162.496 173.859 -11.363 19854 5877 1 6 . 1 1 170 170 GLY CA C 170 44.037 44.037 44.899 -0.862 19854 5878 1 6 . 1 1 170 170 GLY H H 170 6.686 6.686 8.006 -1.320 19854 5879 1 6 . 1 1 171 171 ASP N N 171 113.232 113.232 121.644 -8.412 19854 5880 1 6 . 1 1 171 171 ASP C C 171 178.910 178.910 176.188 2.722 19854 5881 1 6 . 1 1 171 171 ASP CA C 171 50.479 50.479 50.570 -0.091 19854 5882 1 6 . 1 1 171 171 ASP CB C 171 41.109 41.109 42.207 -1.098 19854 5883 1 6 . 1 1 171 171 ASP H H 171 6.815 6.815 7.547 -0.732 19854 5884 1 6 . 1 1 172 172 PRO C C 172 176.566 176.566 177.227 -0.661 19854 5885 1 6 . 1 1 172 172 PRO CA C 172 63.965 63.965 64.325 -0.360 19854 5886 1 6 . 1 1 172 172 PRO CB C 172 31.732 31.732 32.229 -0.497 19854 5887 1 6 . 1 1 173 173 ASN N N 173 109.779 109.779 115.338 -5.559 19854 5888 1 6 . 1 1 173 173 ASN C C 173 175.979 175.979 175.161 0.818 19854 5889 1 6 . 1 1 173 173 ASN CA C 173 54.579 54.579 52.847 1.732 19854 5890 1 6 . 1 1 173 173 ASN CB C 173 36.424 36.424 39.158 -2.734 19854 5891 1 6 . 1 1 173 173 ASN H H 173 8.016 8.016 8.346 -0.330 19854 5892 1 6 . 1 1 174 174 LEU N N 174 109.248 109.248 122.827 -13.579 19854 5893 1 6 . 1 1 174 174 LEU C C 174 176.566 176.566 175.445 1.121 19854 5894 1 6 . 1 1 174 174 LEU CA C 174 56.336 56.336 56.056 0.279 19854 5895 1 6 . 1 1 174 174 LEU CB C 174 44.037 44.037 42.919 1.118 19854 5896 1 6 . 1 1 174 174 LEU H H 174 7.871 7.871 7.315 0.556 19854 5897 1 6 . 1 1 175 175 GLU N N 175 125.185 125.185 125.228 -0.043 19854 5898 1 6 . 1 1 175 175 GLU C C 175 177.445 177.445 174.552 2.893 19854 5899 1 6 . 1 1 175 175 GLU CA C 175 76.247 76.247 54.280 21.967 19854 5900 1 6 . 1 1 175 175 GLU CB C 175 28.811 28.811 33.445 -4.634 19854 5901 1 6 . 1 1 175 175 GLU H H 175 9.127 9.127 8.202 0.925 19854 5902 1 6 . 1 1 176 176 PHE N N 176 136.873 136.873 124.316 12.557 19854 5903 1 6 . 1 1 176 176 PHE C C 176 178.617 178.617 175.535 3.082 19854 5904 1 6 . 1 1 176 176 PHE CA C 176 59.264 59.264 58.063 1.201 19854 5905 1 6 . 1 1 176 176 PHE CB C 176 44.623 44.623 40.224 4.399 19854 5906 1 6 . 1 1 176 176 PHE H H 176 10.058 10.058 8.761 1.297 19854 5907 1 6 . 1 1 177 177 VAL N N 177 118.877 118.877 124.065 -5.188 19854 5908 1 6 . 1 1 177 177 VAL C C 177 177.445 177.445 174.046 3.399 19854 5909 1 6 . 1 1 177 177 VAL CA C 177 62.777 62.777 59.061 3.716 19854 5910 1 6 . 1 1 177 177 VAL CB C 177 34.668 34.668 34.113 0.555 19854 5911 1 6 . 1 1 177 177 VAL H H 177 7.789 7.789 8.020 -0.231 19854 5912 1 6 . 1 1 178 178 ALA N N 178 123.859 123.859 125.107 -1.248 19854 5913 1 6 . 1 1 178 178 ALA C C 178 177.144 177.144 177.318 -0.174 19854 5914 1 6 . 1 1 178 178 ALA CA C 178 54.000 54.000 54.535 -0.535 19854 5915 1 6 . 1 1 178 178 ALA CB C 178 15.035 15.035 18.759 -3.724 19854 5916 1 6 . 1 1 178 178 ALA H H 178 7.683 7.683 8.124 -0.441 19854 5917 1 6 . 1 1 179 179 MET N N 179 121.668 121.668 117.141 4.527 19854 5918 1 6 . 1 1 179 179 MET C C 179 177.144 177.144 173.453 3.691 19854 5919 1 6 . 1 1 179 179 MET CA C 179 60.445 60.445 52.860 7.585 19854 5920 1 6 . 1 1 179 179 MET CB C 179 39.351 39.351 33.467 5.884 19854 5921 1 6 . 1 1 179 179 MET H H 179 7.648 7.648 7.662 -0.014 19854 5922 1 6 . 1 1 180 180 PRO C C 180 177.445 177.445 175.312 2.133 19854 5923 1 6 . 1 1 180 180 PRO CA C 180 64.844 64.844 62.314 2.530 19854 5924 1 6 . 1 1 180 180 PRO CB C 180 29.974 29.974 33.236 -3.262 19854 5925 1 6 . 1 1 181 181 ALA N N 181 128.439 128.439 124.795 3.644 19854 5926 1 6 . 1 1 181 181 ALA C C 181 176.273 176.273 177.009 -0.736 19854 5927 1 6 . 1 1 181 181 ALA CA C 181 58.092 58.092 51.532 6.559 19854 5928 1 6 . 1 1 181 181 ALA CB C 181 21.198 21.198 19.166 2.032 19854 5929 1 6 . 1 1 181 181 ALA H H 181 8.673 8.673 8.391 0.282 19854 5930 1 6 . 1 1 182 182 LEU N N 182 122.130 122.130 123.627 -1.497 19854 5931 1 6 . 1 1 182 182 LEU C C 182 177.445 177.445 177.096 0.349 19854 5932 1 6 . 1 1 182 182 LEU CA C 182 55.164 55.164 54.035 1.129 19854 5933 1 6 . 1 1 182 182 LEU CB C 182 42.866 42.866 43.383 -0.516 19854 5934 1 6 . 1 1 182 182 LEU H H 182 8.821 8.821 8.526 0.295 19854 5935 1 6 . 1 1 183 183 ALA N N 183 121.004 121.004 125.931 -4.927 19854 5936 1 6 . 1 1 183 183 ALA C C 183 178.617 178.617 176.021 2.596 19854 5937 1 6 . 1 1 183 183 ALA CA C 183 57.808 57.808 50.750 7.058 19854 5938 1 6 . 1 1 183 183 ALA CB C 183 24.117 24.117 18.496 5.621 19854 5939 1 6 . 1 1 183 183 ALA H H 183 8.356 8.356 8.304 0.052 19854 5940 1 6 . 1 1 184 184 PRO C C 184 177.152 177.152 175.385 1.767 19854 5941 1 6 . 1 1 184 184 PRO CA C 184 64.258 64.258 61.898 2.360 19854 5942 1 6 . 1 1 184 184 PRO CB C 184 29.681 29.681 31.435 -1.754 19854 5943 1 6 . 1 1 185 185 PRO C C 185 175.686 175.686 177.193 -1.507 19854 5944 1 6 . 1 1 185 185 PRO CA C 185 63.379 63.379 62.416 0.964 19854 5945 1 6 . 1 1 185 185 PRO CB C 185 35.248 35.248 32.504 2.744 19854 5946 1 6 . 1 1 186 186 GLU N N 186 120.539 120.539 119.248 1.291 19854 5947 1 6 . 1 1 186 186 GLU C C 186 176.273 176.273 176.185 0.088 19854 5948 1 6 . 1 1 186 186 GLU CA C 186 58.101 58.101 57.548 0.553 19854 5949 1 6 . 1 1 186 186 GLU CB C 186 35.836 35.836 29.595 6.241 19854 5950 1 6 . 1 1 186 186 GLU H H 186 8.086 8.086 8.442 -0.356 19854 5951 1 6 . 1 1 187 187 VAL N N 187 124.455 124.455 117.679 6.776 19854 5952 1 6 . 1 1 187 187 VAL C C 187 178.910 178.910 175.228 3.682 19854 5953 1 6 . 1 1 187 187 VAL CA C 187 63.363 63.363 62.502 0.861 19854 5954 1 6 . 1 1 187 187 VAL CB C 187 34.082 34.082 30.734 3.348 19854 5955 1 6 . 1 1 187 187 VAL H H 187 8.622 8.622 7.860 0.762 19854 5956 1 6 . 1 1 188 188 VAL N N 188 128.572 128.572 121.977 6.595 19854 5957 1 6 . 1 1 188 188 VAL C C 188 178.324 178.324 176.953 1.371 19854 5958 1 6 . 1 1 188 188 VAL CA C 188 68.634 68.634 62.201 6.433 19854 5959 1 6 . 1 1 188 188 VAL CB C 188 31.154 31.154 32.605 -1.451 19854 5960 1 6 . 1 1 188 188 VAL H H 188 8.497 8.497 7.938 0.559 19854 5961 1 6 . 1 1 189 189 MET N N 189 122.795 122.795 119.755 3.040 19854 5962 1 6 . 1 1 189 189 MET C C 189 177.445 177.445 175.811 1.634 19854 5963 1 6 . 1 1 189 189 MET CA C 189 55.164 55.164 56.948 -1.784 19854 5964 1 6 . 1 1 189 189 MET CB C 189 35.253 35.253 31.755 3.498 19854 5965 1 6 . 1 1 189 189 MET H H 189 6.991 6.991 8.373 -1.382 19854 5966 1 6 . 1 1 190 190 ASP N N 190 114.959 114.959 115.752 -0.793 19854 5967 1 6 . 1 1 190 190 ASP C C 190 175.686 175.686 175.199 0.487 19854 5968 1 6 . 1 1 190 190 ASP CA C 190 51.065 51.065 54.532 -3.466 19854 5969 1 6 . 1 1 190 190 ASP CB C 190 41.695 41.695 38.836 2.859 19854 5970 1 6 . 1 1 190 190 ASP H H 190 7.210 7.210 8.606 -1.396 19854 5971 1 6 . 1 1 191 191 PRO C C 191 176.566 176.566 177.462 -0.896 19854 5972 1 6 . 1 1 191 191 PRO CA C 191 63.965 63.965 64.739 -0.774 19854 5973 1 6 . 1 1 191 191 PRO CB C 191 31.146 31.146 31.782 -0.636 19854 5974 1 6 . 1 1 192 192 ALA N N 192 109.513 109.513 119.415 -9.902 19854 5975 1 6 . 1 1 192 192 ALA CA C 192 53.993 53.993 53.468 0.526 19854 5976 1 6 . 1 1 192 192 ALA CB C 192 19.441 19.441 18.599 0.842 19854 5977 1 6 . 1 1 192 192 ALA H H 192 7.394 7.394 8.442 -1.048 19854 5978 1 6 . 1 1 193 193 LEU N N 193 119.009 119.009 119.313 -0.304 19854 5979 1 6 . 1 1 193 193 LEU C C 193 175.979 175.979 177.203 -1.224 19854 5980 1 6 . 1 1 193 193 LEU CA C 193 56.336 56.336 55.695 0.641 19854 5981 1 6 . 1 1 193 193 LEU CB C 193 42.866 42.866 42.049 0.817 19854 5982 1 6 . 1 1 193 193 LEU H H 193 8.340 8.340 7.750 0.590 19854 5983 1 6 . 1 1 194 194 ALA N N 194 121.666 121.666 119.891 1.775 19854 5984 1 6 . 1 1 194 194 ALA C C 194 166.896 166.896 178.040 -11.144 19854 5985 1 6 . 1 1 194 194 ALA CA C 194 55.164 55.164 52.864 2.300 19854 5986 1 6 . 1 1 194 194 ALA CB C 194 16.513 16.513 19.175 -2.663 19854 5987 1 6 . 1 1 194 194 ALA H H 194 8.176 8.176 7.820 0.356 19854 5988 1 6 . 1 1 195 195 ALA N N 195 119.541 119.541 120.820 -1.279 19854 5989 1 6 . 1 1 195 195 ALA C C 195 173.928 173.928 179.155 -5.227 19854 5990 1 6 . 1 1 195 195 ALA CA C 195 57.507 57.507 54.187 3.321 19854 5991 1 6 . 1 1 195 195 ALA CB C 195 19.441 19.441 17.127 2.314 19854 5992 1 6 . 1 1 195 195 ALA H H 195 8.364 8.364 8.771 -0.407 19854 5993 1 6 . 1 1 196 196 GLN N N 196 107.322 107.322 119.689 -12.367 19854 5994 1 6 . 1 1 196 196 GLN C C 196 176.273 176.273 177.338 -1.065 19854 5995 1 6 . 1 1 196 196 GLN CA C 196 56.921 56.921 58.315 -1.394 19854 5996 1 6 . 1 1 196 196 GLN CB C 196 29.983 29.983 28.768 1.215 19854 5997 1 6 . 1 1 196 196 GLN H H 196 7.910 7.910 7.937 -0.027 19854 5998 1 6 . 1 1 197 197 TYR N N 197 119.277 119.277 120.139 -0.862 19854 5999 1 6 . 1 1 197 197 TYR C C 197 178.316 178.316 177.606 0.710 19854 6000 1 6 . 1 1 197 197 TYR CA C 197 56.343 56.343 61.037 -4.694 19854 6001 1 6 . 1 1 197 197 TYR CB C 197 43.453 43.453 38.188 5.265 19854 6002 1 6 . 1 1 197 197 TYR H H 197 8.180 8.180 8.463 -0.283 19854 6003 1 6 . 1 1 198 198 GLU N N 198 110.244 110.244 118.512 -8.268 19854 6004 1 6 . 1 1 198 198 GLU C C 198 176.273 176.273 178.717 -2.444 19854 6005 1 6 . 1 1 198 198 GLU CA C 198 53.407 53.407 59.322 -5.915 19854 6006 1 6 . 1 1 198 198 GLU CB C 198 30.568 30.568 29.233 1.335 19854 6007 1 6 . 1 1 198 198 GLU H H 198 7.523 7.523 7.943 -0.420 19854 6008 1 6 . 1 1 199 199 HIS N N 199 119.211 119.211 119.548 -0.337 19854 6009 1 6 . 1 1 199 199 HIS C C 199 178.902 178.902 177.180 1.722 19854 6010 1 6 . 1 1 199 199 HIS CA C 199 58.687 58.687 59.245 -0.558 19854 6011 1 6 . 1 1 199 199 HIS CB C 199 34.957 34.957 29.777 5.180 19854 6012 1 6 . 1 1 199 199 HIS H H 199 8.258 8.258 7.591 0.667 19854 6013 1 6 . 1 1 200 200 ASP N N 200 124.722 124.722 120.070 4.652 19854 6014 1 6 . 1 1 200 200 ASP C C 200 176.705 176.705 178.795 -2.090 19854 6015 1 6 . 1 1 200 200 ASP CA C 200 58.687 58.687 57.234 1.453 19854 6016 1 6 . 1 1 200 200 ASP CB C 200 39.644 39.644 40.307 -0.663 19854 6017 1 6 . 1 1 200 200 ASP H H 200 8.086 8.086 8.141 -0.055 19854 6018 1 6 . 1 1 201 201 LEU N N 201 116.353 116.353 119.924 -3.571 19854 6019 1 6 . 1 1 201 201 LEU C C 201 178.910 178.910 178.879 0.031 19854 6020 1 6 . 1 1 201 201 LEU CA C 201 61.606 61.606 57.942 3.664 19854 6021 1 6 . 1 1 201 201 LEU CB C 201 41.109 41.109 41.564 -0.455 19854 6022 1 6 . 1 1 201 201 LEU H H 201 7.722 7.722 7.807 -0.085 19854 6023 1 6 . 1 1 202 202 GLU N N 202 118.080 118.080 119.605 -1.525 19854 6024 1 6 . 1 1 202 202 GLU C C 202 176.566 176.566 179.118 -2.552 19854 6025 1 6 . 1 1 202 202 GLU CA C 202 56.921 56.921 59.528 -2.607 19854 6026 1 6 . 1 1 202 202 GLU CB C 202 30.568 30.568 29.379 1.189 19854 6027 1 6 . 1 1 202 202 GLU H H 202 8.857 8.857 7.649 1.208 19854 6028 1 6 . 1 1 203 203 VAL N N 203 129.369 129.369 119.948 9.421 19854 6029 1 6 . 1 1 203 203 VAL C C 203 178.617 178.617 177.760 0.857 19854 6030 1 6 . 1 1 203 203 VAL CA C 203 64.534 64.534 66.649 -2.115 19854 6031 1 6 . 1 1 203 203 VAL CB C 203 27.640 27.640 31.273 -3.633 19854 6032 1 6 . 1 1 203 203 VAL H H 203 9.283 9.283 7.616 1.667 19854 6033 1 6 . 1 1 204 204 ALA N N 204 109.580 109.580 122.085 -12.505 19854 6034 1 6 . 1 1 204 204 ALA C C 204 176.859 176.859 179.346 -2.487 19854 6035 1 6 . 1 1 204 204 ALA CA C 204 54.579 54.579 54.855 -0.276 19854 6036 1 6 . 1 1 204 204 ALA CB C 204 18.270 18.270 18.298 -0.028 19854 6037 1 6 . 1 1 204 204 ALA H H 204 8.528 8.528 7.818 0.710 19854 6038 1 6 . 1 1 205 205 GLN N N 205 123.328 123.328 116.341 6.987 19854 6039 1 6 . 1 1 205 205 GLN C C 205 177.418 177.418 178.160 -0.742 19854 6040 1 6 . 1 1 205 205 GLN CA C 205 57.515 57.515 58.481 -0.966 19854 6041 1 6 . 1 1 205 205 GLN CB C 205 33.785 33.785 29.014 4.771 19854 6042 1 6 . 1 1 205 205 GLN H H 205 8.160 8.160 7.927 0.233 19854 6043 1 6 . 1 1 206 206 THR N N 206 120.271 120.271 113.738 6.533 19854 6044 1 6 . 1 1 206 206 THR C C 206 176.273 176.273 175.433 0.840 19854 6045 1 6 . 1 1 206 206 THR CA C 206 67.462 67.462 64.606 2.856 19854 6046 1 6 . 1 1 206 206 THR CB C 206 70.390 70.390 69.070 1.320 19854 6047 1 6 . 1 1 206 206 THR H H 206 7.585 7.585 7.739 -0.154 19854 6048 1 6 . 1 1 207 207 THR N N 207 111.970 111.970 118.694 -6.724 19854 6049 1 6 . 1 1 207 207 THR C C 207 176.566 176.566 174.048 2.518 19854 6050 1 6 . 1 1 207 207 THR CA C 207 64.534 64.534 63.417 1.117 19854 6051 1 6 . 1 1 207 207 THR CB C 207 72.733 72.733 69.538 3.195 19854 6052 1 6 . 1 1 207 207 THR H H 207 7.468 7.468 7.552 -0.084 19854 6053 1 6 . 1 1 208 208 ALA N N 208 115.623 115.623 128.557 -12.934 19854 6054 1 6 . 1 1 208 208 ALA C C 208 168.947 168.947 177.248 -8.301 19854 6055 1 6 . 1 1 208 208 ALA CA C 208 55.164 55.164 52.040 3.124 19854 6056 1 6 . 1 1 208 208 ALA CB C 208 22.369 22.369 19.510 2.859 19854 6057 1 6 . 1 1 208 208 ALA H H 208 7.390 7.390 8.239 -0.849 19854 6058 1 6 . 1 1 209 209 LEU N N 209 117.814 117.814 124.831 -7.017 19854 6059 1 6 . 1 1 209 209 LEU C C 209 176.273 176.273 175.564 0.709 19854 6060 1 6 . 1 1 209 209 LEU CA C 209 58.678 58.678 52.463 6.215 19854 6061 1 6 . 1 1 209 209 LEU CB C 209 46.380 46.380 42.680 3.700 19854 6062 1 6 . 1 1 209 209 LEU H H 209 7.652 7.652 8.114 -0.462 19854 6063 1 6 . 1 1 210 210 PRO C C 210 176.566 176.566 175.771 0.795 19854 6064 1 6 . 1 1 210 210 PRO CA C 210 63.086 63.086 62.077 1.009 19854 6065 1 6 . 1 1 210 210 PRO CB C 210 31.146 31.146 32.751 -1.605 19854 6066 1 6 . 1 1 211 211 ASP N N 211 122.863 122.863 119.822 3.041 19854 6067 1 6 . 1 1 211 211 ASP C C 211 175.686 175.686 175.472 0.214 19854 6068 1 6 . 1 1 211 211 ASP CA C 211 56.343 56.343 54.421 1.922 19854 6069 1 6 . 1 1 211 211 ASP CB C 211 41.402 41.402 40.926 0.476 19854 6070 1 6 . 1 1 211 211 ASP H H 211 8.360 8.360 8.330 0.030 19854 6071 1 6 . 1 1 212 212 GLU N N 212 131.162 131.162 125.063 6.099 19854 6072 1 6 . 1 1 212 212 GLU C C 212 176.273 176.273 176.300 -0.027 19854 6073 1 6 . 1 1 212 212 GLU CA C 212 55.164 55.164 57.389 -2.225 19854 6074 1 6 . 1 1 212 212 GLU CB C 212 30.568 30.568 31.492 -0.924 19854 6075 1 6 . 1 1 212 212 GLU H H 212 8.399 8.399 8.453 -0.054 19854 6076 1 6 . 1 1 213 213 ASP N N 213 122.797 122.797 116.190 6.607 19854 6077 1 6 . 1 1 213 213 ASP C C 213 177.152 177.152 177.118 0.034 19854 6078 1 6 . 1 1 213 213 ASP CA C 213 61.914 61.914 53.194 8.720 19854 6079 1 6 . 1 1 213 213 ASP CB C 213 49.607 49.607 40.869 8.738 19854 6080 1 6 . 1 1 213 213 ASP H H 213 8.168 8.168 8.398 -0.230 19854 6081 1 6 . 1 1 214 214 ASP N N 214 112.369 112.369 121.654 -9.285 19854 6082 1 6 . 1 1 214 214 ASP C C 214 178.910 178.910 177.218 1.692 19854 6083 1 6 . 1 1 214 214 ASP CA C 214 54.579 54.579 56.788 -2.209 19854 6084 1 6 . 1 1 214 214 ASP CB C 214 39.353 39.353 40.358 -1.006 19854 6085 1 6 . 1 1 214 214 ASP H H 214 7.464 7.464 8.021 -0.557 19854 6086 1 6 . 1 1 215 215 ASP N N 215 127.244 127.244 118.861 8.383 19854 6087 1 6 . 1 1 215 215 ASP C C 215 176.859 176.859 177.040 -0.181 19854 6088 1 6 . 1 1 215 215 ASP CA C 215 54.579 54.579 55.893 -1.314 19854 6089 1 6 . 1 1 215 215 ASP CB C 215 40.524 40.524 40.800 -0.276 19854 6090 1 6 . 1 1 215 215 ASP H H 215 8.301 8.301 8.303 -0.002 19854 6091 1 7 . 1 1 2 2 ALA N N 2 131.228 131.228 123.841 7.387 19854 6092 1 7 . 1 1 2 2 ALA C C 2 187.031 187.031 179.103 7.928 19854 6093 1 7 . 1 1 2 2 ALA CA C 2 53.407 53.407 55.350 -1.943 19854 6094 1 7 . 1 1 2 2 ALA CB C 2 20.027 20.027 18.379 1.648 19854 6095 1 7 . 1 1 2 2 ALA H H 2 10.644 10.644 8.657 1.987 19854 6096 1 7 . 1 1 3 3 ALA N N 3 124.521 124.521 120.476 4.045 19854 6097 1 7 . 1 1 3 3 ALA C C 3 176.566 176.566 179.196 -2.630 19854 6098 1 7 . 1 1 3 3 ALA CA C 3 49.894 49.894 54.437 -4.543 19854 6099 1 7 . 1 1 3 3 ALA CB C 3 18.270 18.270 17.785 0.485 19854 6100 1 7 . 1 1 3 3 ALA H H 3 8.669 8.669 8.196 0.473 19854 6101 1 7 . 1 1 4 4 GLN N N 4 118.080 118.080 116.767 1.313 19854 6102 1 7 . 1 1 4 4 GLN C C 4 176.273 176.273 177.126 -0.853 19854 6103 1 7 . 1 1 4 4 GLN CA C 4 54.579 54.579 56.555 -1.976 19854 6104 1 7 . 1 1 4 4 GLN CB C 4 27.054 27.054 29.190 -2.136 19854 6105 1 7 . 1 1 4 4 GLN H H 4 8.919 8.919 8.240 0.679 19854 6106 1 7 . 1 1 5 5 GLY N N 5 121.002 121.002 106.315 14.687 19854 6107 1 7 . 1 1 5 5 GLY C C 5 181.877 181.877 173.678 8.199 19854 6108 1 7 . 1 1 5 5 GLY CA C 5 45.794 45.794 44.748 1.046 19854 6109 1 7 . 1 1 5 5 GLY H H 5 8.082 8.082 7.901 0.181 19854 6110 1 7 . 1 1 6 6 GLU N N 6 129.435 129.435 122.196 7.239 19854 6111 1 7 . 1 1 6 6 GLU C C 6 176.566 176.566 174.855 1.711 19854 6112 1 7 . 1 1 6 6 GLU CA C 6 56.336 56.336 53.169 3.167 19854 6113 1 7 . 1 1 6 6 GLU CB C 6 28.811 28.811 30.410 -1.599 19854 6114 1 7 . 1 1 6 6 GLU H H 6 9.267 9.267 7.875 1.392 19854 6115 1 7 . 1 1 7 7 PRO C C 7 176.566 176.566 177.215 -0.649 19854 6116 1 7 . 1 1 7 7 PRO CA C 7 63.672 63.672 64.732 -1.060 19854 6117 1 7 . 1 1 7 7 PRO CB C 7 31.146 31.146 32.249 -1.103 19854 6118 1 7 . 1 1 8 8 GLN N N 8 112.502 112.502 113.246 -0.744 19854 6119 1 7 . 1 1 8 8 GLN C C 8 177.445 177.445 175.324 2.121 19854 6120 1 7 . 1 1 8 8 GLN CA C 8 50.479 50.479 56.195 -5.716 19854 6121 1 7 . 1 1 8 8 GLN CB C 8 28.811 28.811 31.796 -2.985 19854 6122 1 7 . 1 1 8 8 GLN H H 8 6.220 6.220 8.177 -1.957 19854 6123 1 7 . 1 1 9 9 VAL N N 9 117.416 117.416 117.989 -0.573 19854 6124 1 7 . 1 1 9 9 VAL C C 9 178.324 178.324 173.608 4.716 19854 6125 1 7 . 1 1 9 9 VAL CA C 9 63.363 63.363 60.774 2.589 19854 6126 1 7 . 1 1 9 9 VAL CB C 9 34.668 34.668 35.330 -0.662 19854 6127 1 7 . 1 1 9 9 VAL H H 9 6.561 6.561 7.754 -1.193 19854 6128 1 7 . 1 1 10 10 GLN N N 10 113.896 113.896 123.110 -9.214 19854 6129 1 7 . 1 1 10 10 GLN C C 10 176.273 176.273 174.562 1.711 19854 6130 1 7 . 1 1 10 10 GLN CA C 10 55.164 55.164 53.879 1.285 19854 6131 1 7 . 1 1 10 10 GLN CB C 10 28.226 28.226 32.194 -3.968 19854 6132 1 7 . 1 1 10 10 GLN H H 10 7.847 7.847 8.002 -0.155 19854 6133 1 7 . 1 1 11 11 PHE N N 11 118.744 118.744 124.703 -5.959 19854 6134 1 7 . 1 1 11 11 PHE C C 11 176.566 176.566 174.816 1.750 19854 6135 1 7 . 1 1 11 11 PHE CA C 11 59.849 59.849 56.337 3.512 19854 6136 1 7 . 1 1 11 11 PHE CB C 11 41.109 41.109 42.058 -0.949 19854 6137 1 7 . 1 1 11 11 PHE H H 11 8.262 8.262 8.968 -0.706 19854 6138 1 7 . 1 1 12 12 LYS N N 12 129.437 129.437 125.817 3.620 19854 6139 1 7 . 1 1 12 12 LYS C C 12 178.609 178.609 175.017 3.592 19854 6140 1 7 . 1 1 12 12 LYS CA C 12 57.808 57.808 55.997 1.811 19854 6141 1 7 . 1 1 12 12 LYS H H 12 10.015 10.015 8.829 1.186 19854 6142 1 7 . 1 1 13 13 LEU N N 13 112.103 112.103 130.294 -18.191 19854 6143 1 7 . 1 1 13 13 LEU C C 13 177.738 177.738 174.663 3.075 19854 6144 1 7 . 1 1 13 13 LEU CA C 13 54.579 54.579 53.561 1.018 19854 6145 1 7 . 1 1 13 13 LEU CB C 13 42.866 42.866 45.366 -2.500 19854 6146 1 7 . 1 1 13 13 LEU H H 13 6.905 6.905 9.159 -2.254 19854 6147 1 7 . 1 1 14 14 VAL N N 14 127.310 127.310 128.119 -0.809 19854 6148 1 7 . 1 1 14 14 VAL C C 14 175.393 175.393 174.192 1.201 19854 6149 1 7 . 1 1 14 14 VAL CA C 14 70.976 70.976 61.806 9.170 19854 6150 1 7 . 1 1 14 14 VAL CB C 14 28.811 28.811 33.354 -4.543 19854 6151 1 7 . 1 1 14 14 VAL H H 14 8.305 8.305 8.958 -0.653 19854 6152 1 7 . 1 1 15 15 LEU N N 15 128.640 128.640 131.052 -2.412 19854 6153 1 7 . 1 1 15 15 LEU C C 15 177.730 177.730 175.094 2.636 19854 6154 1 7 . 1 1 15 15 LEU CA C 15 55.758 55.758 53.199 2.559 19854 6155 1 7 . 1 1 15 15 LEU H H 15 7.718 7.718 9.042 -1.324 19854 6156 1 7 . 1 1 16 16 VAL N N 16 121.267 121.267 121.635 -0.368 19854 6157 1 7 . 1 1 16 16 VAL C C 16 178.324 178.324 174.394 3.930 19854 6158 1 7 . 1 1 16 16 VAL CA C 16 63.363 63.363 58.528 4.835 19854 6159 1 7 . 1 1 16 16 VAL CB C 16 35.839 35.839 35.145 0.694 19854 6160 1 7 . 1 1 16 16 VAL H H 16 8.935 8.935 8.831 0.104 19854 6161 1 7 . 1 1 17 17 GLY N N 17 127.908 127.908 106.929 20.979 19854 6162 1 7 . 1 1 17 17 GLY C C 17 174.514 174.514 173.034 1.480 19854 6163 1 7 . 1 1 17 17 GLY CA C 17 42.281 42.281 44.728 -2.447 19854 6164 1 7 . 1 1 17 17 GLY H H 17 9.682 9.682 6.914 2.768 19854 6165 1 7 . 1 1 18 18 ASP N N 18 125.054 125.054 121.287 3.767 19854 6166 1 7 . 1 1 18 18 ASP C C 18 176.851 176.851 177.492 -0.641 19854 6167 1 7 . 1 1 18 18 ASP CA C 18 57.515 57.515 54.311 3.204 19854 6168 1 7 . 1 1 18 18 ASP CB C 18 46.090 46.090 42.105 3.985 19854 6169 1 7 . 1 1 18 18 ASP H H 18 8.282 8.282 8.400 -0.118 19854 6170 1 7 . 1 1 19 19 GLY N N 19 120.670 120.670 106.557 14.113 19854 6171 1 7 . 1 1 19 19 GLY C C 19 178.324 178.324 174.808 3.516 19854 6172 1 7 . 1 1 19 19 GLY CA C 19 42.281 42.281 45.716 -3.435 19854 6173 1 7 . 1 1 19 19 GLY H H 19 8.825 8.825 8.605 0.220 19854 6174 1 7 . 1 1 20 20 GLY N N 20 129.369 129.369 112.177 17.192 19854 6175 1 7 . 1 1 20 20 GLY C C 20 174.221 174.221 175.826 -1.605 19854 6176 1 7 . 1 1 20 20 GLY CA C 20 41.695 41.695 45.534 -3.839 19854 6177 1 7 . 1 1 20 20 GLY H H 20 8.477 8.477 8.110 0.367 19854 6178 1 7 . 1 1 21 21 THR N N 21 122.199 122.199 116.548 5.651 19854 6179 1 7 . 1 1 21 21 THR C C 21 171.291 171.291 174.947 -3.656 19854 6180 1 7 . 1 1 21 21 THR CA C 21 61.914 61.914 66.064 -4.149 19854 6181 1 7 . 1 1 21 21 THR CB C 21 65.137 65.137 69.311 -4.174 19854 6182 1 7 . 1 1 21 21 THR H H 21 8.059 8.059 7.451 0.608 19854 6183 1 7 . 1 1 22 22 GLY N N 22 112.369 112.369 105.868 6.501 19854 6184 1 7 . 1 1 22 22 GLY C C 22 184.807 184.807 175.197 9.610 19854 6185 1 7 . 1 1 22 22 GLY CA C 22 45.209 45.209 45.116 0.093 19854 6186 1 7 . 1 1 22 22 GLY H H 22 6.772 6.772 8.270 -1.498 19854 6187 1 7 . 1 1 23 23 LYS N N 23 122.066 122.066 120.539 1.527 19854 6188 1 7 . 1 1 23 23 LYS C C 23 178.589 178.589 177.946 0.643 19854 6189 1 7 . 1 1 23 23 LYS CA C 23 58.101 58.101 59.819 -1.718 19854 6190 1 7 . 1 1 23 23 LYS CB C 23 40.230 40.230 32.341 7.889 19854 6191 1 7 . 1 1 23 23 LYS H H 23 7.441 7.441 8.472 -1.031 19854 6192 1 7 . 1 1 24 24 THR N N 24 114.627 114.627 114.436 0.191 19854 6193 1 7 . 1 1 24 24 THR C C 24 178.324 178.324 176.833 1.491 19854 6194 1 7 . 1 1 24 24 THR CA C 24 62.192 62.192 67.346 -5.154 19854 6195 1 7 . 1 1 24 24 THR CB C 24 71.562 71.562 68.212 3.350 19854 6196 1 7 . 1 1 24 24 THR H H 24 8.469 8.469 8.529 -0.060 19854 6197 1 7 . 1 1 25 25 THR N N 25 110.377 110.377 119.489 -9.112 19854 6198 1 7 . 1 1 25 25 THR C C 25 178.324 178.324 176.195 2.129 19854 6199 1 7 . 1 1 25 25 THR CA C 25 64.534 64.534 67.434 -2.900 19854 6200 1 7 . 1 1 25 25 THR CB C 25 71.562 71.562 68.543 3.019 19854 6201 1 7 . 1 1 25 25 THR H H 25 8.415 8.415 8.227 0.188 19854 6202 1 7 . 1 1 26 26 PHE N N 26 114.295 114.295 122.588 -8.293 19854 6203 1 7 . 1 1 26 26 PHE C C 26 174.514 174.514 177.069 -2.555 19854 6204 1 7 . 1 1 26 26 PHE CA C 26 53.407 53.407 61.995 -8.588 19854 6205 1 7 . 1 1 26 26 PHE CB C 26 40.524 40.524 39.065 1.459 19854 6206 1 7 . 1 1 26 26 PHE H H 26 7.707 7.707 8.450 -0.743 19854 6207 1 7 . 1 1 27 27 VAL N N 27 123.525 123.525 120.358 3.167 19854 6208 1 7 . 1 1 27 27 VAL C C 27 178.031 178.031 177.859 0.172 19854 6209 1 7 . 1 1 27 27 VAL CA C 27 67.462 67.462 67.019 0.443 19854 6210 1 7 . 1 1 27 27 VAL CB C 27 29.397 29.397 31.471 -2.075 19854 6211 1 7 . 1 1 27 27 VAL H H 27 6.967 6.967 8.259 -1.292 19854 6212 1 7 . 1 1 28 28 LYS N N 28 114.228 114.228 119.647 -5.419 19854 6213 1 7 . 1 1 28 28 LYS C C 28 176.566 176.566 178.636 -2.070 19854 6214 1 7 . 1 1 28 28 LYS CA C 28 58.092 58.092 59.909 -1.817 19854 6215 1 7 . 1 1 28 28 LYS CB C 28 34.082 34.082 31.956 2.126 19854 6216 1 7 . 1 1 28 28 LYS H H 28 7.429 7.429 8.190 -0.761 19854 6217 1 7 . 1 1 29 29 ARG N N 29 112.037 112.037 120.011 -7.974 19854 6218 1 7 . 1 1 29 29 ARG C C 29 174.221 174.221 178.902 -4.681 19854 6219 1 7 . 1 1 29 29 ARG CA C 29 72.147 72.147 59.256 12.891 19854 6220 1 7 . 1 1 29 29 ARG CB C 29 37.596 37.596 30.034 7.562 19854 6221 1 7 . 1 1 29 29 ARG H H 29 6.803 6.803 8.161 -1.358 19854 6222 1 7 . 1 1 30 30 HIS N N 30 122.396 122.396 117.679 4.717 19854 6223 1 7 . 1 1 30 30 HIS C C 30 172.170 172.170 177.450 -5.280 19854 6224 1 7 . 1 1 30 30 HIS CA C 30 51.651 51.651 59.466 -7.815 19854 6225 1 7 . 1 1 30 30 HIS CB C 30 30.568 30.568 29.438 1.130 19854 6226 1 7 . 1 1 30 30 HIS H H 30 7.644 7.644 7.828 -0.184 19854 6227 1 7 . 1 1 31 31 LEU N N 31 110.377 110.377 119.602 -9.225 19854 6228 1 7 . 1 1 31 31 LEU C C 31 178.031 178.031 178.773 -0.742 19854 6229 1 7 . 1 1 31 31 LEU CA C 31 55.164 55.164 57.699 -2.535 19854 6230 1 7 . 1 1 31 31 LEU CB C 31 42.281 42.281 42.160 0.121 19854 6231 1 7 . 1 1 31 31 LEU H H 31 7.894 7.894 8.290 -0.396 19854 6232 1 7 . 1 1 32 32 THR N N 32 121.468 121.468 106.108 15.360 19854 6233 1 7 . 1 1 32 32 THR C C 32 170.705 170.705 175.548 -4.843 19854 6234 1 7 . 1 1 32 32 THR CA C 32 63.668 63.668 61.887 1.781 19854 6235 1 7 . 1 1 32 32 THR CB C 32 75.679 75.679 70.756 4.923 19854 6236 1 7 . 1 1 32 32 THR H H 32 8.372 8.372 8.315 0.057 19854 6237 1 7 . 1 1 33 33 GLY N N 33 127.841 127.841 110.125 17.716 19854 6238 1 7 . 1 1 33 33 GLY C C 33 161.914 161.914 174.073 -12.159 19854 6239 1 7 . 1 1 33 33 GLY CA C 33 42.866 42.866 44.878 -2.012 19854 6240 1 7 . 1 1 33 33 GLY H H 33 9.662 9.662 7.698 1.964 19854 6241 1 7 . 1 1 34 34 GLU N N 34 120.871 120.871 120.256 0.615 19854 6242 1 7 . 1 1 34 34 GLU C C 34 174.508 174.508 175.052 -0.544 19854 6243 1 7 . 1 1 34 34 GLU CA C 34 58.101 58.101 55.932 2.168 19854 6244 1 7 . 1 1 34 34 GLU CB C 34 34.371 34.371 30.738 3.633 19854 6245 1 7 . 1 1 34 34 GLU H H 34 8.211 8.211 7.523 0.688 19854 6246 1 7 . 1 1 35 35 PHE N N 35 111.838 111.838 119.168 -7.330 19854 6247 1 7 . 1 1 35 35 PHE C C 35 174.221 174.221 175.247 -1.026 19854 6248 1 7 . 1 1 35 35 PHE CA C 35 49.308 49.308 57.047 -7.739 19854 6249 1 7 . 1 1 35 35 PHE CB C 35 41.695 41.695 40.865 0.830 19854 6250 1 7 . 1 1 35 35 PHE H H 35 6.772 6.772 8.311 -1.539 19854 6251 1 7 . 1 1 36 36 GLU N N 36 120.672 120.672 125.276 -4.604 19854 6252 1 7 . 1 1 36 36 GLU C C 36 175.686 175.686 175.987 -0.301 19854 6253 1 7 . 1 1 36 36 GLU CA C 36 58.980 58.980 54.995 3.985 19854 6254 1 7 . 1 1 36 36 GLU CB C 36 48.140 48.140 31.072 17.068 19854 6255 1 7 . 1 1 36 36 GLU H H 36 8.293 8.293 8.755 -0.462 19854 6256 1 7 . 1 1 37 37 LYS N N 37 118.810 118.810 124.986 -6.176 19854 6257 1 7 . 1 1 37 37 LYS C C 37 172.756 172.756 176.464 -3.708 19854 6258 1 7 . 1 1 37 37 LYS CA C 37 48.137 48.137 57.197 -9.060 19854 6259 1 7 . 1 1 37 37 LYS CB C 37 37.010 37.010 33.316 3.694 19854 6260 1 7 . 1 1 37 37 LYS H H 37 8.509 8.509 8.600 -0.091 19854 6261 1 7 . 1 1 38 38 LYS N N 38 108.052 108.052 120.515 -12.463 19854 6262 1 7 . 1 1 38 38 LYS C C 38 176.273 176.273 175.450 0.823 19854 6263 1 7 . 1 1 38 38 LYS CA C 38 59.849 59.849 56.174 3.675 19854 6264 1 7 . 1 1 38 38 LYS CB C 38 34.668 34.668 32.933 1.735 19854 6265 1 7 . 1 1 38 38 LYS H H 38 7.715 7.715 7.731 -0.016 19854 6266 1 7 . 1 1 39 39 TYR N N 39 108.650 108.650 126.182 -17.532 19854 6267 1 7 . 1 1 39 39 TYR C C 39 175.686 175.686 174.657 1.029 19854 6268 1 7 . 1 1 39 39 TYR CA C 39 61.020 61.020 58.208 2.812 19854 6269 1 7 . 1 1 39 39 TYR CB C 39 36.424 36.424 39.292 -2.868 19854 6270 1 7 . 1 1 39 39 TYR H H 39 7.362 7.362 8.594 -1.232 19854 6271 1 7 . 1 1 40 40 VAL N N 40 117.947 117.947 127.941 -9.994 19854 6272 1 7 . 1 1 40 40 VAL C C 40 175.393 175.393 174.055 1.338 19854 6273 1 7 . 1 1 40 40 VAL CA C 40 61.020 61.020 59.977 1.044 19854 6274 1 7 . 1 1 40 40 VAL CB C 40 31.154 31.154 35.056 -3.902 19854 6275 1 7 . 1 1 40 40 VAL H H 40 8.442 8.442 7.814 0.628 19854 6276 1 7 . 1 1 42 42 THR N N 42 117.150 117.150 119.606 -2.456 19854 6277 1 7 . 1 1 42 42 THR C C 42 178.910 178.910 174.045 4.865 19854 6278 1 7 . 1 1 42 42 THR CA C 42 60.435 60.435 62.646 -2.211 19854 6279 1 7 . 1 1 42 42 THR CB C 42 70.390 70.390 69.886 0.504 19854 6280 1 7 . 1 1 42 42 THR H H 42 8.192 8.192 8.448 -0.256 19854 6281 1 7 . 1 1 43 43 LEU N N 43 119.209 119.209 128.598 -9.389 19854 6282 1 7 . 1 1 43 43 LEU C C 43 174.807 174.807 177.787 -2.980 19854 6283 1 7 . 1 1 43 43 LEU CA C 43 57.507 57.507 54.085 3.422 19854 6284 1 7 . 1 1 43 43 LEU CB C 43 42.866 42.866 42.931 -0.065 19854 6285 1 7 . 1 1 43 43 LEU H H 43 9.260 9.260 8.471 0.789 19854 6286 1 7 . 1 1 44 44 GLY N N 44 114.361 114.361 114.022 0.339 19854 6287 1 7 . 1 1 44 44 GLY C C 44 178.910 178.910 172.812 6.098 19854 6288 1 7 . 1 1 44 44 GLY CA C 44 54.579 54.579 45.825 8.754 19854 6289 1 7 . 1 1 44 44 GLY H H 44 6.979 6.979 8.618 -1.639 19854 6290 1 7 . 1 1 45 45 VAL N N 45 110.244 110.244 122.879 -12.635 19854 6291 1 7 . 1 1 45 45 VAL C C 45 174.807 174.807 174.673 0.134 19854 6292 1 7 . 1 1 45 45 VAL CA C 45 63.363 63.363 60.645 2.718 19854 6293 1 7 . 1 1 45 45 VAL CB C 45 17.099 17.099 34.688 -17.589 19854 6294 1 7 . 1 1 45 45 VAL H H 45 8.309 8.309 8.064 0.245 19854 6295 1 7 . 1 1 46 46 GLU N N 46 130.365 130.365 126.784 3.581 19854 6296 1 7 . 1 1 46 46 GLU C C 46 176.859 176.859 174.249 2.610 19854 6297 1 7 . 1 1 46 46 GLU CA C 46 55.164 55.164 54.548 0.616 19854 6298 1 7 . 1 1 46 46 GLU CB C 46 32.325 32.325 32.210 0.115 19854 6299 1 7 . 1 1 46 46 GLU H H 46 9.741 9.741 8.711 1.030 19854 6300 1 7 . 1 1 47 47 VAL N N 47 125.254 125.254 124.245 1.009 19854 6301 1 7 . 1 1 47 47 VAL C C 47 175.661 175.661 175.032 0.629 19854 6302 1 7 . 1 1 47 47 VAL CA C 47 63.375 63.375 60.973 2.402 19854 6303 1 7 . 1 1 47 47 VAL CB C 47 37.300 37.300 31.945 5.355 19854 6304 1 7 . 1 1 47 47 VAL H H 47 8.250 8.250 6.991 1.259 19854 6305 1 7 . 1 1 48 48 HIS N N 48 129.236 129.236 126.879 2.357 19854 6306 1 7 . 1 1 48 48 HIS C C 48 169.240 169.240 172.811 -3.571 19854 6307 1 7 . 1 1 48 48 HIS CA C 48 49.894 49.894 53.168 -3.274 19854 6308 1 7 . 1 1 48 48 HIS CB C 48 27.640 27.640 31.971 -4.331 19854 6309 1 7 . 1 1 48 48 HIS H H 48 10.390 10.390 8.838 1.552 19854 6310 1 7 . 1 1 49 49 PRO C C 49 176.273 176.273 175.779 0.494 19854 6311 1 7 . 1 1 49 49 PRO CA C 49 62.500 62.500 62.813 -0.313 19854 6312 1 7 . 1 1 49 49 PRO CB C 49 29.974 29.974 32.182 -2.208 19854 6313 1 7 . 1 1 50 50 LEU N N 50 119.408 119.408 127.520 -8.112 19854 6314 1 7 . 1 1 50 50 LEU C C 50 177.445 177.445 175.086 2.359 19854 6315 1 7 . 1 1 50 50 LEU CA C 50 59.264 59.264 53.934 5.330 19854 6316 1 7 . 1 1 50 50 LEU CB C 50 42.281 42.281 45.028 -2.747 19854 6317 1 7 . 1 1 50 50 LEU H H 50 7.492 7.492 8.901 -1.409 19854 6318 1 7 . 1 1 51 51 VAL N N 51 117.947 117.947 122.852 -4.905 19854 6319 1 7 . 1 1 51 51 VAL C C 51 174.514 174.514 174.946 -0.432 19854 6320 1 7 . 1 1 51 51 VAL CA C 51 64.534 64.534 61.358 3.176 19854 6321 1 7 . 1 1 51 51 VAL CB C 51 37.010 37.010 32.908 4.102 19854 6322 1 7 . 1 1 51 51 VAL H H 51 7.715 7.715 8.095 -0.380 19854 6323 1 7 . 1 1 52 52 PHE N N 52 124.853 124.853 126.647 -1.794 19854 6324 1 7 . 1 1 52 52 PHE C C 52 175.100 175.100 174.484 0.616 19854 6325 1 7 . 1 1 52 52 PHE CA C 52 56.336 56.336 56.397 -0.061 19854 6326 1 7 . 1 1 52 52 PHE CB C 52 39.938 39.938 41.932 -1.994 19854 6327 1 7 . 1 1 52 52 PHE H H 52 8.935 8.935 9.117 -0.182 19854 6328 1 7 . 1 1 53 53 HIS N N 53 120.603 120.603 122.708 -2.105 19854 6329 1 7 . 1 1 53 53 HIS C C 53 170.119 170.119 174.936 -4.817 19854 6330 1 7 . 1 1 53 53 HIS CA C 53 55.164 55.164 56.048 -0.884 19854 6331 1 7 . 1 1 53 53 HIS CB C 53 30.568 30.568 31.376 -0.808 19854 6332 1 7 . 1 1 53 53 HIS H H 53 8.356 8.356 9.215 -0.859 19854 6333 1 7 . 1 1 54 54 THR N N 54 112.634 112.634 116.247 -3.613 19854 6334 1 7 . 1 1 54 54 THR C C 54 178.910 178.910 176.327 2.583 19854 6335 1 7 . 1 1 54 54 THR CA C 54 63.363 63.363 59.490 3.873 19854 6336 1 7 . 1 1 54 54 THR CB C 54 72.733 72.733 71.687 1.046 19854 6337 1 7 . 1 1 54 54 THR H H 54 7.574 7.574 8.491 -0.917 19854 6338 1 7 . 1 1 55 55 ASN N N 55 131.095 131.095 120.436 10.659 19854 6339 1 7 . 1 1 55 55 ASN C C 55 176.273 176.273 176.581 -0.308 19854 6340 1 7 . 1 1 55 55 ASN CA C 55 51.065 51.065 55.906 -4.841 19854 6341 1 7 . 1 1 55 55 ASN CB C 55 37.010 37.010 38.371 -1.361 19854 6342 1 7 . 1 1 55 55 ASN H H 55 10.187 10.187 8.656 1.531 19854 6343 1 7 . 1 1 56 56 ARG N N 56 122.064 122.064 117.998 4.066 19854 6344 1 7 . 1 1 56 56 ARG C C 56 175.100 175.100 176.145 -1.045 19854 6345 1 7 . 1 1 56 56 ARG CA C 56 61.606 61.606 55.983 5.623 19854 6346 1 7 . 1 1 56 56 ARG CB C 56 32.911 32.911 30.631 2.280 19854 6347 1 7 . 1 1 56 56 ARG H H 56 7.433 7.433 8.004 -0.571 19854 6348 1 7 . 1 1 57 57 GLY N N 57 127.709 127.709 107.658 20.051 19854 6349 1 7 . 1 1 57 57 GLY C C 57 175.979 175.979 172.158 3.821 19854 6350 1 7 . 1 1 57 57 GLY CA C 57 42.281 42.281 44.248 -1.967 19854 6351 1 7 . 1 1 57 57 GLY H H 57 9.373 9.373 7.720 1.653 19854 6352 1 7 . 1 1 58 58 PRO C C 58 177.152 177.152 175.797 1.355 19854 6353 1 7 . 1 1 58 58 PRO CA C 58 65.137 65.137 63.046 2.091 19854 6354 1 7 . 1 1 58 58 PRO CB C 58 29.095 29.095 32.231 -3.136 19854 6355 1 7 . 1 1 59 59 ILE N N 59 128.638 128.638 121.781 6.857 19854 6356 1 7 . 1 1 59 59 ILE C C 59 175.979 175.979 174.322 1.657 19854 6357 1 7 . 1 1 59 59 ILE CA C 59 65.120 65.120 60.181 4.939 19854 6358 1 7 . 1 1 59 59 ILE CB C 59 40.524 40.524 42.640 -2.116 19854 6359 1 7 . 1 1 59 59 ILE H H 59 8.794 8.794 8.972 -0.178 19854 6360 1 7 . 1 1 60 60 LYS N N 60 127.711 127.711 125.322 2.389 19854 6361 1 7 . 1 1 60 60 LYS C C 60 178.902 178.902 174.909 3.993 19854 6362 1 7 . 1 1 60 60 LYS CA C 60 74.293 74.293 54.389 19.904 19854 6363 1 7 . 1 1 60 60 LYS CB C 60 32.027 32.027 35.829 -3.802 19854 6364 1 7 . 1 1 60 60 LYS H H 60 8.024 8.024 8.654 -0.630 19854 6365 1 7 . 1 1 61 61 PHE N N 61 120.670 120.670 125.765 -5.095 19854 6366 1 7 . 1 1 61 61 PHE C C 61 175.393 175.393 174.913 0.480 19854 6367 1 7 . 1 1 61 61 PHE CA C 61 57.507 57.507 56.678 0.829 19854 6368 1 7 . 1 1 61 61 PHE CB C 61 41.109 41.109 40.872 0.237 19854 6369 1 7 . 1 1 61 61 PHE H H 61 7.515 7.515 9.464 -1.949 19854 6370 1 7 . 1 1 62 62 ASN N N 62 124.789 124.789 123.976 0.813 19854 6371 1 7 . 1 1 62 62 ASN C C 62 173.336 173.336 173.956 -0.620 19854 6372 1 7 . 1 1 62 62 ASN CA C 62 53.121 53.121 52.373 0.748 19854 6373 1 7 . 1 1 62 62 ASN CB C 62 41.695 41.695 39.632 2.063 19854 6374 1 7 . 1 1 62 62 ASN H H 62 8.325 8.325 9.088 -0.763 19854 6375 1 7 . 1 1 63 63 VAL N N 63 106.127 106.127 127.245 -21.118 19854 6376 1 7 . 1 1 63 63 VAL C C 63 175.100 175.100 174.964 0.136 19854 6377 1 7 . 1 1 63 63 VAL CA C 63 61.020 61.020 62.333 -1.313 19854 6378 1 7 . 1 1 63 63 VAL CB C 63 31.154 31.154 32.605 -1.451 19854 6379 1 7 . 1 1 63 63 VAL H H 63 8.113 8.113 8.767 -0.654 19854 6380 1 7 . 1 1 64 64 TRP N N 64 129.302 129.302 129.502 -0.200 19854 6381 1 7 . 1 1 64 64 TRP C C 64 177.152 177.152 175.091 2.061 19854 6382 1 7 . 1 1 64 64 TRP CA C 64 59.264 59.264 55.738 3.526 19854 6383 1 7 . 1 1 64 64 TRP CB C 64 29.397 29.397 30.053 -0.656 19854 6384 1 7 . 1 1 64 64 TRP H H 64 8.970 8.970 9.501 -0.531 19854 6385 1 7 . 1 1 65 65 ASP N N 65 119.607 119.607 125.732 -6.125 19854 6386 1 7 . 1 1 65 65 ASP C C 65 174.514 174.514 175.770 -1.256 19854 6387 1 7 . 1 1 65 65 ASP CA C 65 55.164 55.164 53.103 2.061 19854 6388 1 7 . 1 1 65 65 ASP CB C 65 41.109 41.109 43.090 -1.981 19854 6389 1 7 . 1 1 65 65 ASP H H 65 8.638 8.638 9.032 -0.394 19854 6390 1 7 . 1 1 66 66 THR N N 66 122.463 122.463 117.975 4.488 19854 6391 1 7 . 1 1 66 66 THR C C 66 178.617 178.617 174.235 4.382 19854 6392 1 7 . 1 1 66 66 THR CA C 66 68.048 68.048 59.723 8.325 19854 6393 1 7 . 1 1 66 66 THR CB C 66 71.562 71.562 71.190 0.372 19854 6394 1 7 . 1 1 66 66 THR H H 66 8.293 8.293 8.424 -0.131 19854 6395 1 7 . 1 1 67 67 ALA N N 67 104.865 104.865 122.895 -18.030 19854 6396 1 7 . 1 1 67 67 ALA C C 67 177.738 177.738 178.286 -0.548 19854 6397 1 7 . 1 1 67 67 ALA CA C 67 48.722 48.722 51.714 -2.992 19854 6398 1 7 . 1 1 67 67 ALA CB C 67 14.171 14.171 19.884 -5.713 19854 6399 1 7 . 1 1 67 67 ALA H H 67 8.657 8.657 8.020 0.637 19854 6400 1 7 . 1 1 68 68 GLY N N 68 115.357 115.357 110.068 5.289 19854 6401 1 7 . 1 1 68 68 GLY C C 68 189.533 189.533 175.966 13.567 19854 6402 1 7 . 1 1 68 68 GLY CA C 68 45.209 45.209 46.158 -0.949 19854 6403 1 7 . 1 1 68 68 GLY H H 68 10.969 10.969 8.984 1.985 19854 6404 1 7 . 1 1 69 69 GLN N N 69 122.730 122.730 119.881 2.849 19854 6405 1 7 . 1 1 69 69 GLN C C 69 174.508 174.508 176.211 -1.703 19854 6406 1 7 . 1 1 69 69 GLN CA C 69 58.394 58.394 57.577 0.817 19854 6407 1 7 . 1 1 69 69 GLN CB C 69 31.441 31.441 28.775 2.666 19854 6408 1 7 . 1 1 69 69 GLN H H 69 8.336 8.336 8.546 -0.210 19854 6409 1 7 . 1 1 70 70 GLU N N 70 114.826 114.826 120.202 -5.376 19854 6410 1 7 . 1 1 70 70 GLU C C 70 176.273 176.273 175.643 0.630 19854 6411 1 7 . 1 1 70 70 GLU CA C 70 57.507 57.507 56.470 1.037 19854 6412 1 7 . 1 1 70 70 GLU CB C 70 28.811 28.811 30.343 -1.532 19854 6413 1 7 . 1 1 70 70 GLU H H 70 9.651 9.651 8.288 1.363 19854 6414 1 7 . 1 1 71 71 LYS N N 71 116.685 116.685 122.904 -6.219 19854 6415 1 7 . 1 1 71 71 LYS C C 71 175.979 175.979 176.143 -0.164 19854 6416 1 7 . 1 1 71 71 LYS CA C 71 48.722 48.722 56.264 -7.542 19854 6417 1 7 . 1 1 71 71 LYS CB C 71 37.010 37.010 32.923 4.087 19854 6418 1 7 . 1 1 71 71 LYS H H 71 8.712 8.712 8.312 0.400 19854 6419 1 7 . 1 1 72 72 PHE N N 72 114.959 114.959 120.598 -5.639 19854 6420 1 7 . 1 1 72 72 PHE C C 72 175.686 175.686 176.361 -0.675 19854 6421 1 7 . 1 1 72 72 PHE CA C 72 56.336 56.336 58.888 -2.552 19854 6422 1 7 . 1 1 72 72 PHE CB C 72 36.424 36.424 39.026 -2.602 19854 6423 1 7 . 1 1 72 72 PHE H H 72 7.965 7.965 8.120 -0.155 19854 6424 1 7 . 1 1 73 73 GLY N N 73 117.084 117.084 111.154 5.930 19854 6425 1 7 . 1 1 73 73 GLY C C 73 168.068 168.068 174.641 -6.573 19854 6426 1 7 . 1 1 73 73 GLY CA C 73 42.281 42.281 44.803 -2.522 19854 6427 1 7 . 1 1 73 73 GLY H H 73 7.609 7.609 7.973 -0.364 19854 6428 1 7 . 1 1 74 74 GLY N N 74 120.537 120.537 108.209 12.328 19854 6429 1 7 . 1 1 74 74 GLY C C 74 174.514 174.514 176.331 -1.817 19854 6430 1 7 . 1 1 74 74 GLY CA C 74 44.037 44.037 46.751 -2.714 19854 6431 1 7 . 1 1 74 74 GLY H H 74 9.326 9.326 8.691 0.635 19854 6432 1 7 . 1 1 75 75 LEU N N 75 127.177 127.177 121.633 5.544 19854 6433 1 7 . 1 1 75 75 LEU C C 75 178.617 178.617 177.746 0.871 19854 6434 1 7 . 1 1 75 75 LEU CA C 75 53.407 53.407 56.776 -3.369 19854 6435 1 7 . 1 1 75 75 LEU CB C 75 42.281 42.281 42.035 0.246 19854 6436 1 7 . 1 1 75 75 LEU H H 75 7.628 7.628 7.805 -0.177 19854 6437 1 7 . 1 1 76 76 ARG N N 76 116.486 116.486 116.139 0.347 19854 6438 1 7 . 1 1 76 76 ARG C C 76 176.859 176.859 177.109 -0.250 19854 6439 1 7 . 1 1 76 76 ARG CA C 76 59.264 59.264 55.496 3.768 19854 6440 1 7 . 1 1 76 76 ARG CB C 76 31.154 31.154 29.334 1.821 19854 6441 1 7 . 1 1 76 76 ARG H H 76 7.143 7.143 7.527 -0.384 19854 6442 1 7 . 1 1 77 77 ASP N N 77 129.236 129.236 120.395 8.841 19854 6443 1 7 . 1 1 77 77 ASP C C 77 177.152 177.152 177.867 -0.715 19854 6444 1 7 . 1 1 77 77 ASP CA C 77 52.822 52.822 58.226 -5.404 19854 6445 1 7 . 1 1 77 77 ASP CB C 77 41.695 41.695 40.335 1.360 19854 6446 1 7 . 1 1 77 77 ASP H H 77 8.947 8.947 7.498 1.449 19854 6447 1 7 . 1 1 78 78 GLY N N 78 127.244 127.244 107.053 20.191 19854 6448 1 7 . 1 1 78 78 GLY C C 78 173.928 173.928 176.286 -2.358 19854 6449 1 7 . 1 1 78 78 GLY CA C 78 44.623 44.623 47.026 -2.403 19854 6450 1 7 . 1 1 78 78 GLY H H 78 8.219 8.219 8.335 -0.116 19854 6451 1 7 . 1 1 79 79 TYR N N 79 120.537 120.537 118.735 1.802 19854 6452 1 7 . 1 1 79 79 TYR C C 79 176.273 176.273 177.283 -1.010 19854 6453 1 7 . 1 1 79 79 TYR CA C 79 58.678 58.678 58.770 -0.092 19854 6454 1 7 . 1 1 79 79 TYR CB C 79 40.524 40.524 37.862 2.662 19854 6455 1 7 . 1 1 79 79 TYR H H 79 8.563 8.563 7.360 1.203 19854 6456 1 7 . 1 1 80 80 TYR N N 80 122.132 122.132 117.457 4.675 19854 6457 1 7 . 1 1 80 80 TYR C C 80 175.979 175.979 175.755 0.224 19854 6458 1 7 . 1 1 80 80 TYR CA C 80 62.203 62.203 59.070 3.133 19854 6459 1 7 . 1 1 80 80 TYR CB C 80 41.988 41.988 39.513 2.475 19854 6460 1 7 . 1 1 80 80 TYR H H 80 8.254 8.254 7.546 0.708 19854 6461 1 7 . 1 1 81 81 ILE N N 81 120.072 120.072 121.158 -1.086 19854 6462 1 7 . 1 1 81 81 ILE C C 81 177.445 177.445 175.993 1.452 19854 6463 1 7 . 1 1 81 81 ILE CA C 81 67.462 67.462 63.404 4.058 19854 6464 1 7 . 1 1 81 81 ILE CB C 81 41.109 41.109 37.983 3.126 19854 6465 1 7 . 1 1 81 81 ILE H H 81 8.837 8.837 7.918 0.919 19854 6466 1 7 . 1 1 82 82 GLN N N 82 121.601 121.601 123.332 -1.731 19854 6467 1 7 . 1 1 82 82 GLN C C 82 173.342 173.342 174.202 -0.860 19854 6468 1 7 . 1 1 82 82 GLN CA C 82 59.859 59.859 56.573 3.286 19854 6469 1 7 . 1 1 82 82 GLN CB C 82 30.855 30.855 26.967 3.888 19854 6470 1 7 . 1 1 82 82 GLN H H 82 8.184 8.184 8.985 -0.801 19854 6471 1 7 . 1 1 83 83 ALA N N 83 109.713 109.713 119.644 -9.931 19854 6472 1 7 . 1 1 83 83 ALA C C 83 175.979 175.979 177.226 -1.247 19854 6473 1 7 . 1 1 83 83 ALA CA C 83 54.579 54.579 52.501 2.078 19854 6474 1 7 . 1 1 83 83 ALA CB C 83 16.513 16.513 19.165 -2.652 19854 6475 1 7 . 1 1 83 83 ALA H H 83 6.306 6.306 7.460 -1.154 19854 6476 1 7 . 1 1 84 84 GLN N N 84 121.203 121.203 121.888 -0.685 19854 6477 1 7 . 1 1 84 84 GLN C C 84 177.144 177.144 176.070 1.074 19854 6478 1 7 . 1 1 84 84 GLN CA C 84 60.152 60.152 56.526 3.626 19854 6479 1 7 . 1 1 84 84 GLN CB C 84 34.957 34.957 31.174 3.783 19854 6480 1 7 . 1 1 84 84 GLN H H 84 8.180 8.180 8.569 -0.389 19854 6481 1 7 . 1 1 85 85 CYS N N 85 120.605 120.605 111.927 8.678 19854 6482 1 7 . 1 1 85 85 CYS C C 85 176.566 176.566 172.764 3.802 19854 6483 1 7 . 1 1 85 85 CYS CA C 85 65.430 65.430 56.077 9.353 19854 6484 1 7 . 1 1 85 85 CYS CB C 85 39.644 39.644 31.841 7.803 19854 6485 1 7 . 1 1 85 85 CYS H H 85 8.364 8.364 7.881 0.483 19854 6486 1 7 . 1 1 86 86 ALA N N 86 114.295 114.295 122.148 -7.853 19854 6487 1 7 . 1 1 86 86 ALA CA C 86 57.507 57.507 50.738 6.769 19854 6488 1 7 . 1 1 86 86 ALA CB C 86 21.784 21.784 22.954 -1.170 19854 6489 1 7 . 1 1 86 86 ALA H H 86 6.897 6.897 8.714 -1.817 19854 6490 1 7 . 1 1 87 87 ILE N N 87 120.670 120.670 121.224 -0.554 19854 6491 1 7 . 1 1 87 87 ILE C C 87 173.928 173.928 174.642 -0.714 19854 6492 1 7 . 1 1 87 87 ILE CA C 87 61.020 61.020 60.049 0.971 19854 6493 1 7 . 1 1 87 87 ILE CB C 87 39.938 39.938 41.449 -1.511 19854 6494 1 7 . 1 1 87 87 ILE H H 87 8.282 8.282 8.660 -0.378 19854 6495 1 7 . 1 1 88 88 ILE N N 88 120.205 120.205 127.463 -7.258 19854 6496 1 7 . 1 1 88 88 ILE C C 88 173.635 173.635 174.896 -1.261 19854 6497 1 7 . 1 1 88 88 ILE CA C 88 64.534 64.534 60.242 4.292 19854 6498 1 7 . 1 1 88 88 ILE CB C 88 37.596 37.596 39.852 -2.256 19854 6499 1 7 . 1 1 88 88 ILE H H 88 5.528 5.528 9.009 -3.481 19854 6500 1 7 . 1 1 89 89 MET N N 89 120.472 120.472 125.932 -5.460 19854 6501 1 7 . 1 1 89 89 MET C C 89 178.617 178.617 175.814 2.803 19854 6502 1 7 . 1 1 89 89 MET CA C 89 58.980 58.980 54.231 4.749 19854 6503 1 7 . 1 1 89 89 MET CB C 89 34.957 34.957 34.853 0.104 19854 6504 1 7 . 1 1 89 89 MET H H 89 8.176 8.176 8.697 -0.521 19854 6505 1 7 . 1 1 90 90 PHE N N 90 121.134 121.134 118.722 2.412 19854 6506 1 7 . 1 1 90 90 PHE C C 90 175.393 175.393 173.305 2.088 19854 6507 1 7 . 1 1 90 90 PHE CA C 90 60.435 60.435 55.688 4.747 19854 6508 1 7 . 1 1 90 90 PHE CB C 90 38.767 38.767 42.467 -3.700 19854 6509 1 7 . 1 1 90 90 PHE H H 90 9.334 9.334 8.800 0.534 19854 6510 1 7 . 1 1 91 91 ASP N N 91 120.273 120.273 121.483 -1.210 19854 6511 1 7 . 1 1 91 91 ASP C C 91 177.730 177.730 178.124 -0.394 19854 6512 1 7 . 1 1 91 91 ASP CA C 91 59.859 59.859 51.826 8.033 19854 6513 1 7 . 1 1 91 91 ASP CB C 91 44.039 44.039 42.744 1.295 19854 6514 1 7 . 1 1 91 91 ASP H H 91 7.597 7.597 8.843 -1.246 19854 6515 1 7 . 1 1 92 92 VAL N N 92 115.158 115.158 123.640 -8.482 19854 6516 1 7 . 1 1 92 92 VAL C C 92 173.342 173.342 176.606 -3.264 19854 6517 1 7 . 1 1 92 92 VAL CA C 92 64.534 64.534 65.011 -0.477 19854 6518 1 7 . 1 1 92 92 VAL CB C 92 37.596 37.596 31.354 6.242 19854 6519 1 7 . 1 1 92 92 VAL H H 92 7.738 7.738 8.531 -0.793 19854 6520 1 7 . 1 1 93 93 THR N N 93 127.179 127.179 110.255 16.924 19854 6521 1 7 . 1 1 93 93 THR C C 93 178.902 178.902 174.497 4.405 19854 6522 1 7 . 1 1 93 93 THR CA C 93 64.254 64.254 63.032 1.222 19854 6523 1 7 . 1 1 93 93 THR CB C 93 74.215 74.215 69.063 5.152 19854 6524 1 7 . 1 1 93 93 THR H H 93 7.636 7.636 8.242 -0.606 19854 6525 1 7 . 1 1 94 94 SER N N 94 122.263 122.263 115.983 6.280 19854 6526 1 7 . 1 1 94 94 SER C C 94 163.965 163.965 175.099 -11.134 19854 6527 1 7 . 1 1 94 94 SER CA C 94 59.849 59.849 55.340 4.509 19854 6528 1 7 . 1 1 94 94 SER CB C 94 62.192 62.192 64.367 -2.175 19854 6529 1 7 . 1 1 94 94 SER H H 94 7.628 7.628 7.829 -0.201 19854 6530 1 7 . 1 1 95 95 ARG N N 95 113.099 113.099 128.641 -15.542 19854 6531 1 7 . 1 1 95 95 ARG C C 95 176.273 176.273 177.902 -1.629 19854 6532 1 7 . 1 1 95 95 ARG CA C 95 53.407 53.407 59.611 -6.204 19854 6533 1 7 . 1 1 95 95 ARG CB C 95 31.154 31.154 30.024 1.130 19854 6534 1 7 . 1 1 95 95 ARG H H 95 8.102 8.102 9.077 -0.975 19854 6535 1 7 . 1 1 96 96 VAL N N 96 124.787 124.787 119.139 5.648 19854 6536 1 7 . 1 1 96 96 VAL C C 96 178.031 178.031 177.705 0.326 19854 6537 1 7 . 1 1 96 96 VAL CA C 96 68.634 68.634 66.466 2.168 19854 6538 1 7 . 1 1 96 96 VAL CB C 96 24.126 24.126 31.371 -7.245 19854 6539 1 7 . 1 1 96 96 VAL H H 96 9.146 9.146 8.056 1.090 19854 6540 1 7 . 1 1 97 97 THR N N 97 111.970 111.970 116.338 -4.368 19854 6541 1 7 . 1 1 97 97 THR C C 97 178.031 178.031 176.185 1.846 19854 6542 1 7 . 1 1 97 97 THR CA C 97 63.949 63.949 66.458 -2.509 19854 6543 1 7 . 1 1 97 97 THR CB C 97 70.390 70.390 68.968 1.422 19854 6544 1 7 . 1 1 97 97 THR H H 97 7.984 7.984 7.658 0.326 19854 6545 1 7 . 1 1 98 98 TYR N N 98 113.232 113.232 121.294 -8.062 19854 6546 1 7 . 1 1 98 98 TYR C C 98 176.273 176.273 177.644 -1.371 19854 6547 1 7 . 1 1 98 98 TYR H H 98 7.605 7.605 7.797 -0.192 19854 6548 1 7 . 1 1 99 99 LYS N N 99 123.726 123.726 118.871 4.855 19854 6549 1 7 . 1 1 99 99 LYS C C 99 178.316 178.316 178.459 -0.143 19854 6550 1 7 . 1 1 99 99 LYS CA C 99 58.691 58.691 59.414 -0.723 19854 6551 1 7 . 1 1 99 99 LYS CB C 99 36.127 36.127 32.063 4.064 19854 6552 1 7 . 1 1 99 99 LYS H H 99 8.360 8.360 8.068 0.292 19854 6553 1 7 . 1 1 100 100 ASN N N 100 111.970 111.970 116.271 -4.301 19854 6554 1 7 . 1 1 100 100 ASN C C 100 175.979 175.979 176.780 -0.801 19854 6555 1 7 . 1 1 100 100 ASN CA C 100 53.407 53.407 54.714 -1.307 19854 6556 1 7 . 1 1 100 100 ASN CB C 100 37.596 37.596 38.382 -0.786 19854 6557 1 7 . 1 1 100 100 ASN H H 100 5.778 5.778 7.883 -2.105 19854 6558 1 7 . 1 1 101 101 VAL N N 101 118.877 118.877 121.697 -2.820 19854 6559 1 7 . 1 1 101 101 VAL C C 101 173.635 173.635 175.029 -1.394 19854 6560 1 7 . 1 1 101 101 VAL CA C 101 62.777 62.777 68.445 -5.668 19854 6561 1 7 . 1 1 101 101 VAL CB C 101 27.054 27.054 29.290 -2.236 19854 6562 1 7 . 1 1 101 101 VAL H H 101 7.370 7.370 7.542 -0.172 19854 6563 1 7 . 1 1 102 102 PRO C C 102 176.566 176.566 177.189 -0.623 19854 6564 1 7 . 1 1 102 102 PRO CA C 102 62.500 62.500 65.533 -3.033 19854 6565 1 7 . 1 1 102 102 PRO CB C 102 30.853 30.853 31.028 -0.175 19854 6566 1 7 . 1 1 103 103 ASN N N 103 122.728 122.728 115.208 7.520 19854 6567 1 7 . 1 1 103 103 ASN C C 103 175.100 175.100 177.223 -2.123 19854 6568 1 7 . 1 1 103 103 ASN CA C 103 54.579 54.579 55.056 -0.477 19854 6569 1 7 . 1 1 103 103 ASN CB C 103 38.767 38.767 37.191 1.576 19854 6570 1 7 . 1 1 103 103 ASN H H 103 7.879 7.879 7.272 0.607 19854 6571 1 7 . 1 1 104 104 TRP N N 104 122.730 122.730 120.268 2.462 19854 6572 1 7 . 1 1 104 104 TRP C C 104 174.215 174.215 177.669 -3.454 19854 6573 1 7 . 1 1 104 104 TRP CA C 104 59.273 59.273 60.488 -1.215 19854 6574 1 7 . 1 1 104 104 TRP CB C 104 35.250 35.250 30.040 5.210 19854 6575 1 7 . 1 1 104 104 TRP H H 104 7.902 7.902 7.755 0.147 19854 6576 1 7 . 1 1 105 105 HIS N N 105 120.869 120.869 116.896 3.973 19854 6577 1 7 . 1 1 105 105 HIS C C 105 177.738 177.738 174.459 3.279 19854 6578 1 7 . 1 1 105 105 HIS H H 105 6.971 6.971 8.446 -1.475 19854 6579 1 7 . 1 1 106 106 ARG N N 106 126.314 126.314 122.549 3.765 19854 6580 1 7 . 1 1 106 106 ARG C C 106 176.566 176.566 176.455 0.111 19854 6581 1 7 . 1 1 106 106 ARG CA C 106 62.777 62.777 57.532 5.245 19854 6582 1 7 . 1 1 106 106 ARG CB C 106 29.397 29.397 31.407 -2.010 19854 6583 1 7 . 1 1 106 106 ARG H H 106 7.507 7.507 7.847 -0.340 19854 6584 1 7 . 1 1 107 107 ASP N N 107 119.076 119.076 121.814 -2.738 19854 6585 1 7 . 1 1 107 107 ASP C C 107 176.566 176.566 178.463 -1.897 19854 6586 1 7 . 1 1 107 107 ASP CA C 107 55.164 55.164 57.865 -2.701 19854 6587 1 7 . 1 1 107 107 ASP CB C 107 41.695 41.695 40.999 0.696 19854 6588 1 7 . 1 1 107 107 ASP H H 107 9.076 9.076 7.913 1.163 19854 6589 1 7 . 1 1 108 108 LEU N N 108 113.299 113.299 119.821 -6.522 19854 6590 1 7 . 1 1 108 108 LEU C C 108 176.273 176.273 178.375 -2.102 19854 6591 1 7 . 1 1 108 108 LEU CA C 108 59.264 59.264 58.290 0.974 19854 6592 1 7 . 1 1 108 108 LEU CB C 108 48.722 48.722 41.445 7.277 19854 6593 1 7 . 1 1 108 108 LEU H H 108 6.725 6.725 7.906 -1.181 19854 6594 1 7 . 1 1 109 109 VAL N N 109 121.267 121.267 118.568 2.699 19854 6595 1 7 . 1 1 109 109 VAL C C 109 175.393 175.393 178.399 -3.006 19854 6596 1 7 . 1 1 109 109 VAL CA C 109 63.949 63.949 66.351 -2.402 19854 6597 1 7 . 1 1 109 109 VAL CB C 109 32.911 32.911 31.123 1.788 19854 6598 1 7 . 1 1 109 109 VAL H H 109 8.763 8.763 7.658 1.105 19854 6599 1 7 . 1 1 110 110 ARG N N 110 112.900 112.900 120.531 -7.631 19854 6600 1 7 . 1 1 110 110 ARG C C 110 176.273 176.273 177.964 -1.691 19854 6601 1 7 . 1 1 110 110 ARG CA C 110 57.507 57.507 59.128 -1.621 19854 6602 1 7 . 1 1 110 110 ARG CB C 110 30.568 30.568 30.167 0.401 19854 6603 1 7 . 1 1 110 110 ARG H H 110 7.241 7.241 7.850 -0.609 19854 6604 1 7 . 1 1 111 111 VAL N N 111 115.556 115.556 116.924 -1.368 19854 6605 1 7 . 1 1 111 111 VAL C C 111 177.445 177.445 177.022 0.423 19854 6606 1 7 . 1 1 111 111 VAL CA C 111 59.849 59.849 66.155 -6.306 19854 6607 1 7 . 1 1 111 111 VAL CB C 111 32.911 32.911 32.735 0.176 19854 6608 1 7 . 1 1 111 111 VAL H H 111 7.566 7.566 7.700 -0.134 19854 6609 1 7 . 1 1 112 112 CYS N N 112 114.295 114.295 115.469 -1.174 19854 6610 1 7 . 1 1 112 112 CYS C C 112 169.826 169.826 174.451 -4.625 19854 6611 1 7 . 1 1 112 112 CYS CA C 112 57.507 57.507 58.705 -1.198 19854 6612 1 7 . 1 1 112 112 CYS CB C 112 35.839 35.839 29.108 6.731 19854 6613 1 7 . 1 1 112 112 CYS H H 112 7.425 7.425 8.283 -0.858 19854 6614 1 7 . 1 1 113 113 GLU N N 113 116.486 116.486 118.453 -1.967 19854 6615 1 7 . 1 1 113 113 GLU C C 113 176.566 176.566 175.903 0.663 19854 6616 1 7 . 1 1 113 113 GLU CA C 113 69.219 69.219 58.609 10.610 19854 6617 1 7 . 1 1 113 113 GLU CB C 113 30.568 30.568 28.011 2.557 19854 6618 1 7 . 1 1 113 113 GLU H H 113 7.241 7.241 8.409 -1.168 19854 6619 1 7 . 1 1 114 114 ASN N N 114 129.302 129.302 121.977 7.325 19854 6620 1 7 . 1 1 114 114 ASN C C 114 175.100 175.100 175.023 0.077 19854 6621 1 7 . 1 1 114 114 ASN CA C 114 52.236 52.236 53.107 -0.871 19854 6622 1 7 . 1 1 114 114 ASN CB C 114 39.938 39.938 38.290 1.648 19854 6623 1 7 . 1 1 114 114 ASN H H 114 8.919 8.919 8.411 0.508 19854 6624 1 7 . 1 1 115 115 ILE N N 115 110.443 110.443 120.063 -9.620 19854 6625 1 7 . 1 1 115 115 ILE C C 115 175.100 175.100 173.364 1.736 19854 6626 1 7 . 1 1 115 115 ILE CA C 115 65.705 65.705 57.911 7.794 19854 6627 1 7 . 1 1 115 115 ILE CB C 115 39.353 39.353 40.108 -0.755 19854 6628 1 7 . 1 1 115 115 ILE H H 115 9.287 9.287 7.955 1.332 19854 6629 1 7 . 1 1 116 116 PRO C C 116 175.979 175.979 175.756 0.223 19854 6630 1 7 . 1 1 116 116 PRO CA C 116 63.086 63.086 63.163 -0.077 19854 6631 1 7 . 1 1 116 116 PRO CB C 116 29.681 29.681 32.480 -2.799 19854 6632 1 7 . 1 1 117 117 ILE N N 117 123.591 123.591 123.855 -0.264 19854 6633 1 7 . 1 1 117 117 ILE C C 117 174.807 174.807 175.151 -0.344 19854 6634 1 7 . 1 1 117 117 ILE CA C 117 66.291 66.291 60.318 5.973 19854 6635 1 7 . 1 1 117 117 ILE CB C 117 38.767 38.767 42.292 -3.525 19854 6636 1 7 . 1 1 117 117 ILE H H 117 7.781 7.781 8.585 -0.804 19854 6637 1 7 . 1 1 118 118 VAL N N 118 119.009 119.009 125.725 -6.716 19854 6638 1 7 . 1 1 118 118 VAL C C 118 178.324 178.324 174.812 3.512 19854 6639 1 7 . 1 1 118 118 VAL CA C 118 62.777 62.777 60.711 2.066 19854 6640 1 7 . 1 1 118 118 VAL CB C 118 31.154 31.154 34.000 -2.846 19854 6641 1 7 . 1 1 118 118 VAL H H 118 8.767 8.767 8.848 -0.081 19854 6642 1 7 . 1 1 119 119 LEU N N 119 119.408 119.408 127.029 -7.621 19854 6643 1 7 . 1 1 119 119 LEU C C 119 178.031 178.031 176.049 1.982 19854 6644 1 7 . 1 1 119 119 LEU CA C 119 42.866 42.866 53.843 -10.977 19854 6645 1 7 . 1 1 119 119 LEU CB C 119 38.767 38.767 43.729 -4.962 19854 6646 1 7 . 1 1 119 119 LEU H H 119 7.734 7.734 9.145 -1.411 19854 6647 1 7 . 1 1 120 120 CYS N N 120 113.232 113.232 122.406 -9.174 19854 6648 1 7 . 1 1 120 120 CYS C C 120 178.031 178.031 174.260 3.771 19854 6649 1 7 . 1 1 120 120 CYS H H 120 8.317 8.317 9.105 -0.788 19854 6650 1 7 . 1 1 121 121 GLY N N 121 117.349 117.349 113.442 3.907 19854 6651 1 7 . 1 1 121 121 GLY C C 121 176.851 176.851 172.842 4.009 19854 6652 1 7 . 1 1 121 121 GLY CA C 121 41.109 41.109 43.729 -2.620 19854 6653 1 7 . 1 1 121 121 GLY H H 121 7.515 7.515 8.907 -1.392 19854 6654 1 7 . 1 1 122 122 ASN N N 122 125.318 125.318 123.852 1.466 19854 6655 1 7 . 1 1 122 122 ASN C C 122 175.686 175.686 175.771 -0.085 19854 6656 1 7 . 1 1 122 122 ASN CA C 122 50.479 50.479 49.980 0.499 19854 6657 1 7 . 1 1 122 122 ASN CB C 122 39.353 39.353 40.830 -1.477 19854 6658 1 7 . 1 1 122 122 ASN H H 122 9.162 9.162 8.606 0.556 19854 6659 1 7 . 1 1 123 123 LYS N N 123 122.132 122.132 114.178 7.954 19854 6660 1 7 . 1 1 123 123 LYS C C 123 173.043 173.043 177.102 -4.059 19854 6661 1 7 . 1 1 123 123 LYS CA C 123 58.101 58.101 57.552 0.549 19854 6662 1 7 . 1 1 123 123 LYS CB C 123 35.543 35.543 29.744 5.799 19854 6663 1 7 . 1 1 123 123 LYS H H 123 7.953 7.953 8.608 -0.655 19854 6664 1 7 . 1 1 124 124 VAL N N 124 123.726 123.726 113.125 10.601 19854 6665 1 7 . 1 1 124 124 VAL C C 124 175.679 175.679 176.596 -0.917 19854 6666 1 7 . 1 1 124 124 VAL CA C 124 64.840 64.840 64.602 0.238 19854 6667 1 7 . 1 1 124 124 VAL CB C 124 42.574 42.574 31.378 11.196 19854 6668 1 7 . 1 1 124 124 VAL H H 124 8.555 8.555 7.551 1.004 19854 6669 1 7 . 1 1 125 125 ASP N N 125 119.607 119.607 120.011 -0.404 19854 6670 1 7 . 1 1 125 125 ASP C C 125 176.566 176.566 176.887 -0.321 19854 6671 1 7 . 1 1 125 125 ASP CA C 125 55.750 55.750 56.261 -0.512 19854 6672 1 7 . 1 1 125 125 ASP CB C 125 40.524 40.524 41.118 -0.594 19854 6673 1 7 . 1 1 125 125 ASP H H 125 7.875 7.875 8.148 -0.273 19854 6674 1 7 . 1 1 126 126 ILE N N 126 116.088 116.088 120.519 -4.431 19854 6675 1 7 . 1 1 126 126 ILE C C 126 177.152 177.152 176.544 0.608 19854 6676 1 7 . 1 1 126 126 ILE CA C 126 66.291 66.291 61.851 4.440 19854 6677 1 7 . 1 1 126 126 ILE CB C 126 39.353 39.353 38.322 1.031 19854 6678 1 7 . 1 1 126 126 ILE H H 126 7.511 7.511 7.437 0.074 19854 6679 1 7 . 1 1 127 127 LYS N N 127 121.203 121.203 125.382 -4.179 19854 6680 1 7 . 1 1 127 127 LYS C C 127 175.979 175.979 177.098 -1.119 19854 6681 1 7 . 1 1 127 127 LYS CA C 127 58.101 58.101 58.535 -0.434 19854 6682 1 7 . 1 1 127 127 LYS CB C 127 35.834 35.834 32.559 3.276 19854 6683 1 7 . 1 1 127 127 LYS H H 127 8.113 8.113 8.438 -0.325 19854 6684 1 7 . 1 1 128 128 ASP N N 128 118.279 118.279 120.175 -1.896 19854 6685 1 7 . 1 1 128 128 ASP C C 128 176.566 176.566 175.083 1.483 19854 6686 1 7 . 1 1 128 128 ASP CA C 128 53.407 53.407 53.084 0.323 19854 6687 1 7 . 1 1 128 128 ASP CB C 128 40.524 40.524 39.702 0.822 19854 6688 1 7 . 1 1 128 128 ASP H H 128 7.241 7.241 8.185 -0.944 19854 6689 1 7 . 1 1 129 129 ARG N N 129 118.943 118.943 123.679 -4.736 19854 6690 1 7 . 1 1 129 129 ARG C C 129 177.738 177.738 176.258 1.480 19854 6691 1 7 . 1 1 129 129 ARG CA C 129 45.794 45.794 56.436 -10.642 19854 6692 1 7 . 1 1 129 129 ARG CB C 129 31.154 31.154 30.968 0.186 19854 6693 1 7 . 1 1 129 129 ARG H H 129 8.423 8.423 7.791 0.632 19854 6694 1 7 . 1 1 130 130 LYS N N 130 109.381 109.381 122.469 -13.088 19854 6695 1 7 . 1 1 130 130 LYS C C 130 176.566 176.566 176.761 -0.195 19854 6696 1 7 . 1 1 130 130 LYS CA C 130 55.164 55.164 56.636 -1.472 19854 6697 1 7 . 1 1 130 130 LYS CB C 130 36.424 36.424 33.650 2.774 19854 6698 1 7 . 1 1 130 130 LYS H H 130 7.296 7.296 8.406 -1.110 19854 6699 1 7 . 1 1 131 131 VAL N N 131 110.377 110.377 120.877 -10.500 19854 6700 1 7 . 1 1 131 131 VAL C C 131 178.617 178.617 174.674 3.943 19854 6701 1 7 . 1 1 131 131 VAL CA C 131 65.705 65.705 61.462 4.243 19854 6702 1 7 . 1 1 131 131 VAL CB C 131 35.839 35.839 31.642 4.197 19854 6703 1 7 . 1 1 131 131 VAL H H 131 9.283 9.283 8.243 1.040 19854 6704 1 7 . 1 1 132 132 LYS N N 132 110.310 110.310 127.446 -17.136 19854 6705 1 7 . 1 1 132 132 LYS C C 132 176.273 176.273 177.491 -1.218 19854 6706 1 7 . 1 1 132 132 LYS CA C 132 59.849 59.849 55.747 4.102 19854 6707 1 7 . 1 1 132 132 LYS CB C 132 35.253 35.253 34.302 0.951 19854 6708 1 7 . 1 1 132 132 LYS H H 132 9.709 9.709 8.381 1.328 19854 6709 1 7 . 1 1 133 133 ALA N N 133 134.349 134.349 126.910 7.439 19854 6710 1 7 . 1 1 133 133 ALA CA C 133 51.065 51.065 54.820 -3.755 19854 6711 1 7 . 1 1 133 133 ALA CB C 133 12.999 12.999 18.545 -5.546 19854 6712 1 7 . 1 1 133 133 ALA H H 133 6.322 6.322 8.691 -2.369 19854 6713 1 7 . 1 1 134 134 LYS N N 134 117.615 117.615 118.170 -0.555 19854 6714 1 7 . 1 1 134 134 LYS C C 134 176.859 176.859 178.193 -1.334 19854 6715 1 7 . 1 1 134 134 LYS CA C 134 55.750 55.750 58.426 -2.676 19854 6716 1 7 . 1 1 134 134 LYS CB C 134 54.579 54.579 32.479 22.100 19854 6717 1 7 . 1 1 134 134 LYS H H 134 6.549 6.549 8.097 -1.548 19854 6718 1 7 . 1 1 135 135 SER N N 135 109.314 109.314 114.174 -4.860 19854 6719 1 7 . 1 1 135 135 SER C C 135 173.635 173.635 174.984 -1.349 19854 6720 1 7 . 1 1 135 135 SER CA C 135 56.336 56.336 59.743 -3.407 19854 6721 1 7 . 1 1 135 135 SER CB C 135 63.949 63.949 63.087 0.862 19854 6722 1 7 . 1 1 135 135 SER H H 135 7.840 7.840 7.715 0.125 19854 6723 1 7 . 1 1 136 136 ILE N N 136 124.123 124.123 122.060 2.063 19854 6724 1 7 . 1 1 136 136 ILE C C 136 175.100 175.100 176.088 -0.988 19854 6725 1 7 . 1 1 136 136 ILE CA C 136 68.634 68.634 62.849 5.785 19854 6726 1 7 . 1 1 136 136 ILE CB C 136 43.452 43.452 38.003 5.449 19854 6727 1 7 . 1 1 136 136 ILE H H 136 8.098 8.098 7.377 0.721 19854 6728 1 7 . 1 1 137 137 VAL N N 137 113.232 113.232 121.911 -8.679 19854 6729 1 7 . 1 1 137 137 VAL C C 137 176.859 176.859 176.067 0.792 19854 6730 1 7 . 1 1 137 137 VAL CA C 137 64.534 64.534 61.432 3.102 19854 6731 1 7 . 1 1 137 137 VAL CB C 137 34.082 34.082 33.074 1.008 19854 6732 1 7 . 1 1 137 137 VAL H H 137 7.711 7.711 8.048 -0.337 19854 6733 1 7 . 1 1 138 138 PHE N N 138 118.279 118.279 123.344 -5.065 19854 6734 1 7 . 1 1 138 138 PHE C C 138 175.393 175.393 176.276 -0.883 19854 6735 1 7 . 1 1 138 138 PHE CA C 138 58.092 58.092 62.689 -4.597 19854 6736 1 7 . 1 1 138 138 PHE CB C 138 39.353 39.353 39.222 0.131 19854 6737 1 7 . 1 1 138 138 PHE H H 138 8.317 8.317 7.661 0.656 19854 6738 1 7 . 1 1 139 139 HIS N N 139 120.605 120.605 116.092 4.513 19854 6739 1 7 . 1 1 139 139 HIS C C 139 175.979 175.979 177.636 -1.657 19854 6740 1 7 . 1 1 139 139 HIS CA C 139 67.775 67.775 59.438 8.337 19854 6741 1 7 . 1 1 139 139 HIS CB C 139 35.836 35.836 28.696 7.140 19854 6742 1 7 . 1 1 139 139 HIS H H 139 8.094 8.094 8.987 -0.893 19854 6743 1 7 . 1 1 140 140 ARG N N 140 120.140 120.140 120.272 -0.132 19854 6744 1 7 . 1 1 140 140 ARG C C 140 178.023 178.023 179.231 -1.208 19854 6745 1 7 . 1 1 140 140 ARG CA C 140 58.394 58.394 59.280 -0.886 19854 6746 1 7 . 1 1 140 140 ARG CB C 140 39.644 39.644 29.688 9.956 19854 6747 1 7 . 1 1 140 140 ARG H H 140 8.149 8.149 7.001 1.148 19854 6748 1 7 . 1 1 141 141 LYS N N 141 115.623 115.623 119.661 -4.038 19854 6749 1 7 . 1 1 141 141 LYS C C 141 173.635 173.635 178.035 -4.400 19854 6750 1 7 . 1 1 141 141 LYS CA C 141 58.092 58.092 58.812 -0.721 19854 6751 1 7 . 1 1 141 141 LYS CB C 141 33.496 33.496 32.234 1.262 19854 6752 1 7 . 1 1 141 141 LYS H H 141 7.449 7.449 7.529 -0.080 19854 6753 1 7 . 1 1 142 142 LYS N N 142 114.162 114.162 116.126 -1.964 19854 6754 1 7 . 1 1 142 142 LYS C C 142 175.979 175.979 175.938 0.041 19854 6755 1 7 . 1 1 142 142 LYS CA C 142 51.065 51.065 55.063 -3.998 19854 6756 1 7 . 1 1 142 142 LYS CB C 142 34.668 34.668 32.234 2.434 19854 6757 1 7 . 1 1 142 142 LYS H H 142 8.982 8.982 7.800 1.182 19854 6758 1 7 . 1 1 143 143 ASN N N 143 112.103 112.103 114.916 -2.813 19854 6759 1 7 . 1 1 143 143 ASN C C 143 175.100 175.100 174.178 0.922 19854 6760 1 7 . 1 1 143 143 ASN CA C 143 53.407 53.407 53.947 -0.540 19854 6761 1 7 . 1 1 143 143 ASN CB C 143 39.938 39.938 36.454 3.484 19854 6762 1 7 . 1 1 143 143 ASN H H 143 7.402 7.402 7.698 -0.296 19854 6763 1 7 . 1 1 144 144 LEU N N 144 118.810 118.810 116.894 1.916 19854 6764 1 7 . 1 1 144 144 LEU CA C 144 53.993 53.993 53.177 0.816 19854 6765 1 7 . 1 1 144 144 LEU CB C 144 42.866 42.866 44.684 -1.818 19854 6766 1 7 . 1 1 144 144 LEU H H 144 7.793 7.793 8.001 -0.208 19854 6767 1 7 . 1 1 145 145 GLN N N 145 119.607 119.607 118.141 1.466 19854 6768 1 7 . 1 1 145 145 GLN C C 145 176.859 176.859 174.087 2.772 19854 6769 1 7 . 1 1 145 145 GLN CA C 145 55.164 55.164 54.339 0.825 19854 6770 1 7 . 1 1 145 145 GLN CB C 145 29.983 29.983 31.260 -1.277 19854 6771 1 7 . 1 1 145 145 GLN H H 145 7.014 7.014 7.960 -0.946 19854 6772 1 7 . 1 1 146 146 TYR N N 146 119.275 119.275 124.749 -5.474 19854 6773 1 7 . 1 1 146 146 TYR C C 146 174.807 174.807 174.373 0.434 19854 6774 1 7 . 1 1 146 146 TYR CA C 146 62.777 62.777 56.156 6.621 19854 6775 1 7 . 1 1 146 146 TYR CB C 146 41.109 41.109 40.175 0.934 19854 6776 1 7 . 1 1 146 146 TYR H H 146 9.350 9.350 8.261 1.089 19854 6777 1 7 . 1 1 147 147 TYR N N 147 123.658 123.658 125.855 -2.197 19854 6778 1 7 . 1 1 147 147 TYR C C 147 177.738 177.738 173.846 3.892 19854 6779 1 7 . 1 1 147 147 TYR CA C 147 58.092 58.092 56.190 1.902 19854 6780 1 7 . 1 1 147 147 TYR CB C 147 39.938 39.938 41.847 -1.909 19854 6781 1 7 . 1 1 147 147 TYR H H 147 8.340 8.340 8.683 -0.343 19854 6782 1 7 . 1 1 148 148 ASP N N 148 121.267 121.267 123.742 -2.475 19854 6783 1 7 . 1 1 148 148 ASP C C 148 176.859 176.859 175.260 1.599 19854 6784 1 7 . 1 1 148 148 ASP CA C 148 54.579 54.579 54.514 0.065 19854 6785 1 7 . 1 1 148 148 ASP CB C 148 41.109 41.109 41.633 -0.524 19854 6786 1 7 . 1 1 148 148 ASP H H 148 8.911 8.911 8.320 0.591 19854 6787 1 7 . 1 1 149 149 ILE N N 149 119.607 119.607 118.753 0.854 19854 6788 1 7 . 1 1 149 149 ILE C C 149 174.807 174.807 174.350 0.457 19854 6789 1 7 . 1 1 149 149 ILE CA C 149 61.020 61.020 59.097 1.923 19854 6790 1 7 . 1 1 149 149 ILE CB C 149 39.353 39.353 42.563 -3.210 19854 6791 1 7 . 1 1 149 149 ILE H H 149 8.712 8.712 8.649 0.063 19854 6792 1 7 . 1 1 150 150 SER N N 150 117.349 117.349 117.046 0.303 19854 6793 1 7 . 1 1 150 150 SER C C 150 175.686 175.686 174.523 1.163 19854 6794 1 7 . 1 1 150 150 SER CA C 150 60.435 60.435 55.384 5.051 19854 6795 1 7 . 1 1 150 150 SER CB C 150 62.192 62.192 65.394 -3.202 19854 6796 1 7 . 1 1 150 150 SER H H 150 8.454 8.454 8.513 -0.059 19854 6797 1 7 . 1 1 151 151 ALA N N 151 131.162 131.162 131.008 0.154 19854 6798 1 7 . 1 1 151 151 ALA C C 151 160.742 160.742 179.480 -18.738 19854 6799 1 7 . 1 1 151 151 ALA CA C 151 53.993 53.993 55.283 -1.290 19854 6800 1 7 . 1 1 151 151 ALA CB C 151 22.369 22.369 18.876 3.493 19854 6801 1 7 . 1 1 151 151 ALA H H 151 10.640 10.640 9.023 1.617 19854 6802 1 7 . 1 1 152 152 LYS N N 152 121.400 121.400 118.859 2.541 19854 6803 1 7 . 1 1 152 152 LYS C C 152 174.221 174.221 178.055 -3.834 19854 6804 1 7 . 1 1 152 152 LYS CA C 152 59.849 59.849 58.552 1.297 19854 6805 1 7 . 1 1 152 152 LYS CB C 152 34.668 34.668 32.489 2.179 19854 6806 1 7 . 1 1 152 152 LYS H H 152 9.099 9.099 8.481 0.618 19854 6807 1 7 . 1 1 153 153 SER N N 153 135.212 135.212 111.389 23.823 19854 6808 1 7 . 1 1 153 153 SER C C 153 177.152 177.152 174.014 3.138 19854 6809 1 7 . 1 1 153 153 SER CA C 153 62.192 62.192 58.706 3.486 19854 6810 1 7 . 1 1 153 153 SER CB C 153 66.291 66.291 63.924 2.367 19854 6811 1 7 . 1 1 153 153 SER H H 153 8.935 8.935 7.823 1.112 19854 6812 1 7 . 1 1 154 154 ASN N N 154 119.341 119.341 115.606 3.735 19854 6813 1 7 . 1 1 154 154 ASN C C 154 175.979 175.979 174.109 1.870 19854 6814 1 7 . 1 1 154 154 ASN CA C 154 49.894 49.894 54.703 -4.809 19854 6815 1 7 . 1 1 154 154 ASN CB C 154 39.353 39.353 36.735 2.618 19854 6816 1 7 . 1 1 154 154 ASN H H 154 7.488 7.488 8.217 -0.729 19854 6817 1 7 . 1 1 155 155 TYR N N 155 120.074 120.074 123.057 -2.983 19854 6818 1 7 . 1 1 155 155 TYR C C 155 177.144 177.144 175.165 1.979 19854 6819 1 7 . 1 1 155 155 TYR CA C 155 60.738 60.738 59.700 1.038 19854 6820 1 7 . 1 1 155 155 TYR CB C 155 41.402 41.402 38.879 2.523 19854 6821 1 7 . 1 1 155 155 TYR H H 155 7.945 7.945 7.590 0.355 19854 6822 1 7 . 1 1 156 156 ASN N N 156 124.058 124.058 122.915 1.143 19854 6823 1 7 . 1 1 156 156 ASN C C 156 175.679 175.679 174.356 1.323 19854 6824 1 7 . 1 1 156 156 ASN CA C 156 53.121 53.121 54.148 -1.027 19854 6825 1 7 . 1 1 156 156 ASN CB C 156 38.179 38.179 35.883 2.296 19854 6826 1 7 . 1 1 156 156 ASN H H 156 8.192 8.192 8.635 -0.443 19854 6827 1 7 . 1 1 157 157 PHE N N 157 123.459 123.459 118.237 5.222 19854 6828 1 7 . 1 1 157 157 PHE C C 157 174.221 174.221 176.099 -1.878 19854 6829 1 7 . 1 1 157 157 PHE CA C 157 57.507 57.507 60.975 -3.468 19854 6830 1 7 . 1 1 157 157 PHE CB C 157 39.353 39.353 39.476 -0.123 19854 6831 1 7 . 1 1 157 157 PHE H H 157 7.429 7.429 7.562 -0.133 19854 6832 1 7 . 1 1 158 158 GLU N N 158 112.568 112.568 116.663 -4.095 19854 6833 1 7 . 1 1 158 158 GLU C C 158 176.566 176.566 177.339 -0.773 19854 6834 1 7 . 1 1 158 158 GLU CA C 158 72.147 72.147 58.192 13.955 19854 6835 1 7 . 1 1 158 158 GLU CB C 158 27.640 27.640 29.075 -1.435 19854 6836 1 7 . 1 1 158 158 GLU H H 158 7.495 7.495 8.761 -1.266 19854 6837 1 7 . 1 1 159 159 LYS N N 159 113.232 113.232 119.685 -6.453 19854 6838 1 7 . 1 1 159 159 LYS C C 159 176.566 176.566 175.487 1.079 19854 6839 1 7 . 1 1 159 159 LYS CA C 159 53.993 53.993 60.946 -6.953 19854 6840 1 7 . 1 1 159 159 LYS CB C 159 33.496 33.496 30.069 3.427 19854 6841 1 7 . 1 1 159 159 LYS H H 159 6.862 6.862 8.108 -1.246 19854 6842 1 7 . 1 1 160 160 PRO C C 160 176.273 176.273 178.462 -2.189 19854 6843 1 7 . 1 1 160 160 PRO CA C 160 64.258 64.258 66.059 -1.801 19854 6844 1 7 . 1 1 160 160 PRO CB C 160 32.318 32.318 30.954 1.364 19854 6845 1 7 . 1 1 161 161 PHE N N 161 123.726 123.726 115.785 7.941 19854 6846 1 7 . 1 1 161 161 PHE C C 161 176.851 176.851 176.607 0.244 19854 6847 1 7 . 1 1 161 161 PHE CA C 161 60.445 60.445 59.892 0.553 19854 6848 1 7 . 1 1 161 161 PHE CB C 161 40.816 40.816 36.741 4.075 19854 6849 1 7 . 1 1 161 161 PHE H H 161 8.215 8.215 7.113 1.102 19854 6850 1 7 . 1 1 162 162 LEU N N 162 110.177 110.177 120.193 -10.016 19854 6851 1 7 . 1 1 162 162 LEU C C 162 176.273 176.273 178.864 -2.591 19854 6852 1 7 . 1 1 162 162 LEU CA C 162 55.750 55.750 57.642 -1.892 19854 6853 1 7 . 1 1 162 162 LEU CB C 162 44.037 44.037 41.107 2.930 19854 6854 1 7 . 1 1 162 162 LEU H H 162 7.527 7.527 7.174 0.353 19854 6855 1 7 . 1 1 163 163 TRP N N 163 123.525 123.525 121.399 2.126 19854 6856 1 7 . 1 1 163 163 TRP C C 163 177.152 177.152 177.965 -0.813 19854 6857 1 7 . 1 1 163 163 TRP CA C 163 61.606 61.606 62.156 -0.549 19854 6858 1 7 . 1 1 163 163 TRP CB C 163 28.811 28.811 29.450 -0.639 19854 6859 1 7 . 1 1 163 163 TRP H H 163 7.476 7.476 8.185 -0.709 19854 6860 1 7 . 1 1 164 164 LEU N N 164 119.740 119.740 119.120 0.620 19854 6861 1 7 . 1 1 164 164 LEU C C 164 175.686 175.686 178.932 -3.246 19854 6862 1 7 . 1 1 164 164 LEU CA C 164 61.020 61.020 57.873 3.147 19854 6863 1 7 . 1 1 164 164 LEU CB C 164 45.794 45.794 41.492 4.302 19854 6864 1 7 . 1 1 164 164 LEU H H 164 9.412 9.412 8.057 1.355 19854 6865 1 7 . 1 1 165 165 ALA N N 165 118.013 118.013 121.414 -3.401 19854 6866 1 7 . 1 1 165 165 ALA C C 165 165.723 165.723 179.617 -13.894 19854 6867 1 7 . 1 1 165 165 ALA CA C 165 52.236 52.236 55.295 -3.059 19854 6868 1 7 . 1 1 165 165 ALA CB C 165 21.784 21.784 18.279 3.505 19854 6869 1 7 . 1 1 165 165 ALA H H 165 7.707 7.707 8.408 -0.701 19854 6870 1 7 . 1 1 166 166 ARG N N 166 122.994 122.994 118.417 4.577 19854 6871 1 7 . 1 1 166 166 ARG C C 166 175.979 175.979 178.861 -2.882 19854 6872 1 7 . 1 1 166 166 ARG CA C 166 49.308 49.308 59.154 -9.846 19854 6873 1 7 . 1 1 166 166 ARG CB C 166 29.397 29.397 30.185 -0.788 19854 6874 1 7 . 1 1 166 166 ARG H H 166 8.692 8.692 8.197 0.495 19854 6875 1 7 . 1 1 167 167 LYS N N 167 112.568 112.568 120.229 -7.661 19854 6876 1 7 . 1 1 167 167 LYS C C 167 176.273 176.273 179.180 -2.907 19854 6877 1 7 . 1 1 167 167 LYS CA C 167 58.092 58.092 58.437 -0.345 19854 6878 1 7 . 1 1 167 167 LYS CB C 167 34.668 34.668 31.425 3.243 19854 6879 1 7 . 1 1 167 167 LYS H H 167 6.819 6.819 7.488 -0.669 19854 6880 1 7 . 1 1 168 168 LEU N N 168 114.959 114.959 119.445 -4.486 19854 6881 1 7 . 1 1 168 168 LEU C C 168 177.738 177.738 179.009 -1.271 19854 6882 1 7 . 1 1 168 168 LEU CA C 168 56.921 56.921 57.531 -0.610 19854 6883 1 7 . 1 1 168 168 LEU CB C 168 41.695 41.695 41.599 0.096 19854 6884 1 7 . 1 1 168 168 LEU H H 168 7.269 7.269 7.739 -0.470 19854 6885 1 7 . 1 1 169 169 ILE N N 169 122.199 122.199 117.283 4.916 19854 6886 1 7 . 1 1 169 169 ILE C C 169 177.445 177.445 177.133 0.312 19854 6887 1 7 . 1 1 169 169 ILE CA C 169 63.375 63.375 63.234 0.141 19854 6888 1 7 . 1 1 169 169 ILE CB C 169 42.281 42.281 38.635 3.646 19854 6889 1 7 . 1 1 169 169 ILE H H 169 8.360 8.360 8.080 0.280 19854 6890 1 7 . 1 1 170 170 GLY N N 170 113.099 113.099 106.779 6.320 19854 6891 1 7 . 1 1 170 170 GLY C C 170 162.496 162.496 174.006 -11.510 19854 6892 1 7 . 1 1 170 170 GLY CA C 170 44.037 44.037 44.887 -0.850 19854 6893 1 7 . 1 1 170 170 GLY H H 170 6.686 6.686 8.016 -1.330 19854 6894 1 7 . 1 1 171 171 ASP N N 171 113.232 113.232 121.900 -8.668 19854 6895 1 7 . 1 1 171 171 ASP C C 171 178.910 178.910 175.782 3.128 19854 6896 1 7 . 1 1 171 171 ASP CA C 171 50.479 50.479 50.429 0.050 19854 6897 1 7 . 1 1 171 171 ASP CB C 171 41.109 41.109 41.690 -0.581 19854 6898 1 7 . 1 1 171 171 ASP H H 171 6.815 6.815 7.719 -0.904 19854 6899 1 7 . 1 1 172 172 PRO C C 172 176.566 176.566 177.219 -0.653 19854 6900 1 7 . 1 1 172 172 PRO CA C 172 63.965 63.965 64.344 -0.379 19854 6901 1 7 . 1 1 172 172 PRO CB C 172 31.732 31.732 32.254 -0.522 19854 6902 1 7 . 1 1 173 173 ASN N N 173 109.779 109.779 116.020 -6.241 19854 6903 1 7 . 1 1 173 173 ASN C C 173 175.979 175.979 174.829 1.150 19854 6904 1 7 . 1 1 173 173 ASN CA C 173 54.579 54.579 53.110 1.469 19854 6905 1 7 . 1 1 173 173 ASN CB C 173 36.424 36.424 38.843 -2.420 19854 6906 1 7 . 1 1 173 173 ASN H H 173 8.016 8.016 8.380 -0.364 19854 6907 1 7 . 1 1 174 174 LEU N N 174 109.248 109.248 123.176 -13.928 19854 6908 1 7 . 1 1 174 174 LEU C C 174 176.566 176.566 175.610 0.956 19854 6909 1 7 . 1 1 174 174 LEU CA C 174 56.336 56.336 56.075 0.261 19854 6910 1 7 . 1 1 174 174 LEU CB C 174 44.037 44.037 42.709 1.328 19854 6911 1 7 . 1 1 174 174 LEU H H 174 7.871 7.871 7.285 0.586 19854 6912 1 7 . 1 1 175 175 GLU N N 175 125.185 125.185 123.569 1.616 19854 6913 1 7 . 1 1 175 175 GLU C C 175 177.445 177.445 174.824 2.621 19854 6914 1 7 . 1 1 175 175 GLU CA C 175 76.247 76.247 54.117 22.130 19854 6915 1 7 . 1 1 175 175 GLU CB C 175 28.811 28.811 34.069 -5.258 19854 6916 1 7 . 1 1 175 175 GLU H H 175 9.127 9.127 8.032 1.095 19854 6917 1 7 . 1 1 176 176 PHE N N 176 136.873 136.873 123.248 13.625 19854 6918 1 7 . 1 1 176 176 PHE C C 176 178.617 178.617 175.707 2.910 19854 6919 1 7 . 1 1 176 176 PHE CA C 176 59.264 59.264 58.550 0.714 19854 6920 1 7 . 1 1 176 176 PHE CB C 176 44.623 44.623 40.344 4.279 19854 6921 1 7 . 1 1 176 176 PHE H H 176 10.058 10.058 8.765 1.293 19854 6922 1 7 . 1 1 177 177 VAL N N 177 118.877 118.877 124.088 -5.211 19854 6923 1 7 . 1 1 177 177 VAL C C 177 177.445 177.445 174.175 3.270 19854 6924 1 7 . 1 1 177 177 VAL CA C 177 62.777 62.777 59.058 3.719 19854 6925 1 7 . 1 1 177 177 VAL CB C 177 34.668 34.668 34.145 0.523 19854 6926 1 7 . 1 1 177 177 VAL H H 177 7.789 7.789 8.085 -0.296 19854 6927 1 7 . 1 1 178 178 ALA N N 178 123.859 123.859 124.719 -0.860 19854 6928 1 7 . 1 1 178 178 ALA C C 178 177.144 177.144 177.341 -0.197 19854 6929 1 7 . 1 1 178 178 ALA CA C 178 54.000 54.000 54.523 -0.523 19854 6930 1 7 . 1 1 178 178 ALA CB C 178 15.035 15.035 18.799 -3.764 19854 6931 1 7 . 1 1 178 178 ALA H H 178 7.683 7.683 8.136 -0.453 19854 6932 1 7 . 1 1 179 179 MET N N 179 121.668 121.668 117.123 4.545 19854 6933 1 7 . 1 1 179 179 MET C C 179 177.144 177.144 173.461 3.683 19854 6934 1 7 . 1 1 179 179 MET CA C 179 60.445 60.445 52.935 7.510 19854 6935 1 7 . 1 1 179 179 MET CB C 179 39.351 39.351 33.355 5.997 19854 6936 1 7 . 1 1 179 179 MET H H 179 7.648 7.648 7.708 -0.060 19854 6937 1 7 . 1 1 180 180 PRO C C 180 177.445 177.445 175.284 2.161 19854 6938 1 7 . 1 1 180 180 PRO CA C 180 64.844 64.844 62.339 2.505 19854 6939 1 7 . 1 1 180 180 PRO CB C 180 29.974 29.974 33.181 -3.207 19854 6940 1 7 . 1 1 181 181 ALA N N 181 128.439 128.439 123.858 4.581 19854 6941 1 7 . 1 1 181 181 ALA C C 181 176.273 176.273 177.155 -0.882 19854 6942 1 7 . 1 1 181 181 ALA CA C 181 58.092 58.092 51.943 6.149 19854 6943 1 7 . 1 1 181 181 ALA CB C 181 21.198 21.198 19.492 1.706 19854 6944 1 7 . 1 1 181 181 ALA H H 181 8.673 8.673 8.212 0.461 19854 6945 1 7 . 1 1 182 182 LEU N N 182 122.130 122.130 121.341 0.789 19854 6946 1 7 . 1 1 182 182 LEU C C 182 177.445 177.445 176.847 0.598 19854 6947 1 7 . 1 1 182 182 LEU CA C 182 55.164 55.164 54.294 0.870 19854 6948 1 7 . 1 1 182 182 LEU CB C 182 42.866 42.866 43.761 -0.895 19854 6949 1 7 . 1 1 182 182 LEU H H 182 8.821 8.821 8.452 0.369 19854 6950 1 7 . 1 1 183 183 ALA N N 183 121.004 121.004 128.079 -7.075 19854 6951 1 7 . 1 1 183 183 ALA C C 183 178.617 178.617 175.775 2.842 19854 6952 1 7 . 1 1 183 183 ALA CA C 183 57.808 57.808 50.217 7.591 19854 6953 1 7 . 1 1 183 183 ALA CB C 183 24.117 24.117 18.626 5.491 19854 6954 1 7 . 1 1 183 183 ALA H H 183 8.356 8.356 8.318 0.038 19854 6955 1 7 . 1 1 184 184 PRO C C 184 177.152 177.152 175.411 1.741 19854 6956 1 7 . 1 1 184 184 PRO CA C 184 64.258 64.258 61.961 2.297 19854 6957 1 7 . 1 1 184 184 PRO CB C 184 29.681 29.681 31.485 -1.804 19854 6958 1 7 . 1 1 185 185 PRO C C 185 175.686 175.686 177.189 -1.503 19854 6959 1 7 . 1 1 185 185 PRO CA C 185 63.379 63.379 62.273 1.106 19854 6960 1 7 . 1 1 185 185 PRO CB C 185 35.248 35.248 32.629 2.619 19854 6961 1 7 . 1 1 186 186 GLU N N 186 120.539 120.539 119.660 0.879 19854 6962 1 7 . 1 1 186 186 GLU C C 186 176.273 176.273 175.927 0.346 19854 6963 1 7 . 1 1 186 186 GLU CA C 186 58.101 58.101 57.723 0.378 19854 6964 1 7 . 1 1 186 186 GLU CB C 186 35.836 35.836 29.835 6.001 19854 6965 1 7 . 1 1 186 186 GLU H H 186 8.086 8.086 8.495 -0.409 19854 6966 1 7 . 1 1 187 187 VAL N N 187 124.455 124.455 117.592 6.863 19854 6967 1 7 . 1 1 187 187 VAL C C 187 178.910 178.910 174.720 4.190 19854 6968 1 7 . 1 1 187 187 VAL CA C 187 63.363 63.363 62.890 0.473 19854 6969 1 7 . 1 1 187 187 VAL CB C 187 34.082 34.082 31.115 2.967 19854 6970 1 7 . 1 1 187 187 VAL H H 187 8.622 8.622 8.067 0.555 19854 6971 1 7 . 1 1 188 188 VAL N N 188 128.572 128.572 123.586 4.986 19854 6972 1 7 . 1 1 188 188 VAL C C 188 178.324 178.324 176.165 2.159 19854 6973 1 7 . 1 1 188 188 VAL CA C 188 68.634 68.634 60.291 8.344 19854 6974 1 7 . 1 1 188 188 VAL CB C 188 31.154 31.154 34.738 -3.584 19854 6975 1 7 . 1 1 188 188 VAL H H 188 8.497 8.497 7.583 0.914 19854 6976 1 7 . 1 1 189 189 MET N N 189 122.795 122.795 117.931 4.864 19854 6977 1 7 . 1 1 189 189 MET C C 189 177.445 177.445 175.415 2.030 19854 6978 1 7 . 1 1 189 189 MET CA C 189 55.164 55.164 57.232 -2.068 19854 6979 1 7 . 1 1 189 189 MET CB C 189 35.253 35.253 31.753 3.500 19854 6980 1 7 . 1 1 189 189 MET H H 189 6.991 6.991 8.627 -1.636 19854 6981 1 7 . 1 1 190 190 ASP N N 190 114.959 114.959 115.856 -0.897 19854 6982 1 7 . 1 1 190 190 ASP C C 190 175.686 175.686 176.019 -0.333 19854 6983 1 7 . 1 1 190 190 ASP CA C 190 51.065 51.065 54.570 -3.505 19854 6984 1 7 . 1 1 190 190 ASP CB C 190 41.695 41.695 38.927 2.768 19854 6985 1 7 . 1 1 190 190 ASP H H 190 7.210 7.210 8.646 -1.436 19854 6986 1 7 . 1 1 191 191 PRO C C 191 176.566 176.566 177.330 -0.764 19854 6987 1 7 . 1 1 191 191 PRO CA C 191 63.965 63.965 64.876 -0.911 19854 6988 1 7 . 1 1 191 191 PRO CB C 191 31.146 31.146 31.850 -0.704 19854 6989 1 7 . 1 1 192 192 ALA N N 192 109.513 109.513 120.878 -11.365 19854 6990 1 7 . 1 1 192 192 ALA CA C 192 53.993 53.993 54.188 -0.195 19854 6991 1 7 . 1 1 192 192 ALA CB C 192 19.441 19.441 18.778 0.663 19854 6992 1 7 . 1 1 192 192 ALA H H 192 7.394 7.394 8.039 -0.644 19854 6993 1 7 . 1 1 193 193 LEU N N 193 119.009 119.009 117.999 1.010 19854 6994 1 7 . 1 1 193 193 LEU C C 193 175.979 175.979 177.032 -1.053 19854 6995 1 7 . 1 1 193 193 LEU CA C 193 56.336 56.336 55.892 0.444 19854 6996 1 7 . 1 1 193 193 LEU CB C 193 42.866 42.866 42.025 0.841 19854 6997 1 7 . 1 1 193 193 LEU H H 193 8.340 8.340 7.894 0.446 19854 6998 1 7 . 1 1 194 194 ALA N N 194 121.666 121.666 118.290 3.376 19854 6999 1 7 . 1 1 194 194 ALA C C 194 166.896 166.896 178.142 -11.246 19854 7000 1 7 . 1 1 194 194 ALA CA C 194 55.164 55.164 51.905 3.259 19854 7001 1 7 . 1 1 194 194 ALA CB C 194 16.513 16.513 19.481 -2.968 19854 7002 1 7 . 1 1 194 194 ALA H H 194 8.176 8.176 7.478 0.698 19854 7003 1 7 . 1 1 195 195 ALA N N 195 119.541 119.541 120.867 -1.326 19854 7004 1 7 . 1 1 195 195 ALA C C 195 173.928 173.928 178.971 -5.043 19854 7005 1 7 . 1 1 195 195 ALA CA C 195 57.507 57.507 54.526 2.981 19854 7006 1 7 . 1 1 195 195 ALA CB C 195 19.441 19.441 17.211 2.230 19854 7007 1 7 . 1 1 195 195 ALA H H 195 8.364 8.364 8.965 -0.601 19854 7008 1 7 . 1 1 196 196 GLN N N 196 107.322 107.322 118.776 -11.454 19854 7009 1 7 . 1 1 196 196 GLN C C 196 176.273 176.273 178.041 -1.768 19854 7010 1 7 . 1 1 196 196 GLN CA C 196 56.921 56.921 58.938 -2.017 19854 7011 1 7 . 1 1 196 196 GLN CB C 196 29.983 29.983 28.723 1.260 19854 7012 1 7 . 1 1 196 196 GLN H H 196 7.910 7.910 7.807 0.103 19854 7013 1 7 . 1 1 197 197 TYR N N 197 119.277 119.277 117.996 1.281 19854 7014 1 7 . 1 1 197 197 TYR C C 197 178.316 178.316 178.502 -0.186 19854 7015 1 7 . 1 1 197 197 TYR CA C 197 56.343 56.343 61.802 -5.459 19854 7016 1 7 . 1 1 197 197 TYR CB C 197 43.453 43.453 37.873 5.580 19854 7017 1 7 . 1 1 197 197 TYR H H 197 8.180 8.180 8.323 -0.143 19854 7018 1 7 . 1 1 198 198 GLU N N 198 110.244 110.244 118.841 -8.597 19854 7019 1 7 . 1 1 198 198 GLU C C 198 176.273 176.273 178.789 -2.516 19854 7020 1 7 . 1 1 198 198 GLU CA C 198 53.407 53.407 59.728 -6.321 19854 7021 1 7 . 1 1 198 198 GLU CB C 198 30.568 30.568 29.120 1.448 19854 7022 1 7 . 1 1 198 198 GLU H H 198 7.523 7.523 8.266 -0.743 19854 7023 1 7 . 1 1 199 199 HIS N N 199 119.211 119.211 119.969 -0.758 19854 7024 1 7 . 1 1 199 199 HIS C C 199 178.902 178.902 177.100 1.802 19854 7025 1 7 . 1 1 199 199 HIS CA C 199 58.687 58.687 59.714 -1.027 19854 7026 1 7 . 1 1 199 199 HIS CB C 199 34.957 34.957 30.091 4.866 19854 7027 1 7 . 1 1 199 199 HIS H H 199 8.258 8.258 8.250 0.008 19854 7028 1 7 . 1 1 200 200 ASP N N 200 124.722 124.722 120.400 4.322 19854 7029 1 7 . 1 1 200 200 ASP C C 200 176.705 176.705 178.878 -2.173 19854 7030 1 7 . 1 1 200 200 ASP CA C 200 58.687 58.687 57.378 1.309 19854 7031 1 7 . 1 1 200 200 ASP CB C 200 39.644 39.644 40.359 -0.715 19854 7032 1 7 . 1 1 200 200 ASP H H 200 8.086 8.086 8.138 -0.052 19854 7033 1 7 . 1 1 201 201 LEU N N 201 116.353 116.353 120.231 -3.878 19854 7034 1 7 . 1 1 201 201 LEU C C 201 178.910 178.910 179.034 -0.124 19854 7035 1 7 . 1 1 201 201 LEU CA C 201 61.606 61.606 58.205 3.401 19854 7036 1 7 . 1 1 201 201 LEU CB C 201 41.109 41.109 41.821 -0.712 19854 7037 1 7 . 1 1 201 201 LEU H H 201 7.722 7.722 8.004 -0.282 19854 7038 1 7 . 1 1 202 202 GLU N N 202 118.080 118.080 119.975 -1.895 19854 7039 1 7 . 1 1 202 202 GLU C C 202 176.566 176.566 179.450 -2.884 19854 7040 1 7 . 1 1 202 202 GLU CA C 202 56.921 56.921 59.372 -2.451 19854 7041 1 7 . 1 1 202 202 GLU CB C 202 30.568 30.568 29.609 0.959 19854 7042 1 7 . 1 1 202 202 GLU H H 202 8.857 8.857 8.032 0.825 19854 7043 1 7 . 1 1 203 203 VAL N N 203 129.369 129.369 119.911 9.458 19854 7044 1 7 . 1 1 203 203 VAL C C 203 178.617 178.617 177.707 0.910 19854 7045 1 7 . 1 1 203 203 VAL CA C 203 64.534 64.534 66.457 -1.923 19854 7046 1 7 . 1 1 203 203 VAL CB C 203 27.640 27.640 31.117 -3.477 19854 7047 1 7 . 1 1 203 203 VAL H H 203 9.283 9.283 7.882 1.401 19854 7048 1 7 . 1 1 204 204 ALA N N 204 109.580 109.580 121.867 -12.287 19854 7049 1 7 . 1 1 204 204 ALA C C 204 176.859 176.859 179.462 -2.603 19854 7050 1 7 . 1 1 204 204 ALA CA C 204 54.579 54.579 55.022 -0.443 19854 7051 1 7 . 1 1 204 204 ALA CB C 204 18.270 18.270 18.240 0.030 19854 7052 1 7 . 1 1 204 204 ALA H H 204 8.528 8.528 7.934 0.594 19854 7053 1 7 . 1 1 205 205 GLN N N 205 123.328 123.328 116.313 7.015 19854 7054 1 7 . 1 1 205 205 GLN C C 205 177.418 177.418 178.183 -0.765 19854 7055 1 7 . 1 1 205 205 GLN CA C 205 57.515 57.515 58.362 -0.848 19854 7056 1 7 . 1 1 205 205 GLN CB C 205 33.785 33.785 29.063 4.722 19854 7057 1 7 . 1 1 205 205 GLN H H 205 8.160 8.160 8.041 0.119 19854 7058 1 7 . 1 1 206 206 THR N N 206 120.271 120.271 113.942 6.329 19854 7059 1 7 . 1 1 206 206 THR C C 206 176.273 176.273 175.445 0.828 19854 7060 1 7 . 1 1 206 206 THR CA C 206 67.462 67.462 64.711 2.751 19854 7061 1 7 . 1 1 206 206 THR CB C 206 70.390 70.390 69.096 1.294 19854 7062 1 7 . 1 1 206 206 THR H H 206 7.585 7.585 7.851 -0.266 19854 7063 1 7 . 1 1 207 207 THR N N 207 111.970 111.970 118.753 -6.783 19854 7064 1 7 . 1 1 207 207 THR C C 207 176.566 176.566 173.944 2.622 19854 7065 1 7 . 1 1 207 207 THR CA C 207 64.534 64.534 63.392 1.143 19854 7066 1 7 . 1 1 207 207 THR CB C 207 72.733 72.733 69.630 3.103 19854 7067 1 7 . 1 1 207 207 THR H H 207 7.468 7.468 7.583 -0.115 19854 7068 1 7 . 1 1 208 208 ALA N N 208 115.623 115.623 128.064 -12.441 19854 7069 1 7 . 1 1 208 208 ALA C C 208 168.947 168.947 176.797 -7.850 19854 7070 1 7 . 1 1 208 208 ALA CA C 208 55.164 55.164 52.533 2.631 19854 7071 1 7 . 1 1 208 208 ALA CB C 208 22.369 22.369 19.177 3.192 19854 7072 1 7 . 1 1 208 208 ALA H H 208 7.390 7.390 8.440 -1.050 19854 7073 1 7 . 1 1 209 209 LEU N N 209 117.814 117.814 125.113 -7.299 19854 7074 1 7 . 1 1 209 209 LEU C C 209 176.273 176.273 175.339 0.934 19854 7075 1 7 . 1 1 209 209 LEU CA C 209 58.678 58.678 52.190 6.489 19854 7076 1 7 . 1 1 209 209 LEU CB C 209 46.380 46.380 43.078 3.302 19854 7077 1 7 . 1 1 209 209 LEU H H 209 7.652 7.652 8.161 -0.509 19854 7078 1 7 . 1 1 210 210 PRO C C 210 176.566 176.566 175.766 0.800 19854 7079 1 7 . 1 1 210 210 PRO CA C 210 63.086 63.086 62.238 0.848 19854 7080 1 7 . 1 1 210 210 PRO CB C 210 31.146 31.146 32.409 -1.263 19854 7081 1 7 . 1 1 211 211 ASP N N 211 122.863 122.863 119.480 3.383 19854 7082 1 7 . 1 1 211 211 ASP C C 211 175.686 175.686 175.874 -0.188 19854 7083 1 7 . 1 1 211 211 ASP CA C 211 56.343 56.343 55.193 1.151 19854 7084 1 7 . 1 1 211 211 ASP CB C 211 41.402 41.402 41.236 0.166 19854 7085 1 7 . 1 1 211 211 ASP H H 211 8.360 8.360 8.279 0.081 19854 7086 1 7 . 1 1 212 212 GLU N N 212 131.162 131.162 124.866 6.296 19854 7087 1 7 . 1 1 212 212 GLU C C 212 176.273 176.273 176.125 0.148 19854 7088 1 7 . 1 1 212 212 GLU CA C 212 55.164 55.164 57.497 -2.333 19854 7089 1 7 . 1 1 212 212 GLU CB C 212 30.568 30.568 31.433 -0.865 19854 7090 1 7 . 1 1 212 212 GLU H H 212 8.399 8.399 8.784 -0.385 19854 7091 1 7 . 1 1 213 213 ASP N N 213 122.797 122.797 115.496 7.301 19854 7092 1 7 . 1 1 213 213 ASP C C 213 177.152 177.152 177.243 -0.091 19854 7093 1 7 . 1 1 213 213 ASP CA C 213 61.914 61.914 53.604 8.310 19854 7094 1 7 . 1 1 213 213 ASP CB C 213 49.607 49.607 41.068 8.539 19854 7095 1 7 . 1 1 213 213 ASP H H 213 8.168 8.168 8.356 -0.188 19854 7096 1 7 . 1 1 214 214 ASP N N 214 112.369 112.369 121.662 -9.293 19854 7097 1 7 . 1 1 214 214 ASP C C 214 178.910 178.910 177.257 1.653 19854 7098 1 7 . 1 1 214 214 ASP CA C 214 54.579 54.579 56.950 -2.371 19854 7099 1 7 . 1 1 214 214 ASP CB C 214 39.353 39.353 40.434 -1.081 19854 7100 1 7 . 1 1 214 214 ASP H H 214 7.464 7.464 8.153 -0.689 19854 7101 1 7 . 1 1 215 215 ASP N N 215 127.244 127.244 118.933 8.311 19854 7102 1 7 . 1 1 215 215 ASP C C 215 176.859 176.859 177.012 -0.153 19854 7103 1 7 . 1 1 215 215 ASP CA C 215 54.579 54.579 56.080 -1.501 19854 7104 1 7 . 1 1 215 215 ASP CB C 215 40.524 40.524 41.279 -0.755 19854 7105 1 7 . 1 1 215 215 ASP H H 215 8.301 8.301 8.089 0.212 19854 7106 1 8 . 1 1 2 2 ALA N N 2 131.228 131.228 124.706 6.522 19854 7107 1 8 . 1 1 2 2 ALA C C 2 187.031 187.031 178.994 8.037 19854 7108 1 8 . 1 1 2 2 ALA CA C 2 53.407 53.407 55.006 -1.599 19854 7109 1 8 . 1 1 2 2 ALA CB C 2 20.027 20.027 18.306 1.721 19854 7110 1 8 . 1 1 2 2 ALA H H 2 10.644 10.644 8.365 2.279 19854 7111 1 8 . 1 1 3 3 ALA N N 3 124.521 124.521 120.367 4.154 19854 7112 1 8 . 1 1 3 3 ALA C C 3 176.566 176.566 179.038 -2.472 19854 7113 1 8 . 1 1 3 3 ALA CA C 3 49.894 49.894 54.428 -4.534 19854 7114 1 8 . 1 1 3 3 ALA CB C 3 18.270 18.270 18.347 -0.077 19854 7115 1 8 . 1 1 3 3 ALA H H 3 8.669 8.669 7.826 0.843 19854 7116 1 8 . 1 1 4 4 GLN N N 4 118.080 118.080 115.700 2.380 19854 7117 1 8 . 1 1 4 4 GLN C C 4 176.273 176.273 176.856 -0.583 19854 7118 1 8 . 1 1 4 4 GLN CA C 4 54.579 54.579 56.995 -2.416 19854 7119 1 8 . 1 1 4 4 GLN CB C 4 27.054 27.054 29.554 -2.500 19854 7120 1 8 . 1 1 4 4 GLN H H 4 8.919 8.919 8.167 0.752 19854 7121 1 8 . 1 1 5 5 GLY N N 5 121.002 121.002 105.188 15.814 19854 7122 1 8 . 1 1 5 5 GLY C C 5 181.877 181.877 173.360 8.517 19854 7123 1 8 . 1 1 5 5 GLY CA C 5 45.794 45.794 44.677 1.117 19854 7124 1 8 . 1 1 5 5 GLY H H 5 8.082 8.082 7.827 0.255 19854 7125 1 8 . 1 1 6 6 GLU N N 6 129.435 129.435 121.270 8.165 19854 7126 1 8 . 1 1 6 6 GLU C C 6 176.566 176.566 175.005 1.561 19854 7127 1 8 . 1 1 6 6 GLU CA C 6 56.336 56.336 52.946 3.390 19854 7128 1 8 . 1 1 6 6 GLU CB C 6 28.811 28.811 30.107 -1.296 19854 7129 1 8 . 1 1 6 6 GLU H H 6 9.267 9.267 7.787 1.480 19854 7130 1 8 . 1 1 7 7 PRO C C 7 176.566 176.566 177.111 -0.545 19854 7131 1 8 . 1 1 7 7 PRO CA C 7 63.672 63.672 65.158 -1.486 19854 7132 1 8 . 1 1 7 7 PRO CB C 7 31.146 31.146 32.665 -1.519 19854 7133 1 8 . 1 1 8 8 GLN N N 8 112.502 112.502 114.839 -2.337 19854 7134 1 8 . 1 1 8 8 GLN C C 8 177.445 177.445 175.345 2.100 19854 7135 1 8 . 1 1 8 8 GLN CA C 8 50.479 50.479 56.232 -5.753 19854 7136 1 8 . 1 1 8 8 GLN CB C 8 28.811 28.811 31.408 -2.597 19854 7137 1 8 . 1 1 8 8 GLN H H 8 6.220 6.220 7.957 -1.737 19854 7138 1 8 . 1 1 9 9 VAL N N 9 117.416 117.416 118.356 -0.940 19854 7139 1 8 . 1 1 9 9 VAL C C 9 178.324 178.324 173.547 4.777 19854 7140 1 8 . 1 1 9 9 VAL CA C 9 63.363 63.363 61.135 2.228 19854 7141 1 8 . 1 1 9 9 VAL CB C 9 34.668 34.668 34.995 -0.327 19854 7142 1 8 . 1 1 9 9 VAL H H 9 6.561 6.561 7.658 -1.097 19854 7143 1 8 . 1 1 10 10 GLN N N 10 113.896 113.896 123.280 -9.384 19854 7144 1 8 . 1 1 10 10 GLN C C 10 176.273 176.273 174.558 1.715 19854 7145 1 8 . 1 1 10 10 GLN CA C 10 55.164 55.164 54.009 1.155 19854 7146 1 8 . 1 1 10 10 GLN CB C 10 28.226 28.226 32.396 -4.170 19854 7147 1 8 . 1 1 10 10 GLN H H 10 7.847 7.847 8.088 -0.241 19854 7148 1 8 . 1 1 11 11 PHE N N 11 118.744 118.744 124.114 -5.370 19854 7149 1 8 . 1 1 11 11 PHE C C 11 176.566 176.566 174.750 1.816 19854 7150 1 8 . 1 1 11 11 PHE CA C 11 59.849 59.849 56.101 3.748 19854 7151 1 8 . 1 1 11 11 PHE CB C 11 41.109 41.109 41.947 -0.838 19854 7152 1 8 . 1 1 11 11 PHE H H 11 8.262 8.262 8.838 -0.576 19854 7153 1 8 . 1 1 12 12 LYS N N 12 129.437 129.437 125.789 3.648 19854 7154 1 8 . 1 1 12 12 LYS C C 12 178.609 178.609 174.779 3.830 19854 7155 1 8 . 1 1 12 12 LYS CA C 12 57.808 57.808 55.637 2.171 19854 7156 1 8 . 1 1 12 12 LYS H H 12 10.015 10.015 8.774 1.241 19854 7157 1 8 . 1 1 13 13 LEU N N 13 112.103 112.103 129.582 -17.479 19854 7158 1 8 . 1 1 13 13 LEU C C 13 177.738 177.738 174.613 3.125 19854 7159 1 8 . 1 1 13 13 LEU CA C 13 54.579 54.579 53.443 1.136 19854 7160 1 8 . 1 1 13 13 LEU CB C 13 42.866 42.866 45.955 -3.089 19854 7161 1 8 . 1 1 13 13 LEU H H 13 6.905 6.905 8.963 -2.058 19854 7162 1 8 . 1 1 14 14 VAL N N 14 127.310 127.310 126.728 0.582 19854 7163 1 8 . 1 1 14 14 VAL C C 14 175.393 175.393 174.119 1.274 19854 7164 1 8 . 1 1 14 14 VAL CA C 14 70.976 70.976 61.699 9.277 19854 7165 1 8 . 1 1 14 14 VAL CB C 14 28.811 28.811 33.461 -4.650 19854 7166 1 8 . 1 1 14 14 VAL H H 14 8.305 8.305 8.722 -0.417 19854 7167 1 8 . 1 1 15 15 LEU N N 15 128.640 128.640 130.987 -2.347 19854 7168 1 8 . 1 1 15 15 LEU C C 15 177.730 177.730 175.087 2.643 19854 7169 1 8 . 1 1 15 15 LEU CA C 15 55.758 55.758 53.219 2.539 19854 7170 1 8 . 1 1 15 15 LEU H H 15 7.718 7.718 9.042 -1.324 19854 7171 1 8 . 1 1 16 16 VAL N N 16 121.267 121.267 121.749 -0.482 19854 7172 1 8 . 1 1 16 16 VAL C C 16 178.324 178.324 174.413 3.911 19854 7173 1 8 . 1 1 16 16 VAL CA C 16 63.363 63.363 58.533 4.830 19854 7174 1 8 . 1 1 16 16 VAL CB C 16 35.839 35.839 35.127 0.712 19854 7175 1 8 . 1 1 16 16 VAL H H 16 8.935 8.935 8.832 0.103 19854 7176 1 8 . 1 1 17 17 GLY N N 17 127.908 127.908 107.076 20.832 19854 7177 1 8 . 1 1 17 17 GLY C C 17 174.514 174.514 173.273 1.241 19854 7178 1 8 . 1 1 17 17 GLY CA C 17 42.281 42.281 44.621 -2.340 19854 7179 1 8 . 1 1 17 17 GLY H H 17 9.682 9.682 6.855 2.827 19854 7180 1 8 . 1 1 18 18 ASP N N 18 125.054 125.054 121.362 3.692 19854 7181 1 8 . 1 1 18 18 ASP C C 18 176.851 176.851 177.552 -0.701 19854 7182 1 8 . 1 1 18 18 ASP CA C 18 57.515 57.515 54.455 3.060 19854 7183 1 8 . 1 1 18 18 ASP CB C 18 46.090 46.090 42.042 4.048 19854 7184 1 8 . 1 1 18 18 ASP H H 18 8.282 8.282 8.435 -0.153 19854 7185 1 8 . 1 1 19 19 GLY N N 19 120.670 120.670 106.619 14.051 19854 7186 1 8 . 1 1 19 19 GLY C C 19 178.324 178.324 174.928 3.396 19854 7187 1 8 . 1 1 19 19 GLY CA C 19 42.281 42.281 45.784 -3.503 19854 7188 1 8 . 1 1 19 19 GLY H H 19 8.825 8.825 8.608 0.217 19854 7189 1 8 . 1 1 20 20 GLY N N 20 129.369 129.369 112.217 17.152 19854 7190 1 8 . 1 1 20 20 GLY C C 20 174.221 174.221 175.671 -1.450 19854 7191 1 8 . 1 1 20 20 GLY CA C 20 41.695 41.695 45.559 -3.864 19854 7192 1 8 . 1 1 20 20 GLY H H 20 8.477 8.477 8.507 -0.030 19854 7193 1 8 . 1 1 21 21 THR N N 21 122.199 122.199 116.500 5.699 19854 7194 1 8 . 1 1 21 21 THR C C 21 171.291 171.291 174.919 -3.628 19854 7195 1 8 . 1 1 21 21 THR CA C 21 61.914 61.914 66.052 -4.138 19854 7196 1 8 . 1 1 21 21 THR CB C 21 65.137 65.137 69.340 -4.203 19854 7197 1 8 . 1 1 21 21 THR H H 21 8.059 8.059 7.487 0.573 19854 7198 1 8 . 1 1 22 22 GLY N N 22 112.369 112.369 106.331 6.038 19854 7199 1 8 . 1 1 22 22 GLY C C 22 184.807 184.807 175.257 9.550 19854 7200 1 8 . 1 1 22 22 GLY CA C 22 45.209 45.209 45.338 -0.129 19854 7201 1 8 . 1 1 22 22 GLY H H 22 6.772 6.772 8.316 -1.544 19854 7202 1 8 . 1 1 23 23 LYS N N 23 122.066 122.066 120.387 1.679 19854 7203 1 8 . 1 1 23 23 LYS C C 23 178.589 178.589 177.922 0.667 19854 7204 1 8 . 1 1 23 23 LYS CA C 23 58.101 58.101 59.158 -1.057 19854 7205 1 8 . 1 1 23 23 LYS CB C 23 40.230 40.230 31.934 8.296 19854 7206 1 8 . 1 1 23 23 LYS H H 23 7.441 7.441 8.355 -0.914 19854 7207 1 8 . 1 1 24 24 THR N N 24 114.627 114.627 115.107 -0.480 19854 7208 1 8 . 1 1 24 24 THR C C 24 178.324 178.324 176.694 1.630 19854 7209 1 8 . 1 1 24 24 THR CA C 24 62.192 62.192 67.184 -4.992 19854 7210 1 8 . 1 1 24 24 THR CB C 24 71.562 71.562 68.160 3.402 19854 7211 1 8 . 1 1 24 24 THR H H 24 8.469 8.469 8.504 -0.035 19854 7212 1 8 . 1 1 25 25 THR N N 25 110.377 110.377 119.784 -9.407 19854 7213 1 8 . 1 1 25 25 THR C C 25 178.324 178.324 176.331 1.993 19854 7214 1 8 . 1 1 25 25 THR CA C 25 64.534 64.534 67.313 -2.779 19854 7215 1 8 . 1 1 25 25 THR CB C 25 71.562 71.562 68.580 2.982 19854 7216 1 8 . 1 1 25 25 THR H H 25 8.415 8.415 8.288 0.127 19854 7217 1 8 . 1 1 26 26 PHE N N 26 114.295 114.295 122.700 -8.405 19854 7218 1 8 . 1 1 26 26 PHE C C 26 174.514 174.514 177.337 -2.823 19854 7219 1 8 . 1 1 26 26 PHE CA C 26 53.407 53.407 62.043 -8.636 19854 7220 1 8 . 1 1 26 26 PHE CB C 26 40.524 40.524 39.183 1.341 19854 7221 1 8 . 1 1 26 26 PHE H H 26 7.707 7.707 8.578 -0.871 19854 7222 1 8 . 1 1 27 27 VAL N N 27 123.525 123.525 120.875 2.650 19854 7223 1 8 . 1 1 27 27 VAL C C 27 178.031 178.031 177.793 0.238 19854 7224 1 8 . 1 1 27 27 VAL CA C 27 67.462 67.462 67.165 0.297 19854 7225 1 8 . 1 1 27 27 VAL CB C 27 29.397 29.397 31.542 -2.145 19854 7226 1 8 . 1 1 27 27 VAL H H 27 6.967 6.967 8.442 -1.475 19854 7227 1 8 . 1 1 28 28 LYS N N 28 114.228 114.228 119.881 -5.653 19854 7228 1 8 . 1 1 28 28 LYS C C 28 176.566 176.566 178.253 -1.687 19854 7229 1 8 . 1 1 28 28 LYS CA C 28 58.092 58.092 59.010 -0.918 19854 7230 1 8 . 1 1 28 28 LYS CB C 28 34.082 34.082 32.051 2.031 19854 7231 1 8 . 1 1 28 28 LYS H H 28 7.429 7.429 8.253 -0.824 19854 7232 1 8 . 1 1 29 29 ARG N N 29 112.037 112.037 119.093 -7.056 19854 7233 1 8 . 1 1 29 29 ARG C C 29 174.221 174.221 179.283 -5.062 19854 7234 1 8 . 1 1 29 29 ARG CA C 29 72.147 72.147 59.257 12.890 19854 7235 1 8 . 1 1 29 29 ARG CB C 29 37.596 37.596 29.817 7.779 19854 7236 1 8 . 1 1 29 29 ARG H H 29 6.803 6.803 8.146 -1.343 19854 7237 1 8 . 1 1 30 30 HIS N N 30 122.396 122.396 118.456 3.940 19854 7238 1 8 . 1 1 30 30 HIS C C 30 172.170 172.170 177.220 -5.050 19854 7239 1 8 . 1 1 30 30 HIS CA C 30 51.651 51.651 59.509 -7.858 19854 7240 1 8 . 1 1 30 30 HIS CB C 30 30.568 30.568 29.478 1.090 19854 7241 1 8 . 1 1 30 30 HIS H H 30 7.644 7.644 7.998 -0.354 19854 7242 1 8 . 1 1 31 31 LEU N N 31 110.377 110.377 119.588 -9.211 19854 7243 1 8 . 1 1 31 31 LEU C C 31 178.031 178.031 178.718 -0.687 19854 7244 1 8 . 1 1 31 31 LEU CA C 31 55.164 55.164 57.679 -2.515 19854 7245 1 8 . 1 1 31 31 LEU CB C 31 42.281 42.281 42.179 0.102 19854 7246 1 8 . 1 1 31 31 LEU H H 31 7.894 7.894 8.259 -0.365 19854 7247 1 8 . 1 1 32 32 THR N N 32 121.468 121.468 106.031 15.437 19854 7248 1 8 . 1 1 32 32 THR C C 32 170.705 170.705 175.502 -4.797 19854 7249 1 8 . 1 1 32 32 THR CA C 32 63.668 63.668 61.835 1.833 19854 7250 1 8 . 1 1 32 32 THR CB C 32 75.679 75.679 70.768 4.911 19854 7251 1 8 . 1 1 32 32 THR H H 32 8.372 8.372 8.239 0.133 19854 7252 1 8 . 1 1 33 33 GLY N N 33 127.841 127.841 110.167 17.674 19854 7253 1 8 . 1 1 33 33 GLY C C 33 161.914 161.914 173.893 -11.979 19854 7254 1 8 . 1 1 33 33 GLY CA C 33 42.866 42.866 44.779 -1.913 19854 7255 1 8 . 1 1 33 33 GLY H H 33 9.662 9.662 7.707 1.955 19854 7256 1 8 . 1 1 34 34 GLU N N 34 120.871 120.871 120.272 0.599 19854 7257 1 8 . 1 1 34 34 GLU C C 34 174.508 174.508 174.880 -0.372 19854 7258 1 8 . 1 1 34 34 GLU CA C 34 58.101 58.101 55.890 2.211 19854 7259 1 8 . 1 1 34 34 GLU CB C 34 34.371 34.371 30.640 3.731 19854 7260 1 8 . 1 1 34 34 GLU H H 34 8.211 8.211 7.366 0.845 19854 7261 1 8 . 1 1 35 35 PHE N N 35 111.838 111.838 120.147 -8.309 19854 7262 1 8 . 1 1 35 35 PHE C C 35 174.221 174.221 175.313 -1.092 19854 7263 1 8 . 1 1 35 35 PHE CA C 35 49.308 49.308 56.990 -7.682 19854 7264 1 8 . 1 1 35 35 PHE CB C 35 41.695 41.695 41.131 0.564 19854 7265 1 8 . 1 1 35 35 PHE H H 35 6.772 6.772 8.354 -1.582 19854 7266 1 8 . 1 1 36 36 GLU N N 36 120.672 120.672 124.433 -3.761 19854 7267 1 8 . 1 1 36 36 GLU C C 36 175.686 175.686 175.998 -0.312 19854 7268 1 8 . 1 1 36 36 GLU CA C 36 58.980 58.980 55.334 3.646 19854 7269 1 8 . 1 1 36 36 GLU CB C 36 48.140 48.140 30.347 17.793 19854 7270 1 8 . 1 1 36 36 GLU H H 36 8.293 8.293 8.691 -0.398 19854 7271 1 8 . 1 1 37 37 LYS N N 37 118.810 118.810 125.062 -6.252 19854 7272 1 8 . 1 1 37 37 LYS C C 37 172.756 172.756 177.218 -4.462 19854 7273 1 8 . 1 1 37 37 LYS CA C 37 48.137 48.137 58.225 -10.088 19854 7274 1 8 . 1 1 37 37 LYS CB C 37 37.010 37.010 32.983 4.027 19854 7275 1 8 . 1 1 37 37 LYS H H 37 8.509 8.509 8.484 0.025 19854 7276 1 8 . 1 1 38 38 LYS N N 38 108.052 108.052 119.877 -11.825 19854 7277 1 8 . 1 1 38 38 LYS C C 38 176.273 176.273 175.664 0.609 19854 7278 1 8 . 1 1 38 38 LYS CA C 38 59.849 59.849 56.099 3.750 19854 7279 1 8 . 1 1 38 38 LYS CB C 38 34.668 34.668 33.006 1.662 19854 7280 1 8 . 1 1 38 38 LYS H H 38 7.715 7.715 7.972 -0.257 19854 7281 1 8 . 1 1 39 39 TYR N N 39 108.650 108.650 123.820 -15.170 19854 7282 1 8 . 1 1 39 39 TYR C C 39 175.686 175.686 175.822 -0.136 19854 7283 1 8 . 1 1 39 39 TYR CA C 39 61.020 61.020 58.155 2.865 19854 7284 1 8 . 1 1 39 39 TYR CB C 39 36.424 36.424 39.457 -3.033 19854 7285 1 8 . 1 1 39 39 TYR H H 39 7.362 7.362 8.555 -1.193 19854 7286 1 8 . 1 1 40 40 VAL N N 40 117.947 117.947 124.450 -6.503 19854 7287 1 8 . 1 1 40 40 VAL C C 40 175.393 175.393 175.634 -0.241 19854 7288 1 8 . 1 1 40 40 VAL CA C 40 61.020 61.020 61.573 -0.553 19854 7289 1 8 . 1 1 40 40 VAL CB C 40 31.154 31.154 33.592 -2.438 19854 7290 1 8 . 1 1 40 40 VAL H H 40 8.442 8.442 8.577 -0.135 19854 7291 1 8 . 1 1 42 42 THR N N 42 117.150 117.150 117.290 -0.140 19854 7292 1 8 . 1 1 42 42 THR C C 42 178.910 178.910 174.035 4.875 19854 7293 1 8 . 1 1 42 42 THR CA C 42 60.435 60.435 62.848 -2.413 19854 7294 1 8 . 1 1 42 42 THR CB C 42 70.390 70.390 69.573 0.817 19854 7295 1 8 . 1 1 42 42 THR H H 42 8.192 8.192 8.337 -0.145 19854 7296 1 8 . 1 1 43 43 LEU N N 43 119.209 119.209 128.001 -8.792 19854 7297 1 8 . 1 1 43 43 LEU C C 43 174.807 174.807 177.772 -2.965 19854 7298 1 8 . 1 1 43 43 LEU CA C 43 57.507 57.507 54.267 3.240 19854 7299 1 8 . 1 1 43 43 LEU CB C 43 42.866 42.866 42.896 -0.030 19854 7300 1 8 . 1 1 43 43 LEU H H 43 9.260 9.260 8.495 0.765 19854 7301 1 8 . 1 1 44 44 GLY N N 44 114.361 114.361 113.051 1.310 19854 7302 1 8 . 1 1 44 44 GLY C C 44 178.910 178.910 172.797 6.113 19854 7303 1 8 . 1 1 44 44 GLY CA C 44 54.579 54.579 45.839 8.740 19854 7304 1 8 . 1 1 44 44 GLY H H 44 6.979 6.979 8.637 -1.658 19854 7305 1 8 . 1 1 45 45 VAL N N 45 110.244 110.244 122.870 -12.626 19854 7306 1 8 . 1 1 45 45 VAL C C 45 174.807 174.807 175.089 -0.282 19854 7307 1 8 . 1 1 45 45 VAL CA C 45 63.363 63.363 60.806 2.557 19854 7308 1 8 . 1 1 45 45 VAL CB C 45 17.099 17.099 34.549 -17.450 19854 7309 1 8 . 1 1 45 45 VAL H H 45 8.309 8.309 7.987 0.322 19854 7310 1 8 . 1 1 46 46 GLU N N 46 130.365 130.365 127.176 3.189 19854 7311 1 8 . 1 1 46 46 GLU C C 46 176.859 176.859 174.751 2.108 19854 7312 1 8 . 1 1 46 46 GLU CA C 46 55.164 55.164 54.948 0.216 19854 7313 1 8 . 1 1 46 46 GLU CB C 46 32.325 32.325 32.255 0.070 19854 7314 1 8 . 1 1 46 46 GLU H H 46 9.741 9.741 8.939 0.802 19854 7315 1 8 . 1 1 47 47 VAL N N 47 125.254 125.254 125.202 0.052 19854 7316 1 8 . 1 1 47 47 VAL C C 47 175.661 175.661 174.837 0.824 19854 7317 1 8 . 1 1 47 47 VAL CA C 47 63.375 63.375 61.623 1.752 19854 7318 1 8 . 1 1 47 47 VAL CB C 47 37.300 37.300 31.921 5.379 19854 7319 1 8 . 1 1 47 47 VAL H H 47 8.250 8.250 7.917 0.333 19854 7320 1 8 . 1 1 48 48 HIS N N 48 129.236 129.236 126.861 2.375 19854 7321 1 8 . 1 1 48 48 HIS C C 48 169.240 169.240 172.995 -3.755 19854 7322 1 8 . 1 1 48 48 HIS CA C 48 49.894 49.894 53.492 -3.598 19854 7323 1 8 . 1 1 48 48 HIS CB C 48 27.640 27.640 32.854 -5.214 19854 7324 1 8 . 1 1 48 48 HIS H H 48 10.390 10.390 9.286 1.104 19854 7325 1 8 . 1 1 49 49 PRO C C 49 176.273 176.273 175.906 0.367 19854 7326 1 8 . 1 1 49 49 PRO CA C 49 62.500 62.500 62.682 -0.182 19854 7327 1 8 . 1 1 49 49 PRO CB C 49 29.974 29.974 32.752 -2.778 19854 7328 1 8 . 1 1 50 50 LEU N N 50 119.408 119.408 124.393 -4.985 19854 7329 1 8 . 1 1 50 50 LEU C C 50 177.445 177.445 175.769 1.676 19854 7330 1 8 . 1 1 50 50 LEU CA C 50 59.264 59.264 53.949 5.315 19854 7331 1 8 . 1 1 50 50 LEU CB C 50 42.281 42.281 45.828 -3.547 19854 7332 1 8 . 1 1 50 50 LEU H H 50 7.492 7.492 8.797 -1.305 19854 7333 1 8 . 1 1 51 51 VAL N N 51 117.947 117.947 122.317 -4.370 19854 7334 1 8 . 1 1 51 51 VAL C C 51 174.514 174.514 175.264 -0.750 19854 7335 1 8 . 1 1 51 51 VAL CA C 51 64.534 64.534 61.891 2.643 19854 7336 1 8 . 1 1 51 51 VAL CB C 51 37.010 37.010 32.792 4.218 19854 7337 1 8 . 1 1 51 51 VAL H H 51 7.715 7.715 8.289 -0.574 19854 7338 1 8 . 1 1 52 52 PHE N N 52 124.853 124.853 126.841 -1.988 19854 7339 1 8 . 1 1 52 52 PHE C C 52 175.100 175.100 174.401 0.699 19854 7340 1 8 . 1 1 52 52 PHE CA C 52 56.336 56.336 56.813 -0.477 19854 7341 1 8 . 1 1 52 52 PHE CB C 52 39.938 39.938 42.472 -2.534 19854 7342 1 8 . 1 1 52 52 PHE H H 52 8.935 8.935 9.258 -0.323 19854 7343 1 8 . 1 1 53 53 HIS N N 53 120.603 120.603 122.899 -2.296 19854 7344 1 8 . 1 1 53 53 HIS C C 53 170.119 170.119 175.027 -4.908 19854 7345 1 8 . 1 1 53 53 HIS CA C 53 55.164 55.164 55.968 -0.804 19854 7346 1 8 . 1 1 53 53 HIS CB C 53 30.568 30.568 31.408 -0.840 19854 7347 1 8 . 1 1 53 53 HIS H H 53 8.356 8.356 9.211 -0.855 19854 7348 1 8 . 1 1 54 54 THR N N 54 112.634 112.634 116.526 -3.892 19854 7349 1 8 . 1 1 54 54 THR C C 54 178.910 178.910 176.296 2.614 19854 7350 1 8 . 1 1 54 54 THR CA C 54 63.363 63.363 59.409 3.954 19854 7351 1 8 . 1 1 54 54 THR CB C 54 72.733 72.733 71.550 1.183 19854 7352 1 8 . 1 1 54 54 THR H H 54 7.574 7.574 8.455 -0.881 19854 7353 1 8 . 1 1 55 55 ASN N N 55 131.095 131.095 120.252 10.843 19854 7354 1 8 . 1 1 55 55 ASN C C 55 176.273 176.273 176.453 -0.180 19854 7355 1 8 . 1 1 55 55 ASN CA C 55 51.065 51.065 55.798 -4.734 19854 7356 1 8 . 1 1 55 55 ASN CB C 55 37.010 37.010 38.205 -1.195 19854 7357 1 8 . 1 1 55 55 ASN H H 55 10.187 10.187 8.594 1.593 19854 7358 1 8 . 1 1 56 56 ARG N N 56 122.064 122.064 118.041 4.023 19854 7359 1 8 . 1 1 56 56 ARG C C 56 175.100 175.100 176.414 -1.314 19854 7360 1 8 . 1 1 56 56 ARG CA C 56 61.606 61.606 55.453 6.153 19854 7361 1 8 . 1 1 56 56 ARG CB C 56 32.911 32.911 30.050 2.861 19854 7362 1 8 . 1 1 56 56 ARG H H 56 7.433 7.433 7.862 -0.429 19854 7363 1 8 . 1 1 57 57 GLY N N 57 127.709 127.709 107.967 19.742 19854 7364 1 8 . 1 1 57 57 GLY C C 57 175.979 175.979 171.770 4.209 19854 7365 1 8 . 1 1 57 57 GLY CA C 57 42.281 42.281 44.338 -2.057 19854 7366 1 8 . 1 1 57 57 GLY H H 57 9.373 9.373 7.684 1.689 19854 7367 1 8 . 1 1 58 58 PRO C C 58 177.152 177.152 175.807 1.345 19854 7368 1 8 . 1 1 58 58 PRO CA C 58 65.137 65.137 63.264 1.873 19854 7369 1 8 . 1 1 58 58 PRO CB C 58 29.095 29.095 31.901 -2.806 19854 7370 1 8 . 1 1 59 59 ILE N N 59 128.638 128.638 122.615 6.023 19854 7371 1 8 . 1 1 59 59 ILE C C 59 175.979 175.979 174.600 1.379 19854 7372 1 8 . 1 1 59 59 ILE CA C 59 65.120 65.120 60.016 5.104 19854 7373 1 8 . 1 1 59 59 ILE CB C 59 40.524 40.524 42.817 -2.293 19854 7374 1 8 . 1 1 59 59 ILE H H 59 8.794 8.794 8.834 -0.040 19854 7375 1 8 . 1 1 60 60 LYS N N 60 127.711 127.711 123.307 4.404 19854 7376 1 8 . 1 1 60 60 LYS C C 60 178.902 178.902 175.565 3.337 19854 7377 1 8 . 1 1 60 60 LYS CA C 60 74.293 74.293 54.498 19.795 19854 7378 1 8 . 1 1 60 60 LYS CB C 60 32.027 32.027 35.355 -3.328 19854 7379 1 8 . 1 1 60 60 LYS H H 60 8.024 8.024 8.562 -0.538 19854 7380 1 8 . 1 1 61 61 PHE N N 61 120.670 120.670 123.434 -2.764 19854 7381 1 8 . 1 1 61 61 PHE C C 61 175.393 175.393 175.343 0.050 19854 7382 1 8 . 1 1 61 61 PHE CA C 61 57.507 57.507 57.220 0.287 19854 7383 1 8 . 1 1 61 61 PHE CB C 61 41.109 41.109 40.718 0.391 19854 7384 1 8 . 1 1 61 61 PHE H H 61 7.515 7.515 9.573 -2.058 19854 7385 1 8 . 1 1 62 62 ASN N N 62 124.789 124.789 124.191 0.598 19854 7386 1 8 . 1 1 62 62 ASN C C 62 173.336 173.336 174.377 -1.041 19854 7387 1 8 . 1 1 62 62 ASN CA C 62 53.121 53.121 52.224 0.897 19854 7388 1 8 . 1 1 62 62 ASN CB C 62 41.695 41.695 39.141 2.554 19854 7389 1 8 . 1 1 62 62 ASN H H 62 8.325 8.325 9.191 -0.866 19854 7390 1 8 . 1 1 63 63 VAL N N 63 106.127 106.127 127.721 -21.594 19854 7391 1 8 . 1 1 63 63 VAL C C 63 175.100 175.100 175.392 -0.292 19854 7392 1 8 . 1 1 63 63 VAL CA C 63 61.020 61.020 62.853 -1.833 19854 7393 1 8 . 1 1 63 63 VAL CB C 63 31.154 31.154 32.944 -1.790 19854 7394 1 8 . 1 1 63 63 VAL H H 63 8.113 8.113 9.009 -0.896 19854 7395 1 8 . 1 1 64 64 TRP N N 64 129.302 129.302 129.532 -0.230 19854 7396 1 8 . 1 1 64 64 TRP C C 64 177.152 177.152 175.444 1.708 19854 7397 1 8 . 1 1 64 64 TRP CA C 64 59.264 59.264 53.974 5.290 19854 7398 1 8 . 1 1 64 64 TRP CB C 64 29.397 29.397 29.648 -0.251 19854 7399 1 8 . 1 1 64 64 TRP H H 64 8.970 8.970 9.512 -0.542 19854 7400 1 8 . 1 1 65 65 ASP N N 65 119.607 119.607 126.062 -6.455 19854 7401 1 8 . 1 1 65 65 ASP C C 65 174.514 174.514 175.754 -1.240 19854 7402 1 8 . 1 1 65 65 ASP CA C 65 55.164 55.164 53.239 1.925 19854 7403 1 8 . 1 1 65 65 ASP CB C 65 41.109 41.109 42.999 -1.890 19854 7404 1 8 . 1 1 65 65 ASP H H 65 8.638 8.638 9.191 -0.553 19854 7405 1 8 . 1 1 66 66 THR N N 66 122.463 122.463 117.968 4.495 19854 7406 1 8 . 1 1 66 66 THR C C 66 178.617 178.617 174.362 4.255 19854 7407 1 8 . 1 1 66 66 THR CA C 66 68.048 68.048 59.742 8.306 19854 7408 1 8 . 1 1 66 66 THR CB C 66 71.562 71.562 71.171 0.390 19854 7409 1 8 . 1 1 66 66 THR H H 66 8.293 8.293 8.328 -0.035 19854 7410 1 8 . 1 1 67 67 ALA N N 67 104.865 104.865 122.874 -18.009 19854 7411 1 8 . 1 1 67 67 ALA C C 67 177.738 177.738 177.980 -0.242 19854 7412 1 8 . 1 1 67 67 ALA CA C 67 48.722 48.722 51.415 -2.693 19854 7413 1 8 . 1 1 67 67 ALA CB C 67 14.171 14.171 19.972 -5.801 19854 7414 1 8 . 1 1 67 67 ALA H H 67 8.657 8.657 8.001 0.656 19854 7415 1 8 . 1 1 68 68 GLY N N 68 115.357 115.357 110.537 4.820 19854 7416 1 8 . 1 1 68 68 GLY C C 68 189.533 189.533 176.163 13.370 19854 7417 1 8 . 1 1 68 68 GLY CA C 68 45.209 45.209 46.225 -1.016 19854 7418 1 8 . 1 1 68 68 GLY H H 68 10.969 10.969 9.061 1.908 19854 7419 1 8 . 1 1 69 69 GLN N N 69 122.730 122.730 119.804 2.926 19854 7420 1 8 . 1 1 69 69 GLN C C 69 174.508 174.508 176.005 -1.497 19854 7421 1 8 . 1 1 69 69 GLN CA C 69 58.394 58.394 57.818 0.576 19854 7422 1 8 . 1 1 69 69 GLN CB C 69 31.441 31.441 28.710 2.731 19854 7423 1 8 . 1 1 69 69 GLN H H 69 8.336 8.336 8.439 -0.103 19854 7424 1 8 . 1 1 70 70 GLU N N 70 114.826 114.826 119.312 -4.486 19854 7425 1 8 . 1 1 70 70 GLU C C 70 176.273 176.273 176.066 0.207 19854 7426 1 8 . 1 1 70 70 GLU CA C 70 57.507 57.507 56.313 1.194 19854 7427 1 8 . 1 1 70 70 GLU CB C 70 28.811 28.811 30.322 -1.511 19854 7428 1 8 . 1 1 70 70 GLU H H 70 9.651 9.651 8.236 1.415 19854 7429 1 8 . 1 1 71 71 LYS N N 71 116.685 116.685 122.427 -5.742 19854 7430 1 8 . 1 1 71 71 LYS C C 71 175.979 175.979 176.720 -0.741 19854 7431 1 8 . 1 1 71 71 LYS CA C 71 48.722 48.722 55.277 -6.555 19854 7432 1 8 . 1 1 71 71 LYS CB C 71 37.010 37.010 32.797 4.213 19854 7433 1 8 . 1 1 71 71 LYS H H 71 8.712 8.712 8.329 0.383 19854 7434 1 8 . 1 1 72 72 PHE N N 72 114.959 114.959 119.774 -4.815 19854 7435 1 8 . 1 1 72 72 PHE C C 72 175.686 175.686 176.495 -0.809 19854 7436 1 8 . 1 1 72 72 PHE CA C 72 56.336 56.336 58.972 -2.636 19854 7437 1 8 . 1 1 72 72 PHE CB C 72 36.424 36.424 38.873 -2.449 19854 7438 1 8 . 1 1 72 72 PHE H H 72 7.965 7.965 7.973 -0.008 19854 7439 1 8 . 1 1 73 73 GLY N N 73 117.084 117.084 111.255 5.829 19854 7440 1 8 . 1 1 73 73 GLY C C 73 168.068 168.068 174.856 -6.788 19854 7441 1 8 . 1 1 73 73 GLY CA C 73 42.281 42.281 44.748 -2.467 19854 7442 1 8 . 1 1 73 73 GLY H H 73 7.609 7.609 7.796 -0.187 19854 7443 1 8 . 1 1 74 74 GLY N N 74 120.537 120.537 108.087 12.450 19854 7444 1 8 . 1 1 74 74 GLY C C 74 174.514 174.514 176.299 -1.785 19854 7445 1 8 . 1 1 74 74 GLY CA C 74 44.037 44.037 46.701 -2.664 19854 7446 1 8 . 1 1 74 74 GLY H H 74 9.326 9.326 8.701 0.625 19854 7447 1 8 . 1 1 75 75 LEU N N 75 127.177 127.177 121.904 5.273 19854 7448 1 8 . 1 1 75 75 LEU C C 75 178.617 178.617 177.738 0.879 19854 7449 1 8 . 1 1 75 75 LEU CA C 75 53.407 53.407 56.617 -3.210 19854 7450 1 8 . 1 1 75 75 LEU CB C 75 42.281 42.281 42.033 0.248 19854 7451 1 8 . 1 1 75 75 LEU H H 75 7.628 7.628 7.806 -0.178 19854 7452 1 8 . 1 1 76 76 ARG N N 76 116.486 116.486 116.936 -0.450 19854 7453 1 8 . 1 1 76 76 ARG C C 76 176.859 176.859 177.259 -0.400 19854 7454 1 8 . 1 1 76 76 ARG CA C 76 59.264 59.264 56.527 2.737 19854 7455 1 8 . 1 1 76 76 ARG CB C 76 31.154 31.154 29.676 1.478 19854 7456 1 8 . 1 1 76 76 ARG H H 76 7.143 7.143 7.410 -0.267 19854 7457 1 8 . 1 1 77 77 ASP N N 77 129.236 129.236 120.887 8.349 19854 7458 1 8 . 1 1 77 77 ASP C C 77 177.152 177.152 178.050 -0.898 19854 7459 1 8 . 1 1 77 77 ASP CA C 77 52.822 52.822 58.578 -5.756 19854 7460 1 8 . 1 1 77 77 ASP CB C 77 41.695 41.695 40.492 1.202 19854 7461 1 8 . 1 1 77 77 ASP H H 77 8.947 8.947 7.569 1.378 19854 7462 1 8 . 1 1 78 78 GLY N N 78 127.244 127.244 107.167 20.077 19854 7463 1 8 . 1 1 78 78 GLY C C 78 173.928 173.928 176.051 -2.123 19854 7464 1 8 . 1 1 78 78 GLY CA C 78 44.623 44.623 47.136 -2.513 19854 7465 1 8 . 1 1 78 78 GLY H H 78 8.219 8.219 8.414 -0.195 19854 7466 1 8 . 1 1 79 79 TYR N N 79 120.537 120.537 118.143 2.394 19854 7467 1 8 . 1 1 79 79 TYR C C 79 176.273 176.273 177.420 -1.147 19854 7468 1 8 . 1 1 79 79 TYR CA C 79 58.678 58.678 58.903 -0.225 19854 7469 1 8 . 1 1 79 79 TYR CB C 79 40.524 40.524 38.070 2.454 19854 7470 1 8 . 1 1 79 79 TYR H H 79 8.563 8.563 7.580 0.983 19854 7471 1 8 . 1 1 80 80 TYR N N 80 122.132 122.132 117.128 5.004 19854 7472 1 8 . 1 1 80 80 TYR C C 80 175.979 175.979 175.757 0.222 19854 7473 1 8 . 1 1 80 80 TYR CA C 80 62.203 62.203 58.889 3.314 19854 7474 1 8 . 1 1 80 80 TYR CB C 80 41.988 41.988 39.425 2.563 19854 7475 1 8 . 1 1 80 80 TYR H H 80 8.254 8.254 7.703 0.551 19854 7476 1 8 . 1 1 81 81 ILE N N 81 120.072 120.072 120.386 -0.314 19854 7477 1 8 . 1 1 81 81 ILE C C 81 177.445 177.445 175.651 1.794 19854 7478 1 8 . 1 1 81 81 ILE CA C 81 67.462 67.462 63.390 4.072 19854 7479 1 8 . 1 1 81 81 ILE CB C 81 41.109 41.109 37.986 3.123 19854 7480 1 8 . 1 1 81 81 ILE H H 81 8.837 8.837 7.772 1.065 19854 7481 1 8 . 1 1 82 82 GLN N N 82 121.601 121.601 119.828 1.773 19854 7482 1 8 . 1 1 82 82 GLN C C 82 173.342 173.342 174.323 -0.981 19854 7483 1 8 . 1 1 82 82 GLN CA C 82 59.859 59.859 56.246 3.612 19854 7484 1 8 . 1 1 82 82 GLN CB C 82 30.855 30.855 25.907 4.948 19854 7485 1 8 . 1 1 82 82 GLN H H 82 8.184 8.184 8.894 -0.710 19854 7486 1 8 . 1 1 83 83 ALA N N 83 109.713 109.713 120.326 -10.613 19854 7487 1 8 . 1 1 83 83 ALA C C 83 175.979 175.979 177.011 -1.032 19854 7488 1 8 . 1 1 83 83 ALA CA C 83 54.579 54.579 52.319 2.260 19854 7489 1 8 . 1 1 83 83 ALA CB C 83 16.513 16.513 19.232 -2.719 19854 7490 1 8 . 1 1 83 83 ALA H H 83 6.306 6.306 7.307 -1.001 19854 7491 1 8 . 1 1 84 84 GLN N N 84 121.203 121.203 120.373 0.830 19854 7492 1 8 . 1 1 84 84 GLN C C 84 177.144 177.144 176.017 1.127 19854 7493 1 8 . 1 1 84 84 GLN CA C 84 60.152 60.152 56.233 3.919 19854 7494 1 8 . 1 1 84 84 GLN CB C 84 34.957 34.957 30.825 4.132 19854 7495 1 8 . 1 1 84 84 GLN H H 84 8.180 8.180 8.668 -0.488 19854 7496 1 8 . 1 1 85 85 CYS N N 85 120.605 120.605 111.683 8.922 19854 7497 1 8 . 1 1 85 85 CYS C C 85 176.566 176.566 172.646 3.920 19854 7498 1 8 . 1 1 85 85 CYS CA C 85 65.430 65.430 56.149 9.281 19854 7499 1 8 . 1 1 85 85 CYS CB C 85 39.644 39.644 31.578 8.066 19854 7500 1 8 . 1 1 85 85 CYS H H 85 8.364 8.364 7.721 0.643 19854 7501 1 8 . 1 1 86 86 ALA N N 86 114.295 114.295 121.924 -7.629 19854 7502 1 8 . 1 1 86 86 ALA CA C 86 57.507 57.507 50.572 6.935 19854 7503 1 8 . 1 1 86 86 ALA CB C 86 21.784 21.784 22.953 -1.169 19854 7504 1 8 . 1 1 86 86 ALA H H 86 6.897 6.897 8.742 -1.845 19854 7505 1 8 . 1 1 87 87 ILE N N 87 120.670 120.670 120.763 -0.093 19854 7506 1 8 . 1 1 87 87 ILE C C 87 173.928 173.928 174.654 -0.726 19854 7507 1 8 . 1 1 87 87 ILE CA C 87 61.020 61.020 59.971 1.049 19854 7508 1 8 . 1 1 87 87 ILE CB C 87 39.938 39.938 41.231 -1.293 19854 7509 1 8 . 1 1 87 87 ILE H H 87 8.282 8.282 8.600 -0.318 19854 7510 1 8 . 1 1 88 88 ILE N N 88 120.205 120.205 127.058 -6.853 19854 7511 1 8 . 1 1 88 88 ILE C C 88 173.635 173.635 174.355 -0.720 19854 7512 1 8 . 1 1 88 88 ILE CA C 88 64.534 64.534 60.120 4.414 19854 7513 1 8 . 1 1 88 88 ILE CB C 88 37.596 37.596 40.193 -2.597 19854 7514 1 8 . 1 1 88 88 ILE H H 88 5.528 5.528 9.006 -3.478 19854 7515 1 8 . 1 1 89 89 MET N N 89 120.472 120.472 127.200 -6.728 19854 7516 1 8 . 1 1 89 89 MET C C 89 178.617 178.617 174.789 3.828 19854 7517 1 8 . 1 1 89 89 MET CA C 89 58.980 58.980 53.847 5.133 19854 7518 1 8 . 1 1 89 89 MET CB C 89 34.957 34.957 35.912 -0.955 19854 7519 1 8 . 1 1 89 89 MET H H 89 8.176 8.176 8.582 -0.406 19854 7520 1 8 . 1 1 90 90 PHE N N 90 121.134 121.134 121.049 0.085 19854 7521 1 8 . 1 1 90 90 PHE C C 90 175.393 175.393 173.103 2.290 19854 7522 1 8 . 1 1 90 90 PHE CA C 90 60.435 60.435 55.654 4.781 19854 7523 1 8 . 1 1 90 90 PHE CB C 90 38.767 38.767 42.349 -3.582 19854 7524 1 8 . 1 1 90 90 PHE H H 90 9.334 9.334 8.862 0.472 19854 7525 1 8 . 1 1 91 91 ASP N N 91 120.273 120.273 121.378 -1.105 19854 7526 1 8 . 1 1 91 91 ASP C C 91 177.730 177.730 178.157 -0.427 19854 7527 1 8 . 1 1 91 91 ASP CA C 91 59.859 59.859 51.896 7.963 19854 7528 1 8 . 1 1 91 91 ASP CB C 91 44.039 44.039 42.534 1.505 19854 7529 1 8 . 1 1 91 91 ASP H H 91 7.597 7.597 8.863 -1.266 19854 7530 1 8 . 1 1 92 92 VAL N N 92 115.158 115.158 123.714 -8.556 19854 7531 1 8 . 1 1 92 92 VAL C C 92 173.342 173.342 176.537 -3.195 19854 7532 1 8 . 1 1 92 92 VAL CA C 92 64.534 64.534 65.004 -0.471 19854 7533 1 8 . 1 1 92 92 VAL CB C 92 37.596 37.596 31.385 6.211 19854 7534 1 8 . 1 1 92 92 VAL H H 92 7.738 7.738 8.535 -0.797 19854 7535 1 8 . 1 1 93 93 THR N N 93 127.179 127.179 110.012 17.167 19854 7536 1 8 . 1 1 93 93 THR C C 93 178.902 178.902 174.098 4.804 19854 7537 1 8 . 1 1 93 93 THR CA C 93 64.254 64.254 63.003 1.251 19854 7538 1 8 . 1 1 93 93 THR CB C 93 74.215 74.215 69.018 5.197 19854 7539 1 8 . 1 1 93 93 THR H H 93 7.636 7.636 8.215 -0.579 19854 7540 1 8 . 1 1 94 94 SER N N 94 122.263 122.263 115.695 6.568 19854 7541 1 8 . 1 1 94 94 SER C C 94 163.965 163.965 175.215 -11.250 19854 7542 1 8 . 1 1 94 94 SER CA C 94 59.849 59.849 55.262 4.587 19854 7543 1 8 . 1 1 94 94 SER CB C 94 62.192 62.192 64.401 -2.209 19854 7544 1 8 . 1 1 94 94 SER H H 94 7.628 7.628 7.785 -0.158 19854 7545 1 8 . 1 1 95 95 ARG N N 95 113.099 113.099 128.202 -15.103 19854 7546 1 8 . 1 1 95 95 ARG C C 95 176.273 176.273 178.003 -1.730 19854 7547 1 8 . 1 1 95 95 ARG CA C 95 53.407 53.407 59.641 -6.234 19854 7548 1 8 . 1 1 95 95 ARG CB C 95 31.154 31.154 30.119 1.035 19854 7549 1 8 . 1 1 95 95 ARG H H 95 8.102 8.102 9.041 -0.939 19854 7550 1 8 . 1 1 96 96 VAL N N 96 124.787 124.787 119.248 5.539 19854 7551 1 8 . 1 1 96 96 VAL C C 96 178.031 178.031 177.756 0.275 19854 7552 1 8 . 1 1 96 96 VAL CA C 96 68.634 68.634 66.504 2.130 19854 7553 1 8 . 1 1 96 96 VAL CB C 96 24.126 24.126 31.375 -7.248 19854 7554 1 8 . 1 1 96 96 VAL H H 96 9.146 9.146 8.032 1.114 19854 7555 1 8 . 1 1 97 97 THR N N 97 111.970 111.970 116.430 -4.460 19854 7556 1 8 . 1 1 97 97 THR C C 97 178.031 178.031 176.310 1.721 19854 7557 1 8 . 1 1 97 97 THR CA C 97 63.949 63.949 66.469 -2.520 19854 7558 1 8 . 1 1 97 97 THR CB C 97 70.390 70.390 68.982 1.408 19854 7559 1 8 . 1 1 97 97 THR H H 97 7.984 7.984 7.618 0.366 19854 7560 1 8 . 1 1 98 98 TYR N N 98 113.232 113.232 121.439 -8.207 19854 7561 1 8 . 1 1 98 98 TYR C C 98 176.273 176.273 177.687 -1.414 19854 7562 1 8 . 1 1 98 98 TYR H H 98 7.605 7.605 7.834 -0.229 19854 7563 1 8 . 1 1 99 99 LYS N N 99 123.726 123.726 118.824 4.902 19854 7564 1 8 . 1 1 99 99 LYS C C 99 178.316 178.316 178.533 -0.217 19854 7565 1 8 . 1 1 99 99 LYS CA C 99 58.691 58.691 59.455 -0.764 19854 7566 1 8 . 1 1 99 99 LYS CB C 99 36.127 36.127 32.060 4.067 19854 7567 1 8 . 1 1 99 99 LYS H H 99 8.360 8.360 8.040 0.320 19854 7568 1 8 . 1 1 100 100 ASN N N 100 111.970 111.970 116.236 -4.266 19854 7569 1 8 . 1 1 100 100 ASN C C 100 175.979 175.979 176.778 -0.799 19854 7570 1 8 . 1 1 100 100 ASN CA C 100 53.407 53.407 55.180 -1.773 19854 7571 1 8 . 1 1 100 100 ASN CB C 100 37.596 37.596 38.742 -1.146 19854 7572 1 8 . 1 1 100 100 ASN H H 100 5.778 5.778 7.853 -2.075 19854 7573 1 8 . 1 1 101 101 VAL N N 101 118.877 118.877 121.615 -2.738 19854 7574 1 8 . 1 1 101 101 VAL C C 101 173.635 173.635 174.976 -1.341 19854 7575 1 8 . 1 1 101 101 VAL CA C 101 62.777 62.777 68.415 -5.638 19854 7576 1 8 . 1 1 101 101 VAL CB C 101 27.054 27.054 29.222 -2.168 19854 7577 1 8 . 1 1 101 101 VAL H H 101 7.370 7.370 7.512 -0.142 19854 7578 1 8 . 1 1 102 102 PRO C C 102 176.566 176.566 177.236 -0.670 19854 7579 1 8 . 1 1 102 102 PRO CA C 102 62.500 62.500 65.443 -2.943 19854 7580 1 8 . 1 1 102 102 PRO CB C 102 30.853 30.853 31.152 -0.299 19854 7581 1 8 . 1 1 103 103 ASN N N 103 122.728 122.728 114.838 7.890 19854 7582 1 8 . 1 1 103 103 ASN C C 103 175.100 175.100 176.925 -1.825 19854 7583 1 8 . 1 1 103 103 ASN CA C 103 54.579 54.579 54.434 0.145 19854 7584 1 8 . 1 1 103 103 ASN CB C 103 38.767 38.767 37.357 1.410 19854 7585 1 8 . 1 1 103 103 ASN H H 103 7.879 7.879 7.312 0.567 19854 7586 1 8 . 1 1 104 104 TRP N N 104 122.730 122.730 120.176 2.554 19854 7587 1 8 . 1 1 104 104 TRP C C 104 174.215 174.215 177.644 -3.429 19854 7588 1 8 . 1 1 104 104 TRP CA C 104 59.273 59.273 60.478 -1.205 19854 7589 1 8 . 1 1 104 104 TRP CB C 104 35.250 35.250 29.997 5.253 19854 7590 1 8 . 1 1 104 104 TRP H H 104 7.902 7.902 7.685 0.217 19854 7591 1 8 . 1 1 105 105 HIS N N 105 120.869 120.869 116.942 3.927 19854 7592 1 8 . 1 1 105 105 HIS C C 105 177.738 177.738 174.435 3.303 19854 7593 1 8 . 1 1 105 105 HIS H H 105 6.971 6.971 8.400 -1.429 19854 7594 1 8 . 1 1 106 106 ARG N N 106 126.314 126.314 122.683 3.631 19854 7595 1 8 . 1 1 106 106 ARG C C 106 176.566 176.566 176.377 0.189 19854 7596 1 8 . 1 1 106 106 ARG CA C 106 62.777 62.777 57.550 5.228 19854 7597 1 8 . 1 1 106 106 ARG CB C 106 29.397 29.397 31.294 -1.897 19854 7598 1 8 . 1 1 106 106 ARG H H 106 7.507 7.507 7.811 -0.304 19854 7599 1 8 . 1 1 107 107 ASP N N 107 119.076 119.076 121.795 -2.719 19854 7600 1 8 . 1 1 107 107 ASP C C 107 176.566 176.566 178.444 -1.878 19854 7601 1 8 . 1 1 107 107 ASP CA C 107 55.164 55.164 57.808 -2.644 19854 7602 1 8 . 1 1 107 107 ASP CB C 107 41.695 41.695 40.991 0.704 19854 7603 1 8 . 1 1 107 107 ASP H H 107 9.076 9.076 7.970 1.106 19854 7604 1 8 . 1 1 108 108 LEU N N 108 113.299 113.299 119.851 -6.552 19854 7605 1 8 . 1 1 108 108 LEU C C 108 176.273 176.273 178.347 -2.074 19854 7606 1 8 . 1 1 108 108 LEU CA C 108 59.264 59.264 58.223 1.041 19854 7607 1 8 . 1 1 108 108 LEU CB C 108 48.722 48.722 41.379 7.343 19854 7608 1 8 . 1 1 108 108 LEU H H 108 6.725 6.725 7.851 -1.126 19854 7609 1 8 . 1 1 109 109 VAL N N 109 121.267 121.267 118.598 2.669 19854 7610 1 8 . 1 1 109 109 VAL C C 109 175.393 175.393 178.383 -2.990 19854 7611 1 8 . 1 1 109 109 VAL CA C 109 63.949 63.949 66.384 -2.435 19854 7612 1 8 . 1 1 109 109 VAL CB C 109 32.911 32.911 31.105 1.806 19854 7613 1 8 . 1 1 109 109 VAL H H 109 8.763 8.763 7.670 1.093 19854 7614 1 8 . 1 1 110 110 ARG N N 110 112.900 112.900 120.693 -7.793 19854 7615 1 8 . 1 1 110 110 ARG C C 110 176.273 176.273 178.015 -1.742 19854 7616 1 8 . 1 1 110 110 ARG CA C 110 57.507 57.507 59.557 -2.050 19854 7617 1 8 . 1 1 110 110 ARG CB C 110 30.568 30.568 30.204 0.364 19854 7618 1 8 . 1 1 110 110 ARG H H 110 7.241 7.241 7.850 -0.609 19854 7619 1 8 . 1 1 111 111 VAL N N 111 115.556 115.556 116.977 -1.421 19854 7620 1 8 . 1 1 111 111 VAL C C 111 177.445 177.445 177.075 0.370 19854 7621 1 8 . 1 1 111 111 VAL CA C 111 59.849 59.849 66.098 -6.249 19854 7622 1 8 . 1 1 111 111 VAL CB C 111 32.911 32.911 32.777 0.134 19854 7623 1 8 . 1 1 111 111 VAL H H 111 7.566 7.566 7.707 -0.141 19854 7624 1 8 . 1 1 112 112 CYS N N 112 114.295 114.295 115.428 -1.133 19854 7625 1 8 . 1 1 112 112 CYS C C 112 169.826 169.826 174.475 -4.649 19854 7626 1 8 . 1 1 112 112 CYS CA C 112 57.507 57.507 58.743 -1.236 19854 7627 1 8 . 1 1 112 112 CYS CB C 112 35.839 35.839 28.783 7.056 19854 7628 1 8 . 1 1 112 112 CYS H H 112 7.425 7.425 8.288 -0.863 19854 7629 1 8 . 1 1 113 113 GLU N N 113 116.486 116.486 118.256 -1.770 19854 7630 1 8 . 1 1 113 113 GLU C C 113 176.566 176.566 175.603 0.963 19854 7631 1 8 . 1 1 113 113 GLU CA C 113 69.219 69.219 58.527 10.692 19854 7632 1 8 . 1 1 113 113 GLU CB C 113 30.568 30.568 28.214 2.354 19854 7633 1 8 . 1 1 113 113 GLU H H 113 7.241 7.241 8.288 -1.047 19854 7634 1 8 . 1 1 114 114 ASN N N 114 129.302 129.302 121.049 8.253 19854 7635 1 8 . 1 1 114 114 ASN C C 114 175.100 175.100 174.881 0.219 19854 7636 1 8 . 1 1 114 114 ASN CA C 114 52.236 52.236 53.100 -0.864 19854 7637 1 8 . 1 1 114 114 ASN CB C 114 39.938 39.938 38.187 1.751 19854 7638 1 8 . 1 1 114 114 ASN H H 114 8.919 8.919 8.321 0.598 19854 7639 1 8 . 1 1 115 115 ILE N N 115 110.443 110.443 119.945 -9.502 19854 7640 1 8 . 1 1 115 115 ILE C C 115 175.100 175.100 173.371 1.729 19854 7641 1 8 . 1 1 115 115 ILE CA C 115 65.705 65.705 57.890 7.815 19854 7642 1 8 . 1 1 115 115 ILE CB C 115 39.353 39.353 40.086 -0.733 19854 7643 1 8 . 1 1 115 115 ILE H H 115 9.287 9.287 7.936 1.351 19854 7644 1 8 . 1 1 116 116 PRO C C 116 175.979 175.979 175.724 0.255 19854 7645 1 8 . 1 1 116 116 PRO CA C 116 63.086 63.086 63.171 -0.085 19854 7646 1 8 . 1 1 116 116 PRO CB C 116 29.681 29.681 32.472 -2.792 19854 7647 1 8 . 1 1 117 117 ILE N N 117 123.591 123.591 124.106 -0.515 19854 7648 1 8 . 1 1 117 117 ILE C C 117 174.807 174.807 175.062 -0.255 19854 7649 1 8 . 1 1 117 117 ILE CA C 117 66.291 66.291 60.330 5.961 19854 7650 1 8 . 1 1 117 117 ILE CB C 117 38.767 38.767 42.232 -3.465 19854 7651 1 8 . 1 1 117 117 ILE H H 117 7.781 7.781 8.584 -0.803 19854 7652 1 8 . 1 1 118 118 VAL N N 118 119.009 119.009 125.842 -6.833 19854 7653 1 8 . 1 1 118 118 VAL C C 118 178.324 178.324 174.715 3.609 19854 7654 1 8 . 1 1 118 118 VAL CA C 118 62.777 62.777 60.706 2.071 19854 7655 1 8 . 1 1 118 118 VAL CB C 118 31.154 31.154 34.110 -2.956 19854 7656 1 8 . 1 1 118 118 VAL H H 118 8.767 8.767 8.807 -0.040 19854 7657 1 8 . 1 1 119 119 LEU N N 119 119.408 119.408 126.743 -7.335 19854 7658 1 8 . 1 1 119 119 LEU C C 119 178.031 178.031 176.014 2.017 19854 7659 1 8 . 1 1 119 119 LEU CA C 119 42.866 42.866 53.799 -10.933 19854 7660 1 8 . 1 1 119 119 LEU CB C 119 38.767 38.767 43.919 -5.152 19854 7661 1 8 . 1 1 119 119 LEU H H 119 7.734 7.734 9.195 -1.461 19854 7662 1 8 . 1 1 120 120 CYS N N 120 113.232 113.232 122.300 -9.068 19854 7663 1 8 . 1 1 120 120 CYS C C 120 178.031 178.031 174.248 3.783 19854 7664 1 8 . 1 1 120 120 CYS H H 120 8.317 8.317 9.171 -0.854 19854 7665 1 8 . 1 1 121 121 GLY N N 121 117.349 117.349 113.449 3.900 19854 7666 1 8 . 1 1 121 121 GLY C C 121 176.851 176.851 172.817 4.034 19854 7667 1 8 . 1 1 121 121 GLY CA C 121 41.109 41.109 43.648 -2.539 19854 7668 1 8 . 1 1 121 121 GLY H H 121 7.515 7.515 8.977 -1.462 19854 7669 1 8 . 1 1 122 122 ASN N N 122 125.318 125.318 123.995 1.323 19854 7670 1 8 . 1 1 122 122 ASN C C 122 175.686 175.686 175.747 -0.061 19854 7671 1 8 . 1 1 122 122 ASN CA C 122 50.479 50.479 49.944 0.535 19854 7672 1 8 . 1 1 122 122 ASN CB C 122 39.353 39.353 40.957 -1.604 19854 7673 1 8 . 1 1 122 122 ASN H H 122 9.162 9.162 8.648 0.514 19854 7674 1 8 . 1 1 123 123 LYS N N 123 122.132 122.132 114.081 8.051 19854 7675 1 8 . 1 1 123 123 LYS C C 123 173.043 173.043 177.062 -4.019 19854 7676 1 8 . 1 1 123 123 LYS CA C 123 58.101 58.101 57.606 0.495 19854 7677 1 8 . 1 1 123 123 LYS CB C 123 35.543 35.543 29.834 5.710 19854 7678 1 8 . 1 1 123 123 LYS H H 123 7.953 7.953 8.668 -0.715 19854 7679 1 8 . 1 1 124 124 VAL N N 124 123.726 123.726 113.144 10.582 19854 7680 1 8 . 1 1 124 124 VAL C C 124 175.679 175.679 176.438 -0.759 19854 7681 1 8 . 1 1 124 124 VAL CA C 124 64.840 64.840 64.564 0.275 19854 7682 1 8 . 1 1 124 124 VAL CB C 124 42.574 42.574 31.454 11.120 19854 7683 1 8 . 1 1 124 124 VAL H H 124 8.555 8.555 7.515 1.040 19854 7684 1 8 . 1 1 125 125 ASP N N 125 119.607 119.607 119.850 -0.243 19854 7685 1 8 . 1 1 125 125 ASP C C 125 176.566 176.566 176.745 -0.179 19854 7686 1 8 . 1 1 125 125 ASP CA C 125 55.750 55.750 56.501 -0.751 19854 7687 1 8 . 1 1 125 125 ASP CB C 125 40.524 40.524 41.025 -0.501 19854 7688 1 8 . 1 1 125 125 ASP H H 125 7.875 7.875 8.183 -0.308 19854 7689 1 8 . 1 1 126 126 ILE N N 126 116.088 116.088 120.558 -4.470 19854 7690 1 8 . 1 1 126 126 ILE C C 126 177.152 177.152 176.441 0.711 19854 7691 1 8 . 1 1 126 126 ILE CA C 126 66.291 66.291 61.935 4.356 19854 7692 1 8 . 1 1 126 126 ILE CB C 126 39.353 39.353 38.302 1.051 19854 7693 1 8 . 1 1 126 126 ILE H H 126 7.511 7.511 7.384 0.127 19854 7694 1 8 . 1 1 127 127 LYS N N 127 121.203 121.203 125.466 -4.263 19854 7695 1 8 . 1 1 127 127 LYS C C 127 175.979 175.979 176.958 -0.979 19854 7696 1 8 . 1 1 127 127 LYS CA C 127 58.101 58.101 58.592 -0.491 19854 7697 1 8 . 1 1 127 127 LYS CB C 127 35.834 35.834 32.571 3.263 19854 7698 1 8 . 1 1 127 127 LYS H H 127 8.113 8.113 8.434 -0.321 19854 7699 1 8 . 1 1 128 128 ASP N N 128 118.279 118.279 120.352 -2.073 19854 7700 1 8 . 1 1 128 128 ASP C C 128 176.566 176.566 175.051 1.515 19854 7701 1 8 . 1 1 128 128 ASP CA C 128 53.407 53.407 53.192 0.215 19854 7702 1 8 . 1 1 128 128 ASP CB C 128 40.524 40.524 39.743 0.780 19854 7703 1 8 . 1 1 128 128 ASP H H 128 7.241 7.241 8.172 -0.931 19854 7704 1 8 . 1 1 129 129 ARG N N 129 118.943 118.943 122.632 -3.689 19854 7705 1 8 . 1 1 129 129 ARG C C 129 177.738 177.738 176.355 1.383 19854 7706 1 8 . 1 1 129 129 ARG CA C 129 45.794 45.794 56.260 -10.466 19854 7707 1 8 . 1 1 129 129 ARG CB C 129 31.154 31.154 31.411 -0.257 19854 7708 1 8 . 1 1 129 129 ARG H H 129 8.423 8.423 7.853 0.570 19854 7709 1 8 . 1 1 130 130 LYS N N 130 109.381 109.381 122.034 -12.653 19854 7710 1 8 . 1 1 130 130 LYS C C 130 176.566 176.566 176.849 -0.283 19854 7711 1 8 . 1 1 130 130 LYS CA C 130 55.164 55.164 57.772 -2.608 19854 7712 1 8 . 1 1 130 130 LYS CB C 130 36.424 36.424 33.856 2.568 19854 7713 1 8 . 1 1 130 130 LYS H H 130 7.296 7.296 8.529 -1.233 19854 7714 1 8 . 1 1 131 131 VAL N N 131 110.377 110.377 121.034 -10.657 19854 7715 1 8 . 1 1 131 131 VAL C C 131 178.617 178.617 174.904 3.713 19854 7716 1 8 . 1 1 131 131 VAL CA C 131 65.705 65.705 61.791 3.914 19854 7717 1 8 . 1 1 131 131 VAL CB C 131 35.839 35.839 31.446 4.393 19854 7718 1 8 . 1 1 131 131 VAL H H 131 9.283 9.283 8.003 1.280 19854 7719 1 8 . 1 1 132 132 LYS N N 132 110.310 110.310 127.859 -17.549 19854 7720 1 8 . 1 1 132 132 LYS C C 132 176.273 176.273 177.337 -1.064 19854 7721 1 8 . 1 1 132 132 LYS CA C 132 59.849 59.849 55.431 4.418 19854 7722 1 8 . 1 1 132 132 LYS CB C 132 35.253 35.253 33.981 1.272 19854 7723 1 8 . 1 1 132 132 LYS H H 132 9.709 9.709 8.324 1.385 19854 7724 1 8 . 1 1 133 133 ALA N N 133 134.349 134.349 127.799 6.550 19854 7725 1 8 . 1 1 133 133 ALA CA C 133 51.065 51.065 54.985 -3.920 19854 7726 1 8 . 1 1 133 133 ALA CB C 133 12.999 12.999 18.523 -5.524 19854 7727 1 8 . 1 1 133 133 ALA H H 133 6.322 6.322 8.853 -2.531 19854 7728 1 8 . 1 1 134 134 LYS N N 134 117.615 117.615 118.128 -0.513 19854 7729 1 8 . 1 1 134 134 LYS C C 134 176.859 176.859 178.073 -1.214 19854 7730 1 8 . 1 1 134 134 LYS CA C 134 55.750 55.750 58.642 -2.892 19854 7731 1 8 . 1 1 134 134 LYS CB C 134 54.579 54.579 32.256 22.323 19854 7732 1 8 . 1 1 134 134 LYS H H 134 6.549 6.549 8.319 -1.770 19854 7733 1 8 . 1 1 135 135 SER N N 135 109.314 109.314 114.241 -4.927 19854 7734 1 8 . 1 1 135 135 SER C C 135 173.635 173.635 174.917 -1.282 19854 7735 1 8 . 1 1 135 135 SER CA C 135 56.336 56.336 59.673 -3.337 19854 7736 1 8 . 1 1 135 135 SER CB C 135 63.949 63.949 63.118 0.831 19854 7737 1 8 . 1 1 135 135 SER H H 135 7.840 7.840 7.832 0.008 19854 7738 1 8 . 1 1 136 136 ILE N N 136 124.123 124.123 122.068 2.055 19854 7739 1 8 . 1 1 136 136 ILE C C 136 175.100 175.100 175.876 -0.776 19854 7740 1 8 . 1 1 136 136 ILE CA C 136 68.634 68.634 62.582 6.052 19854 7741 1 8 . 1 1 136 136 ILE CB C 136 43.452 43.452 38.312 5.141 19854 7742 1 8 . 1 1 136 136 ILE H H 136 8.098 8.098 7.261 0.837 19854 7743 1 8 . 1 1 137 137 VAL N N 137 113.232 113.232 122.062 -8.830 19854 7744 1 8 . 1 1 137 137 VAL C C 137 176.859 176.859 176.035 0.824 19854 7745 1 8 . 1 1 137 137 VAL CA C 137 64.534 64.534 61.272 3.262 19854 7746 1 8 . 1 1 137 137 VAL CB C 137 34.082 34.082 32.607 1.475 19854 7747 1 8 . 1 1 137 137 VAL H H 137 7.711 7.711 7.912 -0.201 19854 7748 1 8 . 1 1 138 138 PHE N N 138 118.279 118.279 123.354 -5.075 19854 7749 1 8 . 1 1 138 138 PHE C C 138 175.393 175.393 176.271 -0.878 19854 7750 1 8 . 1 1 138 138 PHE CA C 138 58.092 58.092 62.724 -4.633 19854 7751 1 8 . 1 1 138 138 PHE CB C 138 39.353 39.353 39.206 0.147 19854 7752 1 8 . 1 1 138 138 PHE H H 138 8.317 8.317 7.634 0.683 19854 7753 1 8 . 1 1 139 139 HIS N N 139 120.605 120.605 116.039 4.566 19854 7754 1 8 . 1 1 139 139 HIS C C 139 175.979 175.979 177.088 -1.109 19854 7755 1 8 . 1 1 139 139 HIS CA C 139 67.775 67.775 59.330 8.445 19854 7756 1 8 . 1 1 139 139 HIS CB C 139 35.836 35.836 28.977 6.859 19854 7757 1 8 . 1 1 139 139 HIS H H 139 8.094 8.094 8.879 -0.785 19854 7758 1 8 . 1 1 140 140 ARG N N 140 120.140 120.140 120.367 -0.227 19854 7759 1 8 . 1 1 140 140 ARG C C 140 178.023 178.023 179.224 -1.201 19854 7760 1 8 . 1 1 140 140 ARG CA C 140 58.394 58.394 59.329 -0.935 19854 7761 1 8 . 1 1 140 140 ARG CB C 140 39.644 39.644 29.692 9.952 19854 7762 1 8 . 1 1 140 140 ARG H H 140 8.149 8.149 6.987 1.162 19854 7763 1 8 . 1 1 141 141 LYS N N 141 115.623 115.623 119.618 -3.995 19854 7764 1 8 . 1 1 141 141 LYS C C 141 173.635 173.635 178.026 -4.391 19854 7765 1 8 . 1 1 141 141 LYS CA C 141 58.092 58.092 58.791 -0.699 19854 7766 1 8 . 1 1 141 141 LYS CB C 141 33.496 33.496 32.216 1.280 19854 7767 1 8 . 1 1 141 141 LYS H H 141 7.449 7.449 7.551 -0.102 19854 7768 1 8 . 1 1 142 142 LYS N N 142 114.162 114.162 116.159 -1.997 19854 7769 1 8 . 1 1 142 142 LYS C C 142 175.979 175.979 175.916 0.063 19854 7770 1 8 . 1 1 142 142 LYS CA C 142 51.065 51.065 54.998 -3.933 19854 7771 1 8 . 1 1 142 142 LYS CB C 142 34.668 34.668 32.188 2.479 19854 7772 1 8 . 1 1 142 142 LYS H H 142 8.982 8.982 7.781 1.201 19854 7773 1 8 . 1 1 143 143 ASN N N 143 112.103 112.103 114.700 -2.597 19854 7774 1 8 . 1 1 143 143 ASN C C 143 175.100 175.100 174.127 0.973 19854 7775 1 8 . 1 1 143 143 ASN CA C 143 53.407 53.407 53.951 -0.544 19854 7776 1 8 . 1 1 143 143 ASN CB C 143 39.938 39.938 36.476 3.462 19854 7777 1 8 . 1 1 143 143 ASN H H 143 7.402 7.402 7.702 -0.300 19854 7778 1 8 . 1 1 144 144 LEU N N 144 118.810 118.810 116.832 1.978 19854 7779 1 8 . 1 1 144 144 LEU CA C 144 53.993 53.993 53.271 0.722 19854 7780 1 8 . 1 1 144 144 LEU CB C 144 42.866 42.866 44.425 -1.559 19854 7781 1 8 . 1 1 144 144 LEU H H 144 7.793 7.793 8.083 -0.290 19854 7782 1 8 . 1 1 145 145 GLN N N 145 119.607 119.607 117.866 1.741 19854 7783 1 8 . 1 1 145 145 GLN C C 145 176.859 176.859 174.151 2.708 19854 7784 1 8 . 1 1 145 145 GLN CA C 145 55.164 55.164 53.540 1.624 19854 7785 1 8 . 1 1 145 145 GLN CB C 145 29.983 29.983 30.931 -0.948 19854 7786 1 8 . 1 1 145 145 GLN H H 145 7.014 7.014 7.984 -0.970 19854 7787 1 8 . 1 1 146 146 TYR N N 146 119.275 119.275 124.987 -5.712 19854 7788 1 8 . 1 1 146 146 TYR C C 146 174.807 174.807 174.243 0.564 19854 7789 1 8 . 1 1 146 146 TYR CA C 146 62.777 62.777 56.056 6.721 19854 7790 1 8 . 1 1 146 146 TYR CB C 146 41.109 41.109 40.308 0.801 19854 7791 1 8 . 1 1 146 146 TYR H H 146 9.350 9.350 8.170 1.180 19854 7792 1 8 . 1 1 147 147 TYR N N 147 123.658 123.658 125.861 -2.203 19854 7793 1 8 . 1 1 147 147 TYR C C 147 177.738 177.738 173.861 3.877 19854 7794 1 8 . 1 1 147 147 TYR CA C 147 58.092 58.092 56.194 1.898 19854 7795 1 8 . 1 1 147 147 TYR CB C 147 39.938 39.938 41.865 -1.927 19854 7796 1 8 . 1 1 147 147 TYR H H 147 8.340 8.340 8.751 -0.411 19854 7797 1 8 . 1 1 148 148 ASP N N 148 121.267 121.267 123.681 -2.414 19854 7798 1 8 . 1 1 148 148 ASP C C 148 176.859 176.859 175.204 1.655 19854 7799 1 8 . 1 1 148 148 ASP CA C 148 54.579 54.579 54.416 0.163 19854 7800 1 8 . 1 1 148 148 ASP CB C 148 41.109 41.109 41.667 -0.558 19854 7801 1 8 . 1 1 148 148 ASP H H 148 8.911 8.911 8.289 0.622 19854 7802 1 8 . 1 1 149 149 ILE N N 149 119.607 119.607 118.512 1.095 19854 7803 1 8 . 1 1 149 149 ILE C C 149 174.807 174.807 174.370 0.437 19854 7804 1 8 . 1 1 149 149 ILE CA C 149 61.020 61.020 59.105 1.915 19854 7805 1 8 . 1 1 149 149 ILE CB C 149 39.353 39.353 42.674 -3.321 19854 7806 1 8 . 1 1 149 149 ILE H H 149 8.712 8.712 8.708 0.004 19854 7807 1 8 . 1 1 150 150 SER N N 150 117.349 117.349 116.958 0.391 19854 7808 1 8 . 1 1 150 150 SER C C 150 175.686 175.686 174.483 1.203 19854 7809 1 8 . 1 1 150 150 SER CA C 150 60.435 60.435 55.730 4.705 19854 7810 1 8 . 1 1 150 150 SER CB C 150 62.192 62.192 65.389 -3.197 19854 7811 1 8 . 1 1 150 150 SER H H 150 8.454 8.454 8.515 -0.061 19854 7812 1 8 . 1 1 151 151 ALA N N 151 131.162 131.162 130.898 0.264 19854 7813 1 8 . 1 1 151 151 ALA C C 151 160.742 160.742 179.261 -18.519 19854 7814 1 8 . 1 1 151 151 ALA CA C 151 53.993 53.993 55.404 -1.411 19854 7815 1 8 . 1 1 151 151 ALA CB C 151 22.369 22.369 19.102 3.267 19854 7816 1 8 . 1 1 151 151 ALA H H 151 10.640 10.640 8.958 1.682 19854 7817 1 8 . 1 1 152 152 LYS N N 152 121.400 121.400 118.824 2.576 19854 7818 1 8 . 1 1 152 152 LYS C C 152 174.221 174.221 178.097 -3.876 19854 7819 1 8 . 1 1 152 152 LYS CA C 152 59.849 59.849 58.733 1.116 19854 7820 1 8 . 1 1 152 152 LYS CB C 152 34.668 34.668 32.466 2.202 19854 7821 1 8 . 1 1 152 152 LYS H H 152 9.099 9.099 8.501 0.598 19854 7822 1 8 . 1 1 153 153 SER N N 153 135.212 135.212 110.805 24.407 19854 7823 1 8 . 1 1 153 153 SER C C 153 177.152 177.152 174.829 2.323 19854 7824 1 8 . 1 1 153 153 SER CA C 153 62.192 62.192 58.118 4.074 19854 7825 1 8 . 1 1 153 153 SER CB C 153 66.291 66.291 64.204 2.087 19854 7826 1 8 . 1 1 153 153 SER H H 153 8.935 8.935 7.773 1.162 19854 7827 1 8 . 1 1 154 154 ASN N N 154 119.341 119.341 116.535 2.806 19854 7828 1 8 . 1 1 154 154 ASN C C 154 175.979 175.979 174.019 1.960 19854 7829 1 8 . 1 1 154 154 ASN CA C 154 49.894 49.894 54.728 -4.834 19854 7830 1 8 . 1 1 154 154 ASN CB C 154 39.353 39.353 36.499 2.854 19854 7831 1 8 . 1 1 154 154 ASN H H 154 7.488 7.488 8.203 -0.715 19854 7832 1 8 . 1 1 155 155 TYR N N 155 120.074 120.074 123.104 -3.030 19854 7833 1 8 . 1 1 155 155 TYR C C 155 177.144 177.144 175.294 1.850 19854 7834 1 8 . 1 1 155 155 TYR CA C 155 60.738 60.738 59.550 1.188 19854 7835 1 8 . 1 1 155 155 TYR CB C 155 41.402 41.402 38.693 2.709 19854 7836 1 8 . 1 1 155 155 TYR H H 155 7.945 7.945 7.517 0.428 19854 7837 1 8 . 1 1 156 156 ASN N N 156 124.058 124.058 122.467 1.591 19854 7838 1 8 . 1 1 156 156 ASN C C 156 175.679 175.679 175.590 0.089 19854 7839 1 8 . 1 1 156 156 ASN CA C 156 53.121 53.121 54.256 -1.135 19854 7840 1 8 . 1 1 156 156 ASN CB C 156 38.179 38.179 35.981 2.198 19854 7841 1 8 . 1 1 156 156 ASN H H 156 8.192 8.192 8.964 -0.772 19854 7842 1 8 . 1 1 157 157 PHE N N 157 123.459 123.459 119.943 3.516 19854 7843 1 8 . 1 1 157 157 PHE C C 157 174.221 174.221 175.791 -1.570 19854 7844 1 8 . 1 1 157 157 PHE CA C 157 57.507 57.507 61.219 -3.712 19854 7845 1 8 . 1 1 157 157 PHE CB C 157 39.353 39.353 39.289 0.064 19854 7846 1 8 . 1 1 157 157 PHE H H 157 7.429 7.429 7.779 -0.350 19854 7847 1 8 . 1 1 158 158 GLU N N 158 112.568 112.568 114.609 -2.041 19854 7848 1 8 . 1 1 158 158 GLU C C 158 176.566 176.566 177.467 -0.901 19854 7849 1 8 . 1 1 158 158 GLU CA C 158 72.147 72.147 56.406 15.741 19854 7850 1 8 . 1 1 158 158 GLU CB C 158 27.640 27.640 28.953 -1.313 19854 7851 1 8 . 1 1 158 158 GLU H H 158 7.495 7.495 8.478 -0.983 19854 7852 1 8 . 1 1 159 159 LYS N N 159 113.232 113.232 120.498 -7.266 19854 7853 1 8 . 1 1 159 159 LYS C C 159 176.566 176.566 175.661 0.905 19854 7854 1 8 . 1 1 159 159 LYS CA C 159 53.993 53.993 61.507 -7.514 19854 7855 1 8 . 1 1 159 159 LYS CB C 159 33.496 33.496 30.169 3.328 19854 7856 1 8 . 1 1 159 159 LYS H H 159 6.862 6.862 7.317 -0.455 19854 7857 1 8 . 1 1 160 160 PRO C C 160 176.273 176.273 178.560 -2.287 19854 7858 1 8 . 1 1 160 160 PRO CA C 160 64.258 64.258 65.654 -1.397 19854 7859 1 8 . 1 1 160 160 PRO CB C 160 32.318 32.318 31.145 1.173 19854 7860 1 8 . 1 1 161 161 PHE N N 161 123.726 123.726 116.102 7.624 19854 7861 1 8 . 1 1 161 161 PHE C C 161 176.851 176.851 177.555 -0.704 19854 7862 1 8 . 1 1 161 161 PHE CA C 161 60.445 60.445 61.942 -1.497 19854 7863 1 8 . 1 1 161 161 PHE CB C 161 40.816 40.816 37.695 3.121 19854 7864 1 8 . 1 1 161 161 PHE H H 161 8.215 8.215 7.271 0.944 19854 7865 1 8 . 1 1 162 162 LEU N N 162 110.177 110.177 119.210 -9.033 19854 7866 1 8 . 1 1 162 162 LEU C C 162 176.273 176.273 178.670 -2.397 19854 7867 1 8 . 1 1 162 162 LEU CA C 162 55.750 55.750 57.977 -2.227 19854 7868 1 8 . 1 1 162 162 LEU CB C 162 44.037 44.037 41.499 2.538 19854 7869 1 8 . 1 1 162 162 LEU H H 162 7.527 7.527 7.991 -0.464 19854 7870 1 8 . 1 1 163 163 TRP N N 163 123.525 123.525 121.340 2.185 19854 7871 1 8 . 1 1 163 163 TRP C C 163 177.152 177.152 177.977 -0.825 19854 7872 1 8 . 1 1 163 163 TRP CA C 163 61.606 61.606 62.172 -0.566 19854 7873 1 8 . 1 1 163 163 TRP CB C 163 28.811 28.811 29.510 -0.699 19854 7874 1 8 . 1 1 163 163 TRP H H 163 7.476 7.476 8.196 -0.720 19854 7875 1 8 . 1 1 164 164 LEU N N 164 119.740 119.740 119.093 0.647 19854 7876 1 8 . 1 1 164 164 LEU C C 164 175.686 175.686 178.874 -3.188 19854 7877 1 8 . 1 1 164 164 LEU CA C 164 61.020 61.020 57.807 3.213 19854 7878 1 8 . 1 1 164 164 LEU CB C 164 45.794 45.794 41.397 4.397 19854 7879 1 8 . 1 1 164 164 LEU H H 164 9.412 9.412 8.004 1.408 19854 7880 1 8 . 1 1 165 165 ALA N N 165 118.013 118.013 121.434 -3.421 19854 7881 1 8 . 1 1 165 165 ALA C C 165 165.723 165.723 179.557 -13.834 19854 7882 1 8 . 1 1 165 165 ALA CA C 165 52.236 52.236 55.255 -3.019 19854 7883 1 8 . 1 1 165 165 ALA CB C 165 21.784 21.784 18.214 3.570 19854 7884 1 8 . 1 1 165 165 ALA H H 165 7.707 7.707 8.305 -0.598 19854 7885 1 8 . 1 1 166 166 ARG N N 166 122.994 122.994 118.352 4.642 19854 7886 1 8 . 1 1 166 166 ARG C C 166 175.979 175.979 178.799 -2.820 19854 7887 1 8 . 1 1 166 166 ARG CA C 166 49.308 49.308 59.193 -9.885 19854 7888 1 8 . 1 1 166 166 ARG CB C 166 29.397 29.397 30.135 -0.738 19854 7889 1 8 . 1 1 166 166 ARG H H 166 8.692 8.692 8.128 0.564 19854 7890 1 8 . 1 1 167 167 LYS N N 167 112.568 112.568 120.141 -7.573 19854 7891 1 8 . 1 1 167 167 LYS C C 167 176.273 176.273 179.128 -2.855 19854 7892 1 8 . 1 1 167 167 LYS CA C 167 58.092 58.092 58.342 -0.250 19854 7893 1 8 . 1 1 167 167 LYS CB C 167 34.668 34.668 31.310 3.358 19854 7894 1 8 . 1 1 167 167 LYS H H 167 6.819 6.819 7.440 -0.621 19854 7895 1 8 . 1 1 168 168 LEU N N 168 114.959 114.959 119.455 -4.496 19854 7896 1 8 . 1 1 168 168 LEU C C 168 177.738 177.738 178.961 -1.223 19854 7897 1 8 . 1 1 168 168 LEU CA C 168 56.921 56.921 57.495 -0.574 19854 7898 1 8 . 1 1 168 168 LEU CB C 168 41.695 41.695 41.505 0.190 19854 7899 1 8 . 1 1 168 168 LEU H H 168 7.269 7.269 7.712 -0.443 19854 7900 1 8 . 1 1 169 169 ILE N N 169 122.199 122.199 117.326 4.873 19854 7901 1 8 . 1 1 169 169 ILE C C 169 177.445 177.445 177.094 0.351 19854 7902 1 8 . 1 1 169 169 ILE CA C 169 63.375 63.375 63.249 0.126 19854 7903 1 8 . 1 1 169 169 ILE CB C 169 42.281 42.281 38.612 3.669 19854 7904 1 8 . 1 1 169 169 ILE H H 169 8.360 8.360 8.017 0.343 19854 7905 1 8 . 1 1 170 170 GLY N N 170 113.099 113.099 106.725 6.374 19854 7906 1 8 . 1 1 170 170 GLY C C 170 162.496 162.496 173.974 -11.478 19854 7907 1 8 . 1 1 170 170 GLY CA C 170 44.037 44.037 44.828 -0.791 19854 7908 1 8 . 1 1 170 170 GLY H H 170 6.686 6.686 7.981 -1.295 19854 7909 1 8 . 1 1 171 171 ASP N N 171 113.232 113.232 121.827 -8.595 19854 7910 1 8 . 1 1 171 171 ASP C C 171 178.910 178.910 175.729 3.181 19854 7911 1 8 . 1 1 171 171 ASP CA C 171 50.479 50.479 50.458 0.021 19854 7912 1 8 . 1 1 171 171 ASP CB C 171 41.109 41.109 41.756 -0.647 19854 7913 1 8 . 1 1 171 171 ASP H H 171 6.815 6.815 7.676 -0.861 19854 7914 1 8 . 1 1 172 172 PRO C C 172 176.566 176.566 177.287 -0.721 19854 7915 1 8 . 1 1 172 172 PRO CA C 172 63.965 63.965 64.373 -0.407 19854 7916 1 8 . 1 1 172 172 PRO CB C 172 31.732 31.732 32.237 -0.505 19854 7917 1 8 . 1 1 173 173 ASN N N 173 109.779 109.779 115.636 -5.857 19854 7918 1 8 . 1 1 173 173 ASN C C 173 175.979 175.979 174.679 1.300 19854 7919 1 8 . 1 1 173 173 ASN CA C 173 54.579 54.579 52.826 1.753 19854 7920 1 8 . 1 1 173 173 ASN CB C 173 36.424 36.424 38.826 -2.402 19854 7921 1 8 . 1 1 173 173 ASN H H 173 8.016 8.016 8.340 -0.324 19854 7922 1 8 . 1 1 174 174 LEU N N 174 109.248 109.248 122.526 -13.278 19854 7923 1 8 . 1 1 174 174 LEU C C 174 176.566 176.566 175.080 1.486 19854 7924 1 8 . 1 1 174 174 LEU CA C 174 56.336 56.336 56.215 0.121 19854 7925 1 8 . 1 1 174 174 LEU CB C 174 44.037 44.037 42.899 1.138 19854 7926 1 8 . 1 1 174 174 LEU H H 174 7.871 7.871 7.278 0.593 19854 7927 1 8 . 1 1 175 175 GLU N N 175 125.185 125.185 124.243 0.942 19854 7928 1 8 . 1 1 175 175 GLU C C 175 177.445 177.445 174.765 2.680 19854 7929 1 8 . 1 1 175 175 GLU CA C 175 76.247 76.247 54.317 21.930 19854 7930 1 8 . 1 1 175 175 GLU CB C 175 28.811 28.811 34.058 -5.247 19854 7931 1 8 . 1 1 175 175 GLU H H 175 9.127 9.127 8.391 0.736 19854 7932 1 8 . 1 1 176 176 PHE N N 176 136.873 136.873 122.974 13.899 19854 7933 1 8 . 1 1 176 176 PHE C C 176 178.617 178.617 175.590 3.027 19854 7934 1 8 . 1 1 176 176 PHE CA C 176 59.264 59.264 58.470 0.794 19854 7935 1 8 . 1 1 176 176 PHE CB C 176 44.623 44.623 40.294 4.329 19854 7936 1 8 . 1 1 176 176 PHE H H 176 10.058 10.058 8.706 1.352 19854 7937 1 8 . 1 1 177 177 VAL N N 177 118.877 118.877 124.337 -5.460 19854 7938 1 8 . 1 1 177 177 VAL C C 177 177.445 177.445 174.500 2.945 19854 7939 1 8 . 1 1 177 177 VAL CA C 177 62.777 62.777 59.293 3.484 19854 7940 1 8 . 1 1 177 177 VAL CB C 177 34.668 34.668 34.771 -0.103 19854 7941 1 8 . 1 1 177 177 VAL H H 177 7.789 7.789 7.891 -0.102 19854 7942 1 8 . 1 1 178 178 ALA N N 178 123.859 123.859 125.994 -2.135 19854 7943 1 8 . 1 1 178 178 ALA C C 178 177.144 177.144 177.331 -0.187 19854 7944 1 8 . 1 1 178 178 ALA CA C 178 54.000 54.000 54.838 -0.838 19854 7945 1 8 . 1 1 178 178 ALA CB C 178 15.035 15.035 18.945 -3.910 19854 7946 1 8 . 1 1 178 178 ALA H H 178 7.683 7.683 8.221 -0.538 19854 7947 1 8 . 1 1 179 179 MET N N 179 121.668 121.668 118.929 2.739 19854 7948 1 8 . 1 1 179 179 MET C C 179 177.144 177.144 173.452 3.692 19854 7949 1 8 . 1 1 179 179 MET CA C 179 60.445 60.445 53.446 6.999 19854 7950 1 8 . 1 1 179 179 MET CB C 179 39.351 39.351 33.212 6.139 19854 7951 1 8 . 1 1 179 179 MET H H 179 7.648 7.648 7.871 -0.223 19854 7952 1 8 . 1 1 180 180 PRO C C 180 177.445 177.445 175.911 1.534 19854 7953 1 8 . 1 1 180 180 PRO CA C 180 64.844 64.844 62.348 2.496 19854 7954 1 8 . 1 1 180 180 PRO CB C 180 29.974 29.974 32.120 -2.146 19854 7955 1 8 . 1 1 181 181 ALA N N 181 128.439 128.439 122.556 5.883 19854 7956 1 8 . 1 1 181 181 ALA C C 181 176.273 176.273 177.784 -1.511 19854 7957 1 8 . 1 1 181 181 ALA CA C 181 58.092 58.092 51.961 6.131 19854 7958 1 8 . 1 1 181 181 ALA CB C 181 21.198 21.198 19.275 1.923 19854 7959 1 8 . 1 1 181 181 ALA H H 181 8.673 8.673 8.046 0.627 19854 7960 1 8 . 1 1 182 182 LEU N N 182 122.130 122.130 122.693 -0.563 19854 7961 1 8 . 1 1 182 182 LEU C C 182 177.445 177.445 177.470 -0.025 19854 7962 1 8 . 1 1 182 182 LEU CA C 182 55.164 55.164 55.073 0.091 19854 7963 1 8 . 1 1 182 182 LEU CB C 182 42.866 42.866 42.706 0.160 19854 7964 1 8 . 1 1 182 182 LEU H H 182 8.821 8.821 8.121 0.700 19854 7965 1 8 . 1 1 183 183 ALA N N 183 121.004 121.004 126.276 -5.272 19854 7966 1 8 . 1 1 183 183 ALA C C 183 178.617 178.617 175.425 3.192 19854 7967 1 8 . 1 1 183 183 ALA CA C 183 57.808 57.808 49.925 7.883 19854 7968 1 8 . 1 1 183 183 ALA CB C 183 24.117 24.117 18.758 5.359 19854 7969 1 8 . 1 1 183 183 ALA H H 183 8.356 8.356 8.332 0.024 19854 7970 1 8 . 1 1 184 184 PRO C C 184 177.152 177.152 175.342 1.810 19854 7971 1 8 . 1 1 184 184 PRO CA C 184 64.258 64.258 61.756 2.502 19854 7972 1 8 . 1 1 184 184 PRO CB C 184 29.681 29.681 31.355 -1.674 19854 7973 1 8 . 1 1 185 185 PRO C C 185 175.686 175.686 177.045 -1.359 19854 7974 1 8 . 1 1 185 185 PRO CA C 185 63.379 63.379 62.069 1.310 19854 7975 1 8 . 1 1 185 185 PRO CB C 185 35.248 35.248 32.813 2.434 19854 7976 1 8 . 1 1 186 186 GLU N N 186 120.539 120.539 121.829 -1.290 19854 7977 1 8 . 1 1 186 186 GLU C C 186 176.273 176.273 176.104 0.169 19854 7978 1 8 . 1 1 186 186 GLU CA C 186 58.101 58.101 58.003 0.098 19854 7979 1 8 . 1 1 186 186 GLU CB C 186 35.836 35.836 29.885 5.951 19854 7980 1 8 . 1 1 186 186 GLU H H 186 8.086 8.086 8.628 -0.542 19854 7981 1 8 . 1 1 187 187 VAL N N 187 124.455 124.455 115.998 8.457 19854 7982 1 8 . 1 1 187 187 VAL C C 187 178.910 178.910 174.870 4.040 19854 7983 1 8 . 1 1 187 187 VAL CA C 187 63.363 63.363 62.953 0.410 19854 7984 1 8 . 1 1 187 187 VAL CB C 187 34.082 34.082 31.338 2.744 19854 7985 1 8 . 1 1 187 187 VAL H H 187 8.622 8.622 7.910 0.712 19854 7986 1 8 . 1 1 188 188 VAL N N 188 128.572 128.572 120.772 7.800 19854 7987 1 8 . 1 1 188 188 VAL C C 188 178.324 178.324 175.980 2.344 19854 7988 1 8 . 1 1 188 188 VAL CA C 188 68.634 68.634 61.140 7.494 19854 7989 1 8 . 1 1 188 188 VAL CB C 188 31.154 31.154 34.265 -3.111 19854 7990 1 8 . 1 1 188 188 VAL H H 188 8.497 8.497 7.898 0.599 19854 7991 1 8 . 1 1 189 189 MET N N 189 122.795 122.795 118.931 3.864 19854 7992 1 8 . 1 1 189 189 MET C C 189 177.445 177.445 175.838 1.607 19854 7993 1 8 . 1 1 189 189 MET CA C 189 55.164 55.164 57.712 -2.549 19854 7994 1 8 . 1 1 189 189 MET CB C 189 35.253 35.253 31.949 3.304 19854 7995 1 8 . 1 1 189 189 MET H H 189 6.991 6.991 8.698 -1.707 19854 7996 1 8 . 1 1 190 190 ASP N N 190 114.959 114.959 115.555 -0.596 19854 7997 1 8 . 1 1 190 190 ASP C C 190 175.686 175.686 175.812 -0.126 19854 7998 1 8 . 1 1 190 190 ASP CA C 190 51.065 51.065 55.051 -3.986 19854 7999 1 8 . 1 1 190 190 ASP CB C 190 41.695 41.695 39.124 2.571 19854 8000 1 8 . 1 1 190 190 ASP H H 190 7.210 7.210 8.858 -1.648 19854 8001 1 8 . 1 1 191 191 PRO C C 191 176.566 176.566 177.500 -0.934 19854 8002 1 8 . 1 1 191 191 PRO CA C 191 63.965 63.965 64.814 -0.849 19854 8003 1 8 . 1 1 191 191 PRO CB C 191 31.146 31.146 31.607 -0.461 19854 8004 1 8 . 1 1 192 192 ALA N N 192 109.513 109.513 120.774 -11.261 19854 8005 1 8 . 1 1 192 192 ALA CA C 192 53.993 53.993 54.352 -0.359 19854 8006 1 8 . 1 1 192 192 ALA CB C 192 19.441 19.441 18.347 1.094 19854 8007 1 8 . 1 1 192 192 ALA H H 192 7.394 7.394 7.997 -0.603 19854 8008 1 8 . 1 1 193 193 LEU N N 193 119.009 119.009 117.604 1.405 19854 8009 1 8 . 1 1 193 193 LEU C C 193 175.979 175.979 176.961 -0.982 19854 8010 1 8 . 1 1 193 193 LEU CA C 193 56.336 56.336 55.870 0.466 19854 8011 1 8 . 1 1 193 193 LEU CB C 193 42.866 42.866 42.083 0.783 19854 8012 1 8 . 1 1 193 193 LEU H H 193 8.340 8.340 7.993 0.347 19854 8013 1 8 . 1 1 194 194 ALA N N 194 121.666 121.666 119.179 2.487 19854 8014 1 8 . 1 1 194 194 ALA C C 194 166.896 166.896 178.343 -11.447 19854 8015 1 8 . 1 1 194 194 ALA CA C 194 55.164 55.164 52.267 2.897 19854 8016 1 8 . 1 1 194 194 ALA CB C 194 16.513 16.513 19.562 -3.049 19854 8017 1 8 . 1 1 194 194 ALA H H 194 8.176 8.176 7.387 0.789 19854 8018 1 8 . 1 1 195 195 ALA N N 195 119.541 119.541 121.144 -1.603 19854 8019 1 8 . 1 1 195 195 ALA C C 195 173.928 173.928 179.160 -5.232 19854 8020 1 8 . 1 1 195 195 ALA CA C 195 57.507 57.507 54.186 3.321 19854 8021 1 8 . 1 1 195 195 ALA CB C 195 19.441 19.441 17.229 2.212 19854 8022 1 8 . 1 1 195 195 ALA H H 195 8.364 8.364 8.816 -0.452 19854 8023 1 8 . 1 1 196 196 GLN N N 196 107.322 107.322 119.734 -12.412 19854 8024 1 8 . 1 1 196 196 GLN C C 196 176.273 176.273 177.519 -1.246 19854 8025 1 8 . 1 1 196 196 GLN CA C 196 56.921 56.921 58.478 -1.557 19854 8026 1 8 . 1 1 196 196 GLN CB C 196 29.983 29.983 28.667 1.316 19854 8027 1 8 . 1 1 196 196 GLN H H 196 7.910 7.910 7.867 0.043 19854 8028 1 8 . 1 1 197 197 TYR N N 197 119.277 119.277 118.488 0.789 19854 8029 1 8 . 1 1 197 197 TYR C C 197 178.316 178.316 178.451 -0.135 19854 8030 1 8 . 1 1 197 197 TYR CA C 197 56.343 56.343 62.148 -5.805 19854 8031 1 8 . 1 1 197 197 TYR CB C 197 43.453 43.453 37.868 5.585 19854 8032 1 8 . 1 1 197 197 TYR H H 197 8.180 8.180 8.312 -0.132 19854 8033 1 8 . 1 1 198 198 GLU N N 198 110.244 110.244 119.328 -9.084 19854 8034 1 8 . 1 1 198 198 GLU C C 198 176.273 176.273 178.866 -2.593 19854 8035 1 8 . 1 1 198 198 GLU CA C 198 53.407 53.407 59.675 -6.268 19854 8036 1 8 . 1 1 198 198 GLU CB C 198 30.568 30.568 29.199 1.369 19854 8037 1 8 . 1 1 198 198 GLU H H 198 7.523 7.523 8.315 -0.792 19854 8038 1 8 . 1 1 199 199 HIS N N 199 119.211 119.211 119.836 -0.625 19854 8039 1 8 . 1 1 199 199 HIS C C 199 178.902 178.902 177.115 1.787 19854 8040 1 8 . 1 1 199 199 HIS CA C 199 58.687 58.687 59.556 -0.869 19854 8041 1 8 . 1 1 199 199 HIS CB C 199 34.957 34.957 29.772 5.185 19854 8042 1 8 . 1 1 199 199 HIS H H 199 8.258 8.258 8.046 0.212 19854 8043 1 8 . 1 1 200 200 ASP N N 200 124.722 124.722 119.882 4.840 19854 8044 1 8 . 1 1 200 200 ASP C C 200 176.705 176.705 178.955 -2.250 19854 8045 1 8 . 1 1 200 200 ASP CA C 200 58.687 58.687 57.249 1.438 19854 8046 1 8 . 1 1 200 200 ASP CB C 200 39.644 39.644 40.234 -0.590 19854 8047 1 8 . 1 1 200 200 ASP H H 200 8.086 8.086 8.008 0.078 19854 8048 1 8 . 1 1 201 201 LEU N N 201 116.353 116.353 120.187 -3.834 19854 8049 1 8 . 1 1 201 201 LEU C C 201 178.910 178.910 179.214 -0.304 19854 8050 1 8 . 1 1 201 201 LEU CA C 201 61.606 61.606 58.318 3.288 19854 8051 1 8 . 1 1 201 201 LEU CB C 201 41.109 41.109 41.898 -0.789 19854 8052 1 8 . 1 1 201 201 LEU H H 201 7.722 7.722 7.978 -0.256 19854 8053 1 8 . 1 1 202 202 GLU N N 202 118.080 118.080 119.704 -1.624 19854 8054 1 8 . 1 1 202 202 GLU C C 202 176.566 176.566 179.362 -2.796 19854 8055 1 8 . 1 1 202 202 GLU CA C 202 56.921 56.921 59.405 -2.484 19854 8056 1 8 . 1 1 202 202 GLU CB C 202 30.568 30.568 29.655 0.913 19854 8057 1 8 . 1 1 202 202 GLU H H 202 8.857 8.857 8.100 0.757 19854 8058 1 8 . 1 1 203 203 VAL N N 203 129.369 129.369 119.975 9.394 19854 8059 1 8 . 1 1 203 203 VAL C C 203 178.617 178.617 177.839 0.778 19854 8060 1 8 . 1 1 203 203 VAL CA C 203 64.534 64.534 66.626 -2.093 19854 8061 1 8 . 1 1 203 203 VAL CB C 203 27.640 27.640 31.082 -3.442 19854 8062 1 8 . 1 1 203 203 VAL H H 203 9.283 9.283 7.903 1.380 19854 8063 1 8 . 1 1 204 204 ALA N N 204 109.580 109.580 121.897 -12.317 19854 8064 1 8 . 1 1 204 204 ALA C C 204 176.859 176.859 179.708 -2.849 19854 8065 1 8 . 1 1 204 204 ALA CA C 204 54.579 54.579 55.036 -0.457 19854 8066 1 8 . 1 1 204 204 ALA CB C 204 18.270 18.270 18.441 -0.171 19854 8067 1 8 . 1 1 204 204 ALA H H 204 8.528 8.528 7.835 0.693 19854 8068 1 8 . 1 1 205 205 GLN N N 205 123.328 123.328 116.787 6.541 19854 8069 1 8 . 1 1 205 205 GLN C C 205 177.418 177.418 178.099 -0.681 19854 8070 1 8 . 1 1 205 205 GLN CA C 205 57.515 57.515 58.220 -0.705 19854 8071 1 8 . 1 1 205 205 GLN CB C 205 33.785 33.785 28.901 4.884 19854 8072 1 8 . 1 1 205 205 GLN H H 205 8.160 8.160 7.964 0.196 19854 8073 1 8 . 1 1 206 206 THR N N 206 120.271 120.271 113.915 6.356 19854 8074 1 8 . 1 1 206 206 THR C C 206 176.273 176.273 175.310 0.963 19854 8075 1 8 . 1 1 206 206 THR CA C 206 67.462 67.462 64.738 2.724 19854 8076 1 8 . 1 1 206 206 THR CB C 206 70.390 70.390 69.089 1.301 19854 8077 1 8 . 1 1 206 206 THR H H 206 7.585 7.585 7.977 -0.392 19854 8078 1 8 . 1 1 207 207 THR N N 207 111.970 111.970 119.472 -7.502 19854 8079 1 8 . 1 1 207 207 THR C C 207 176.566 176.566 174.073 2.493 19854 8080 1 8 . 1 1 207 207 THR CA C 207 64.534 64.534 63.832 0.702 19854 8081 1 8 . 1 1 207 207 THR CB C 207 72.733 72.733 69.439 3.295 19854 8082 1 8 . 1 1 207 207 THR H H 207 7.468 7.468 7.612 -0.144 19854 8083 1 8 . 1 1 208 208 ALA N N 208 115.623 115.623 128.717 -13.094 19854 8084 1 8 . 1 1 208 208 ALA C C 208 168.947 168.947 177.181 -8.234 19854 8085 1 8 . 1 1 208 208 ALA CA C 208 55.164 55.164 51.934 3.229 19854 8086 1 8 . 1 1 208 208 ALA CB C 208 22.369 22.369 19.478 2.891 19854 8087 1 8 . 1 1 208 208 ALA H H 208 7.390 7.390 8.319 -0.929 19854 8088 1 8 . 1 1 209 209 LEU N N 209 117.814 117.814 124.802 -6.988 19854 8089 1 8 . 1 1 209 209 LEU C C 209 176.273 176.273 176.128 0.145 19854 8090 1 8 . 1 1 209 209 LEU CA C 209 58.678 58.678 52.798 5.880 19854 8091 1 8 . 1 1 209 209 LEU CB C 209 46.380 46.380 41.886 4.494 19854 8092 1 8 . 1 1 209 209 LEU H H 209 7.652 7.652 8.260 -0.608 19854 8093 1 8 . 1 1 210 210 PRO C C 210 176.566 176.566 175.895 0.671 19854 8094 1 8 . 1 1 210 210 PRO CA C 210 63.086 63.086 62.231 0.855 19854 8095 1 8 . 1 1 210 210 PRO CB C 210 31.146 31.146 32.590 -1.444 19854 8096 1 8 . 1 1 211 211 ASP N N 211 122.863 122.863 119.889 2.974 19854 8097 1 8 . 1 1 211 211 ASP C C 211 175.686 175.686 176.124 -0.438 19854 8098 1 8 . 1 1 211 211 ASP CA C 211 56.343 56.343 54.388 1.955 19854 8099 1 8 . 1 1 211 211 ASP CB C 211 41.402 41.402 40.816 0.586 19854 8100 1 8 . 1 1 211 211 ASP H H 211 8.360 8.360 8.320 0.040 19854 8101 1 8 . 1 1 212 212 GLU N N 212 131.162 131.162 124.949 6.213 19854 8102 1 8 . 1 1 212 212 GLU C C 212 176.273 176.273 176.738 -0.465 19854 8103 1 8 . 1 1 212 212 GLU CA C 212 55.164 55.164 57.414 -2.250 19854 8104 1 8 . 1 1 212 212 GLU CB C 212 30.568 30.568 31.831 -1.263 19854 8105 1 8 . 1 1 212 212 GLU H H 212 8.399 8.399 8.189 0.210 19854 8106 1 8 . 1 1 213 213 ASP N N 213 122.797 122.797 117.270 5.527 19854 8107 1 8 . 1 1 213 213 ASP C C 213 177.152 177.152 177.462 -0.310 19854 8108 1 8 . 1 1 213 213 ASP CA C 213 61.914 61.914 53.919 7.995 19854 8109 1 8 . 1 1 213 213 ASP CB C 213 49.607 49.607 40.953 8.654 19854 8110 1 8 . 1 1 213 213 ASP H H 213 8.168 8.168 8.512 -0.344 19854 8111 1 8 . 1 1 214 214 ASP N N 214 112.369 112.369 121.426 -9.057 19854 8112 1 8 . 1 1 214 214 ASP C C 214 178.910 178.910 177.191 1.719 19854 8113 1 8 . 1 1 214 214 ASP CA C 214 54.579 54.579 56.834 -2.256 19854 8114 1 8 . 1 1 214 214 ASP CB C 214 39.353 39.353 40.192 -0.839 19854 8115 1 8 . 1 1 214 214 ASP H H 214 7.464 7.464 8.125 -0.661 19854 8116 1 8 . 1 1 215 215 ASP N N 215 127.244 127.244 118.806 8.438 19854 8117 1 8 . 1 1 215 215 ASP C C 215 176.859 176.859 177.216 -0.357 19854 8118 1 8 . 1 1 215 215 ASP CA C 215 54.579 54.579 55.821 -1.242 19854 8119 1 8 . 1 1 215 215 ASP CB C 215 40.524 40.524 40.760 -0.236 19854 8120 1 8 . 1 1 215 215 ASP H H 215 8.301 8.301 8.344 -0.043 19854 8121 1 9 . 1 1 2 2 ALA N N 2 131.228 131.228 123.956 7.272 19854 8122 1 9 . 1 1 2 2 ALA C C 2 187.031 187.031 179.718 7.313 19854 8123 1 9 . 1 1 2 2 ALA CA C 2 53.407 53.407 55.320 -1.913 19854 8124 1 9 . 1 1 2 2 ALA CB C 2 20.027 20.027 18.193 1.834 19854 8125 1 9 . 1 1 2 2 ALA H H 2 10.644 10.644 8.693 1.951 19854 8126 1 9 . 1 1 3 3 ALA N N 3 124.521 124.521 120.739 3.782 19854 8127 1 9 . 1 1 3 3 ALA C C 3 176.566 176.566 179.222 -2.656 19854 8128 1 9 . 1 1 3 3 ALA CA C 3 49.894 49.894 54.542 -4.648 19854 8129 1 9 . 1 1 3 3 ALA CB C 3 18.270 18.270 18.207 0.063 19854 8130 1 9 . 1 1 3 3 ALA H H 3 8.669 8.669 8.437 0.232 19854 8131 1 9 . 1 1 4 4 GLN N N 4 118.080 118.080 116.530 1.550 19854 8132 1 9 . 1 1 4 4 GLN C C 4 176.273 176.273 177.256 -0.983 19854 8133 1 9 . 1 1 4 4 GLN CA C 4 54.579 54.579 57.191 -2.612 19854 8134 1 9 . 1 1 4 4 GLN CB C 4 27.054 27.054 28.883 -1.829 19854 8135 1 9 . 1 1 4 4 GLN H H 4 8.919 8.919 8.340 0.579 19854 8136 1 9 . 1 1 5 5 GLY N N 5 121.002 121.002 106.437 14.565 19854 8137 1 9 . 1 1 5 5 GLY C C 5 181.877 181.877 173.688 8.189 19854 8138 1 9 . 1 1 5 5 GLY CA C 5 45.794 45.794 44.929 0.865 19854 8139 1 9 . 1 1 5 5 GLY H H 5 8.082 8.082 7.931 0.151 19854 8140 1 9 . 1 1 6 6 GLU N N 6 129.435 129.435 122.493 6.942 19854 8141 1 9 . 1 1 6 6 GLU C C 6 176.566 176.566 175.497 1.069 19854 8142 1 9 . 1 1 6 6 GLU CA C 6 56.336 56.336 53.137 3.199 19854 8143 1 9 . 1 1 6 6 GLU CB C 6 28.811 28.811 30.438 -1.627 19854 8144 1 9 . 1 1 6 6 GLU H H 6 9.267 9.267 7.943 1.324 19854 8145 1 9 . 1 1 7 7 PRO C C 7 176.566 176.566 176.986 -0.420 19854 8146 1 9 . 1 1 7 7 PRO CA C 7 63.672 63.672 64.953 -1.281 19854 8147 1 9 . 1 1 7 7 PRO CB C 7 31.146 31.146 32.177 -1.031 19854 8148 1 9 . 1 1 8 8 GLN N N 8 112.502 112.502 115.221 -2.719 19854 8149 1 9 . 1 1 8 8 GLN C C 8 177.445 177.445 174.904 2.541 19854 8150 1 9 . 1 1 8 8 GLN CA C 8 50.479 50.479 56.114 -5.635 19854 8151 1 9 . 1 1 8 8 GLN CB C 8 28.811 28.811 31.498 -2.687 19854 8152 1 9 . 1 1 8 8 GLN H H 8 6.220 6.220 8.107 -1.887 19854 8153 1 9 . 1 1 9 9 VAL N N 9 117.416 117.416 115.203 2.213 19854 8154 1 9 . 1 1 9 9 VAL C C 9 178.324 178.324 173.512 4.812 19854 8155 1 9 . 1 1 9 9 VAL CA C 9 63.363 63.363 59.632 3.731 19854 8156 1 9 . 1 1 9 9 VAL CB C 9 34.668 34.668 34.758 -0.090 19854 8157 1 9 . 1 1 9 9 VAL H H 9 6.561 6.561 7.620 -1.059 19854 8158 1 9 . 1 1 10 10 GLN N N 10 113.896 113.896 122.976 -9.080 19854 8159 1 9 . 1 1 10 10 GLN C C 10 176.273 176.273 174.263 2.010 19854 8160 1 9 . 1 1 10 10 GLN CA C 10 55.164 55.164 54.038 1.126 19854 8161 1 9 . 1 1 10 10 GLN CB C 10 28.226 28.226 32.196 -3.970 19854 8162 1 9 . 1 1 10 10 GLN H H 10 7.847 7.847 7.903 -0.056 19854 8163 1 9 . 1 1 11 11 PHE N N 11 118.744 118.744 124.030 -5.286 19854 8164 1 9 . 1 1 11 11 PHE C C 11 176.566 176.566 174.693 1.873 19854 8165 1 9 . 1 1 11 11 PHE CA C 11 59.849 59.849 56.383 3.466 19854 8166 1 9 . 1 1 11 11 PHE CB C 11 41.109 41.109 42.409 -1.300 19854 8167 1 9 . 1 1 11 11 PHE H H 11 8.262 8.262 8.887 -0.625 19854 8168 1 9 . 1 1 12 12 LYS N N 12 129.437 129.437 125.418 4.019 19854 8169 1 9 . 1 1 12 12 LYS C C 12 178.609 178.609 174.847 3.762 19854 8170 1 9 . 1 1 12 12 LYS CA C 12 57.808 57.808 55.715 2.093 19854 8171 1 9 . 1 1 12 12 LYS H H 12 10.015 10.015 8.779 1.236 19854 8172 1 9 . 1 1 13 13 LEU N N 13 112.103 112.103 129.616 -17.513 19854 8173 1 9 . 1 1 13 13 LEU C C 13 177.738 177.738 174.619 3.119 19854 8174 1 9 . 1 1 13 13 LEU CA C 13 54.579 54.579 53.450 1.129 19854 8175 1 9 . 1 1 13 13 LEU CB C 13 42.866 42.866 45.941 -3.075 19854 8176 1 9 . 1 1 13 13 LEU H H 13 6.905 6.905 8.891 -1.986 19854 8177 1 9 . 1 1 14 14 VAL N N 14 127.310 127.310 126.799 0.511 19854 8178 1 9 . 1 1 14 14 VAL C C 14 175.393 175.393 174.202 1.191 19854 8179 1 9 . 1 1 14 14 VAL CA C 14 70.976 70.976 61.684 9.292 19854 8180 1 9 . 1 1 14 14 VAL CB C 14 28.811 28.811 33.320 -4.509 19854 8181 1 9 . 1 1 14 14 VAL H H 14 8.305 8.305 8.823 -0.518 19854 8182 1 9 . 1 1 15 15 LEU N N 15 128.640 128.640 131.166 -2.526 19854 8183 1 9 . 1 1 15 15 LEU C C 15 177.730 177.730 175.159 2.571 19854 8184 1 9 . 1 1 15 15 LEU CA C 15 55.758 55.758 53.287 2.471 19854 8185 1 9 . 1 1 15 15 LEU H H 15 7.718 7.718 9.034 -1.316 19854 8186 1 9 . 1 1 16 16 VAL N N 16 121.267 121.267 121.636 -0.369 19854 8187 1 9 . 1 1 16 16 VAL C C 16 178.324 178.324 174.443 3.881 19854 8188 1 9 . 1 1 16 16 VAL CA C 16 63.363 63.363 58.519 4.844 19854 8189 1 9 . 1 1 16 16 VAL CB C 16 35.839 35.839 35.254 0.585 19854 8190 1 9 . 1 1 16 16 VAL H H 16 8.935 8.935 8.908 0.027 19854 8191 1 9 . 1 1 17 17 GLY N N 17 127.908 127.908 106.862 21.046 19854 8192 1 9 . 1 1 17 17 GLY C C 17 174.514 174.514 173.161 1.353 19854 8193 1 9 . 1 1 17 17 GLY CA C 17 42.281 42.281 44.595 -2.314 19854 8194 1 9 . 1 1 17 17 GLY H H 17 9.682 9.682 6.811 2.871 19854 8195 1 9 . 1 1 18 18 ASP N N 18 125.054 125.054 121.087 3.967 19854 8196 1 9 . 1 1 18 18 ASP C C 18 176.851 176.851 177.724 -0.873 19854 8197 1 9 . 1 1 18 18 ASP CA C 18 57.515 57.515 54.555 2.960 19854 8198 1 9 . 1 1 18 18 ASP CB C 18 46.090 46.090 41.924 4.166 19854 8199 1 9 . 1 1 18 18 ASP H H 18 8.282 8.282 8.436 -0.154 19854 8200 1 9 . 1 1 19 19 GLY N N 19 120.670 120.670 106.423 14.247 19854 8201 1 9 . 1 1 19 19 GLY C C 19 178.324 178.324 174.782 3.542 19854 8202 1 9 . 1 1 19 19 GLY CA C 19 42.281 42.281 45.456 -3.175 19854 8203 1 9 . 1 1 19 19 GLY H H 19 8.825 8.825 8.736 0.089 19854 8204 1 9 . 1 1 20 20 GLY N N 20 129.369 129.369 113.044 16.325 19854 8205 1 9 . 1 1 20 20 GLY C C 20 174.221 174.221 175.774 -1.553 19854 8206 1 9 . 1 1 20 20 GLY CA C 20 41.695 41.695 45.376 -3.681 19854 8207 1 9 . 1 1 20 20 GLY H H 20 8.477 8.477 7.745 0.732 19854 8208 1 9 . 1 1 21 21 THR N N 21 122.199 122.199 116.668 5.531 19854 8209 1 9 . 1 1 21 21 THR C C 21 171.291 171.291 174.880 -3.589 19854 8210 1 9 . 1 1 21 21 THR CA C 21 61.914 61.914 66.206 -4.292 19854 8211 1 9 . 1 1 21 21 THR CB C 21 65.137 65.137 69.334 -4.197 19854 8212 1 9 . 1 1 21 21 THR H H 21 8.059 8.059 7.539 0.520 19854 8213 1 9 . 1 1 22 22 GLY N N 22 112.369 112.369 105.793 6.576 19854 8214 1 9 . 1 1 22 22 GLY C C 22 184.807 184.807 175.172 9.635 19854 8215 1 9 . 1 1 22 22 GLY CA C 22 45.209 45.209 45.127 0.082 19854 8216 1 9 . 1 1 22 22 GLY H H 22 6.772 6.772 8.369 -1.597 19854 8217 1 9 . 1 1 23 23 LYS N N 23 122.066 122.066 120.896 1.170 19854 8218 1 9 . 1 1 23 23 LYS C C 23 178.589 178.589 177.931 0.658 19854 8219 1 9 . 1 1 23 23 LYS CA C 23 58.101 58.101 60.024 -1.923 19854 8220 1 9 . 1 1 23 23 LYS CB C 23 40.230 40.230 32.226 8.004 19854 8221 1 9 . 1 1 23 23 LYS H H 23 7.441 7.441 8.602 -1.161 19854 8222 1 9 . 1 1 24 24 THR N N 24 114.627 114.627 114.747 -0.120 19854 8223 1 9 . 1 1 24 24 THR C C 24 178.324 178.324 176.498 1.826 19854 8224 1 9 . 1 1 24 24 THR CA C 24 62.192 62.192 67.437 -5.245 19854 8225 1 9 . 1 1 24 24 THR CB C 24 71.562 71.562 67.746 3.816 19854 8226 1 9 . 1 1 24 24 THR H H 24 8.469 8.469 8.401 0.068 19854 8227 1 9 . 1 1 25 25 THR N N 25 110.377 110.377 119.032 -8.655 19854 8228 1 9 . 1 1 25 25 THR C C 25 178.324 178.324 176.012 2.312 19854 8229 1 9 . 1 1 25 25 THR CA C 25 64.534 64.534 67.697 -3.163 19854 8230 1 9 . 1 1 25 25 THR CB C 25 71.562 71.562 68.456 3.106 19854 8231 1 9 . 1 1 25 25 THR H H 25 8.415 8.415 8.220 0.195 19854 8232 1 9 . 1 1 26 26 PHE N N 26 114.295 114.295 122.482 -8.187 19854 8233 1 9 . 1 1 26 26 PHE C C 26 174.514 174.514 176.921 -2.407 19854 8234 1 9 . 1 1 26 26 PHE CA C 26 53.407 53.407 61.842 -8.434 19854 8235 1 9 . 1 1 26 26 PHE CB C 26 40.524 40.524 39.115 1.409 19854 8236 1 9 . 1 1 26 26 PHE H H 26 7.707 7.707 8.419 -0.712 19854 8237 1 9 . 1 1 27 27 VAL N N 27 123.525 123.525 119.961 3.564 19854 8238 1 9 . 1 1 27 27 VAL C C 27 178.031 178.031 177.871 0.160 19854 8239 1 9 . 1 1 27 27 VAL CA C 27 67.462 67.462 67.002 0.459 19854 8240 1 9 . 1 1 27 27 VAL CB C 27 29.397 29.397 31.506 -2.109 19854 8241 1 9 . 1 1 27 27 VAL H H 27 6.967 6.967 8.258 -1.290 19854 8242 1 9 . 1 1 28 28 LYS N N 28 114.228 114.228 119.764 -5.536 19854 8243 1 9 . 1 1 28 28 LYS C C 28 176.566 176.566 178.562 -1.996 19854 8244 1 9 . 1 1 28 28 LYS CA C 28 58.092 58.092 59.937 -1.845 19854 8245 1 9 . 1 1 28 28 LYS CB C 28 34.082 34.082 31.921 2.161 19854 8246 1 9 . 1 1 28 28 LYS H H 28 7.429 7.429 8.223 -0.794 19854 8247 1 9 . 1 1 29 29 ARG N N 29 112.037 112.037 119.792 -7.755 19854 8248 1 9 . 1 1 29 29 ARG C C 29 174.221 174.221 178.502 -4.281 19854 8249 1 9 . 1 1 29 29 ARG CA C 29 72.147 72.147 58.974 13.173 19854 8250 1 9 . 1 1 29 29 ARG CB C 29 37.596 37.596 29.740 7.856 19854 8251 1 9 . 1 1 29 29 ARG H H 29 6.803 6.803 7.977 -1.174 19854 8252 1 9 . 1 1 30 30 HIS N N 30 122.396 122.396 116.817 5.579 19854 8253 1 9 . 1 1 30 30 HIS C C 30 172.170 172.170 177.265 -5.095 19854 8254 1 9 . 1 1 30 30 HIS CA C 30 51.651 51.651 59.185 -7.534 19854 8255 1 9 . 1 1 30 30 HIS CB C 30 30.568 30.568 29.869 0.699 19854 8256 1 9 . 1 1 30 30 HIS H H 30 7.644 7.644 7.569 0.075 19854 8257 1 9 . 1 1 31 31 LEU N N 31 110.377 110.377 119.649 -9.272 19854 8258 1 9 . 1 1 31 31 LEU C C 31 178.031 178.031 178.776 -0.745 19854 8259 1 9 . 1 1 31 31 LEU CA C 31 55.164 55.164 57.701 -2.537 19854 8260 1 9 . 1 1 31 31 LEU CB C 31 42.281 42.281 42.180 0.101 19854 8261 1 9 . 1 1 31 31 LEU H H 31 7.894 7.894 8.264 -0.370 19854 8262 1 9 . 1 1 32 32 THR N N 32 121.468 121.468 106.034 15.434 19854 8263 1 9 . 1 1 32 32 THR C C 32 170.705 170.705 175.519 -4.814 19854 8264 1 9 . 1 1 32 32 THR CA C 32 63.668 63.668 61.820 1.848 19854 8265 1 9 . 1 1 32 32 THR CB C 32 75.679 75.679 70.691 4.988 19854 8266 1 9 . 1 1 32 32 THR H H 32 8.372 8.372 8.222 0.150 19854 8267 1 9 . 1 1 33 33 GLY N N 33 127.841 127.841 110.044 17.797 19854 8268 1 9 . 1 1 33 33 GLY C C 33 161.914 161.914 174.027 -12.113 19854 8269 1 9 . 1 1 33 33 GLY CA C 33 42.866 42.866 44.803 -1.937 19854 8270 1 9 . 1 1 33 33 GLY H H 33 9.662 9.662 7.633 2.029 19854 8271 1 9 . 1 1 34 34 GLU N N 34 120.871 120.871 120.387 0.484 19854 8272 1 9 . 1 1 34 34 GLU C C 34 174.508 174.508 175.075 -0.567 19854 8273 1 9 . 1 1 34 34 GLU CA C 34 58.101 58.101 55.998 2.103 19854 8274 1 9 . 1 1 34 34 GLU CB C 34 34.371 34.371 30.617 3.754 19854 8275 1 9 . 1 1 34 34 GLU H H 34 8.211 8.211 7.363 0.848 19854 8276 1 9 . 1 1 35 35 PHE N N 35 111.838 111.838 119.925 -8.087 19854 8277 1 9 . 1 1 35 35 PHE C C 35 174.221 174.221 175.162 -0.941 19854 8278 1 9 . 1 1 35 35 PHE CA C 35 49.308 49.308 57.048 -7.740 19854 8279 1 9 . 1 1 35 35 PHE CB C 35 41.695 41.695 40.686 1.009 19854 8280 1 9 . 1 1 35 35 PHE H H 35 6.772 6.772 8.349 -1.577 19854 8281 1 9 . 1 1 36 36 GLU N N 36 120.672 120.672 126.001 -5.329 19854 8282 1 9 . 1 1 36 36 GLU C C 36 175.686 175.686 176.062 -0.376 19854 8283 1 9 . 1 1 36 36 GLU CA C 36 58.980 58.980 55.113 3.867 19854 8284 1 9 . 1 1 36 36 GLU CB C 36 48.140 48.140 30.907 17.233 19854 8285 1 9 . 1 1 36 36 GLU H H 36 8.293 8.293 8.714 -0.421 19854 8286 1 9 . 1 1 37 37 LYS N N 37 118.810 118.810 126.882 -8.072 19854 8287 1 9 . 1 1 37 37 LYS C C 37 172.756 172.756 177.665 -4.909 19854 8288 1 9 . 1 1 37 37 LYS CA C 37 48.137 48.137 58.023 -9.886 19854 8289 1 9 . 1 1 37 37 LYS CB C 37 37.010 37.010 32.998 4.011 19854 8290 1 9 . 1 1 37 37 LYS H H 37 8.509 8.509 9.036 -0.527 19854 8291 1 9 . 1 1 38 38 LYS N N 38 108.052 108.052 119.783 -11.731 19854 8292 1 9 . 1 1 38 38 LYS C C 38 176.273 176.273 175.631 0.642 19854 8293 1 9 . 1 1 38 38 LYS CA C 38 59.849 59.849 56.084 3.765 19854 8294 1 9 . 1 1 38 38 LYS CB C 38 34.668 34.668 33.185 1.483 19854 8295 1 9 . 1 1 38 38 LYS H H 38 7.715 7.715 7.937 -0.222 19854 8296 1 9 . 1 1 39 39 TYR N N 39 108.650 108.650 122.774 -14.124 19854 8297 1 9 . 1 1 39 39 TYR C C 39 175.686 175.686 174.648 1.038 19854 8298 1 9 . 1 1 39 39 TYR CA C 39 61.020 61.020 57.820 3.200 19854 8299 1 9 . 1 1 39 39 TYR CB C 39 36.424 36.424 39.227 -2.803 19854 8300 1 9 . 1 1 39 39 TYR H H 39 7.362 7.362 8.369 -1.007 19854 8301 1 9 . 1 1 40 40 VAL N N 40 117.947 117.947 128.678 -10.731 19854 8302 1 9 . 1 1 40 40 VAL C C 40 175.393 175.393 173.940 1.453 19854 8303 1 9 . 1 1 40 40 VAL CA C 40 61.020 61.020 60.113 0.907 19854 8304 1 9 . 1 1 40 40 VAL CB C 40 31.154 31.154 35.038 -3.884 19854 8305 1 9 . 1 1 40 40 VAL H H 40 8.442 8.442 7.936 0.506 19854 8306 1 9 . 1 1 42 42 THR N N 42 117.150 117.150 119.547 -2.397 19854 8307 1 9 . 1 1 42 42 THR C C 42 178.910 178.910 174.040 4.870 19854 8308 1 9 . 1 1 42 42 THR CA C 42 60.435 60.435 62.749 -2.314 19854 8309 1 9 . 1 1 42 42 THR CB C 42 70.390 70.390 69.814 0.576 19854 8310 1 9 . 1 1 42 42 THR H H 42 8.192 8.192 8.447 -0.255 19854 8311 1 9 . 1 1 43 43 LEU N N 43 119.209 119.209 127.093 -7.884 19854 8312 1 9 . 1 1 43 43 LEU C C 43 174.807 174.807 177.322 -2.515 19854 8313 1 9 . 1 1 43 43 LEU CA C 43 57.507 57.507 54.590 2.917 19854 8314 1 9 . 1 1 43 43 LEU CB C 43 42.866 42.866 42.839 0.027 19854 8315 1 9 . 1 1 43 43 LEU H H 43 9.260 9.260 8.543 0.717 19854 8316 1 9 . 1 1 44 44 GLY N N 44 114.361 114.361 113.590 0.771 19854 8317 1 9 . 1 1 44 44 GLY C C 44 178.910 178.910 172.826 6.084 19854 8318 1 9 . 1 1 44 44 GLY CA C 44 54.579 54.579 45.870 8.709 19854 8319 1 9 . 1 1 44 44 GLY H H 44 6.979 6.979 8.657 -1.678 19854 8320 1 9 . 1 1 45 45 VAL N N 45 110.244 110.244 122.854 -12.610 19854 8321 1 9 . 1 1 45 45 VAL C C 45 174.807 174.807 175.065 -0.258 19854 8322 1 9 . 1 1 45 45 VAL CA C 45 63.363 63.363 60.865 2.498 19854 8323 1 9 . 1 1 45 45 VAL CB C 45 17.099 17.099 34.566 -17.467 19854 8324 1 9 . 1 1 45 45 VAL H H 45 8.309 8.309 7.998 0.311 19854 8325 1 9 . 1 1 46 46 GLU N N 46 130.365 130.365 127.394 2.971 19854 8326 1 9 . 1 1 46 46 GLU C C 46 176.859 176.859 174.585 2.274 19854 8327 1 9 . 1 1 46 46 GLU CA C 46 55.164 55.164 54.944 0.220 19854 8328 1 9 . 1 1 46 46 GLU CB C 46 32.325 32.325 32.226 0.099 19854 8329 1 9 . 1 1 46 46 GLU H H 46 9.741 9.741 8.896 0.845 19854 8330 1 9 . 1 1 47 47 VAL N N 47 125.254 125.254 125.061 0.193 19854 8331 1 9 . 1 1 47 47 VAL C C 47 175.661 175.661 174.611 1.050 19854 8332 1 9 . 1 1 47 47 VAL CA C 47 63.375 63.375 61.530 1.845 19854 8333 1 9 . 1 1 47 47 VAL CB C 47 37.300 37.300 32.106 5.194 19854 8334 1 9 . 1 1 47 47 VAL H H 47 8.250 8.250 8.514 -0.264 19854 8335 1 9 . 1 1 48 48 HIS N N 48 129.236 129.236 126.935 2.301 19854 8336 1 9 . 1 1 48 48 HIS C C 48 169.240 169.240 172.768 -3.528 19854 8337 1 9 . 1 1 48 48 HIS CA C 48 49.894 49.894 53.301 -3.407 19854 8338 1 9 . 1 1 48 48 HIS CB C 48 27.640 27.640 32.669 -5.029 19854 8339 1 9 . 1 1 48 48 HIS H H 48 10.390 10.390 9.241 1.149 19854 8340 1 9 . 1 1 49 49 PRO C C 49 176.273 176.273 175.797 0.476 19854 8341 1 9 . 1 1 49 49 PRO CA C 49 62.500 62.500 62.464 0.036 19854 8342 1 9 . 1 1 49 49 PRO CB C 49 29.974 29.974 32.104 -2.130 19854 8343 1 9 . 1 1 50 50 LEU N N 50 119.408 119.408 127.496 -8.088 19854 8344 1 9 . 1 1 50 50 LEU C C 50 177.445 177.445 175.453 1.992 19854 8345 1 9 . 1 1 50 50 LEU CA C 50 59.264 59.264 54.023 5.241 19854 8346 1 9 . 1 1 50 50 LEU CB C 50 42.281 42.281 44.881 -2.600 19854 8347 1 9 . 1 1 50 50 LEU H H 50 7.492 7.492 8.992 -1.500 19854 8348 1 9 . 1 1 51 51 VAL N N 51 117.947 117.947 122.940 -4.993 19854 8349 1 9 . 1 1 51 51 VAL C C 51 174.514 174.514 175.082 -0.568 19854 8350 1 9 . 1 1 51 51 VAL CA C 51 64.534 64.534 61.331 3.203 19854 8351 1 9 . 1 1 51 51 VAL CB C 51 37.010 37.010 33.143 3.867 19854 8352 1 9 . 1 1 51 51 VAL H H 51 7.715 7.715 8.184 -0.469 19854 8353 1 9 . 1 1 52 52 PHE N N 52 124.853 124.853 126.582 -1.729 19854 8354 1 9 . 1 1 52 52 PHE C C 52 175.100 175.100 174.272 0.828 19854 8355 1 9 . 1 1 52 52 PHE CA C 52 56.336 56.336 56.722 -0.386 19854 8356 1 9 . 1 1 52 52 PHE CB C 52 39.938 39.938 42.372 -2.434 19854 8357 1 9 . 1 1 52 52 PHE H H 52 8.935 8.935 9.195 -0.260 19854 8358 1 9 . 1 1 53 53 HIS N N 53 120.603 120.603 122.787 -2.184 19854 8359 1 9 . 1 1 53 53 HIS C C 53 170.119 170.119 174.925 -4.806 19854 8360 1 9 . 1 1 53 53 HIS CA C 53 55.164 55.164 55.297 -0.133 19854 8361 1 9 . 1 1 53 53 HIS CB C 53 30.568 30.568 31.091 -0.523 19854 8362 1 9 . 1 1 53 53 HIS H H 53 8.356 8.356 9.202 -0.846 19854 8363 1 9 . 1 1 54 54 THR N N 54 112.634 112.634 116.192 -3.558 19854 8364 1 9 . 1 1 54 54 THR C C 54 178.910 178.910 176.286 2.624 19854 8365 1 9 . 1 1 54 54 THR CA C 54 63.363 63.363 59.442 3.921 19854 8366 1 9 . 1 1 54 54 THR CB C 54 72.733 72.733 71.543 1.190 19854 8367 1 9 . 1 1 54 54 THR H H 54 7.574 7.574 8.367 -0.793 19854 8368 1 9 . 1 1 55 55 ASN N N 55 131.095 131.095 120.176 10.919 19854 8369 1 9 . 1 1 55 55 ASN C C 55 176.273 176.273 176.570 -0.297 19854 8370 1 9 . 1 1 55 55 ASN CA C 55 51.065 51.065 55.863 -4.798 19854 8371 1 9 . 1 1 55 55 ASN CB C 55 37.010 37.010 38.340 -1.330 19854 8372 1 9 . 1 1 55 55 ASN H H 55 10.187 10.187 8.602 1.585 19854 8373 1 9 . 1 1 56 56 ARG N N 56 122.064 122.064 118.896 3.168 19854 8374 1 9 . 1 1 56 56 ARG C C 56 175.100 175.100 176.111 -1.011 19854 8375 1 9 . 1 1 56 56 ARG CA C 56 61.606 61.606 55.869 5.737 19854 8376 1 9 . 1 1 56 56 ARG CB C 56 32.911 32.911 30.524 2.387 19854 8377 1 9 . 1 1 56 56 ARG H H 56 7.433 7.433 7.862 -0.429 19854 8378 1 9 . 1 1 57 57 GLY N N 57 127.709 127.709 107.443 20.266 19854 8379 1 9 . 1 1 57 57 GLY C C 57 175.979 175.979 172.055 3.924 19854 8380 1 9 . 1 1 57 57 GLY CA C 57 42.281 42.281 44.191 -1.910 19854 8381 1 9 . 1 1 57 57 GLY H H 57 9.373 9.373 7.616 1.757 19854 8382 1 9 . 1 1 58 58 PRO C C 58 177.152 177.152 175.864 1.288 19854 8383 1 9 . 1 1 58 58 PRO CA C 58 65.137 65.137 63.288 1.849 19854 8384 1 9 . 1 1 58 58 PRO CB C 58 29.095 29.095 32.153 -3.058 19854 8385 1 9 . 1 1 59 59 ILE N N 59 128.638 128.638 122.405 6.233 19854 8386 1 9 . 1 1 59 59 ILE C C 59 175.979 175.979 174.255 1.724 19854 8387 1 9 . 1 1 59 59 ILE CA C 59 65.120 65.120 60.136 4.984 19854 8388 1 9 . 1 1 59 59 ILE CB C 59 40.524 40.524 42.663 -2.139 19854 8389 1 9 . 1 1 59 59 ILE H H 59 8.794 8.794 8.920 -0.126 19854 8390 1 9 . 1 1 60 60 LYS N N 60 127.711 127.711 125.579 2.132 19854 8391 1 9 . 1 1 60 60 LYS C C 60 178.902 178.902 174.819 4.083 19854 8392 1 9 . 1 1 60 60 LYS CA C 60 74.293 74.293 54.415 19.878 19854 8393 1 9 . 1 1 60 60 LYS CB C 60 32.027 32.027 36.014 -3.987 19854 8394 1 9 . 1 1 60 60 LYS H H 60 8.024 8.024 8.658 -0.634 19854 8395 1 9 . 1 1 61 61 PHE N N 61 120.670 120.670 125.633 -4.963 19854 8396 1 9 . 1 1 61 61 PHE C C 61 175.393 175.393 175.149 0.244 19854 8397 1 9 . 1 1 61 61 PHE CA C 61 57.507 57.507 56.613 0.894 19854 8398 1 9 . 1 1 61 61 PHE CB C 61 41.109 41.109 41.225 -0.116 19854 8399 1 9 . 1 1 61 61 PHE H H 61 7.515 7.515 9.596 -2.081 19854 8400 1 9 . 1 1 62 62 ASN N N 62 124.789 124.789 124.309 0.480 19854 8401 1 9 . 1 1 62 62 ASN C C 62 173.336 173.336 174.836 -1.500 19854 8402 1 9 . 1 1 62 62 ASN CA C 62 53.121 53.121 52.563 0.558 19854 8403 1 9 . 1 1 62 62 ASN CB C 62 41.695 41.695 39.000 2.695 19854 8404 1 9 . 1 1 62 62 ASN H H 62 8.325 8.325 9.108 -0.783 19854 8405 1 9 . 1 1 63 63 VAL N N 63 106.127 106.127 125.420 -19.293 19854 8406 1 9 . 1 1 63 63 VAL C C 63 175.100 175.100 175.542 -0.442 19854 8407 1 9 . 1 1 63 63 VAL CA C 63 61.020 61.020 62.877 -1.857 19854 8408 1 9 . 1 1 63 63 VAL CB C 63 31.154 31.154 32.792 -1.638 19854 8409 1 9 . 1 1 63 63 VAL H H 63 8.113 8.113 8.999 -0.886 19854 8410 1 9 . 1 1 64 64 TRP N N 64 129.302 129.302 129.781 -0.479 19854 8411 1 9 . 1 1 64 64 TRP C C 64 177.152 177.152 175.426 1.726 19854 8412 1 9 . 1 1 64 64 TRP CA C 64 59.264 59.264 54.402 4.862 19854 8413 1 9 . 1 1 64 64 TRP CB C 64 29.397 29.397 29.538 -0.141 19854 8414 1 9 . 1 1 64 64 TRP H H 64 8.970 8.970 9.552 -0.582 19854 8415 1 9 . 1 1 65 65 ASP N N 65 119.607 119.607 126.159 -6.552 19854 8416 1 9 . 1 1 65 65 ASP C C 65 174.514 174.514 175.988 -1.474 19854 8417 1 9 . 1 1 65 65 ASP CA C 65 55.164 55.164 53.462 1.702 19854 8418 1 9 . 1 1 65 65 ASP CB C 65 41.109 41.109 43.377 -2.268 19854 8419 1 9 . 1 1 65 65 ASP H H 65 8.638 8.638 9.224 -0.586 19854 8420 1 9 . 1 1 66 66 THR N N 66 122.463 122.463 117.671 4.792 19854 8421 1 9 . 1 1 66 66 THR C C 66 178.617 178.617 174.166 4.451 19854 8422 1 9 . 1 1 66 66 THR CA C 66 68.048 68.048 59.902 8.146 19854 8423 1 9 . 1 1 66 66 THR CB C 66 71.562 71.562 71.228 0.334 19854 8424 1 9 . 1 1 66 66 THR H H 66 8.293 8.293 8.374 -0.081 19854 8425 1 9 . 1 1 67 67 ALA N N 67 104.865 104.865 123.279 -18.414 19854 8426 1 9 . 1 1 67 67 ALA C C 67 177.738 177.738 177.387 0.351 19854 8427 1 9 . 1 1 67 67 ALA CA C 67 48.722 48.722 51.753 -3.031 19854 8428 1 9 . 1 1 67 67 ALA CB C 67 14.171 14.171 19.951 -5.780 19854 8429 1 9 . 1 1 67 67 ALA H H 67 8.657 8.657 7.883 0.774 19854 8430 1 9 . 1 1 68 68 GLY N N 68 115.357 115.357 110.137 5.220 19854 8431 1 9 . 1 1 68 68 GLY C C 68 189.533 189.533 176.126 13.407 19854 8432 1 9 . 1 1 68 68 GLY CA C 68 45.209 45.209 46.142 -0.933 19854 8433 1 9 . 1 1 68 68 GLY H H 68 10.969 10.969 9.043 1.926 19854 8434 1 9 . 1 1 69 69 GLN N N 69 122.730 122.730 119.960 2.770 19854 8435 1 9 . 1 1 69 69 GLN C C 69 174.508 174.508 176.469 -1.961 19854 8436 1 9 . 1 1 69 69 GLN CA C 69 58.394 58.394 57.744 0.650 19854 8437 1 9 . 1 1 69 69 GLN CB C 69 31.441 31.441 28.654 2.787 19854 8438 1 9 . 1 1 69 69 GLN H H 69 8.336 8.336 8.556 -0.220 19854 8439 1 9 . 1 1 70 70 GLU N N 70 114.826 114.826 120.169 -5.343 19854 8440 1 9 . 1 1 70 70 GLU C C 70 176.273 176.273 175.773 0.500 19854 8441 1 9 . 1 1 70 70 GLU CA C 70 57.507 57.507 56.362 1.145 19854 8442 1 9 . 1 1 70 70 GLU CB C 70 28.811 28.811 30.325 -1.514 19854 8443 1 9 . 1 1 70 70 GLU H H 70 9.651 9.651 8.336 1.315 19854 8444 1 9 . 1 1 71 71 LYS N N 71 116.685 116.685 122.614 -5.929 19854 8445 1 9 . 1 1 71 71 LYS C C 71 175.979 175.979 176.650 -0.671 19854 8446 1 9 . 1 1 71 71 LYS CA C 71 48.722 48.722 56.065 -7.343 19854 8447 1 9 . 1 1 71 71 LYS CB C 71 37.010 37.010 33.012 3.998 19854 8448 1 9 . 1 1 71 71 LYS H H 71 8.712 8.712 8.251 0.461 19854 8449 1 9 . 1 1 72 72 PHE N N 72 114.959 114.959 120.357 -5.398 19854 8450 1 9 . 1 1 72 72 PHE C C 72 175.686 175.686 176.978 -1.292 19854 8451 1 9 . 1 1 72 72 PHE CA C 72 56.336 56.336 58.808 -2.472 19854 8452 1 9 . 1 1 72 72 PHE CB C 72 36.424 36.424 38.831 -2.407 19854 8453 1 9 . 1 1 72 72 PHE H H 72 7.965 7.965 8.142 -0.177 19854 8454 1 9 . 1 1 73 73 GLY N N 73 117.084 117.084 111.163 5.921 19854 8455 1 9 . 1 1 73 73 GLY C C 73 168.068 168.068 174.475 -6.407 19854 8456 1 9 . 1 1 73 73 GLY CA C 73 42.281 42.281 44.892 -2.611 19854 8457 1 9 . 1 1 73 73 GLY H H 73 7.609 7.609 7.867 -0.258 19854 8458 1 9 . 1 1 74 74 GLY N N 74 120.537 120.537 108.350 12.187 19854 8459 1 9 . 1 1 74 74 GLY C C 74 174.514 174.514 176.411 -1.897 19854 8460 1 9 . 1 1 74 74 GLY CA C 74 44.037 44.037 46.492 -2.455 19854 8461 1 9 . 1 1 74 74 GLY H H 74 9.326 9.326 8.673 0.653 19854 8462 1 9 . 1 1 75 75 LEU N N 75 127.177 127.177 121.565 5.612 19854 8463 1 9 . 1 1 75 75 LEU C C 75 178.617 178.617 178.198 0.419 19854 8464 1 9 . 1 1 75 75 LEU CA C 75 53.407 53.407 57.103 -3.696 19854 8465 1 9 . 1 1 75 75 LEU CB C 75 42.281 42.281 41.690 0.591 19854 8466 1 9 . 1 1 75 75 LEU H H 75 7.628 7.628 7.765 -0.137 19854 8467 1 9 . 1 1 76 76 ARG N N 76 116.486 116.486 115.618 0.868 19854 8468 1 9 . 1 1 76 76 ARG C C 76 176.859 176.859 176.942 -0.083 19854 8469 1 9 . 1 1 76 76 ARG CA C 76 59.264 59.264 54.822 4.442 19854 8470 1 9 . 1 1 76 76 ARG CB C 76 31.154 31.154 29.320 1.834 19854 8471 1 9 . 1 1 76 76 ARG H H 76 7.143 7.143 7.480 -0.337 19854 8472 1 9 . 1 1 77 77 ASP N N 77 129.236 129.236 120.367 8.869 19854 8473 1 9 . 1 1 77 77 ASP C C 77 177.152 177.152 177.870 -0.718 19854 8474 1 9 . 1 1 77 77 ASP CA C 77 52.822 52.822 57.553 -4.731 19854 8475 1 9 . 1 1 77 77 ASP CB C 77 41.695 41.695 40.314 1.381 19854 8476 1 9 . 1 1 77 77 ASP H H 77 8.947 8.947 7.528 1.419 19854 8477 1 9 . 1 1 78 78 GLY N N 78 127.244 127.244 107.264 19.980 19854 8478 1 9 . 1 1 78 78 GLY C C 78 173.928 173.928 176.511 -2.583 19854 8479 1 9 . 1 1 78 78 GLY CA C 78 44.623 44.623 47.112 -2.490 19854 8480 1 9 . 1 1 78 78 GLY H H 78 8.219 8.219 8.429 -0.210 19854 8481 1 9 . 1 1 79 79 TYR N N 79 120.537 120.537 119.087 1.450 19854 8482 1 9 . 1 1 79 79 TYR C C 79 176.273 176.273 177.492 -1.219 19854 8483 1 9 . 1 1 79 79 TYR CA C 79 58.678 58.678 58.804 -0.126 19854 8484 1 9 . 1 1 79 79 TYR CB C 79 40.524 40.524 38.035 2.489 19854 8485 1 9 . 1 1 79 79 TYR H H 79 8.563 8.563 7.534 1.029 19854 8486 1 9 . 1 1 80 80 TYR N N 80 122.132 122.132 118.062 4.070 19854 8487 1 9 . 1 1 80 80 TYR C C 80 175.979 175.979 175.803 0.176 19854 8488 1 9 . 1 1 80 80 TYR CA C 80 62.203 62.203 59.203 3.000 19854 8489 1 9 . 1 1 80 80 TYR CB C 80 41.988 41.988 39.520 2.468 19854 8490 1 9 . 1 1 80 80 TYR H H 80 8.254 8.254 7.616 0.638 19854 8491 1 9 . 1 1 81 81 ILE N N 81 120.072 120.072 120.492 -0.420 19854 8492 1 9 . 1 1 81 81 ILE C C 81 177.445 177.445 175.920 1.525 19854 8493 1 9 . 1 1 81 81 ILE CA C 81 67.462 67.462 63.404 4.058 19854 8494 1 9 . 1 1 81 81 ILE CB C 81 41.109 41.109 38.142 2.967 19854 8495 1 9 . 1 1 81 81 ILE H H 81 8.837 8.837 7.930 0.907 19854 8496 1 9 . 1 1 82 82 GLN N N 82 121.601 121.601 119.763 1.838 19854 8497 1 9 . 1 1 82 82 GLN C C 82 173.342 173.342 174.449 -1.107 19854 8498 1 9 . 1 1 82 82 GLN CA C 82 59.859 59.859 56.377 3.482 19854 8499 1 9 . 1 1 82 82 GLN CB C 82 30.855 30.855 26.331 4.524 19854 8500 1 9 . 1 1 82 82 GLN H H 82 8.184 8.184 8.977 -0.793 19854 8501 1 9 . 1 1 83 83 ALA N N 83 109.713 109.713 120.697 -10.984 19854 8502 1 9 . 1 1 83 83 ALA C C 83 175.979 175.979 177.109 -1.130 19854 8503 1 9 . 1 1 83 83 ALA CA C 83 54.579 54.579 52.602 1.977 19854 8504 1 9 . 1 1 83 83 ALA CB C 83 16.513 16.513 19.234 -2.721 19854 8505 1 9 . 1 1 83 83 ALA H H 83 6.306 6.306 7.373 -1.067 19854 8506 1 9 . 1 1 84 84 GLN N N 84 121.203 121.203 120.728 0.475 19854 8507 1 9 . 1 1 84 84 GLN C C 84 177.144 177.144 176.055 1.089 19854 8508 1 9 . 1 1 84 84 GLN CA C 84 60.152 60.152 56.340 3.812 19854 8509 1 9 . 1 1 84 84 GLN CB C 84 34.957 34.957 30.905 4.052 19854 8510 1 9 . 1 1 84 84 GLN H H 84 8.180 8.180 8.679 -0.499 19854 8511 1 9 . 1 1 85 85 CYS N N 85 120.605 120.605 111.883 8.722 19854 8512 1 9 . 1 1 85 85 CYS C C 85 176.566 176.566 172.682 3.884 19854 8513 1 9 . 1 1 85 85 CYS CA C 85 65.430 65.430 56.069 9.361 19854 8514 1 9 . 1 1 85 85 CYS CB C 85 39.644 39.644 31.744 7.900 19854 8515 1 9 . 1 1 85 85 CYS H H 85 8.364 8.364 7.852 0.512 19854 8516 1 9 . 1 1 86 86 ALA N N 86 114.295 114.295 121.971 -7.676 19854 8517 1 9 . 1 1 86 86 ALA CA C 86 57.507 57.507 50.677 6.830 19854 8518 1 9 . 1 1 86 86 ALA CB C 86 21.784 21.784 22.928 -1.144 19854 8519 1 9 . 1 1 86 86 ALA H H 86 6.897 6.897 8.778 -1.881 19854 8520 1 9 . 1 1 87 87 ILE N N 87 120.670 120.670 120.846 -0.176 19854 8521 1 9 . 1 1 87 87 ILE C C 87 173.928 173.928 174.665 -0.737 19854 8522 1 9 . 1 1 87 87 ILE CA C 87 61.020 61.020 59.981 1.039 19854 8523 1 9 . 1 1 87 87 ILE CB C 87 39.938 39.938 41.314 -1.376 19854 8524 1 9 . 1 1 87 87 ILE H H 87 8.282 8.282 8.611 -0.329 19854 8525 1 9 . 1 1 88 88 ILE N N 88 120.205 120.205 126.985 -6.780 19854 8526 1 9 . 1 1 88 88 ILE C C 88 173.635 173.635 174.347 -0.712 19854 8527 1 9 . 1 1 88 88 ILE CA C 88 64.534 64.534 60.160 4.374 19854 8528 1 9 . 1 1 88 88 ILE CB C 88 37.596 37.596 40.095 -2.499 19854 8529 1 9 . 1 1 88 88 ILE H H 88 5.528 5.528 9.040 -3.512 19854 8530 1 9 . 1 1 89 89 MET N N 89 120.472 120.472 127.532 -7.060 19854 8531 1 9 . 1 1 89 89 MET C C 89 178.617 178.617 174.516 4.101 19854 8532 1 9 . 1 1 89 89 MET CA C 89 58.980 58.980 53.769 5.211 19854 8533 1 9 . 1 1 89 89 MET CB C 89 34.957 34.957 35.947 -0.990 19854 8534 1 9 . 1 1 89 89 MET H H 89 8.176 8.176 8.554 -0.378 19854 8535 1 9 . 1 1 90 90 PHE N N 90 121.134 121.134 120.724 0.410 19854 8536 1 9 . 1 1 90 90 PHE C C 90 175.393 175.393 173.103 2.290 19854 8537 1 9 . 1 1 90 90 PHE CA C 90 60.435 60.435 55.435 5.000 19854 8538 1 9 . 1 1 90 90 PHE CB C 90 38.767 38.767 42.382 -3.615 19854 8539 1 9 . 1 1 90 90 PHE H H 90 9.334 9.334 8.857 0.477 19854 8540 1 9 . 1 1 91 91 ASP N N 91 120.273 120.273 121.440 -1.167 19854 8541 1 9 . 1 1 91 91 ASP C C 91 177.730 177.730 178.140 -0.410 19854 8542 1 9 . 1 1 91 91 ASP CA C 91 59.859 59.859 51.771 8.088 19854 8543 1 9 . 1 1 91 91 ASP CB C 91 44.039 44.039 42.833 1.206 19854 8544 1 9 . 1 1 91 91 ASP H H 91 7.597 7.597 8.882 -1.285 19854 8545 1 9 . 1 1 92 92 VAL N N 92 115.158 115.158 123.777 -8.619 19854 8546 1 9 . 1 1 92 92 VAL C C 92 173.342 173.342 176.714 -3.372 19854 8547 1 9 . 1 1 92 92 VAL CA C 92 64.534 64.534 65.089 -0.555 19854 8548 1 9 . 1 1 92 92 VAL CB C 92 37.596 37.596 31.377 6.219 19854 8549 1 9 . 1 1 92 92 VAL H H 92 7.738 7.738 8.519 -0.781 19854 8550 1 9 . 1 1 93 93 THR N N 93 127.179 127.179 110.452 16.727 19854 8551 1 9 . 1 1 93 93 THR C C 93 178.902 178.902 174.834 4.068 19854 8552 1 9 . 1 1 93 93 THR CA C 93 64.254 64.254 63.407 0.846 19854 8553 1 9 . 1 1 93 93 THR CB C 93 74.215 74.215 69.129 5.085 19854 8554 1 9 . 1 1 93 93 THR H H 93 7.636 7.636 8.191 -0.555 19854 8555 1 9 . 1 1 94 94 SER N N 94 122.263 122.263 117.124 5.139 19854 8556 1 9 . 1 1 94 94 SER C C 94 163.965 163.965 174.557 -10.592 19854 8557 1 9 . 1 1 94 94 SER CA C 94 59.849 59.849 55.819 4.030 19854 8558 1 9 . 1 1 94 94 SER CB C 94 62.192 62.192 64.287 -2.095 19854 8559 1 9 . 1 1 94 94 SER H H 94 7.628 7.628 7.880 -0.252 19854 8560 1 9 . 1 1 95 95 ARG N N 95 113.099 113.099 129.898 -16.799 19854 8561 1 9 . 1 1 95 95 ARG C C 95 176.273 176.273 177.778 -1.505 19854 8562 1 9 . 1 1 95 95 ARG CA C 95 53.407 53.407 58.866 -5.459 19854 8563 1 9 . 1 1 95 95 ARG CB C 95 31.154 31.154 29.655 1.499 19854 8564 1 9 . 1 1 95 95 ARG H H 95 8.102 8.102 9.180 -1.078 19854 8565 1 9 . 1 1 96 96 VAL N N 96 124.787 124.787 118.608 6.179 19854 8566 1 9 . 1 1 96 96 VAL C C 96 178.031 178.031 177.903 0.128 19854 8567 1 9 . 1 1 96 96 VAL CA C 96 68.634 68.634 66.555 2.079 19854 8568 1 9 . 1 1 96 96 VAL CB C 96 24.126 24.126 31.404 -7.278 19854 8569 1 9 . 1 1 96 96 VAL H H 96 9.146 9.146 8.051 1.095 19854 8570 1 9 . 1 1 97 97 THR N N 97 111.970 111.970 116.467 -4.497 19854 8571 1 9 . 1 1 97 97 THR C C 97 178.031 178.031 176.227 1.804 19854 8572 1 9 . 1 1 97 97 THR CA C 97 63.949 63.949 66.481 -2.532 19854 8573 1 9 . 1 1 97 97 THR CB C 97 70.390 70.390 68.990 1.400 19854 8574 1 9 . 1 1 97 97 THR H H 97 7.984 7.984 7.669 0.315 19854 8575 1 9 . 1 1 98 98 TYR N N 98 113.232 113.232 121.349 -8.117 19854 8576 1 9 . 1 1 98 98 TYR C C 98 176.273 176.273 177.676 -1.403 19854 8577 1 9 . 1 1 98 98 TYR H H 98 7.605 7.605 7.834 -0.229 19854 8578 1 9 . 1 1 99 99 LYS N N 99 123.726 123.726 118.862 4.864 19854 8579 1 9 . 1 1 99 99 LYS C C 99 178.316 178.316 178.484 -0.168 19854 8580 1 9 . 1 1 99 99 LYS CA C 99 58.691 58.691 59.438 -0.747 19854 8581 1 9 . 1 1 99 99 LYS CB C 99 36.127 36.127 32.071 4.056 19854 8582 1 9 . 1 1 99 99 LYS H H 99 8.360 8.360 8.024 0.336 19854 8583 1 9 . 1 1 100 100 ASN N N 100 111.970 111.970 116.229 -4.259 19854 8584 1 9 . 1 1 100 100 ASN C C 100 175.979 175.979 176.778 -0.799 19854 8585 1 9 . 1 1 100 100 ASN CA C 100 53.407 53.407 55.045 -1.638 19854 8586 1 9 . 1 1 100 100 ASN CB C 100 37.596 37.596 38.632 -1.036 19854 8587 1 9 . 1 1 100 100 ASN H H 100 5.778 5.778 7.881 -2.103 19854 8588 1 9 . 1 1 101 101 VAL N N 101 118.877 118.877 121.635 -2.758 19854 8589 1 9 . 1 1 101 101 VAL C C 101 173.635 173.635 175.011 -1.376 19854 8590 1 9 . 1 1 101 101 VAL CA C 101 62.777 62.777 68.439 -5.662 19854 8591 1 9 . 1 1 101 101 VAL CB C 101 27.054 27.054 29.236 -2.182 19854 8592 1 9 . 1 1 101 101 VAL H H 101 7.370 7.370 7.514 -0.144 19854 8593 1 9 . 1 1 102 102 PRO C C 102 176.566 176.566 177.590 -1.024 19854 8594 1 9 . 1 1 102 102 PRO CA C 102 62.500 62.500 65.570 -3.070 19854 8595 1 9 . 1 1 102 102 PRO CB C 102 30.853 30.853 31.039 -0.186 19854 8596 1 9 . 1 1 103 103 ASN N N 103 122.728 122.728 115.577 7.151 19854 8597 1 9 . 1 1 103 103 ASN C C 103 175.100 175.100 176.950 -1.850 19854 8598 1 9 . 1 1 103 103 ASN CA C 103 54.579 54.579 55.087 -0.508 19854 8599 1 9 . 1 1 103 103 ASN CB C 103 38.767 38.767 37.055 1.712 19854 8600 1 9 . 1 1 103 103 ASN H H 103 7.879 7.879 7.286 0.593 19854 8601 1 9 . 1 1 104 104 TRP N N 104 122.730 122.730 119.800 2.930 19854 8602 1 9 . 1 1 104 104 TRP C C 104 174.215 174.215 176.928 -2.713 19854 8603 1 9 . 1 1 104 104 TRP CA C 104 59.273 59.273 60.579 -1.306 19854 8604 1 9 . 1 1 104 104 TRP CB C 104 35.250 35.250 30.018 5.232 19854 8605 1 9 . 1 1 104 104 TRP H H 104 7.902 7.902 7.925 -0.023 19854 8606 1 9 . 1 1 105 105 HIS N N 105 120.869 120.869 117.725 3.144 19854 8607 1 9 . 1 1 105 105 HIS C C 105 177.738 177.738 173.702 4.036 19854 8608 1 9 . 1 1 105 105 HIS H H 105 6.971 6.971 8.447 -1.476 19854 8609 1 9 . 1 1 106 106 ARG N N 106 126.314 126.314 121.314 5.000 19854 8610 1 9 . 1 1 106 106 ARG C C 106 176.566 176.566 177.005 -0.439 19854 8611 1 9 . 1 1 106 106 ARG CA C 106 62.777 62.777 57.369 5.408 19854 8612 1 9 . 1 1 106 106 ARG CB C 106 29.397 29.397 31.603 -2.206 19854 8613 1 9 . 1 1 106 106 ARG H H 106 7.507 7.507 7.863 -0.356 19854 8614 1 9 . 1 1 107 107 ASP N N 107 119.076 119.076 122.283 -3.207 19854 8615 1 9 . 1 1 107 107 ASP C C 107 176.566 176.566 178.676 -2.110 19854 8616 1 9 . 1 1 107 107 ASP CA C 107 55.164 55.164 57.583 -2.419 19854 8617 1 9 . 1 1 107 107 ASP CB C 107 41.695 41.695 40.748 0.947 19854 8618 1 9 . 1 1 107 107 ASP H H 107 9.076 9.076 7.856 1.220 19854 8619 1 9 . 1 1 108 108 LEU N N 108 113.299 113.299 120.141 -6.842 19854 8620 1 9 . 1 1 108 108 LEU C C 108 176.273 176.273 178.270 -1.997 19854 8621 1 9 . 1 1 108 108 LEU CA C 108 59.264 59.264 58.083 1.181 19854 8622 1 9 . 1 1 108 108 LEU CB C 108 48.722 48.722 41.294 7.428 19854 8623 1 9 . 1 1 108 108 LEU H H 108 6.725 6.725 7.932 -1.207 19854 8624 1 9 . 1 1 109 109 VAL N N 109 121.267 121.267 118.584 2.683 19854 8625 1 9 . 1 1 109 109 VAL C C 109 175.393 175.393 178.685 -3.292 19854 8626 1 9 . 1 1 109 109 VAL CA C 109 63.949 63.949 66.258 -2.309 19854 8627 1 9 . 1 1 109 109 VAL CB C 109 32.911 32.911 31.134 1.776 19854 8628 1 9 . 1 1 109 109 VAL H H 109 8.763 8.763 7.754 1.009 19854 8629 1 9 . 1 1 110 110 ARG N N 110 112.900 112.900 119.128 -6.228 19854 8630 1 9 . 1 1 110 110 ARG C C 110 176.273 176.273 178.358 -2.085 19854 8631 1 9 . 1 1 110 110 ARG CA C 110 57.507 57.507 59.372 -1.865 19854 8632 1 9 . 1 1 110 110 ARG CB C 110 30.568 30.568 30.205 0.363 19854 8633 1 9 . 1 1 110 110 ARG H H 110 7.241 7.241 7.756 -0.515 19854 8634 1 9 . 1 1 111 111 VAL N N 111 115.556 115.556 117.891 -2.335 19854 8635 1 9 . 1 1 111 111 VAL C C 111 177.445 177.445 177.294 0.151 19854 8636 1 9 . 1 1 111 111 VAL CA C 111 59.849 59.849 65.875 -6.026 19854 8637 1 9 . 1 1 111 111 VAL CB C 111 32.911 32.911 32.621 0.290 19854 8638 1 9 . 1 1 111 111 VAL H H 111 7.566 7.566 7.647 -0.081 19854 8639 1 9 . 1 1 112 112 CYS N N 112 114.295 114.295 115.318 -1.023 19854 8640 1 9 . 1 1 112 112 CYS C C 112 169.826 169.826 174.572 -4.746 19854 8641 1 9 . 1 1 112 112 CYS CA C 112 57.507 57.507 58.970 -1.463 19854 8642 1 9 . 1 1 112 112 CYS CB C 112 35.839 35.839 28.746 7.093 19854 8643 1 9 . 1 1 112 112 CYS H H 112 7.425 7.425 8.374 -0.949 19854 8644 1 9 . 1 1 113 113 GLU N N 113 116.486 116.486 119.503 -3.017 19854 8645 1 9 . 1 1 113 113 GLU C C 113 176.566 176.566 175.596 0.970 19854 8646 1 9 . 1 1 113 113 GLU CA C 113 69.219 69.219 58.338 10.881 19854 8647 1 9 . 1 1 113 113 GLU CB C 113 30.568 30.568 28.681 1.887 19854 8648 1 9 . 1 1 113 113 GLU H H 113 7.241 7.241 8.145 -0.904 19854 8649 1 9 . 1 1 114 114 ASN N N 114 129.302 129.302 121.964 7.338 19854 8650 1 9 . 1 1 114 114 ASN C C 114 175.100 175.100 174.982 0.118 19854 8651 1 9 . 1 1 114 114 ASN CA C 114 52.236 52.236 52.812 -0.577 19854 8652 1 9 . 1 1 114 114 ASN CB C 114 39.938 39.938 38.096 1.842 19854 8653 1 9 . 1 1 114 114 ASN H H 114 8.919 8.919 8.371 0.548 19854 8654 1 9 . 1 1 115 115 ILE N N 115 110.443 110.443 120.868 -10.425 19854 8655 1 9 . 1 1 115 115 ILE C C 115 175.100 175.100 173.240 1.860 19854 8656 1 9 . 1 1 115 115 ILE CA C 115 65.705 65.705 58.053 7.652 19854 8657 1 9 . 1 1 115 115 ILE CB C 115 39.353 39.353 40.200 -0.847 19854 8658 1 9 . 1 1 115 115 ILE H H 115 9.287 9.287 7.877 1.410 19854 8659 1 9 . 1 1 116 116 PRO C C 116 175.979 175.979 175.605 0.374 19854 8660 1 9 . 1 1 116 116 PRO CA C 116 63.086 63.086 63.284 -0.198 19854 8661 1 9 . 1 1 116 116 PRO CB C 116 29.681 29.681 32.201 -2.520 19854 8662 1 9 . 1 1 117 117 ILE N N 117 123.591 123.591 124.643 -1.052 19854 8663 1 9 . 1 1 117 117 ILE C C 117 174.807 174.807 174.976 -0.169 19854 8664 1 9 . 1 1 117 117 ILE CA C 117 66.291 66.291 60.329 5.962 19854 8665 1 9 . 1 1 117 117 ILE CB C 117 38.767 38.767 42.139 -3.372 19854 8666 1 9 . 1 1 117 117 ILE H H 117 7.781 7.781 8.534 -0.753 19854 8667 1 9 . 1 1 118 118 VAL N N 118 119.009 119.009 125.925 -6.916 19854 8668 1 9 . 1 1 118 118 VAL C C 118 178.324 178.324 174.709 3.615 19854 8669 1 9 . 1 1 118 118 VAL CA C 118 62.777 62.777 60.711 2.066 19854 8670 1 9 . 1 1 118 118 VAL CB C 118 31.154 31.154 34.096 -2.942 19854 8671 1 9 . 1 1 118 118 VAL H H 118 8.767 8.767 8.768 -0.001 19854 8672 1 9 . 1 1 119 119 LEU N N 119 119.408 119.408 126.698 -7.290 19854 8673 1 9 . 1 1 119 119 LEU C C 119 178.031 178.031 176.020 2.011 19854 8674 1 9 . 1 1 119 119 LEU CA C 119 42.866 42.866 53.792 -10.926 19854 8675 1 9 . 1 1 119 119 LEU CB C 119 38.767 38.767 43.802 -5.035 19854 8676 1 9 . 1 1 119 119 LEU H H 119 7.734 7.734 9.204 -1.470 19854 8677 1 9 . 1 1 120 120 CYS N N 120 113.232 113.232 122.422 -9.190 19854 8678 1 9 . 1 1 120 120 CYS C C 120 178.031 178.031 174.219 3.812 19854 8679 1 9 . 1 1 120 120 CYS H H 120 8.317 8.317 9.144 -0.827 19854 8680 1 9 . 1 1 121 121 GLY N N 121 117.349 117.349 113.433 3.916 19854 8681 1 9 . 1 1 121 121 GLY C C 121 176.851 176.851 172.785 4.066 19854 8682 1 9 . 1 1 121 121 GLY CA C 121 41.109 41.109 43.620 -2.511 19854 8683 1 9 . 1 1 121 121 GLY H H 121 7.515 7.515 8.925 -1.410 19854 8684 1 9 . 1 1 122 122 ASN N N 122 125.318 125.318 123.640 1.678 19854 8685 1 9 . 1 1 122 122 ASN C C 122 175.686 175.686 175.768 -0.082 19854 8686 1 9 . 1 1 122 122 ASN CA C 122 50.479 50.479 49.908 0.571 19854 8687 1 9 . 1 1 122 122 ASN CB C 122 39.353 39.353 40.924 -1.571 19854 8688 1 9 . 1 1 122 122 ASN H H 122 9.162 9.162 8.590 0.572 19854 8689 1 9 . 1 1 123 123 LYS N N 123 122.132 122.132 114.219 7.913 19854 8690 1 9 . 1 1 123 123 LYS C C 123 173.043 173.043 177.120 -4.077 19854 8691 1 9 . 1 1 123 123 LYS CA C 123 58.101 58.101 57.479 0.622 19854 8692 1 9 . 1 1 123 123 LYS CB C 123 35.543 35.543 29.712 5.831 19854 8693 1 9 . 1 1 123 123 LYS H H 123 7.953 7.953 8.545 -0.592 19854 8694 1 9 . 1 1 124 124 VAL N N 124 123.726 123.726 112.845 10.881 19854 8695 1 9 . 1 1 124 124 VAL C C 124 175.679 175.679 176.266 -0.587 19854 8696 1 9 . 1 1 124 124 VAL CA C 124 64.840 64.840 64.529 0.311 19854 8697 1 9 . 1 1 124 124 VAL CB C 124 42.574 42.574 31.422 11.152 19854 8698 1 9 . 1 1 124 124 VAL H H 124 8.555 8.555 7.590 0.965 19854 8699 1 9 . 1 1 125 125 ASP N N 125 119.607 119.607 119.604 0.003 19854 8700 1 9 . 1 1 125 125 ASP C C 125 176.566 176.566 177.013 -0.447 19854 8701 1 9 . 1 1 125 125 ASP CA C 125 55.750 55.750 56.218 -0.468 19854 8702 1 9 . 1 1 125 125 ASP CB C 125 40.524 40.524 40.689 -0.165 19854 8703 1 9 . 1 1 125 125 ASP H H 125 7.875 7.875 8.162 -0.287 19854 8704 1 9 . 1 1 126 126 ILE N N 126 116.088 116.088 120.859 -4.771 19854 8705 1 9 . 1 1 126 126 ILE C C 126 177.152 177.152 176.431 0.721 19854 8706 1 9 . 1 1 126 126 ILE CA C 126 66.291 66.291 61.823 4.468 19854 8707 1 9 . 1 1 126 126 ILE CB C 126 39.353 39.353 38.296 1.057 19854 8708 1 9 . 1 1 126 126 ILE H H 126 7.511 7.511 7.431 0.080 19854 8709 1 9 . 1 1 127 127 LYS N N 127 121.203 121.203 125.065 -3.862 19854 8710 1 9 . 1 1 127 127 LYS C C 127 175.979 175.979 177.384 -1.405 19854 8711 1 9 . 1 1 127 127 LYS CA C 127 58.101 58.101 58.435 -0.334 19854 8712 1 9 . 1 1 127 127 LYS CB C 127 35.834 35.834 32.606 3.228 19854 8713 1 9 . 1 1 127 127 LYS H H 127 8.113 8.113 8.335 -0.222 19854 8714 1 9 . 1 1 128 128 ASP N N 128 118.279 118.279 120.162 -1.883 19854 8715 1 9 . 1 1 128 128 ASP C C 128 176.566 176.566 174.660 1.906 19854 8716 1 9 . 1 1 128 128 ASP CA C 128 53.407 53.407 53.060 0.347 19854 8717 1 9 . 1 1 128 128 ASP CB C 128 40.524 40.524 39.803 0.721 19854 8718 1 9 . 1 1 128 128 ASP H H 128 7.241 7.241 8.206 -0.965 19854 8719 1 9 . 1 1 129 129 ARG N N 129 118.943 118.943 123.413 -4.470 19854 8720 1 9 . 1 1 129 129 ARG C C 129 177.738 177.738 176.344 1.394 19854 8721 1 9 . 1 1 129 129 ARG CA C 129 45.794 45.794 56.102 -10.308 19854 8722 1 9 . 1 1 129 129 ARG CB C 129 31.154 31.154 31.135 0.019 19854 8723 1 9 . 1 1 129 129 ARG H H 129 8.423 8.423 7.890 0.533 19854 8724 1 9 . 1 1 130 130 LYS N N 130 109.381 109.381 125.492 -16.111 19854 8725 1 9 . 1 1 130 130 LYS C C 130 176.566 176.566 176.642 -0.076 19854 8726 1 9 . 1 1 130 130 LYS CA C 130 55.164 55.164 57.609 -2.445 19854 8727 1 9 . 1 1 130 130 LYS CB C 130 36.424 36.424 33.576 2.848 19854 8728 1 9 . 1 1 130 130 LYS H H 130 7.296 7.296 8.404 -1.108 19854 8729 1 9 . 1 1 131 131 VAL N N 131 110.377 110.377 122.056 -11.679 19854 8730 1 9 . 1 1 131 131 VAL C C 131 178.617 178.617 174.355 4.262 19854 8731 1 9 . 1 1 131 131 VAL CA C 131 65.705 65.705 61.631 4.074 19854 8732 1 9 . 1 1 131 131 VAL CB C 131 35.839 35.839 31.457 4.382 19854 8733 1 9 . 1 1 131 131 VAL H H 131 9.283 9.283 8.213 1.070 19854 8734 1 9 . 1 1 132 132 LYS N N 132 110.310 110.310 128.203 -17.893 19854 8735 1 9 . 1 1 132 132 LYS C C 132 176.273 176.273 177.162 -0.889 19854 8736 1 9 . 1 1 132 132 LYS CA C 132 59.849 59.849 56.051 3.798 19854 8737 1 9 . 1 1 132 132 LYS CB C 132 35.253 35.253 33.646 1.607 19854 8738 1 9 . 1 1 132 132 LYS H H 132 9.709 9.709 8.231 1.478 19854 8739 1 9 . 1 1 133 133 ALA N N 133 134.349 134.349 128.244 6.105 19854 8740 1 9 . 1 1 133 133 ALA CA C 133 51.065 51.065 54.802 -3.737 19854 8741 1 9 . 1 1 133 133 ALA CB C 133 12.999 12.999 18.384 -5.385 19854 8742 1 9 . 1 1 133 133 ALA H H 133 6.322 6.322 8.808 -2.486 19854 8743 1 9 . 1 1 134 134 LYS N N 134 117.615 117.615 117.768 -0.153 19854 8744 1 9 . 1 1 134 134 LYS C C 134 176.859 176.859 177.951 -1.092 19854 8745 1 9 . 1 1 134 134 LYS CA C 134 55.750 55.750 58.690 -2.940 19854 8746 1 9 . 1 1 134 134 LYS CB C 134 54.579 54.579 32.395 22.184 19854 8747 1 9 . 1 1 134 134 LYS H H 134 6.549 6.549 8.172 -1.623 19854 8748 1 9 . 1 1 135 135 SER N N 135 109.314 109.314 114.193 -4.879 19854 8749 1 9 . 1 1 135 135 SER C C 135 173.635 173.635 174.978 -1.343 19854 8750 1 9 . 1 1 135 135 SER CA C 135 56.336 56.336 59.639 -3.303 19854 8751 1 9 . 1 1 135 135 SER CB C 135 63.949 63.949 63.072 0.877 19854 8752 1 9 . 1 1 135 135 SER H H 135 7.840 7.840 7.720 0.120 19854 8753 1 9 . 1 1 136 136 ILE N N 136 124.123 124.123 122.267 1.856 19854 8754 1 9 . 1 1 136 136 ILE C C 136 175.100 175.100 175.393 -0.293 19854 8755 1 9 . 1 1 136 136 ILE CA C 136 68.634 68.634 62.891 5.743 19854 8756 1 9 . 1 1 136 136 ILE CB C 136 43.452 43.452 38.017 5.436 19854 8757 1 9 . 1 1 136 136 ILE H H 136 8.098 8.098 7.391 0.707 19854 8758 1 9 . 1 1 137 137 VAL N N 137 113.232 113.232 126.390 -13.158 19854 8759 1 9 . 1 1 137 137 VAL C C 137 176.859 176.859 176.006 0.853 19854 8760 1 9 . 1 1 137 137 VAL CA C 137 64.534 64.534 61.479 3.055 19854 8761 1 9 . 1 1 137 137 VAL CB C 137 34.082 34.082 34.149 -0.067 19854 8762 1 9 . 1 1 137 137 VAL H H 137 7.711 7.711 8.427 -0.716 19854 8763 1 9 . 1 1 138 138 PHE N N 138 118.279 118.279 122.589 -4.310 19854 8764 1 9 . 1 1 138 138 PHE C C 138 175.393 175.393 176.086 -0.693 19854 8765 1 9 . 1 1 138 138 PHE CA C 138 58.092 58.092 62.145 -4.053 19854 8766 1 9 . 1 1 138 138 PHE CB C 138 39.353 39.353 39.075 0.278 19854 8767 1 9 . 1 1 138 138 PHE H H 138 8.317 8.317 7.723 0.594 19854 8768 1 9 . 1 1 139 139 HIS N N 139 120.605 120.605 116.085 4.520 19854 8769 1 9 . 1 1 139 139 HIS C C 139 175.979 175.979 177.050 -1.071 19854 8770 1 9 . 1 1 139 139 HIS CA C 139 67.775 67.775 59.380 8.395 19854 8771 1 9 . 1 1 139 139 HIS CB C 139 35.836 35.836 28.909 6.927 19854 8772 1 9 . 1 1 139 139 HIS H H 139 8.094 8.094 8.938 -0.844 19854 8773 1 9 . 1 1 140 140 ARG N N 140 120.140 120.140 120.183 -0.043 19854 8774 1 9 . 1 1 140 140 ARG C C 140 178.023 178.023 179.216 -1.193 19854 8775 1 9 . 1 1 140 140 ARG CA C 140 58.394 58.394 59.221 -0.827 19854 8776 1 9 . 1 1 140 140 ARG CB C 140 39.644 39.644 29.682 9.962 19854 8777 1 9 . 1 1 140 140 ARG H H 140 8.149 8.149 6.941 1.208 19854 8778 1 9 . 1 1 141 141 LYS N N 141 115.623 115.623 120.302 -4.679 19854 8779 1 9 . 1 1 141 141 LYS C C 141 173.635 173.635 178.165 -4.530 19854 8780 1 9 . 1 1 141 141 LYS CA C 141 58.092 58.092 58.761 -0.669 19854 8781 1 9 . 1 1 141 141 LYS CB C 141 33.496 33.496 32.308 1.188 19854 8782 1 9 . 1 1 141 141 LYS H H 141 7.449 7.449 7.559 -0.110 19854 8783 1 9 . 1 1 142 142 LYS N N 142 114.162 114.162 116.033 -1.871 19854 8784 1 9 . 1 1 142 142 LYS C C 142 175.979 175.979 175.886 0.093 19854 8785 1 9 . 1 1 142 142 LYS CA C 142 51.065 51.065 54.878 -3.813 19854 8786 1 9 . 1 1 142 142 LYS CB C 142 34.668 34.668 32.247 2.421 19854 8787 1 9 . 1 1 142 142 LYS H H 142 8.982 8.982 7.756 1.226 19854 8788 1 9 . 1 1 143 143 ASN N N 143 112.103 112.103 114.853 -2.750 19854 8789 1 9 . 1 1 143 143 ASN C C 143 175.100 175.100 174.208 0.892 19854 8790 1 9 . 1 1 143 143 ASN CA C 143 53.407 53.407 53.936 -0.529 19854 8791 1 9 . 1 1 143 143 ASN CB C 143 39.938 39.938 36.489 3.450 19854 8792 1 9 . 1 1 143 143 ASN H H 143 7.402 7.402 7.678 -0.276 19854 8793 1 9 . 1 1 144 144 LEU N N 144 118.810 118.810 116.961 1.849 19854 8794 1 9 . 1 1 144 144 LEU CA C 144 53.993 53.993 53.353 0.640 19854 8795 1 9 . 1 1 144 144 LEU CB C 144 42.866 42.866 44.268 -1.402 19854 8796 1 9 . 1 1 144 144 LEU H H 144 7.793 7.793 8.037 -0.244 19854 8797 1 9 . 1 1 145 145 GLN N N 145 119.607 119.607 117.845 1.762 19854 8798 1 9 . 1 1 145 145 GLN C C 145 176.859 176.859 174.233 2.626 19854 8799 1 9 . 1 1 145 145 GLN CA C 145 55.164 55.164 53.458 1.706 19854 8800 1 9 . 1 1 145 145 GLN CB C 145 29.983 29.983 30.781 -0.798 19854 8801 1 9 . 1 1 145 145 GLN H H 145 7.014 7.014 7.983 -0.969 19854 8802 1 9 . 1 1 146 146 TYR N N 146 119.275 119.275 124.702 -5.427 19854 8803 1 9 . 1 1 146 146 TYR C C 146 174.807 174.807 174.388 0.419 19854 8804 1 9 . 1 1 146 146 TYR CA C 146 62.777 62.777 56.121 6.656 19854 8805 1 9 . 1 1 146 146 TYR CB C 146 41.109 41.109 40.450 0.659 19854 8806 1 9 . 1 1 146 146 TYR H H 146 9.350 9.350 8.214 1.136 19854 8807 1 9 . 1 1 147 147 TYR N N 147 123.658 123.658 125.736 -2.078 19854 8808 1 9 . 1 1 147 147 TYR C C 147 177.738 177.738 173.781 3.957 19854 8809 1 9 . 1 1 147 147 TYR CA C 147 58.092 58.092 56.231 1.861 19854 8810 1 9 . 1 1 147 147 TYR CB C 147 39.938 39.938 41.955 -2.017 19854 8811 1 9 . 1 1 147 147 TYR H H 147 8.340 8.340 8.668 -0.328 19854 8812 1 9 . 1 1 148 148 ASP N N 148 121.267 121.267 123.661 -2.394 19854 8813 1 9 . 1 1 148 148 ASP C C 148 176.859 176.859 175.234 1.625 19854 8814 1 9 . 1 1 148 148 ASP CA C 148 54.579 54.579 54.374 0.205 19854 8815 1 9 . 1 1 148 148 ASP CB C 148 41.109 41.109 41.742 -0.633 19854 8816 1 9 . 1 1 148 148 ASP H H 148 8.911 8.911 8.327 0.584 19854 8817 1 9 . 1 1 149 149 ILE N N 149 119.607 119.607 118.749 0.858 19854 8818 1 9 . 1 1 149 149 ILE C C 149 174.807 174.807 174.340 0.467 19854 8819 1 9 . 1 1 149 149 ILE CA C 149 61.020 61.020 59.093 1.927 19854 8820 1 9 . 1 1 149 149 ILE CB C 149 39.353 39.353 42.607 -3.254 19854 8821 1 9 . 1 1 149 149 ILE H H 149 8.712 8.712 8.662 0.050 19854 8822 1 9 . 1 1 150 150 SER N N 150 117.349 117.349 116.944 0.405 19854 8823 1 9 . 1 1 150 150 SER C C 150 175.686 175.686 174.445 1.241 19854 8824 1 9 . 1 1 150 150 SER CA C 150 60.435 60.435 55.416 5.019 19854 8825 1 9 . 1 1 150 150 SER CB C 150 62.192 62.192 65.426 -3.234 19854 8826 1 9 . 1 1 150 150 SER H H 150 8.454 8.454 8.492 -0.038 19854 8827 1 9 . 1 1 151 151 ALA N N 151 131.162 131.162 131.161 0.001 19854 8828 1 9 . 1 1 151 151 ALA C C 151 160.742 160.742 179.235 -18.493 19854 8829 1 9 . 1 1 151 151 ALA CA C 151 53.993 53.993 54.931 -0.938 19854 8830 1 9 . 1 1 151 151 ALA CB C 151 22.369 22.369 18.736 3.632 19854 8831 1 9 . 1 1 151 151 ALA H H 151 10.640 10.640 8.988 1.652 19854 8832 1 9 . 1 1 152 152 LYS N N 152 121.400 121.400 118.646 2.754 19854 8833 1 9 . 1 1 152 152 LYS C C 152 174.221 174.221 177.941 -3.720 19854 8834 1 9 . 1 1 152 152 LYS CA C 152 59.849 59.849 58.447 1.402 19854 8835 1 9 . 1 1 152 152 LYS CB C 152 34.668 34.668 32.627 2.041 19854 8836 1 9 . 1 1 152 152 LYS H H 152 9.099 9.099 8.265 0.834 19854 8837 1 9 . 1 1 153 153 SER N N 153 135.212 135.212 110.916 24.296 19854 8838 1 9 . 1 1 153 153 SER C C 153 177.152 177.152 174.863 2.289 19854 8839 1 9 . 1 1 153 153 SER CA C 153 62.192 62.192 58.301 3.891 19854 8840 1 9 . 1 1 153 153 SER CB C 153 66.291 66.291 64.176 2.115 19854 8841 1 9 . 1 1 153 153 SER H H 153 8.935 8.935 7.793 1.143 19854 8842 1 9 . 1 1 154 154 ASN N N 154 119.341 119.341 116.355 2.986 19854 8843 1 9 . 1 1 154 154 ASN C C 154 175.979 175.979 174.055 1.924 19854 8844 1 9 . 1 1 154 154 ASN CA C 154 49.894 49.894 54.552 -4.658 19854 8845 1 9 . 1 1 154 154 ASN CB C 154 39.353 39.353 36.736 2.617 19854 8846 1 9 . 1 1 154 154 ASN H H 154 7.488 7.488 8.158 -0.670 19854 8847 1 9 . 1 1 155 155 TYR N N 155 120.074 120.074 123.289 -3.215 19854 8848 1 9 . 1 1 155 155 TYR C C 155 177.144 177.144 175.286 1.858 19854 8849 1 9 . 1 1 155 155 TYR CA C 155 60.738 60.738 59.470 1.268 19854 8850 1 9 . 1 1 155 155 TYR CB C 155 41.402 41.402 38.467 2.935 19854 8851 1 9 . 1 1 155 155 TYR H H 155 7.945 7.945 7.524 0.421 19854 8852 1 9 . 1 1 156 156 ASN N N 156 124.058 124.058 122.610 1.448 19854 8853 1 9 . 1 1 156 156 ASN C C 156 175.679 175.679 175.692 -0.013 19854 8854 1 9 . 1 1 156 156 ASN CA C 156 53.121 53.121 54.320 -1.199 19854 8855 1 9 . 1 1 156 156 ASN CB C 156 38.179 38.179 35.760 2.419 19854 8856 1 9 . 1 1 156 156 ASN H H 156 8.192 8.192 8.986 -0.794 19854 8857 1 9 . 1 1 157 157 PHE N N 157 123.459 123.459 117.023 6.436 19854 8858 1 9 . 1 1 157 157 PHE C C 157 174.221 174.221 176.127 -1.906 19854 8859 1 9 . 1 1 157 157 PHE CA C 157 57.507 57.507 60.747 -3.240 19854 8860 1 9 . 1 1 157 157 PHE CB C 157 39.353 39.353 38.577 0.776 19854 8861 1 9 . 1 1 157 157 PHE H H 157 7.429 7.429 7.919 -0.490 19854 8862 1 9 . 1 1 158 158 GLU N N 158 112.568 112.568 116.991 -4.423 19854 8863 1 9 . 1 1 158 158 GLU C C 158 176.566 176.566 177.788 -1.222 19854 8864 1 9 . 1 1 158 158 GLU CA C 158 72.147 72.147 56.836 15.311 19854 8865 1 9 . 1 1 158 158 GLU CB C 158 27.640 27.640 28.507 -0.867 19854 8866 1 9 . 1 1 158 158 GLU H H 158 7.495 7.495 7.975 -0.480 19854 8867 1 9 . 1 1 159 159 LYS N N 159 113.232 113.232 119.734 -6.502 19854 8868 1 9 . 1 1 159 159 LYS C C 159 176.566 176.566 175.844 0.722 19854 8869 1 9 . 1 1 159 159 LYS CA C 159 53.993 53.993 61.455 -7.462 19854 8870 1 9 . 1 1 159 159 LYS CB C 159 33.496 33.496 30.079 3.417 19854 8871 1 9 . 1 1 159 159 LYS H H 159 6.862 6.862 7.287 -0.425 19854 8872 1 9 . 1 1 160 160 PRO C C 160 176.273 176.273 178.526 -2.253 19854 8873 1 9 . 1 1 160 160 PRO CA C 160 64.258 64.258 65.478 -1.220 19854 8874 1 9 . 1 1 160 160 PRO CB C 160 32.318 32.318 31.064 1.254 19854 8875 1 9 . 1 1 161 161 PHE N N 161 123.726 123.726 116.988 6.738 19854 8876 1 9 . 1 1 161 161 PHE C C 161 176.851 176.851 177.551 -0.700 19854 8877 1 9 . 1 1 161 161 PHE CA C 161 60.445 60.445 61.967 -1.522 19854 8878 1 9 . 1 1 161 161 PHE CB C 161 40.816 40.816 37.566 3.250 19854 8879 1 9 . 1 1 161 161 PHE H H 161 8.215 8.215 7.216 0.999 19854 8880 1 9 . 1 1 162 162 LEU N N 162 110.177 110.177 119.037 -8.860 19854 8881 1 9 . 1 1 162 162 LEU C C 162 176.273 176.273 178.674 -2.401 19854 8882 1 9 . 1 1 162 162 LEU CA C 162 55.750 55.750 57.891 -2.141 19854 8883 1 9 . 1 1 162 162 LEU CB C 162 44.037 44.037 41.469 2.568 19854 8884 1 9 . 1 1 162 162 LEU H H 162 7.527 7.527 7.906 -0.379 19854 8885 1 9 . 1 1 163 163 TRP N N 163 123.525 123.525 121.468 2.057 19854 8886 1 9 . 1 1 163 163 TRP C C 163 177.152 177.152 177.967 -0.815 19854 8887 1 9 . 1 1 163 163 TRP CA C 163 61.606 61.606 62.193 -0.587 19854 8888 1 9 . 1 1 163 163 TRP CB C 163 28.811 28.811 29.506 -0.695 19854 8889 1 9 . 1 1 163 163 TRP H H 163 7.476 7.476 8.267 -0.791 19854 8890 1 9 . 1 1 164 164 LEU N N 164 119.740 119.740 119.083 0.657 19854 8891 1 9 . 1 1 164 164 LEU C C 164 175.686 175.686 178.877 -3.191 19854 8892 1 9 . 1 1 164 164 LEU CA C 164 61.020 61.020 57.839 3.181 19854 8893 1 9 . 1 1 164 164 LEU CB C 164 45.794 45.794 41.337 4.457 19854 8894 1 9 . 1 1 164 164 LEU H H 164 9.412 9.412 8.079 1.333 19854 8895 1 9 . 1 1 165 165 ALA N N 165 118.013 118.013 121.362 -3.349 19854 8896 1 9 . 1 1 165 165 ALA C C 165 165.723 165.723 179.536 -13.813 19854 8897 1 9 . 1 1 165 165 ALA CA C 165 52.236 52.236 55.207 -2.971 19854 8898 1 9 . 1 1 165 165 ALA CB C 165 21.784 21.784 18.176 3.608 19854 8899 1 9 . 1 1 165 165 ALA H H 165 7.707 7.707 8.287 -0.580 19854 8900 1 9 . 1 1 166 166 ARG N N 166 122.994 122.994 118.442 4.552 19854 8901 1 9 . 1 1 166 166 ARG C C 166 175.979 175.979 178.795 -2.816 19854 8902 1 9 . 1 1 166 166 ARG CA C 166 49.308 49.308 59.186 -9.878 19854 8903 1 9 . 1 1 166 166 ARG CB C 166 29.397 29.397 30.105 -0.708 19854 8904 1 9 . 1 1 166 166 ARG H H 166 8.692 8.692 8.155 0.537 19854 8905 1 9 . 1 1 167 167 LYS N N 167 112.568 112.568 120.042 -7.474 19854 8906 1 9 . 1 1 167 167 LYS C C 167 176.273 176.273 179.136 -2.863 19854 8907 1 9 . 1 1 167 167 LYS CA C 167 58.092 58.092 58.346 -0.254 19854 8908 1 9 . 1 1 167 167 LYS CB C 167 34.668 34.668 31.342 3.326 19854 8909 1 9 . 1 1 167 167 LYS H H 167 6.819 6.819 7.395 -0.576 19854 8910 1 9 . 1 1 168 168 LEU N N 168 114.959 114.959 119.481 -4.522 19854 8911 1 9 . 1 1 168 168 LEU C C 168 177.738 177.738 178.951 -1.213 19854 8912 1 9 . 1 1 168 168 LEU CA C 168 56.921 56.921 57.504 -0.583 19854 8913 1 9 . 1 1 168 168 LEU CB C 168 41.695 41.695 41.609 0.086 19854 8914 1 9 . 1 1 168 168 LEU H H 168 7.269 7.269 7.691 -0.422 19854 8915 1 9 . 1 1 169 169 ILE N N 169 122.199 122.199 117.142 5.057 19854 8916 1 9 . 1 1 169 169 ILE C C 169 177.445 177.445 177.091 0.354 19854 8917 1 9 . 1 1 169 169 ILE CA C 169 63.375 63.375 63.107 0.268 19854 8918 1 9 . 1 1 169 169 ILE CB C 169 42.281 42.281 38.573 3.708 19854 8919 1 9 . 1 1 169 169 ILE H H 169 8.360 8.360 8.060 0.300 19854 8920 1 9 . 1 1 170 170 GLY N N 170 113.099 113.099 106.739 6.360 19854 8921 1 9 . 1 1 170 170 GLY C C 170 162.496 162.496 173.921 -11.425 19854 8922 1 9 . 1 1 170 170 GLY CA C 170 44.037 44.037 44.807 -0.770 19854 8923 1 9 . 1 1 170 170 GLY H H 170 6.686 6.686 7.991 -1.305 19854 8924 1 9 . 1 1 171 171 ASP N N 171 113.232 113.232 121.675 -8.443 19854 8925 1 9 . 1 1 171 171 ASP C C 171 178.910 178.910 175.581 3.329 19854 8926 1 9 . 1 1 171 171 ASP CA C 171 50.479 50.479 50.514 -0.035 19854 8927 1 9 . 1 1 171 171 ASP CB C 171 41.109 41.109 41.870 -0.761 19854 8928 1 9 . 1 1 171 171 ASP H H 171 6.815 6.815 7.691 -0.876 19854 8929 1 9 . 1 1 172 172 PRO C C 172 176.566 176.566 177.030 -0.464 19854 8930 1 9 . 1 1 172 172 PRO CA C 172 63.965 63.965 64.160 -0.195 19854 8931 1 9 . 1 1 172 172 PRO CB C 172 31.732 31.732 32.273 -0.541 19854 8932 1 9 . 1 1 173 173 ASN N N 173 109.779 109.779 116.432 -6.653 19854 8933 1 9 . 1 1 173 173 ASN C C 173 175.979 175.979 174.711 1.268 19854 8934 1 9 . 1 1 173 173 ASN CA C 173 54.579 54.579 52.933 1.646 19854 8935 1 9 . 1 1 173 173 ASN CB C 173 36.424 36.424 38.781 -2.357 19854 8936 1 9 . 1 1 173 173 ASN H H 173 8.016 8.016 8.433 -0.417 19854 8937 1 9 . 1 1 174 174 LEU N N 174 109.248 109.248 123.190 -13.942 19854 8938 1 9 . 1 1 174 174 LEU C C 174 176.566 176.566 175.703 0.863 19854 8939 1 9 . 1 1 174 174 LEU CA C 174 56.336 56.336 55.995 0.341 19854 8940 1 9 . 1 1 174 174 LEU CB C 174 44.037 44.037 42.714 1.323 19854 8941 1 9 . 1 1 174 174 LEU H H 174 7.871 7.871 7.219 0.652 19854 8942 1 9 . 1 1 175 175 GLU N N 175 125.185 125.185 125.332 -0.147 19854 8943 1 9 . 1 1 175 175 GLU C C 175 177.445 177.445 174.907 2.538 19854 8944 1 9 . 1 1 175 175 GLU CA C 175 76.247 76.247 54.046 22.201 19854 8945 1 9 . 1 1 175 175 GLU CB C 175 28.811 28.811 33.900 -5.089 19854 8946 1 9 . 1 1 175 175 GLU H H 175 9.127 9.127 8.175 0.952 19854 8947 1 9 . 1 1 176 176 PHE N N 176 136.873 136.873 122.992 13.881 19854 8948 1 9 . 1 1 176 176 PHE C C 176 178.617 178.617 175.829 2.788 19854 8949 1 9 . 1 1 176 176 PHE CA C 176 59.264 59.264 58.299 0.965 19854 8950 1 9 . 1 1 176 176 PHE CB C 176 44.623 44.623 40.242 4.381 19854 8951 1 9 . 1 1 176 176 PHE H H 176 10.058 10.058 8.615 1.443 19854 8952 1 9 . 1 1 177 177 VAL N N 177 118.877 118.877 124.087 -5.210 19854 8953 1 9 . 1 1 177 177 VAL C C 177 177.445 177.445 174.108 3.337 19854 8954 1 9 . 1 1 177 177 VAL CA C 177 62.777 62.777 59.049 3.728 19854 8955 1 9 . 1 1 177 177 VAL CB C 177 34.668 34.668 34.062 0.606 19854 8956 1 9 . 1 1 177 177 VAL H H 177 7.789 7.789 7.975 -0.186 19854 8957 1 9 . 1 1 178 178 ALA N N 178 123.859 123.859 125.970 -2.111 19854 8958 1 9 . 1 1 178 178 ALA C C 178 177.144 177.144 177.182 -0.038 19854 8959 1 9 . 1 1 178 178 ALA CA C 178 54.000 54.000 54.720 -0.720 19854 8960 1 9 . 1 1 178 178 ALA CB C 178 15.035 15.035 19.000 -3.965 19854 8961 1 9 . 1 1 178 178 ALA H H 178 7.683 7.683 8.227 -0.544 19854 8962 1 9 . 1 1 179 179 MET N N 179 121.668 121.668 117.101 4.567 19854 8963 1 9 . 1 1 179 179 MET C C 179 177.144 177.144 173.449 3.695 19854 8964 1 9 . 1 1 179 179 MET CA C 179 60.445 60.445 52.801 7.644 19854 8965 1 9 . 1 1 179 179 MET CB C 179 39.351 39.351 33.414 5.937 19854 8966 1 9 . 1 1 179 179 MET H H 179 7.648 7.648 7.686 -0.038 19854 8967 1 9 . 1 1 180 180 PRO C C 180 177.445 177.445 175.304 2.141 19854 8968 1 9 . 1 1 180 180 PRO CA C 180 64.844 64.844 62.288 2.556 19854 8969 1 9 . 1 1 180 180 PRO CB C 180 29.974 29.974 33.233 -3.259 19854 8970 1 9 . 1 1 181 181 ALA N N 181 128.439 128.439 123.993 4.446 19854 8971 1 9 . 1 1 181 181 ALA C C 181 176.273 176.273 176.967 -0.694 19854 8972 1 9 . 1 1 181 181 ALA CA C 181 58.092 58.092 51.746 6.346 19854 8973 1 9 . 1 1 181 181 ALA CB C 181 21.198 21.198 19.482 1.716 19854 8974 1 9 . 1 1 181 181 ALA H H 181 8.673 8.673 8.194 0.479 19854 8975 1 9 . 1 1 182 182 LEU N N 182 122.130 122.130 121.070 1.060 19854 8976 1 9 . 1 1 182 182 LEU C C 182 177.445 177.445 176.749 0.696 19854 8977 1 9 . 1 1 182 182 LEU CA C 182 55.164 55.164 54.232 0.932 19854 8978 1 9 . 1 1 182 182 LEU CB C 182 42.866 42.866 44.273 -1.407 19854 8979 1 9 . 1 1 182 182 LEU H H 182 8.821 8.821 8.478 0.343 19854 8980 1 9 . 1 1 183 183 ALA N N 183 121.004 121.004 125.784 -4.780 19854 8981 1 9 . 1 1 183 183 ALA C C 183 178.617 178.617 175.776 2.841 19854 8982 1 9 . 1 1 183 183 ALA CA C 183 57.808 57.808 50.136 7.672 19854 8983 1 9 . 1 1 183 183 ALA CB C 183 24.117 24.117 18.631 5.486 19854 8984 1 9 . 1 1 183 183 ALA H H 183 8.356 8.356 8.247 0.109 19854 8985 1 9 . 1 1 184 184 PRO C C 184 177.152 177.152 175.094 2.058 19854 8986 1 9 . 1 1 184 184 PRO CA C 184 64.258 64.258 61.945 2.313 19854 8987 1 9 . 1 1 184 184 PRO CB C 184 29.681 29.681 31.429 -1.748 19854 8988 1 9 . 1 1 185 185 PRO C C 185 175.686 175.686 177.118 -1.432 19854 8989 1 9 . 1 1 185 185 PRO CA C 185 63.379 63.379 62.418 0.961 19854 8990 1 9 . 1 1 185 185 PRO CB C 185 35.248 35.248 32.391 2.857 19854 8991 1 9 . 1 1 186 186 GLU N N 186 120.539 120.539 119.710 0.829 19854 8992 1 9 . 1 1 186 186 GLU C C 186 176.273 176.273 175.916 0.357 19854 8993 1 9 . 1 1 186 186 GLU CA C 186 58.101 58.101 57.578 0.523 19854 8994 1 9 . 1 1 186 186 GLU CB C 186 35.836 35.836 29.732 6.104 19854 8995 1 9 . 1 1 186 186 GLU H H 186 8.086 8.086 8.473 -0.387 19854 8996 1 9 . 1 1 187 187 VAL N N 187 124.455 124.455 117.332 7.123 19854 8997 1 9 . 1 1 187 187 VAL C C 187 178.910 178.910 175.086 3.824 19854 8998 1 9 . 1 1 187 187 VAL CA C 187 63.363 63.363 62.719 0.643 19854 8999 1 9 . 1 1 187 187 VAL CB C 187 34.082 34.082 31.168 2.914 19854 9000 1 9 . 1 1 187 187 VAL H H 187 8.622 8.622 7.926 0.696 19854 9001 1 9 . 1 1 188 188 VAL N N 188 128.572 128.572 119.946 8.626 19854 9002 1 9 . 1 1 188 188 VAL C C 188 178.324 178.324 176.335 1.989 19854 9003 1 9 . 1 1 188 188 VAL CA C 188 68.634 68.634 60.927 7.707 19854 9004 1 9 . 1 1 188 188 VAL CB C 188 31.154 31.154 33.888 -2.734 19854 9005 1 9 . 1 1 188 188 VAL H H 188 8.497 8.497 7.831 0.666 19854 9006 1 9 . 1 1 189 189 MET N N 189 122.795 122.795 118.051 4.744 19854 9007 1 9 . 1 1 189 189 MET C C 189 177.445 177.445 176.139 1.306 19854 9008 1 9 . 1 1 189 189 MET CA C 189 55.164 55.164 57.470 -2.306 19854 9009 1 9 . 1 1 189 189 MET CB C 189 35.253 35.253 30.634 4.619 19854 9010 1 9 . 1 1 189 189 MET H H 189 6.991 6.991 8.673 -1.682 19854 9011 1 9 . 1 1 190 190 ASP N N 190 114.959 114.959 118.037 -3.078 19854 9012 1 9 . 1 1 190 190 ASP C C 190 175.686 175.686 175.756 -0.070 19854 9013 1 9 . 1 1 190 190 ASP CA C 190 51.065 51.065 54.464 -3.398 19854 9014 1 9 . 1 1 190 190 ASP CB C 190 41.695 41.695 39.462 2.233 19854 9015 1 9 . 1 1 190 190 ASP H H 190 7.210 7.210 8.621 -1.411 19854 9016 1 9 . 1 1 191 191 PRO C C 191 176.566 176.566 177.539 -0.973 19854 9017 1 9 . 1 1 191 191 PRO CA C 191 63.965 63.965 64.639 -0.674 19854 9018 1 9 . 1 1 191 191 PRO CB C 191 31.146 31.146 31.843 -0.697 19854 9019 1 9 . 1 1 192 192 ALA N N 192 109.513 109.513 121.116 -11.603 19854 9020 1 9 . 1 1 192 192 ALA CA C 192 53.993 53.993 53.423 0.570 19854 9021 1 9 . 1 1 192 192 ALA CB C 192 19.441 19.441 18.559 0.882 19854 9022 1 9 . 1 1 192 192 ALA H H 192 7.394 7.394 8.361 -0.967 19854 9023 1 9 . 1 1 193 193 LEU N N 193 119.009 119.009 118.229 0.780 19854 9024 1 9 . 1 1 193 193 LEU C C 193 175.979 175.979 176.548 -0.569 19854 9025 1 9 . 1 1 193 193 LEU CA C 193 56.336 56.336 55.621 0.715 19854 9026 1 9 . 1 1 193 193 LEU CB C 193 42.866 42.866 41.938 0.928 19854 9027 1 9 . 1 1 193 193 LEU H H 193 8.340 8.340 7.855 0.485 19854 9028 1 9 . 1 1 194 194 ALA N N 194 121.666 121.666 118.200 3.466 19854 9029 1 9 . 1 1 194 194 ALA C C 194 166.896 166.896 177.677 -10.781 19854 9030 1 9 . 1 1 194 194 ALA CA C 194 55.164 55.164 51.969 3.195 19854 9031 1 9 . 1 1 194 194 ALA CB C 194 16.513 16.513 19.268 -2.755 19854 9032 1 9 . 1 1 194 194 ALA H H 194 8.176 8.176 7.271 0.905 19854 9033 1 9 . 1 1 195 195 ALA N N 195 119.541 119.541 119.580 -0.039 19854 9034 1 9 . 1 1 195 195 ALA C C 195 173.928 173.928 178.825 -4.897 19854 9035 1 9 . 1 1 195 195 ALA CA C 195 57.507 57.507 54.330 3.177 19854 9036 1 9 . 1 1 195 195 ALA CB C 195 19.441 19.441 16.915 2.526 19854 9037 1 9 . 1 1 195 195 ALA H H 195 8.364 8.364 8.877 -0.513 19854 9038 1 9 . 1 1 196 196 GLN N N 196 107.322 107.322 118.929 -11.607 19854 9039 1 9 . 1 1 196 196 GLN C C 196 176.273 176.273 178.089 -1.816 19854 9040 1 9 . 1 1 196 196 GLN CA C 196 56.921 56.921 58.969 -2.048 19854 9041 1 9 . 1 1 196 196 GLN CB C 196 29.983 29.983 28.806 1.177 19854 9042 1 9 . 1 1 196 196 GLN H H 196 7.910 7.910 7.636 0.274 19854 9043 1 9 . 1 1 197 197 TYR N N 197 119.277 119.277 118.165 1.112 19854 9044 1 9 . 1 1 197 197 TYR C C 197 178.316 178.316 178.712 -0.396 19854 9045 1 9 . 1 1 197 197 TYR CA C 197 56.343 56.343 59.525 -3.182 19854 9046 1 9 . 1 1 197 197 TYR CB C 197 43.453 43.453 37.542 5.911 19854 9047 1 9 . 1 1 197 197 TYR H H 197 8.180 8.180 7.881 0.299 19854 9048 1 9 . 1 1 198 198 GLU N N 198 110.244 110.244 118.936 -8.692 19854 9049 1 9 . 1 1 198 198 GLU C C 198 176.273 176.273 178.439 -2.166 19854 9050 1 9 . 1 1 198 198 GLU CA C 198 53.407 53.407 59.731 -6.324 19854 9051 1 9 . 1 1 198 198 GLU CB C 198 30.568 30.568 29.275 1.293 19854 9052 1 9 . 1 1 198 198 GLU H H 198 7.523 7.523 8.428 -0.905 19854 9053 1 9 . 1 1 199 199 HIS N N 199 119.211 119.211 119.812 -0.601 19854 9054 1 9 . 1 1 199 199 HIS C C 199 178.902 178.902 177.412 1.490 19854 9055 1 9 . 1 1 199 199 HIS CA C 199 58.687 58.687 59.942 -1.255 19854 9056 1 9 . 1 1 199 199 HIS CB C 199 34.957 34.957 29.838 5.119 19854 9057 1 9 . 1 1 199 199 HIS H H 199 8.258 8.258 8.335 -0.077 19854 9058 1 9 . 1 1 200 200 ASP N N 200 124.722 124.722 119.942 4.780 19854 9059 1 9 . 1 1 200 200 ASP C C 200 176.705 176.705 178.797 -2.092 19854 9060 1 9 . 1 1 200 200 ASP CA C 200 58.687 58.687 57.416 1.271 19854 9061 1 9 . 1 1 200 200 ASP CB C 200 39.644 39.644 40.536 -0.892 19854 9062 1 9 . 1 1 200 200 ASP H H 200 8.086 8.086 8.049 0.037 19854 9063 1 9 . 1 1 201 201 LEU N N 201 116.353 116.353 120.381 -4.028 19854 9064 1 9 . 1 1 201 201 LEU C C 201 178.910 178.910 179.259 -0.349 19854 9065 1 9 . 1 1 201 201 LEU CA C 201 61.606 61.606 58.174 3.432 19854 9066 1 9 . 1 1 201 201 LEU CB C 201 41.109 41.109 41.837 -0.728 19854 9067 1 9 . 1 1 201 201 LEU H H 201 7.722 7.722 7.895 -0.173 19854 9068 1 9 . 1 1 202 202 GLU N N 202 118.080 118.080 118.899 -0.819 19854 9069 1 9 . 1 1 202 202 GLU C C 202 176.566 176.566 179.344 -2.778 19854 9070 1 9 . 1 1 202 202 GLU CA C 202 56.921 56.921 59.223 -2.302 19854 9071 1 9 . 1 1 202 202 GLU CB C 202 30.568 30.568 29.225 1.343 19854 9072 1 9 . 1 1 202 202 GLU H H 202 8.857 8.857 8.276 0.581 19854 9073 1 9 . 1 1 203 203 VAL N N 203 129.369 129.369 120.233 9.136 19854 9074 1 9 . 1 1 203 203 VAL C C 203 178.617 178.617 177.880 0.737 19854 9075 1 9 . 1 1 203 203 VAL CA C 203 64.534 64.534 66.486 -1.952 19854 9076 1 9 . 1 1 203 203 VAL CB C 203 27.640 27.640 31.000 -3.360 19854 9077 1 9 . 1 1 203 203 VAL H H 203 9.283 9.283 8.052 1.231 19854 9078 1 9 . 1 1 204 204 ALA N N 204 109.580 109.580 121.927 -12.347 19854 9079 1 9 . 1 1 204 204 ALA C C 204 176.859 176.859 178.897 -2.038 19854 9080 1 9 . 1 1 204 204 ALA CA C 204 54.579 54.579 54.918 -0.339 19854 9081 1 9 . 1 1 204 204 ALA CB C 204 18.270 18.270 18.395 -0.125 19854 9082 1 9 . 1 1 204 204 ALA H H 204 8.528 8.528 7.760 0.768 19854 9083 1 9 . 1 1 205 205 GLN N N 205 123.328 123.328 116.496 6.832 19854 9084 1 9 . 1 1 205 205 GLN C C 205 177.418 177.418 177.679 -0.261 19854 9085 1 9 . 1 1 205 205 GLN CA C 205 57.515 57.515 58.063 -0.548 19854 9086 1 9 . 1 1 205 205 GLN CB C 205 33.785 33.785 29.205 4.580 19854 9087 1 9 . 1 1 205 205 GLN H H 205 8.160 8.160 7.841 0.319 19854 9088 1 9 . 1 1 206 206 THR N N 206 120.271 120.271 113.891 6.380 19854 9089 1 9 . 1 1 206 206 THR C C 206 176.273 176.273 175.371 0.902 19854 9090 1 9 . 1 1 206 206 THR CA C 206 67.462 67.462 64.698 2.764 19854 9091 1 9 . 1 1 206 206 THR CB C 206 70.390 70.390 69.098 1.292 19854 9092 1 9 . 1 1 206 206 THR H H 206 7.585 7.585 7.963 -0.378 19854 9093 1 9 . 1 1 207 207 THR N N 207 111.970 111.970 118.968 -6.998 19854 9094 1 9 . 1 1 207 207 THR C C 207 176.566 176.566 174.018 2.548 19854 9095 1 9 . 1 1 207 207 THR CA C 207 64.534 64.534 63.651 0.883 19854 9096 1 9 . 1 1 207 207 THR CB C 207 72.733 72.733 69.518 3.215 19854 9097 1 9 . 1 1 207 207 THR H H 207 7.468 7.468 7.590 -0.122 19854 9098 1 9 . 1 1 208 208 ALA N N 208 115.623 115.623 129.822 -14.199 19854 9099 1 9 . 1 1 208 208 ALA C C 208 168.947 168.947 176.836 -7.889 19854 9100 1 9 . 1 1 208 208 ALA CA C 208 55.164 55.164 52.305 2.859 19854 9101 1 9 . 1 1 208 208 ALA CB C 208 22.369 22.369 19.663 2.706 19854 9102 1 9 . 1 1 208 208 ALA H H 208 7.390 7.390 8.210 -0.820 19854 9103 1 9 . 1 1 209 209 LEU N N 209 117.814 117.814 123.894 -6.080 19854 9104 1 9 . 1 1 209 209 LEU C C 209 176.273 176.273 175.413 0.860 19854 9105 1 9 . 1 1 209 209 LEU CA C 209 58.678 58.678 52.961 5.717 19854 9106 1 9 . 1 1 209 209 LEU CB C 209 46.380 46.380 42.766 3.614 19854 9107 1 9 . 1 1 209 209 LEU H H 209 7.652 7.652 8.405 -0.753 19854 9108 1 9 . 1 1 210 210 PRO C C 210 176.566 176.566 175.739 0.827 19854 9109 1 9 . 1 1 210 210 PRO CA C 210 63.086 63.086 62.244 0.842 19854 9110 1 9 . 1 1 210 210 PRO CB C 210 31.146 31.146 32.676 -1.530 19854 9111 1 9 . 1 1 211 211 ASP N N 211 122.863 122.863 119.951 2.912 19854 9112 1 9 . 1 1 211 211 ASP C C 211 175.686 175.686 175.611 0.075 19854 9113 1 9 . 1 1 211 211 ASP CA C 211 56.343 56.343 53.933 2.410 19854 9114 1 9 . 1 1 211 211 ASP CB C 211 41.402 41.402 40.648 0.754 19854 9115 1 9 . 1 1 211 211 ASP H H 211 8.360 8.360 8.301 0.059 19854 9116 1 9 . 1 1 212 212 GLU N N 212 131.162 131.162 125.325 5.837 19854 9117 1 9 . 1 1 212 212 GLU C C 212 176.273 176.273 176.440 -0.167 19854 9118 1 9 . 1 1 212 212 GLU CA C 212 55.164 55.164 57.156 -1.992 19854 9119 1 9 . 1 1 212 212 GLU CB C 212 30.568 30.568 31.328 -0.760 19854 9120 1 9 . 1 1 212 212 GLU H H 212 8.399 8.399 8.437 -0.038 19854 9121 1 9 . 1 1 213 213 ASP N N 213 122.797 122.797 116.635 6.162 19854 9122 1 9 . 1 1 213 213 ASP C C 213 177.152 177.152 177.241 -0.089 19854 9123 1 9 . 1 1 213 213 ASP CA C 213 61.914 61.914 53.328 8.586 19854 9124 1 9 . 1 1 213 213 ASP CB C 213 49.607 49.607 41.223 8.384 19854 9125 1 9 . 1 1 213 213 ASP H H 213 8.168 8.168 8.469 -0.301 19854 9126 1 9 . 1 1 214 214 ASP N N 214 112.369 112.369 121.692 -9.323 19854 9127 1 9 . 1 1 214 214 ASP C C 214 178.910 178.910 177.163 1.747 19854 9128 1 9 . 1 1 214 214 ASP CA C 214 54.579 54.579 56.879 -2.300 19854 9129 1 9 . 1 1 214 214 ASP CB C 214 39.353 39.353 40.259 -0.906 19854 9130 1 9 . 1 1 214 214 ASP H H 214 7.464 7.464 8.142 -0.677 19854 9131 1 9 . 1 1 215 215 ASP N N 215 127.244 127.244 118.800 8.444 19854 9132 1 9 . 1 1 215 215 ASP C C 215 176.859 176.859 177.194 -0.335 19854 9133 1 9 . 1 1 215 215 ASP CA C 215 54.579 54.579 55.868 -1.289 19854 9134 1 9 . 1 1 215 215 ASP CB C 215 40.524 40.524 40.801 -0.277 19854 9135 1 9 . 1 1 215 215 ASP H H 215 8.301 8.301 8.317 -0.016 19854 9136 1 10 . 1 1 2 2 ALA N N 2 131.228 131.228 123.344 7.884 19854 9137 1 10 . 1 1 2 2 ALA C C 2 187.031 187.031 179.644 7.387 19854 9138 1 10 . 1 1 2 2 ALA CA C 2 53.407 53.407 55.208 -1.801 19854 9139 1 10 . 1 1 2 2 ALA CB C 2 20.027 20.027 18.023 2.004 19854 9140 1 10 . 1 1 2 2 ALA H H 2 10.644 10.644 8.403 2.241 19854 9141 1 10 . 1 1 3 3 ALA N N 3 124.521 124.521 121.524 2.997 19854 9142 1 10 . 1 1 3 3 ALA C C 3 176.566 176.566 178.723 -2.157 19854 9143 1 10 . 1 1 3 3 ALA CA C 3 49.894 49.894 54.573 -4.679 19854 9144 1 10 . 1 1 3 3 ALA CB C 3 18.270 18.270 17.976 0.294 19854 9145 1 10 . 1 1 3 3 ALA H H 3 8.669 8.669 8.405 0.264 19854 9146 1 10 . 1 1 4 4 GLN N N 4 118.080 118.080 116.939 1.141 19854 9147 1 10 . 1 1 4 4 GLN C C 4 176.273 176.273 176.828 -0.555 19854 9148 1 10 . 1 1 4 4 GLN CA C 4 54.579 54.579 56.771 -2.192 19854 9149 1 10 . 1 1 4 4 GLN CB C 4 27.054 27.054 29.103 -2.049 19854 9150 1 10 . 1 1 4 4 GLN H H 4 8.919 8.919 8.221 0.698 19854 9151 1 10 . 1 1 5 5 GLY N N 5 121.002 121.002 106.197 14.805 19854 9152 1 10 . 1 1 5 5 GLY C C 5 181.877 181.877 173.765 8.112 19854 9153 1 10 . 1 1 5 5 GLY CA C 5 45.794 45.794 44.935 0.859 19854 9154 1 10 . 1 1 5 5 GLY H H 5 8.082 8.082 7.962 0.120 19854 9155 1 10 . 1 1 6 6 GLU N N 6 129.435 129.435 122.478 6.957 19854 9156 1 10 . 1 1 6 6 GLU C C 6 176.566 176.566 175.542 1.024 19854 9157 1 10 . 1 1 6 6 GLU CA C 6 56.336 56.336 53.160 3.176 19854 9158 1 10 . 1 1 6 6 GLU CB C 6 28.811 28.811 30.448 -1.637 19854 9159 1 10 . 1 1 6 6 GLU H H 6 9.267 9.267 7.956 1.311 19854 9160 1 10 . 1 1 7 7 PRO C C 7 176.566 176.566 177.053 -0.487 19854 9161 1 10 . 1 1 7 7 PRO CA C 7 63.672 63.672 64.913 -1.241 19854 9162 1 10 . 1 1 7 7 PRO CB C 7 31.146 31.146 32.331 -1.185 19854 9163 1 10 . 1 1 8 8 GLN N N 8 112.502 112.502 114.266 -1.764 19854 9164 1 10 . 1 1 8 8 GLN C C 8 177.445 177.445 175.319 2.126 19854 9165 1 10 . 1 1 8 8 GLN CA C 8 50.479 50.479 56.103 -5.624 19854 9166 1 10 . 1 1 8 8 GLN CB C 8 28.811 28.811 31.529 -2.718 19854 9167 1 10 . 1 1 8 8 GLN H H 8 6.220 6.220 8.188 -1.968 19854 9168 1 10 . 1 1 9 9 VAL N N 9 117.416 117.416 118.298 -0.882 19854 9169 1 10 . 1 1 9 9 VAL C C 9 178.324 178.324 173.663 4.661 19854 9170 1 10 . 1 1 9 9 VAL CA C 9 63.363 63.363 60.763 2.600 19854 9171 1 10 . 1 1 9 9 VAL CB C 9 34.668 34.668 35.176 -0.508 19854 9172 1 10 . 1 1 9 9 VAL H H 9 6.561 6.561 7.715 -1.154 19854 9173 1 10 . 1 1 10 10 GLN N N 10 113.896 113.896 123.243 -9.347 19854 9174 1 10 . 1 1 10 10 GLN C C 10 176.273 176.273 174.520 1.753 19854 9175 1 10 . 1 1 10 10 GLN CA C 10 55.164 55.164 53.927 1.237 19854 9176 1 10 . 1 1 10 10 GLN CB C 10 28.226 28.226 32.166 -3.940 19854 9177 1 10 . 1 1 10 10 GLN H H 10 7.847 7.847 8.078 -0.231 19854 9178 1 10 . 1 1 11 11 PHE N N 11 118.744 118.744 124.835 -6.091 19854 9179 1 10 . 1 1 11 11 PHE C C 11 176.566 176.566 174.772 1.794 19854 9180 1 10 . 1 1 11 11 PHE CA C 11 59.849 59.849 56.428 3.421 19854 9181 1 10 . 1 1 11 11 PHE CB C 11 41.109 41.109 42.243 -1.134 19854 9182 1 10 . 1 1 11 11 PHE H H 11 8.262 8.262 8.956 -0.694 19854 9183 1 10 . 1 1 12 12 LYS N N 12 129.437 129.437 125.302 4.135 19854 9184 1 10 . 1 1 12 12 LYS C C 12 178.609 178.609 174.820 3.789 19854 9185 1 10 . 1 1 12 12 LYS CA C 12 57.808 57.808 55.515 2.293 19854 9186 1 10 . 1 1 12 12 LYS H H 12 10.015 10.015 8.729 1.286 19854 9187 1 10 . 1 1 13 13 LEU N N 13 112.103 112.103 129.373 -17.270 19854 9188 1 10 . 1 1 13 13 LEU C C 13 177.738 177.738 174.596 3.142 19854 9189 1 10 . 1 1 13 13 LEU CA C 13 54.579 54.579 53.412 1.167 19854 9190 1 10 . 1 1 13 13 LEU CB C 13 42.866 42.866 45.910 -3.044 19854 9191 1 10 . 1 1 13 13 LEU H H 13 6.905 6.905 8.904 -1.999 19854 9192 1 10 . 1 1 14 14 VAL N N 14 127.310 127.310 126.768 0.542 19854 9193 1 10 . 1 1 14 14 VAL C C 14 175.393 175.393 174.146 1.247 19854 9194 1 10 . 1 1 14 14 VAL CA C 14 70.976 70.976 61.677 9.299 19854 9195 1 10 . 1 1 14 14 VAL CB C 14 28.811 28.811 33.382 -4.571 19854 9196 1 10 . 1 1 14 14 VAL H H 14 8.305 8.305 8.837 -0.532 19854 9197 1 10 . 1 1 15 15 LEU N N 15 128.640 128.640 131.038 -2.398 19854 9198 1 10 . 1 1 15 15 LEU C C 15 177.730 177.730 175.116 2.614 19854 9199 1 10 . 1 1 15 15 LEU CA C 15 55.758 55.758 53.191 2.567 19854 9200 1 10 . 1 1 15 15 LEU H H 15 7.718 7.718 9.054 -1.336 19854 9201 1 10 . 1 1 16 16 VAL N N 16 121.267 121.267 121.619 -0.352 19854 9202 1 10 . 1 1 16 16 VAL C C 16 178.324 178.324 174.318 4.006 19854 9203 1 10 . 1 1 16 16 VAL CA C 16 63.363 63.363 58.607 4.756 19854 9204 1 10 . 1 1 16 16 VAL CB C 16 35.839 35.839 35.099 0.740 19854 9205 1 10 . 1 1 16 16 VAL H H 16 8.935 8.935 8.824 0.111 19854 9206 1 10 . 1 1 17 17 GLY N N 17 127.908 127.908 106.812 21.096 19854 9207 1 10 . 1 1 17 17 GLY C C 17 174.514 174.514 173.152 1.362 19854 9208 1 10 . 1 1 17 17 GLY CA C 17 42.281 42.281 44.727 -2.446 19854 9209 1 10 . 1 1 17 17 GLY H H 17 9.682 9.682 6.879 2.803 19854 9210 1 10 . 1 1 18 18 ASP N N 18 125.054 125.054 121.079 3.975 19854 9211 1 10 . 1 1 18 18 ASP C C 18 176.851 176.851 177.690 -0.839 19854 9212 1 10 . 1 1 18 18 ASP CA C 18 57.515 57.515 54.335 3.180 19854 9213 1 10 . 1 1 18 18 ASP CB C 18 46.090 46.090 41.997 4.093 19854 9214 1 10 . 1 1 18 18 ASP H H 18 8.282 8.282 8.427 -0.145 19854 9215 1 10 . 1 1 19 19 GLY N N 19 120.670 120.670 105.941 14.729 19854 9216 1 10 . 1 1 19 19 GLY C C 19 178.324 178.324 174.590 3.734 19854 9217 1 10 . 1 1 19 19 GLY CA C 19 42.281 42.281 45.331 -3.050 19854 9218 1 10 . 1 1 19 19 GLY H H 19 8.825 8.825 8.736 0.089 19854 9219 1 10 . 1 1 20 20 GLY N N 20 129.369 129.369 113.354 16.015 19854 9220 1 10 . 1 1 20 20 GLY C C 20 174.221 174.221 175.920 -1.699 19854 9221 1 10 . 1 1 20 20 GLY CA C 20 41.695 41.695 45.357 -3.662 19854 9222 1 10 . 1 1 20 20 GLY H H 20 8.477 8.477 7.889 0.588 19854 9223 1 10 . 1 1 21 21 THR N N 21 122.199 122.199 116.848 5.351 19854 9224 1 10 . 1 1 21 21 THR C C 21 171.291 171.291 175.009 -3.718 19854 9225 1 10 . 1 1 21 21 THR CA C 21 61.914 61.914 66.328 -4.414 19854 9226 1 10 . 1 1 21 21 THR CB C 21 65.137 65.137 69.324 -4.187 19854 9227 1 10 . 1 1 21 21 THR H H 21 8.059 8.059 7.519 0.540 19854 9228 1 10 . 1 1 22 22 GLY N N 22 112.369 112.369 106.144 6.225 19854 9229 1 10 . 1 1 22 22 GLY C C 22 184.807 184.807 175.225 9.582 19854 9230 1 10 . 1 1 22 22 GLY CA C 22 45.209 45.209 45.292 -0.083 19854 9231 1 10 . 1 1 22 22 GLY H H 22 6.772 6.772 8.415 -1.643 19854 9232 1 10 . 1 1 23 23 LYS N N 23 122.066 122.066 120.364 1.702 19854 9233 1 10 . 1 1 23 23 LYS C C 23 178.589 178.589 177.976 0.613 19854 9234 1 10 . 1 1 23 23 LYS CA C 23 58.101 58.101 59.061 -0.960 19854 9235 1 10 . 1 1 23 23 LYS CB C 23 40.230 40.230 31.914 8.316 19854 9236 1 10 . 1 1 23 23 LYS H H 23 7.441 7.441 8.381 -0.940 19854 9237 1 10 . 1 1 24 24 THR N N 24 114.627 114.627 115.098 -0.471 19854 9238 1 10 . 1 1 24 24 THR C C 24 178.324 178.324 176.705 1.619 19854 9239 1 10 . 1 1 24 24 THR CA C 24 62.192 62.192 67.156 -4.964 19854 9240 1 10 . 1 1 24 24 THR CB C 24 71.562 71.562 68.185 3.377 19854 9241 1 10 . 1 1 24 24 THR H H 24 8.469 8.469 8.513 -0.044 19854 9242 1 10 . 1 1 25 25 THR N N 25 110.377 110.377 119.338 -8.961 19854 9243 1 10 . 1 1 25 25 THR C C 25 178.324 178.324 176.204 2.120 19854 9244 1 10 . 1 1 25 25 THR CA C 25 64.534 64.534 67.576 -3.042 19854 9245 1 10 . 1 1 25 25 THR CB C 25 71.562 71.562 68.525 3.037 19854 9246 1 10 . 1 1 25 25 THR H H 25 8.415 8.415 8.236 0.179 19854 9247 1 10 . 1 1 26 26 PHE N N 26 114.295 114.295 123.181 -8.886 19854 9248 1 10 . 1 1 26 26 PHE C C 26 174.514 174.514 177.189 -2.675 19854 9249 1 10 . 1 1 26 26 PHE CA C 26 53.407 53.407 62.170 -8.763 19854 9250 1 10 . 1 1 26 26 PHE CB C 26 40.524 40.524 38.944 1.580 19854 9251 1 10 . 1 1 26 26 PHE H H 26 7.707 7.707 8.575 -0.868 19854 9252 1 10 . 1 1 27 27 VAL N N 27 123.525 123.525 120.978 2.547 19854 9253 1 10 . 1 1 27 27 VAL C C 27 178.031 178.031 177.872 0.159 19854 9254 1 10 . 1 1 27 27 VAL CA C 27 67.462 67.462 66.802 0.660 19854 9255 1 10 . 1 1 27 27 VAL CB C 27 29.397 29.397 31.572 -2.175 19854 9256 1 10 . 1 1 27 27 VAL H H 27 6.967 6.967 8.363 -1.395 19854 9257 1 10 . 1 1 28 28 LYS N N 28 114.228 114.228 119.784 -5.556 19854 9258 1 10 . 1 1 28 28 LYS C C 28 176.566 176.566 178.642 -2.076 19854 9259 1 10 . 1 1 28 28 LYS CA C 28 58.092 58.092 59.992 -1.900 19854 9260 1 10 . 1 1 28 28 LYS CB C 28 34.082 34.082 31.997 2.084 19854 9261 1 10 . 1 1 28 28 LYS H H 28 7.429 7.429 8.227 -0.798 19854 9262 1 10 . 1 1 29 29 ARG N N 29 112.037 112.037 120.019 -7.982 19854 9263 1 10 . 1 1 29 29 ARG C C 29 174.221 174.221 179.320 -5.099 19854 9264 1 10 . 1 1 29 29 ARG CA C 29 72.147 72.147 59.210 12.937 19854 9265 1 10 . 1 1 29 29 ARG CB C 29 37.596 37.596 30.003 7.593 19854 9266 1 10 . 1 1 29 29 ARG H H 29 6.803 6.803 8.236 -1.433 19854 9267 1 10 . 1 1 30 30 HIS N N 30 122.396 122.396 117.861 4.535 19854 9268 1 10 . 1 1 30 30 HIS C C 30 172.170 172.170 176.970 -4.800 19854 9269 1 10 . 1 1 30 30 HIS CA C 30 51.651 51.651 59.652 -8.001 19854 9270 1 10 . 1 1 30 30 HIS CB C 30 30.568 30.568 29.535 1.033 19854 9271 1 10 . 1 1 30 30 HIS H H 30 7.644 7.644 7.870 -0.226 19854 9272 1 10 . 1 1 31 31 LEU N N 31 110.377 110.377 117.915 -7.538 19854 9273 1 10 . 1 1 31 31 LEU C C 31 178.031 178.031 178.525 -0.494 19854 9274 1 10 . 1 1 31 31 LEU CA C 31 55.164 55.164 57.287 -2.123 19854 9275 1 10 . 1 1 31 31 LEU CB C 31 42.281 42.281 42.257 0.024 19854 9276 1 10 . 1 1 31 31 LEU H H 31 7.894 7.894 8.155 -0.261 19854 9277 1 10 . 1 1 32 32 THR N N 32 121.468 121.468 106.158 15.310 19854 9278 1 10 . 1 1 32 32 THR C C 32 170.705 170.705 175.569 -4.864 19854 9279 1 10 . 1 1 32 32 THR CA C 32 63.668 63.668 61.860 1.808 19854 9280 1 10 . 1 1 32 32 THR CB C 32 75.679 75.679 70.731 4.948 19854 9281 1 10 . 1 1 32 32 THR H H 32 8.372 8.372 8.285 0.087 19854 9282 1 10 . 1 1 33 33 GLY N N 33 127.841 127.841 110.152 17.689 19854 9283 1 10 . 1 1 33 33 GLY C C 33 161.914 161.914 173.990 -12.076 19854 9284 1 10 . 1 1 33 33 GLY CA C 33 42.866 42.866 44.795 -1.929 19854 9285 1 10 . 1 1 33 33 GLY H H 33 9.662 9.662 7.720 1.942 19854 9286 1 10 . 1 1 34 34 GLU N N 34 120.871 120.871 120.294 0.577 19854 9287 1 10 . 1 1 34 34 GLU C C 34 174.508 174.508 175.032 -0.524 19854 9288 1 10 . 1 1 34 34 GLU CA C 34 58.101 58.101 55.682 2.419 19854 9289 1 10 . 1 1 34 34 GLU CB C 34 34.371 34.371 30.757 3.614 19854 9290 1 10 . 1 1 34 34 GLU H H 34 8.211 8.211 7.498 0.713 19854 9291 1 10 . 1 1 35 35 PHE N N 35 111.838 111.838 119.240 -7.402 19854 9292 1 10 . 1 1 35 35 PHE C C 35 174.221 174.221 175.250 -1.029 19854 9293 1 10 . 1 1 35 35 PHE CA C 35 49.308 49.308 56.930 -7.622 19854 9294 1 10 . 1 1 35 35 PHE CB C 35 41.695 41.695 40.797 0.898 19854 9295 1 10 . 1 1 35 35 PHE H H 35 6.772 6.772 8.252 -1.480 19854 9296 1 10 . 1 1 36 36 GLU N N 36 120.672 120.672 125.554 -4.882 19854 9297 1 10 . 1 1 36 36 GLU C C 36 175.686 175.686 176.140 -0.454 19854 9298 1 10 . 1 1 36 36 GLU CA C 36 58.980 58.980 55.064 3.916 19854 9299 1 10 . 1 1 36 36 GLU CB C 36 48.140 48.140 30.743 17.397 19854 9300 1 10 . 1 1 36 36 GLU H H 36 8.293 8.293 8.774 -0.481 19854 9301 1 10 . 1 1 37 37 LYS N N 37 118.810 118.810 127.032 -8.222 19854 9302 1 10 . 1 1 37 37 LYS C C 37 172.756 172.756 177.609 -4.853 19854 9303 1 10 . 1 1 37 37 LYS CA C 37 48.137 48.137 57.992 -9.855 19854 9304 1 10 . 1 1 37 37 LYS CB C 37 37.010 37.010 33.083 3.927 19854 9305 1 10 . 1 1 37 37 LYS H H 37 8.509 8.509 8.553 -0.044 19854 9306 1 10 . 1 1 38 38 LYS N N 38 108.052 108.052 119.752 -11.700 19854 9307 1 10 . 1 1 38 38 LYS C C 38 176.273 176.273 175.727 0.546 19854 9308 1 10 . 1 1 38 38 LYS CA C 38 59.849 59.849 56.346 3.503 19854 9309 1 10 . 1 1 38 38 LYS CB C 38 34.668 34.668 33.020 1.648 19854 9310 1 10 . 1 1 38 38 LYS H H 38 7.715 7.715 7.953 -0.238 19854 9311 1 10 . 1 1 39 39 TYR N N 39 108.650 108.650 124.971 -16.321 19854 9312 1 10 . 1 1 39 39 TYR C C 39 175.686 175.686 174.992 0.694 19854 9313 1 10 . 1 1 39 39 TYR CA C 39 61.020 61.020 57.892 3.128 19854 9314 1 10 . 1 1 39 39 TYR CB C 39 36.424 36.424 39.102 -2.678 19854 9315 1 10 . 1 1 39 39 TYR H H 39 7.362 7.362 8.474 -1.112 19854 9316 1 10 . 1 1 40 40 VAL N N 40 117.947 117.947 128.836 -10.889 19854 9317 1 10 . 1 1 40 40 VAL C C 40 175.393 175.393 174.077 1.316 19854 9318 1 10 . 1 1 40 40 VAL CA C 40 61.020 61.020 60.225 0.795 19854 9319 1 10 . 1 1 40 40 VAL CB C 40 31.154 31.154 35.097 -3.943 19854 9320 1 10 . 1 1 40 40 VAL H H 40 8.442 8.442 7.946 0.496 19854 9321 1 10 . 1 1 42 42 THR N N 42 117.150 117.150 119.577 -2.427 19854 9322 1 10 . 1 1 42 42 THR C C 42 178.910 178.910 173.789 5.121 19854 9323 1 10 . 1 1 42 42 THR CA C 42 60.435 60.435 62.546 -2.111 19854 9324 1 10 . 1 1 42 42 THR CB C 42 70.390 70.390 69.564 0.826 19854 9325 1 10 . 1 1 42 42 THR H H 42 8.192 8.192 8.449 -0.257 19854 9326 1 10 . 1 1 43 43 LEU N N 43 119.209 119.209 127.461 -8.252 19854 9327 1 10 . 1 1 43 43 LEU C C 43 174.807 174.807 177.517 -2.710 19854 9328 1 10 . 1 1 43 43 LEU CA C 43 57.507 57.507 54.692 2.815 19854 9329 1 10 . 1 1 43 43 LEU CB C 43 42.866 42.866 42.930 -0.064 19854 9330 1 10 . 1 1 43 43 LEU H H 43 9.260 9.260 8.538 0.722 19854 9331 1 10 . 1 1 44 44 GLY N N 44 114.361 114.361 113.610 0.751 19854 9332 1 10 . 1 1 44 44 GLY C C 44 178.910 178.910 172.877 6.033 19854 9333 1 10 . 1 1 44 44 GLY CA C 44 54.579 54.579 45.884 8.695 19854 9334 1 10 . 1 1 44 44 GLY H H 44 6.979 6.979 8.649 -1.670 19854 9335 1 10 . 1 1 45 45 VAL N N 45 110.244 110.244 122.835 -12.591 19854 9336 1 10 . 1 1 45 45 VAL C C 45 174.807 174.807 175.101 -0.294 19854 9337 1 10 . 1 1 45 45 VAL CA C 45 63.363 63.363 60.802 2.561 19854 9338 1 10 . 1 1 45 45 VAL CB C 45 17.099 17.099 34.322 -17.223 19854 9339 1 10 . 1 1 45 45 VAL H H 45 8.309 8.309 7.943 0.366 19854 9340 1 10 . 1 1 46 46 GLU N N 46 130.365 130.365 127.785 2.580 19854 9341 1 10 . 1 1 46 46 GLU C C 46 176.859 176.859 174.615 2.244 19854 9342 1 10 . 1 1 46 46 GLU CA C 46 55.164 55.164 54.729 0.435 19854 9343 1 10 . 1 1 46 46 GLU CB C 46 32.325 32.325 32.244 0.081 19854 9344 1 10 . 1 1 46 46 GLU H H 46 9.741 9.741 8.883 0.858 19854 9345 1 10 . 1 1 47 47 VAL N N 47 125.254 125.254 124.953 0.301 19854 9346 1 10 . 1 1 47 47 VAL C C 47 175.661 175.661 175.699 -0.038 19854 9347 1 10 . 1 1 47 47 VAL CA C 47 63.375 63.375 61.801 1.574 19854 9348 1 10 . 1 1 47 47 VAL CB C 47 37.300 37.300 32.363 4.937 19854 9349 1 10 . 1 1 47 47 VAL H H 47 8.250 8.250 8.310 -0.060 19854 9350 1 10 . 1 1 48 48 HIS N N 48 129.236 129.236 127.248 1.988 19854 9351 1 10 . 1 1 48 48 HIS C C 48 169.240 169.240 173.020 -3.780 19854 9352 1 10 . 1 1 48 48 HIS CA C 48 49.894 49.894 53.435 -3.541 19854 9353 1 10 . 1 1 48 48 HIS CB C 48 27.640 27.640 32.187 -4.547 19854 9354 1 10 . 1 1 48 48 HIS H H 48 10.390 10.390 9.301 1.089 19854 9355 1 10 . 1 1 49 49 PRO C C 49 176.273 176.273 175.968 0.305 19854 9356 1 10 . 1 1 49 49 PRO CA C 49 62.500 62.500 62.837 -0.337 19854 9357 1 10 . 1 1 49 49 PRO CB C 49 29.974 29.974 32.378 -2.404 19854 9358 1 10 . 1 1 50 50 LEU N N 50 119.408 119.408 127.417 -8.009 19854 9359 1 10 . 1 1 50 50 LEU C C 50 177.445 177.445 175.463 1.982 19854 9360 1 10 . 1 1 50 50 LEU CA C 50 59.264 59.264 54.130 5.134 19854 9361 1 10 . 1 1 50 50 LEU CB C 50 42.281 42.281 45.314 -3.033 19854 9362 1 10 . 1 1 50 50 LEU H H 50 7.492 7.492 9.163 -1.671 19854 9363 1 10 . 1 1 51 51 VAL N N 51 117.947 117.947 122.435 -4.488 19854 9364 1 10 . 1 1 51 51 VAL C C 51 174.514 174.514 175.081 -0.567 19854 9365 1 10 . 1 1 51 51 VAL CA C 51 64.534 64.534 61.467 3.067 19854 9366 1 10 . 1 1 51 51 VAL CB C 51 37.010 37.010 33.132 3.878 19854 9367 1 10 . 1 1 51 51 VAL H H 51 7.715 7.715 8.188 -0.473 19854 9368 1 10 . 1 1 52 52 PHE N N 52 124.853 124.853 126.420 -1.567 19854 9369 1 10 . 1 1 52 52 PHE C C 52 175.100 175.100 174.282 0.818 19854 9370 1 10 . 1 1 52 52 PHE CA C 52 56.336 56.336 56.679 -0.344 19854 9371 1 10 . 1 1 52 52 PHE CB C 52 39.938 39.938 42.346 -2.409 19854 9372 1 10 . 1 1 52 52 PHE H H 52 8.935 8.935 9.269 -0.334 19854 9373 1 10 . 1 1 53 53 HIS N N 53 120.603 120.603 122.980 -2.377 19854 9374 1 10 . 1 1 53 53 HIS C C 53 170.119 170.119 175.062 -4.943 19854 9375 1 10 . 1 1 53 53 HIS CA C 53 55.164 55.164 55.261 -0.097 19854 9376 1 10 . 1 1 53 53 HIS CB C 53 30.568 30.568 30.718 -0.150 19854 9377 1 10 . 1 1 53 53 HIS H H 53 8.356 8.356 9.057 -0.701 19854 9378 1 10 . 1 1 54 54 THR N N 54 112.634 112.634 116.034 -3.400 19854 9379 1 10 . 1 1 54 54 THR C C 54 178.910 178.910 176.269 2.641 19854 9380 1 10 . 1 1 54 54 THR CA C 54 63.363 63.363 59.362 4.001 19854 9381 1 10 . 1 1 54 54 THR CB C 54 72.733 72.733 71.700 1.033 19854 9382 1 10 . 1 1 54 54 THR H H 54 7.574 7.574 8.371 -0.797 19854 9383 1 10 . 1 1 55 55 ASN N N 55 131.095 131.095 120.458 10.637 19854 9384 1 10 . 1 1 55 55 ASN C C 55 176.273 176.273 176.363 -0.090 19854 9385 1 10 . 1 1 55 55 ASN CA C 55 51.065 51.065 55.806 -4.741 19854 9386 1 10 . 1 1 55 55 ASN CB C 55 37.010 37.010 38.273 -1.263 19854 9387 1 10 . 1 1 55 55 ASN H H 55 10.187 10.187 8.616 1.571 19854 9388 1 10 . 1 1 56 56 ARG N N 56 122.064 122.064 118.763 3.301 19854 9389 1 10 . 1 1 56 56 ARG C C 56 175.100 175.100 176.142 -1.042 19854 9390 1 10 . 1 1 56 56 ARG CA C 56 61.606 61.606 55.217 6.389 19854 9391 1 10 . 1 1 56 56 ARG CB C 56 32.911 32.911 29.811 3.099 19854 9392 1 10 . 1 1 56 56 ARG H H 56 7.433 7.433 7.787 -0.354 19854 9393 1 10 . 1 1 57 57 GLY N N 57 127.709 127.709 107.921 19.788 19854 9394 1 10 . 1 1 57 57 GLY C C 57 175.979 175.979 171.975 4.004 19854 9395 1 10 . 1 1 57 57 GLY CA C 57 42.281 42.281 44.299 -2.018 19854 9396 1 10 . 1 1 57 57 GLY H H 57 9.373 9.373 7.653 1.720 19854 9397 1 10 . 1 1 58 58 PRO C C 58 177.152 177.152 175.788 1.364 19854 9398 1 10 . 1 1 58 58 PRO CA C 58 65.137 65.137 62.974 2.163 19854 9399 1 10 . 1 1 58 58 PRO CB C 58 29.095 29.095 32.087 -2.992 19854 9400 1 10 . 1 1 59 59 ILE N N 59 128.638 128.638 122.335 6.303 19854 9401 1 10 . 1 1 59 59 ILE C C 59 175.979 175.979 174.320 1.659 19854 9402 1 10 . 1 1 59 59 ILE CA C 59 65.120 65.120 58.994 6.126 19854 9403 1 10 . 1 1 59 59 ILE CB C 59 40.524 40.524 42.005 -1.481 19854 9404 1 10 . 1 1 59 59 ILE H H 59 8.794 8.794 9.017 -0.223 19854 9405 1 10 . 1 1 60 60 LYS N N 60 127.711 127.711 125.362 2.349 19854 9406 1 10 . 1 1 60 60 LYS C C 60 178.902 178.902 174.866 4.036 19854 9407 1 10 . 1 1 60 60 LYS CA C 60 74.293 74.293 54.290 20.003 19854 9408 1 10 . 1 1 60 60 LYS CB C 60 32.027 32.027 35.883 -3.856 19854 9409 1 10 . 1 1 60 60 LYS H H 60 8.024 8.024 8.643 -0.619 19854 9410 1 10 . 1 1 61 61 PHE N N 61 120.670 120.670 125.608 -4.938 19854 9411 1 10 . 1 1 61 61 PHE C C 61 175.393 175.393 175.032 0.361 19854 9412 1 10 . 1 1 61 61 PHE CA C 61 57.507 57.507 56.944 0.563 19854 9413 1 10 . 1 1 61 61 PHE CB C 61 41.109 41.109 40.984 0.125 19854 9414 1 10 . 1 1 61 61 PHE H H 61 7.515 7.515 9.608 -2.093 19854 9415 1 10 . 1 1 62 62 ASN N N 62 124.789 124.789 123.966 0.823 19854 9416 1 10 . 1 1 62 62 ASN C C 62 173.336 173.336 174.256 -0.920 19854 9417 1 10 . 1 1 62 62 ASN CA C 62 53.121 53.121 52.244 0.877 19854 9418 1 10 . 1 1 62 62 ASN CB C 62 41.695 41.695 39.468 2.227 19854 9419 1 10 . 1 1 62 62 ASN H H 62 8.325 8.325 9.130 -0.805 19854 9420 1 10 . 1 1 63 63 VAL N N 63 106.127 106.127 127.946 -21.819 19854 9421 1 10 . 1 1 63 63 VAL C C 63 175.100 175.100 175.395 -0.295 19854 9422 1 10 . 1 1 63 63 VAL CA C 63 61.020 61.020 62.595 -1.575 19854 9423 1 10 . 1 1 63 63 VAL CB C 63 31.154 31.154 32.894 -1.740 19854 9424 1 10 . 1 1 63 63 VAL H H 63 8.113 8.113 9.112 -0.999 19854 9425 1 10 . 1 1 64 64 TRP N N 64 129.302 129.302 129.779 -0.477 19854 9426 1 10 . 1 1 64 64 TRP C C 64 177.152 177.152 175.441 1.711 19854 9427 1 10 . 1 1 64 64 TRP CA C 64 59.264 59.264 54.202 5.062 19854 9428 1 10 . 1 1 64 64 TRP CB C 64 29.397 29.397 29.575 -0.178 19854 9429 1 10 . 1 1 64 64 TRP H H 64 8.970 8.970 9.517 -0.547 19854 9430 1 10 . 1 1 65 65 ASP N N 65 119.607 119.607 126.222 -6.615 19854 9431 1 10 . 1 1 65 65 ASP C C 65 174.514 174.514 175.813 -1.299 19854 9432 1 10 . 1 1 65 65 ASP CA C 65 55.164 55.164 53.163 2.001 19854 9433 1 10 . 1 1 65 65 ASP CB C 65 41.109 41.109 43.175 -2.066 19854 9434 1 10 . 1 1 65 65 ASP H H 65 8.638 8.638 9.186 -0.548 19854 9435 1 10 . 1 1 66 66 THR N N 66 122.463 122.463 117.805 4.658 19854 9436 1 10 . 1 1 66 66 THR C C 66 178.617 178.617 174.340 4.277 19854 9437 1 10 . 1 1 66 66 THR CA C 66 68.048 68.048 59.738 8.310 19854 9438 1 10 . 1 1 66 66 THR CB C 66 71.562 71.562 71.274 0.288 19854 9439 1 10 . 1 1 66 66 THR H H 66 8.293 8.293 8.462 -0.169 19854 9440 1 10 . 1 1 67 67 ALA N N 67 104.865 104.865 122.955 -18.090 19854 9441 1 10 . 1 1 67 67 ALA C C 67 177.738 177.738 177.439 0.299 19854 9442 1 10 . 1 1 67 67 ALA CA C 67 48.722 48.722 51.793 -3.071 19854 9443 1 10 . 1 1 67 67 ALA CB C 67 14.171 14.171 19.789 -5.618 19854 9444 1 10 . 1 1 67 67 ALA H H 67 8.657 8.657 7.981 0.676 19854 9445 1 10 . 1 1 68 68 GLY N N 68 115.357 115.357 109.691 5.666 19854 9446 1 10 . 1 1 68 68 GLY C C 68 189.533 189.533 176.069 13.464 19854 9447 1 10 . 1 1 68 68 GLY CA C 68 45.209 45.209 45.965 -0.756 19854 9448 1 10 . 1 1 68 68 GLY H H 68 10.969 10.969 8.950 2.019 19854 9449 1 10 . 1 1 69 69 GLN N N 69 122.730 122.730 119.857 2.873 19854 9450 1 10 . 1 1 69 69 GLN C C 69 174.508 174.508 176.352 -1.844 19854 9451 1 10 . 1 1 69 69 GLN CA C 69 58.394 58.394 57.709 0.685 19854 9452 1 10 . 1 1 69 69 GLN CB C 69 31.441 31.441 28.786 2.655 19854 9453 1 10 . 1 1 69 69 GLN H H 69 8.336 8.336 8.552 -0.216 19854 9454 1 10 . 1 1 70 70 GLU N N 70 114.826 114.826 119.954 -5.128 19854 9455 1 10 . 1 1 70 70 GLU C C 70 176.273 176.273 175.755 0.518 19854 9456 1 10 . 1 1 70 70 GLU CA C 70 57.507 57.507 56.288 1.219 19854 9457 1 10 . 1 1 70 70 GLU CB C 70 28.811 28.811 30.367 -1.556 19854 9458 1 10 . 1 1 70 70 GLU H H 70 9.651 9.651 8.270 1.381 19854 9459 1 10 . 1 1 71 71 LYS N N 71 116.685 116.685 122.432 -5.747 19854 9460 1 10 . 1 1 71 71 LYS C C 71 175.979 175.979 176.556 -0.577 19854 9461 1 10 . 1 1 71 71 LYS CA C 71 48.722 48.722 56.312 -7.590 19854 9462 1 10 . 1 1 71 71 LYS CB C 71 37.010 37.010 32.928 4.082 19854 9463 1 10 . 1 1 71 71 LYS H H 71 8.712 8.712 8.296 0.416 19854 9464 1 10 . 1 1 72 72 PHE N N 72 114.959 114.959 120.981 -6.022 19854 9465 1 10 . 1 1 72 72 PHE C C 72 175.686 175.686 176.740 -1.054 19854 9466 1 10 . 1 1 72 72 PHE CA C 72 56.336 56.336 59.084 -2.748 19854 9467 1 10 . 1 1 72 72 PHE CB C 72 36.424 36.424 38.865 -2.441 19854 9468 1 10 . 1 1 72 72 PHE H H 72 7.965 7.965 8.175 -0.210 19854 9469 1 10 . 1 1 73 73 GLY N N 73 117.084 117.084 111.939 5.145 19854 9470 1 10 . 1 1 73 73 GLY C C 73 168.068 168.068 174.691 -6.623 19854 9471 1 10 . 1 1 73 73 GLY CA C 73 42.281 42.281 44.945 -2.664 19854 9472 1 10 . 1 1 73 73 GLY H H 73 7.609 7.609 7.700 -0.091 19854 9473 1 10 . 1 1 74 74 GLY N N 74 120.537 120.537 108.278 12.259 19854 9474 1 10 . 1 1 74 74 GLY C C 74 174.514 174.514 176.536 -2.022 19854 9475 1 10 . 1 1 74 74 GLY CA C 74 44.037 44.037 46.401 -2.364 19854 9476 1 10 . 1 1 74 74 GLY H H 74 9.326 9.326 8.734 0.592 19854 9477 1 10 . 1 1 75 75 LEU N N 75 127.177 127.177 121.905 5.272 19854 9478 1 10 . 1 1 75 75 LEU C C 75 178.617 178.617 177.700 0.917 19854 9479 1 10 . 1 1 75 75 LEU CA C 75 53.407 53.407 56.876 -3.469 19854 9480 1 10 . 1 1 75 75 LEU CB C 75 42.281 42.281 41.963 0.318 19854 9481 1 10 . 1 1 75 75 LEU H H 75 7.628 7.628 7.731 -0.103 19854 9482 1 10 . 1 1 76 76 ARG N N 76 116.486 116.486 116.214 0.272 19854 9483 1 10 . 1 1 76 76 ARG C C 76 176.859 176.859 177.038 -0.179 19854 9484 1 10 . 1 1 76 76 ARG CA C 76 59.264 59.264 55.211 4.053 19854 9485 1 10 . 1 1 76 76 ARG CB C 76 31.154 31.154 29.181 1.973 19854 9486 1 10 . 1 1 76 76 ARG H H 76 7.143 7.143 7.521 -0.378 19854 9487 1 10 . 1 1 77 77 ASP N N 77 129.236 129.236 120.436 8.800 19854 9488 1 10 . 1 1 77 77 ASP C C 77 177.152 177.152 177.926 -0.774 19854 9489 1 10 . 1 1 77 77 ASP CA C 77 52.822 52.822 57.642 -4.820 19854 9490 1 10 . 1 1 77 77 ASP CB C 77 41.695 41.695 40.306 1.389 19854 9491 1 10 . 1 1 77 77 ASP H H 77 8.947 8.947 7.564 1.383 19854 9492 1 10 . 1 1 78 78 GLY N N 78 127.244 127.244 107.217 20.027 19854 9493 1 10 . 1 1 78 78 GLY C C 78 173.928 173.928 176.199 -2.271 19854 9494 1 10 . 1 1 78 78 GLY CA C 78 44.623 44.623 47.072 -2.449 19854 9495 1 10 . 1 1 78 78 GLY H H 78 8.219 8.219 8.404 -0.185 19854 9496 1 10 . 1 1 79 79 TYR N N 79 120.537 120.537 118.675 1.862 19854 9497 1 10 . 1 1 79 79 TYR C C 79 176.273 176.273 177.673 -1.400 19854 9498 1 10 . 1 1 79 79 TYR CA C 79 58.678 58.678 58.573 0.105 19854 9499 1 10 . 1 1 79 79 TYR CB C 79 40.524 40.524 38.213 2.311 19854 9500 1 10 . 1 1 79 79 TYR H H 79 8.563 8.563 7.528 1.035 19854 9501 1 10 . 1 1 80 80 TYR N N 80 122.132 122.132 118.513 3.619 19854 9502 1 10 . 1 1 80 80 TYR C C 80 175.979 175.979 175.802 0.177 19854 9503 1 10 . 1 1 80 80 TYR CA C 80 62.203 62.203 59.341 2.862 19854 9504 1 10 . 1 1 80 80 TYR CB C 80 41.988 41.988 39.055 2.933 19854 9505 1 10 . 1 1 80 80 TYR H H 80 8.254 8.254 7.686 0.568 19854 9506 1 10 . 1 1 81 81 ILE N N 81 120.072 120.072 120.802 -0.730 19854 9507 1 10 . 1 1 81 81 ILE C C 81 177.445 177.445 175.977 1.468 19854 9508 1 10 . 1 1 81 81 ILE CA C 81 67.462 67.462 63.362 4.100 19854 9509 1 10 . 1 1 81 81 ILE CB C 81 41.109 41.109 38.136 2.973 19854 9510 1 10 . 1 1 81 81 ILE H H 81 8.837 8.837 7.901 0.936 19854 9511 1 10 . 1 1 82 82 GLN N N 82 121.601 121.601 122.590 -0.989 19854 9512 1 10 . 1 1 82 82 GLN C C 82 173.342 173.342 174.131 -0.789 19854 9513 1 10 . 1 1 82 82 GLN CA C 82 59.859 59.859 56.557 3.302 19854 9514 1 10 . 1 1 82 82 GLN CB C 82 30.855 30.855 27.078 3.777 19854 9515 1 10 . 1 1 82 82 GLN H H 82 8.184 8.184 8.927 -0.743 19854 9516 1 10 . 1 1 83 83 ALA N N 83 109.713 109.713 119.491 -9.778 19854 9517 1 10 . 1 1 83 83 ALA C C 83 175.979 175.979 177.032 -1.053 19854 9518 1 10 . 1 1 83 83 ALA CA C 83 54.579 54.579 52.263 2.316 19854 9519 1 10 . 1 1 83 83 ALA CB C 83 16.513 16.513 19.186 -2.674 19854 9520 1 10 . 1 1 83 83 ALA H H 83 6.306 6.306 7.406 -1.100 19854 9521 1 10 . 1 1 84 84 GLN N N 84 121.203 121.203 121.481 -0.278 19854 9522 1 10 . 1 1 84 84 GLN C C 84 177.144 177.144 176.068 1.076 19854 9523 1 10 . 1 1 84 84 GLN CA C 84 60.152 60.152 56.617 3.535 19854 9524 1 10 . 1 1 84 84 GLN CB C 84 34.957 34.957 31.067 3.890 19854 9525 1 10 . 1 1 84 84 GLN H H 84 8.180 8.180 8.518 -0.338 19854 9526 1 10 . 1 1 85 85 CYS N N 85 120.605 120.605 111.788 8.817 19854 9527 1 10 . 1 1 85 85 CYS C C 85 176.566 176.566 172.678 3.888 19854 9528 1 10 . 1 1 85 85 CYS CA C 85 65.430 65.430 56.011 9.419 19854 9529 1 10 . 1 1 85 85 CYS CB C 85 39.644 39.644 31.758 7.886 19854 9530 1 10 . 1 1 85 85 CYS H H 85 8.364 8.364 7.802 0.562 19854 9531 1 10 . 1 1 86 86 ALA N N 86 114.295 114.295 121.962 -7.667 19854 9532 1 10 . 1 1 86 86 ALA CA C 86 57.507 57.507 50.573 6.934 19854 9533 1 10 . 1 1 86 86 ALA CB C 86 21.784 21.784 22.912 -1.128 19854 9534 1 10 . 1 1 86 86 ALA H H 86 6.897 6.897 8.735 -1.838 19854 9535 1 10 . 1 1 87 87 ILE N N 87 120.670 120.670 120.871 -0.201 19854 9536 1 10 . 1 1 87 87 ILE C C 87 173.928 173.928 174.652 -0.724 19854 9537 1 10 . 1 1 87 87 ILE CA C 87 61.020 61.020 59.946 1.074 19854 9538 1 10 . 1 1 87 87 ILE CB C 87 39.938 39.938 41.215 -1.276 19854 9539 1 10 . 1 1 87 87 ILE H H 87 8.282 8.282 8.611 -0.329 19854 9540 1 10 . 1 1 88 88 ILE N N 88 120.205 120.205 127.127 -6.922 19854 9541 1 10 . 1 1 88 88 ILE C C 88 173.635 173.635 174.356 -0.721 19854 9542 1 10 . 1 1 88 88 ILE CA C 88 64.534 64.534 60.168 4.366 19854 9543 1 10 . 1 1 88 88 ILE CB C 88 37.596 37.596 40.063 -2.467 19854 9544 1 10 . 1 1 88 88 ILE H H 88 5.528 5.528 8.958 -3.430 19854 9545 1 10 . 1 1 89 89 MET N N 89 120.472 120.472 127.702 -7.230 19854 9546 1 10 . 1 1 89 89 MET C C 89 178.617 178.617 174.263 4.354 19854 9547 1 10 . 1 1 89 89 MET CA C 89 58.980 58.980 53.843 5.137 19854 9548 1 10 . 1 1 89 89 MET CB C 89 34.957 34.957 35.935 -0.978 19854 9549 1 10 . 1 1 89 89 MET H H 89 8.176 8.176 8.531 -0.355 19854 9550 1 10 . 1 1 90 90 PHE N N 90 121.134 121.134 120.215 0.919 19854 9551 1 10 . 1 1 90 90 PHE C C 90 175.393 175.393 173.083 2.310 19854 9552 1 10 . 1 1 90 90 PHE CA C 90 60.435 60.435 55.357 5.078 19854 9553 1 10 . 1 1 90 90 PHE CB C 90 38.767 38.767 42.290 -3.523 19854 9554 1 10 . 1 1 90 90 PHE H H 90 9.334 9.334 8.765 0.569 19854 9555 1 10 . 1 1 91 91 ASP N N 91 120.273 120.273 121.410 -1.137 19854 9556 1 10 . 1 1 91 91 ASP C C 91 177.730 177.730 178.165 -0.435 19854 9557 1 10 . 1 1 91 91 ASP CA C 91 59.859 59.859 51.818 8.041 19854 9558 1 10 . 1 1 91 91 ASP CB C 91 44.039 44.039 42.706 1.333 19854 9559 1 10 . 1 1 91 91 ASP H H 91 7.597 7.597 8.876 -1.279 19854 9560 1 10 . 1 1 92 92 VAL N N 92 115.158 115.158 123.720 -8.562 19854 9561 1 10 . 1 1 92 92 VAL C C 92 173.342 173.342 176.644 -3.302 19854 9562 1 10 . 1 1 92 92 VAL CA C 92 64.534 64.534 65.031 -0.497 19854 9563 1 10 . 1 1 92 92 VAL CB C 92 37.596 37.596 31.361 6.235 19854 9564 1 10 . 1 1 92 92 VAL H H 92 7.738 7.738 8.505 -0.767 19854 9565 1 10 . 1 1 93 93 THR N N 93 127.179 127.179 110.241 16.938 19854 9566 1 10 . 1 1 93 93 THR C C 93 178.902 178.902 174.750 4.152 19854 9567 1 10 . 1 1 93 93 THR CA C 93 64.254 64.254 63.158 1.096 19854 9568 1 10 . 1 1 93 93 THR CB C 93 74.215 74.215 69.140 5.075 19854 9569 1 10 . 1 1 93 93 THR H H 93 7.636 7.636 8.237 -0.601 19854 9570 1 10 . 1 1 94 94 SER N N 94 122.263 122.263 116.460 5.803 19854 9571 1 10 . 1 1 94 94 SER C C 94 163.965 163.965 174.970 -11.005 19854 9572 1 10 . 1 1 94 94 SER CA C 94 59.849 59.849 55.502 4.347 19854 9573 1 10 . 1 1 94 94 SER CB C 94 62.192 62.192 64.151 -1.959 19854 9574 1 10 . 1 1 94 94 SER H H 94 7.628 7.628 7.843 -0.215 19854 9575 1 10 . 1 1 95 95 ARG N N 95 113.099 113.099 128.678 -15.579 19854 9576 1 10 . 1 1 95 95 ARG C C 95 176.273 176.273 177.910 -1.637 19854 9577 1 10 . 1 1 95 95 ARG CA C 95 53.407 53.407 59.639 -6.232 19854 9578 1 10 . 1 1 95 95 ARG CB C 95 31.154 31.154 30.034 1.120 19854 9579 1 10 . 1 1 95 95 ARG H H 95 8.102 8.102 9.081 -0.979 19854 9580 1 10 . 1 1 96 96 VAL N N 96 124.787 124.787 119.367 5.420 19854 9581 1 10 . 1 1 96 96 VAL C C 96 178.031 178.031 177.781 0.250 19854 9582 1 10 . 1 1 96 96 VAL CA C 96 68.634 68.634 66.465 2.169 19854 9583 1 10 . 1 1 96 96 VAL CB C 96 24.126 24.126 31.370 -7.245 19854 9584 1 10 . 1 1 96 96 VAL H H 96 9.146 9.146 8.069 1.077 19854 9585 1 10 . 1 1 97 97 THR N N 97 111.970 111.970 116.365 -4.395 19854 9586 1 10 . 1 1 97 97 THR C C 97 178.031 178.031 176.247 1.784 19854 9587 1 10 . 1 1 97 97 THR CA C 97 63.949 63.949 66.451 -2.502 19854 9588 1 10 . 1 1 97 97 THR CB C 97 70.390 70.390 68.974 1.416 19854 9589 1 10 . 1 1 97 97 THR H H 97 7.984 7.984 7.693 0.291 19854 9590 1 10 . 1 1 98 98 TYR N N 98 113.232 113.232 121.371 -8.139 19854 9591 1 10 . 1 1 98 98 TYR C C 98 176.273 176.273 177.660 -1.387 19854 9592 1 10 . 1 1 98 98 TYR H H 98 7.605 7.605 7.822 -0.217 19854 9593 1 10 . 1 1 99 99 LYS N N 99 123.726 123.726 118.786 4.940 19854 9594 1 10 . 1 1 99 99 LYS C C 99 178.316 178.316 178.506 -0.190 19854 9595 1 10 . 1 1 99 99 LYS CA C 99 58.691 58.691 59.431 -0.739 19854 9596 1 10 . 1 1 99 99 LYS CB C 99 36.127 36.127 32.051 4.076 19854 9597 1 10 . 1 1 99 99 LYS H H 99 8.360 8.360 8.055 0.305 19854 9598 1 10 . 1 1 100 100 ASN N N 100 111.970 111.970 116.244 -4.274 19854 9599 1 10 . 1 1 100 100 ASN C C 100 175.979 175.979 176.744 -0.765 19854 9600 1 10 . 1 1 100 100 ASN CA C 100 53.407 53.407 55.134 -1.727 19854 9601 1 10 . 1 1 100 100 ASN CB C 100 37.596 37.596 38.727 -1.131 19854 9602 1 10 . 1 1 100 100 ASN H H 100 5.778 5.778 7.762 -1.984 19854 9603 1 10 . 1 1 101 101 VAL N N 101 118.877 118.877 121.628 -2.751 19854 9604 1 10 . 1 1 101 101 VAL C C 101 173.635 173.635 175.005 -1.370 19854 9605 1 10 . 1 1 101 101 VAL CA C 101 62.777 62.777 68.458 -5.681 19854 9606 1 10 . 1 1 101 101 VAL CB C 101 27.054 27.054 29.246 -2.192 19854 9607 1 10 . 1 1 101 101 VAL H H 101 7.370 7.370 7.512 -0.142 19854 9608 1 10 . 1 1 102 102 PRO C C 102 176.566 176.566 177.186 -0.620 19854 9609 1 10 . 1 1 102 102 PRO CA C 102 62.500 62.500 65.351 -2.851 19854 9610 1 10 . 1 1 102 102 PRO CB C 102 30.853 30.853 31.066 -0.213 19854 9611 1 10 . 1 1 103 103 ASN N N 103 122.728 122.728 114.885 7.843 19854 9612 1 10 . 1 1 103 103 ASN C C 103 175.100 175.100 176.860 -1.760 19854 9613 1 10 . 1 1 103 103 ASN CA C 103 54.579 54.579 54.949 -0.370 19854 9614 1 10 . 1 1 103 103 ASN CB C 103 38.767 38.767 37.201 1.566 19854 9615 1 10 . 1 1 103 103 ASN H H 103 7.879 7.879 7.313 0.566 19854 9616 1 10 . 1 1 104 104 TRP N N 104 122.730 122.730 120.118 2.612 19854 9617 1 10 . 1 1 104 104 TRP C C 104 174.215 174.215 177.709 -3.494 19854 9618 1 10 . 1 1 104 104 TRP CA C 104 59.273 59.273 60.478 -1.205 19854 9619 1 10 . 1 1 104 104 TRP CB C 104 35.250 35.250 30.018 5.231 19854 9620 1 10 . 1 1 104 104 TRP H H 104 7.902 7.902 7.765 0.137 19854 9621 1 10 . 1 1 105 105 HIS N N 105 120.869 120.869 116.882 3.987 19854 9622 1 10 . 1 1 105 105 HIS C C 105 177.738 177.738 174.448 3.290 19854 9623 1 10 . 1 1 105 105 HIS H H 105 6.971 6.971 8.437 -1.466 19854 9624 1 10 . 1 1 106 106 ARG N N 106 126.314 126.314 122.059 4.255 19854 9625 1 10 . 1 1 106 106 ARG C C 106 176.566 176.566 176.609 -0.043 19854 9626 1 10 . 1 1 106 106 ARG CA C 106 62.777 62.777 57.476 5.301 19854 9627 1 10 . 1 1 106 106 ARG CB C 106 29.397 29.397 31.379 -1.982 19854 9628 1 10 . 1 1 106 106 ARG H H 106 7.507 7.507 7.835 -0.328 19854 9629 1 10 . 1 1 107 107 ASP N N 107 119.076 119.076 122.284 -3.208 19854 9630 1 10 . 1 1 107 107 ASP C C 107 176.566 176.566 178.693 -2.127 19854 9631 1 10 . 1 1 107 107 ASP CA C 107 55.164 55.164 57.585 -2.421 19854 9632 1 10 . 1 1 107 107 ASP CB C 107 41.695 41.695 40.730 0.965 19854 9633 1 10 . 1 1 107 107 ASP H H 107 9.076 9.076 7.880 1.196 19854 9634 1 10 . 1 1 108 108 LEU N N 108 113.299 113.299 120.238 -6.939 19854 9635 1 10 . 1 1 108 108 LEU C C 108 176.273 176.273 178.268 -1.995 19854 9636 1 10 . 1 1 108 108 LEU CA C 108 59.264 59.264 58.091 1.173 19854 9637 1 10 . 1 1 108 108 LEU CB C 108 48.722 48.722 41.264 7.457 19854 9638 1 10 . 1 1 108 108 LEU H H 108 6.725 6.725 7.900 -1.175 19854 9639 1 10 . 1 1 109 109 VAL N N 109 121.267 121.267 118.832 2.435 19854 9640 1 10 . 1 1 109 109 VAL C C 109 175.393 175.393 178.594 -3.201 19854 9641 1 10 . 1 1 109 109 VAL CA C 109 63.949 63.949 66.329 -2.380 19854 9642 1 10 . 1 1 109 109 VAL CB C 109 32.911 32.911 31.172 1.740 19854 9643 1 10 . 1 1 109 109 VAL H H 109 8.763 8.763 7.784 0.979 19854 9644 1 10 . 1 1 110 110 ARG N N 110 112.900 112.900 119.729 -6.829 19854 9645 1 10 . 1 1 110 110 ARG C C 110 176.273 176.273 178.433 -2.160 19854 9646 1 10 . 1 1 110 110 ARG CA C 110 57.507 57.507 59.516 -2.009 19854 9647 1 10 . 1 1 110 110 ARG CB C 110 30.568 30.568 30.085 0.483 19854 9648 1 10 . 1 1 110 110 ARG H H 110 7.241 7.241 7.802 -0.561 19854 9649 1 10 . 1 1 111 111 VAL N N 111 115.556 115.556 117.929 -2.373 19854 9650 1 10 . 1 1 111 111 VAL C C 111 177.445 177.445 177.037 0.408 19854 9651 1 10 . 1 1 111 111 VAL CA C 111 59.849 59.849 65.835 -5.987 19854 9652 1 10 . 1 1 111 111 VAL CB C 111 32.911 32.911 32.596 0.315 19854 9653 1 10 . 1 1 111 111 VAL H H 111 7.566 7.566 7.746 -0.180 19854 9654 1 10 . 1 1 112 112 CYS N N 112 114.295 114.295 115.425 -1.130 19854 9655 1 10 . 1 1 112 112 CYS C C 112 169.826 169.826 174.746 -4.920 19854 9656 1 10 . 1 1 112 112 CYS CA C 112 57.507 57.507 58.254 -0.747 19854 9657 1 10 . 1 1 112 112 CYS CB C 112 35.839 35.839 28.505 7.334 19854 9658 1 10 . 1 1 112 112 CYS H H 112 7.425 7.425 8.240 -0.815 19854 9659 1 10 . 1 1 113 113 GLU N N 113 116.486 116.486 118.025 -1.539 19854 9660 1 10 . 1 1 113 113 GLU C C 113 176.566 176.566 175.135 1.431 19854 9661 1 10 . 1 1 113 113 GLU CA C 113 69.219 69.219 58.277 10.942 19854 9662 1 10 . 1 1 113 113 GLU CB C 113 30.568 30.568 28.519 2.049 19854 9663 1 10 . 1 1 113 113 GLU H H 113 7.241 7.241 8.350 -1.109 19854 9664 1 10 . 1 1 114 114 ASN N N 114 129.302 129.302 121.443 7.859 19854 9665 1 10 . 1 1 114 114 ASN C C 114 175.100 175.100 174.634 0.466 19854 9666 1 10 . 1 1 114 114 ASN CA C 114 52.236 52.236 52.573 -0.337 19854 9667 1 10 . 1 1 114 114 ASN CB C 114 39.938 39.938 38.121 1.817 19854 9668 1 10 . 1 1 114 114 ASN H H 114 8.919 8.919 8.366 0.553 19854 9669 1 10 . 1 1 115 115 ILE N N 115 110.443 110.443 121.160 -10.717 19854 9670 1 10 . 1 1 115 115 ILE C C 115 175.100 175.100 173.441 1.659 19854 9671 1 10 . 1 1 115 115 ILE CA C 115 65.705 65.705 57.936 7.769 19854 9672 1 10 . 1 1 115 115 ILE CB C 115 39.353 39.353 40.131 -0.778 19854 9673 1 10 . 1 1 115 115 ILE H H 115 9.287 9.287 7.948 1.339 19854 9674 1 10 . 1 1 116 116 PRO C C 116 175.979 175.979 175.721 0.258 19854 9675 1 10 . 1 1 116 116 PRO CA C 116 63.086 63.086 63.169 -0.083 19854 9676 1 10 . 1 1 116 116 PRO CB C 116 29.681 29.681 32.530 -2.849 19854 9677 1 10 . 1 1 117 117 ILE N N 117 123.591 123.591 123.837 -0.246 19854 9678 1 10 . 1 1 117 117 ILE C C 117 174.807 174.807 175.075 -0.268 19854 9679 1 10 . 1 1 117 117 ILE CA C 117 66.291 66.291 60.265 6.026 19854 9680 1 10 . 1 1 117 117 ILE CB C 117 38.767 38.767 42.250 -3.483 19854 9681 1 10 . 1 1 117 117 ILE H H 117 7.781 7.781 8.545 -0.764 19854 9682 1 10 . 1 1 118 118 VAL N N 118 119.009 119.009 125.778 -6.769 19854 9683 1 10 . 1 1 118 118 VAL C C 118 178.324 178.324 174.756 3.568 19854 9684 1 10 . 1 1 118 118 VAL CA C 118 62.777 62.777 60.697 2.080 19854 9685 1 10 . 1 1 118 118 VAL CB C 118 31.154 31.154 34.034 -2.880 19854 9686 1 10 . 1 1 118 118 VAL H H 118 8.767 8.767 8.737 0.030 19854 9687 1 10 . 1 1 119 119 LEU N N 119 119.408 119.408 126.948 -7.540 19854 9688 1 10 . 1 1 119 119 LEU C C 119 178.031 178.031 176.050 1.981 19854 9689 1 10 . 1 1 119 119 LEU CA C 119 42.866 42.866 53.803 -10.937 19854 9690 1 10 . 1 1 119 119 LEU CB C 119 38.767 38.767 43.656 -4.889 19854 9691 1 10 . 1 1 119 119 LEU H H 119 7.734 7.734 9.189 -1.455 19854 9692 1 10 . 1 1 120 120 CYS N N 120 113.232 113.232 122.572 -9.340 19854 9693 1 10 . 1 1 120 120 CYS C C 120 178.031 178.031 174.242 3.789 19854 9694 1 10 . 1 1 120 120 CYS H H 120 8.317 8.317 9.079 -0.762 19854 9695 1 10 . 1 1 121 121 GLY N N 121 117.349 117.349 113.579 3.770 19854 9696 1 10 . 1 1 121 121 GLY C C 121 176.851 176.851 172.819 4.032 19854 9697 1 10 . 1 1 121 121 GLY CA C 121 41.109 41.109 43.658 -2.549 19854 9698 1 10 . 1 1 121 121 GLY H H 121 7.515 7.515 8.913 -1.398 19854 9699 1 10 . 1 1 122 122 ASN N N 122 125.318 125.318 123.807 1.511 19854 9700 1 10 . 1 1 122 122 ASN C C 122 175.686 175.686 175.773 -0.087 19854 9701 1 10 . 1 1 122 122 ASN CA C 122 50.479 50.479 49.977 0.502 19854 9702 1 10 . 1 1 122 122 ASN CB C 122 39.353 39.353 40.896 -1.543 19854 9703 1 10 . 1 1 122 122 ASN H H 122 9.162 9.162 8.598 0.564 19854 9704 1 10 . 1 1 123 123 LYS N N 123 122.132 122.132 114.111 8.021 19854 9705 1 10 . 1 1 123 123 LYS C C 123 173.043 173.043 177.109 -4.066 19854 9706 1 10 . 1 1 123 123 LYS CA C 123 58.101 58.101 57.514 0.587 19854 9707 1 10 . 1 1 123 123 LYS CB C 123 35.543 35.543 29.706 5.837 19854 9708 1 10 . 1 1 123 123 LYS H H 123 7.953 7.953 8.593 -0.640 19854 9709 1 10 . 1 1 124 124 VAL N N 124 123.726 123.726 112.832 10.894 19854 9710 1 10 . 1 1 124 124 VAL C C 124 175.679 175.679 176.317 -0.638 19854 9711 1 10 . 1 1 124 124 VAL CA C 124 64.840 64.840 64.608 0.232 19854 9712 1 10 . 1 1 124 124 VAL CB C 124 42.574 42.574 31.421 11.153 19854 9713 1 10 . 1 1 124 124 VAL H H 124 8.555 8.555 7.594 0.961 19854 9714 1 10 . 1 1 125 125 ASP N N 125 119.607 119.607 119.594 0.013 19854 9715 1 10 . 1 1 125 125 ASP C C 125 176.566 176.566 177.007 -0.441 19854 9716 1 10 . 1 1 125 125 ASP CA C 125 55.750 55.750 56.202 -0.452 19854 9717 1 10 . 1 1 125 125 ASP CB C 125 40.524 40.524 40.672 -0.148 19854 9718 1 10 . 1 1 125 125 ASP H H 125 7.875 7.875 8.183 -0.308 19854 9719 1 10 . 1 1 126 126 ILE N N 126 116.088 116.088 120.819 -4.731 19854 9720 1 10 . 1 1 126 126 ILE C C 126 177.152 177.152 176.347 0.805 19854 9721 1 10 . 1 1 126 126 ILE CA C 126 66.291 66.291 61.588 4.703 19854 9722 1 10 . 1 1 126 126 ILE CB C 126 39.353 39.353 38.563 0.790 19854 9723 1 10 . 1 1 126 126 ILE H H 126 7.511 7.511 7.413 0.098 19854 9724 1 10 . 1 1 127 127 LYS N N 127 121.203 121.203 124.445 -3.242 19854 9725 1 10 . 1 1 127 127 LYS C C 127 175.979 175.979 177.414 -1.435 19854 9726 1 10 . 1 1 127 127 LYS CA C 127 58.101 58.101 57.956 0.145 19854 9727 1 10 . 1 1 127 127 LYS CB C 127 35.834 35.834 32.607 3.227 19854 9728 1 10 . 1 1 127 127 LYS H H 127 8.113 8.113 8.317 -0.204 19854 9729 1 10 . 1 1 128 128 ASP N N 128 118.279 118.279 119.572 -1.293 19854 9730 1 10 . 1 1 128 128 ASP C C 128 176.566 176.566 174.952 1.614 19854 9731 1 10 . 1 1 128 128 ASP CA C 128 53.407 53.407 53.056 0.351 19854 9732 1 10 . 1 1 128 128 ASP CB C 128 40.524 40.524 39.778 0.746 19854 9733 1 10 . 1 1 128 128 ASP H H 128 7.241 7.241 8.094 -0.853 19854 9734 1 10 . 1 1 129 129 ARG N N 129 118.943 118.943 123.822 -4.879 19854 9735 1 10 . 1 1 129 129 ARG C C 129 177.738 177.738 176.295 1.443 19854 9736 1 10 . 1 1 129 129 ARG CA C 129 45.794 45.794 56.037 -10.243 19854 9737 1 10 . 1 1 129 129 ARG CB C 129 31.154 31.154 31.288 -0.134 19854 9738 1 10 . 1 1 129 129 ARG H H 129 8.423 8.423 7.920 0.503 19854 9739 1 10 . 1 1 130 130 LYS N N 130 109.381 109.381 124.923 -15.542 19854 9740 1 10 . 1 1 130 130 LYS C C 130 176.566 176.566 176.662 -0.096 19854 9741 1 10 . 1 1 130 130 LYS CA C 130 55.164 55.164 57.631 -2.467 19854 9742 1 10 . 1 1 130 130 LYS CB C 130 36.424 36.424 33.621 2.803 19854 9743 1 10 . 1 1 130 130 LYS H H 130 7.296 7.296 8.342 -1.046 19854 9744 1 10 . 1 1 131 131 VAL N N 131 110.377 110.377 121.942 -11.565 19854 9745 1 10 . 1 1 131 131 VAL C C 131 178.617 178.617 174.376 4.241 19854 9746 1 10 . 1 1 131 131 VAL CA C 131 65.705 65.705 61.574 4.131 19854 9747 1 10 . 1 1 131 131 VAL CB C 131 35.839 35.839 31.379 4.460 19854 9748 1 10 . 1 1 131 131 VAL H H 131 9.283 9.283 8.237 1.046 19854 9749 1 10 . 1 1 132 132 LYS N N 132 110.310 110.310 127.504 -17.194 19854 9750 1 10 . 1 1 132 132 LYS C C 132 176.273 176.273 177.524 -1.251 19854 9751 1 10 . 1 1 132 132 LYS CA C 132 59.849 59.849 55.922 3.927 19854 9752 1 10 . 1 1 132 132 LYS CB C 132 35.253 35.253 34.231 1.022 19854 9753 1 10 . 1 1 132 132 LYS H H 132 9.709 9.709 8.161 1.548 19854 9754 1 10 . 1 1 133 133 ALA N N 133 134.349 134.349 127.009 7.340 19854 9755 1 10 . 1 1 133 133 ALA CA C 133 51.065 51.065 55.048 -3.983 19854 9756 1 10 . 1 1 133 133 ALA CB C 133 12.999 12.999 18.464 -5.465 19854 9757 1 10 . 1 1 133 133 ALA H H 133 6.322 6.322 8.774 -2.452 19854 9758 1 10 . 1 1 134 134 LYS N N 134 117.615 117.615 117.983 -0.368 19854 9759 1 10 . 1 1 134 134 LYS C C 134 176.859 176.859 178.752 -1.893 19854 9760 1 10 . 1 1 134 134 LYS CA C 134 55.750 55.750 58.813 -3.063 19854 9761 1 10 . 1 1 134 134 LYS CB C 134 54.579 54.579 32.298 22.281 19854 9762 1 10 . 1 1 134 134 LYS H H 134 6.549 6.549 8.236 -1.687 19854 9763 1 10 . 1 1 135 135 SER N N 135 109.314 109.314 114.703 -5.389 19854 9764 1 10 . 1 1 135 135 SER C C 135 173.635 173.635 174.975 -1.340 19854 9765 1 10 . 1 1 135 135 SER CA C 135 56.336 56.336 59.839 -3.503 19854 9766 1 10 . 1 1 135 135 SER CB C 135 63.949 63.949 63.064 0.885 19854 9767 1 10 . 1 1 135 135 SER H H 135 7.840 7.840 7.799 0.041 19854 9768 1 10 . 1 1 136 136 ILE N N 136 124.123 124.123 121.756 2.367 19854 9769 1 10 . 1 1 136 136 ILE C C 136 175.100 175.100 175.848 -0.748 19854 9770 1 10 . 1 1 136 136 ILE CA C 136 68.634 68.634 62.961 5.673 19854 9771 1 10 . 1 1 136 136 ILE CB C 136 43.452 43.452 37.902 5.550 19854 9772 1 10 . 1 1 136 136 ILE H H 136 8.098 8.098 7.385 0.713 19854 9773 1 10 . 1 1 137 137 VAL N N 137 113.232 113.232 124.478 -11.246 19854 9774 1 10 . 1 1 137 137 VAL C C 137 176.859 176.859 176.221 0.638 19854 9775 1 10 . 1 1 137 137 VAL CA C 137 64.534 64.534 62.308 2.226 19854 9776 1 10 . 1 1 137 137 VAL CB C 137 34.082 34.082 32.354 1.728 19854 9777 1 10 . 1 1 137 137 VAL H H 137 7.711 7.711 8.282 -0.571 19854 9778 1 10 . 1 1 138 138 PHE N N 138 118.279 118.279 123.372 -5.093 19854 9779 1 10 . 1 1 138 138 PHE C C 138 175.393 175.393 176.304 -0.911 19854 9780 1 10 . 1 1 138 138 PHE CA C 138 58.092 58.092 62.741 -4.649 19854 9781 1 10 . 1 1 138 138 PHE CB C 138 39.353 39.353 39.231 0.122 19854 9782 1 10 . 1 1 138 138 PHE H H 138 8.317 8.317 7.657 0.660 19854 9783 1 10 . 1 1 139 139 HIS N N 139 120.605 120.605 116.417 4.188 19854 9784 1 10 . 1 1 139 139 HIS C C 139 175.979 175.979 177.111 -1.132 19854 9785 1 10 . 1 1 139 139 HIS CA C 139 67.775 67.775 59.410 8.365 19854 9786 1 10 . 1 1 139 139 HIS CB C 139 35.836 35.836 28.965 6.871 19854 9787 1 10 . 1 1 139 139 HIS H H 139 8.094 8.094 8.951 -0.857 19854 9788 1 10 . 1 1 140 140 ARG N N 140 120.140 120.140 120.272 -0.132 19854 9789 1 10 . 1 1 140 140 ARG C C 140 178.023 178.023 179.233 -1.210 19854 9790 1 10 . 1 1 140 140 ARG CA C 140 58.394 58.394 59.326 -0.932 19854 9791 1 10 . 1 1 140 140 ARG CB C 140 39.644 39.644 29.672 9.972 19854 9792 1 10 . 1 1 140 140 ARG H H 140 8.149 8.149 7.041 1.108 19854 9793 1 10 . 1 1 141 141 LYS N N 141 115.623 115.623 120.197 -4.574 19854 9794 1 10 . 1 1 141 141 LYS C C 141 173.635 173.635 178.205 -4.570 19854 9795 1 10 . 1 1 141 141 LYS CA C 141 58.092 58.092 58.710 -0.618 19854 9796 1 10 . 1 1 141 141 LYS CB C 141 33.496 33.496 32.299 1.197 19854 9797 1 10 . 1 1 141 141 LYS H H 141 7.449 7.449 7.553 -0.104 19854 9798 1 10 . 1 1 142 142 LYS N N 142 114.162 114.162 116.081 -1.919 19854 9799 1 10 . 1 1 142 142 LYS C C 142 175.979 175.979 176.008 -0.029 19854 9800 1 10 . 1 1 142 142 LYS CA C 142 51.065 51.065 54.912 -3.847 19854 9801 1 10 . 1 1 142 142 LYS CB C 142 34.668 34.668 31.784 2.885 19854 9802 1 10 . 1 1 142 142 LYS H H 142 8.982 8.982 7.757 1.225 19854 9803 1 10 . 1 1 143 143 ASN N N 143 112.103 112.103 116.624 -4.521 19854 9804 1 10 . 1 1 143 143 ASN C C 143 175.100 175.100 173.982 1.118 19854 9805 1 10 . 1 1 143 143 ASN CA C 143 53.407 53.407 53.811 -0.404 19854 9806 1 10 . 1 1 143 143 ASN CB C 143 39.938 39.938 37.171 2.767 19854 9807 1 10 . 1 1 143 143 ASN H H 143 7.402 7.402 7.675 -0.273 19854 9808 1 10 . 1 1 144 144 LEU N N 144 118.810 118.810 116.542 2.268 19854 9809 1 10 . 1 1 144 144 LEU CA C 144 53.993 53.993 53.319 0.674 19854 9810 1 10 . 1 1 144 144 LEU CB C 144 42.866 42.866 44.543 -1.677 19854 9811 1 10 . 1 1 144 144 LEU H H 144 7.793 7.793 8.064 -0.271 19854 9812 1 10 . 1 1 145 145 GLN N N 145 119.607 119.607 118.001 1.606 19854 9813 1 10 . 1 1 145 145 GLN C C 145 176.859 176.859 174.238 2.621 19854 9814 1 10 . 1 1 145 145 GLN CA C 145 55.164 55.164 53.533 1.631 19854 9815 1 10 . 1 1 145 145 GLN CB C 145 29.983 29.983 30.752 -0.769 19854 9816 1 10 . 1 1 145 145 GLN H H 145 7.014 7.014 7.974 -0.960 19854 9817 1 10 . 1 1 146 146 TYR N N 146 119.275 119.275 124.822 -5.547 19854 9818 1 10 . 1 1 146 146 TYR C C 146 174.807 174.807 174.339 0.468 19854 9819 1 10 . 1 1 146 146 TYR CA C 146 62.777 62.777 56.115 6.662 19854 9820 1 10 . 1 1 146 146 TYR CB C 146 41.109 41.109 40.415 0.694 19854 9821 1 10 . 1 1 146 146 TYR H H 146 9.350 9.350 8.204 1.146 19854 9822 1 10 . 1 1 147 147 TYR N N 147 123.658 123.658 125.842 -2.184 19854 9823 1 10 . 1 1 147 147 TYR C C 147 177.738 177.738 173.815 3.923 19854 9824 1 10 . 1 1 147 147 TYR CA C 147 58.092 58.092 56.215 1.877 19854 9825 1 10 . 1 1 147 147 TYR CB C 147 39.938 39.938 41.905 -1.967 19854 9826 1 10 . 1 1 147 147 TYR H H 147 8.340 8.340 8.646 -0.306 19854 9827 1 10 . 1 1 148 148 ASP N N 148 121.267 121.267 123.702 -2.435 19854 9828 1 10 . 1 1 148 148 ASP C C 148 176.859 176.859 175.269 1.590 19854 9829 1 10 . 1 1 148 148 ASP CA C 148 54.579 54.579 54.392 0.187 19854 9830 1 10 . 1 1 148 148 ASP CB C 148 41.109 41.109 41.638 -0.529 19854 9831 1 10 . 1 1 148 148 ASP H H 148 8.911 8.911 8.340 0.571 19854 9832 1 10 . 1 1 149 149 ILE N N 149 119.607 119.607 118.695 0.912 19854 9833 1 10 . 1 1 149 149 ILE C C 149 174.807 174.807 174.403 0.404 19854 9834 1 10 . 1 1 149 149 ILE CA C 149 61.020 61.020 59.129 1.891 19854 9835 1 10 . 1 1 149 149 ILE CB C 149 39.353 39.353 42.619 -3.266 19854 9836 1 10 . 1 1 149 149 ILE H H 149 8.712 8.712 8.643 0.069 19854 9837 1 10 . 1 1 150 150 SER N N 150 117.349 117.349 116.998 0.351 19854 9838 1 10 . 1 1 150 150 SER C C 150 175.686 175.686 174.490 1.196 19854 9839 1 10 . 1 1 150 150 SER CA C 150 60.435 60.435 55.413 5.022 19854 9840 1 10 . 1 1 150 150 SER CB C 150 62.192 62.192 65.375 -3.183 19854 9841 1 10 . 1 1 150 150 SER H H 150 8.454 8.454 8.485 -0.031 19854 9842 1 10 . 1 1 151 151 ALA N N 151 131.162 131.162 130.864 0.298 19854 9843 1 10 . 1 1 151 151 ALA C C 151 160.742 160.742 179.326 -18.584 19854 9844 1 10 . 1 1 151 151 ALA CA C 151 53.993 53.993 55.251 -1.258 19854 9845 1 10 . 1 1 151 151 ALA CB C 151 22.369 22.369 18.933 3.436 19854 9846 1 10 . 1 1 151 151 ALA H H 151 10.640 10.640 8.989 1.651 19854 9847 1 10 . 1 1 152 152 LYS N N 152 121.400 121.400 118.650 2.750 19854 9848 1 10 . 1 1 152 152 LYS C C 152 174.221 174.221 178.017 -3.796 19854 9849 1 10 . 1 1 152 152 LYS CA C 152 59.849 59.849 58.586 1.263 19854 9850 1 10 . 1 1 152 152 LYS CB C 152 34.668 34.668 32.414 2.254 19854 9851 1 10 . 1 1 152 152 LYS H H 152 9.099 9.099 8.394 0.705 19854 9852 1 10 . 1 1 153 153 SER N N 153 135.212 135.212 110.770 24.442 19854 9853 1 10 . 1 1 153 153 SER C C 153 177.152 177.152 174.823 2.329 19854 9854 1 10 . 1 1 153 153 SER CA C 153 62.192 62.192 58.153 4.039 19854 9855 1 10 . 1 1 153 153 SER CB C 153 66.291 66.291 64.163 2.128 19854 9856 1 10 . 1 1 153 153 SER H H 153 8.935 8.935 7.821 1.114 19854 9857 1 10 . 1 1 154 154 ASN N N 154 119.341 119.341 116.730 2.611 19854 9858 1 10 . 1 1 154 154 ASN C C 154 175.979 175.979 173.961 2.018 19854 9859 1 10 . 1 1 154 154 ASN CA C 154 49.894 49.894 54.735 -4.841 19854 9860 1 10 . 1 1 154 154 ASN CB C 154 39.353 39.353 36.559 2.795 19854 9861 1 10 . 1 1 154 154 ASN H H 154 7.488 7.488 8.087 -0.599 19854 9862 1 10 . 1 1 155 155 TYR N N 155 120.074 120.074 122.762 -2.688 19854 9863 1 10 . 1 1 155 155 TYR C C 155 177.144 177.144 175.274 1.870 19854 9864 1 10 . 1 1 155 155 TYR CA C 155 60.738 60.738 59.547 1.191 19854 9865 1 10 . 1 1 155 155 TYR CB C 155 41.402 41.402 38.762 2.640 19854 9866 1 10 . 1 1 155 155 TYR H H 155 7.945 7.945 7.498 0.447 19854 9867 1 10 . 1 1 156 156 ASN N N 156 124.058 124.058 122.875 1.183 19854 9868 1 10 . 1 1 156 156 ASN C C 156 175.679 175.679 175.148 0.531 19854 9869 1 10 . 1 1 156 156 ASN CA C 156 53.121 53.121 54.240 -1.119 19854 9870 1 10 . 1 1 156 156 ASN CB C 156 38.179 38.179 35.988 2.191 19854 9871 1 10 . 1 1 156 156 ASN H H 156 8.192 8.192 8.899 -0.707 19854 9872 1 10 . 1 1 157 157 PHE N N 157 123.459 123.459 119.408 4.051 19854 9873 1 10 . 1 1 157 157 PHE C C 157 174.221 174.221 175.965 -1.744 19854 9874 1 10 . 1 1 157 157 PHE CA C 157 57.507 57.507 61.118 -3.611 19854 9875 1 10 . 1 1 157 157 PHE CB C 157 39.353 39.353 39.224 0.129 19854 9876 1 10 . 1 1 157 157 PHE H H 157 7.429 7.429 7.640 -0.211 19854 9877 1 10 . 1 1 158 158 GLU N N 158 112.568 112.568 115.640 -3.072 19854 9878 1 10 . 1 1 158 158 GLU C C 158 176.566 176.566 177.263 -0.697 19854 9879 1 10 . 1 1 158 158 GLU CA C 158 72.147 72.147 57.184 14.963 19854 9880 1 10 . 1 1 158 158 GLU CB C 158 27.640 27.640 29.183 -1.543 19854 9881 1 10 . 1 1 158 158 GLU H H 158 7.495 7.495 8.680 -1.185 19854 9882 1 10 . 1 1 159 159 LYS N N 159 113.232 113.232 120.226 -6.994 19854 9883 1 10 . 1 1 159 159 LYS C C 159 176.566 176.566 175.718 0.848 19854 9884 1 10 . 1 1 159 159 LYS CA C 159 53.993 53.993 61.428 -7.435 19854 9885 1 10 . 1 1 159 159 LYS CB C 159 33.496 33.496 30.138 3.358 19854 9886 1 10 . 1 1 159 159 LYS H H 159 6.862 6.862 7.295 -0.433 19854 9887 1 10 . 1 1 160 160 PRO C C 160 176.273 176.273 178.525 -2.252 19854 9888 1 10 . 1 1 160 160 PRO CA C 160 64.258 64.258 65.628 -1.370 19854 9889 1 10 . 1 1 160 160 PRO CB C 160 32.318 32.318 31.109 1.209 19854 9890 1 10 . 1 1 161 161 PHE N N 161 123.726 123.726 116.037 7.689 19854 9891 1 10 . 1 1 161 161 PHE C C 161 176.851 176.851 177.553 -0.702 19854 9892 1 10 . 1 1 161 161 PHE CA C 161 60.445 60.445 61.898 -1.454 19854 9893 1 10 . 1 1 161 161 PHE CB C 161 40.816 40.816 37.589 3.227 19854 9894 1 10 . 1 1 161 161 PHE H H 161 8.215 8.215 7.247 0.968 19854 9895 1 10 . 1 1 162 162 LEU N N 162 110.177 110.177 119.170 -8.993 19854 9896 1 10 . 1 1 162 162 LEU C C 162 176.273 176.273 178.703 -2.430 19854 9897 1 10 . 1 1 162 162 LEU CA C 162 55.750 55.750 57.964 -2.214 19854 9898 1 10 . 1 1 162 162 LEU CB C 162 44.037 44.037 41.507 2.530 19854 9899 1 10 . 1 1 162 162 LEU H H 162 7.527 7.527 7.994 -0.467 19854 9900 1 10 . 1 1 163 163 TRP N N 163 123.525 123.525 121.351 2.174 19854 9901 1 10 . 1 1 163 163 TRP C C 163 177.152 177.152 178.025 -0.873 19854 9902 1 10 . 1 1 163 163 TRP CA C 163 61.606 61.606 62.225 -0.619 19854 9903 1 10 . 1 1 163 163 TRP CB C 163 28.811 28.811 29.552 -0.741 19854 9904 1 10 . 1 1 163 163 TRP H H 163 7.476 7.476 8.191 -0.715 19854 9905 1 10 . 1 1 164 164 LEU N N 164 119.740 119.740 119.031 0.709 19854 9906 1 10 . 1 1 164 164 LEU C C 164 175.686 175.686 178.885 -3.199 19854 9907 1 10 . 1 1 164 164 LEU CA C 164 61.020 61.020 57.834 3.186 19854 9908 1 10 . 1 1 164 164 LEU CB C 164 45.794 45.794 41.345 4.449 19854 9909 1 10 . 1 1 164 164 LEU H H 164 9.412 9.412 8.042 1.370 19854 9910 1 10 . 1 1 165 165 ALA N N 165 118.013 118.013 121.466 -3.453 19854 9911 1 10 . 1 1 165 165 ALA C C 165 165.723 165.723 179.550 -13.827 19854 9912 1 10 . 1 1 165 165 ALA CA C 165 52.236 52.236 55.262 -3.026 19854 9913 1 10 . 1 1 165 165 ALA CB C 165 21.784 21.784 18.173 3.611 19854 9914 1 10 . 1 1 165 165 ALA H H 165 7.707 7.707 8.340 -0.633 19854 9915 1 10 . 1 1 166 166 ARG N N 166 122.994 122.994 118.389 4.605 19854 9916 1 10 . 1 1 166 166 ARG C C 166 175.979 175.979 178.838 -2.859 19854 9917 1 10 . 1 1 166 166 ARG CA C 166 49.308 49.308 59.167 -9.859 19854 9918 1 10 . 1 1 166 166 ARG CB C 166 29.397 29.397 30.116 -0.719 19854 9919 1 10 . 1 1 166 166 ARG H H 166 8.692 8.692 8.117 0.575 19854 9920 1 10 . 1 1 167 167 LYS N N 167 112.568 112.568 120.119 -7.551 19854 9921 1 10 . 1 1 167 167 LYS C C 167 176.273 176.273 179.168 -2.895 19854 9922 1 10 . 1 1 167 167 LYS CA C 167 58.092 58.092 58.493 -0.401 19854 9923 1 10 . 1 1 167 167 LYS CB C 167 34.668 34.668 31.450 3.219 19854 9924 1 10 . 1 1 167 167 LYS H H 167 6.819 6.819 7.404 -0.585 19854 9925 1 10 . 1 1 168 168 LEU N N 168 114.959 114.959 119.437 -4.478 19854 9926 1 10 . 1 1 168 168 LEU C C 168 177.738 177.738 178.993 -1.255 19854 9927 1 10 . 1 1 168 168 LEU CA C 168 56.921 56.921 57.530 -0.609 19854 9928 1 10 . 1 1 168 168 LEU CB C 168 41.695 41.695 41.576 0.119 19854 9929 1 10 . 1 1 168 168 LEU H H 168 7.269 7.269 7.739 -0.470 19854 9930 1 10 . 1 1 169 169 ILE N N 169 122.199 122.199 117.326 4.873 19854 9931 1 10 . 1 1 169 169 ILE C C 169 177.445 177.445 177.111 0.334 19854 9932 1 10 . 1 1 169 169 ILE CA C 169 63.375 63.375 63.255 0.120 19854 9933 1 10 . 1 1 169 169 ILE CB C 169 42.281 42.281 38.577 3.704 19854 9934 1 10 . 1 1 169 169 ILE H H 169 8.360 8.360 8.118 0.242 19854 9935 1 10 . 1 1 170 170 GLY N N 170 113.099 113.099 106.704 6.395 19854 9936 1 10 . 1 1 170 170 GLY C C 170 162.496 162.496 173.948 -11.452 19854 9937 1 10 . 1 1 170 170 GLY CA C 170 44.037 44.037 44.865 -0.828 19854 9938 1 10 . 1 1 170 170 GLY H H 170 6.686 6.686 7.967 -1.281 19854 9939 1 10 . 1 1 171 171 ASP N N 171 113.232 113.232 121.664 -8.432 19854 9940 1 10 . 1 1 171 171 ASP C C 171 178.910 178.910 175.607 3.303 19854 9941 1 10 . 1 1 171 171 ASP CA C 171 50.479 50.479 50.468 0.011 19854 9942 1 10 . 1 1 171 171 ASP CB C 171 41.109 41.109 41.825 -0.716 19854 9943 1 10 . 1 1 171 171 ASP H H 171 6.815 6.815 7.675 -0.860 19854 9944 1 10 . 1 1 172 172 PRO C C 172 176.566 176.566 177.072 -0.506 19854 9945 1 10 . 1 1 172 172 PRO CA C 172 63.965 63.965 64.185 -0.220 19854 9946 1 10 . 1 1 172 172 PRO CB C 172 31.732 31.732 32.252 -0.520 19854 9947 1 10 . 1 1 173 173 ASN N N 173 109.779 109.779 116.300 -6.521 19854 9948 1 10 . 1 1 173 173 ASN C C 173 175.979 175.979 174.719 1.260 19854 9949 1 10 . 1 1 173 173 ASN CA C 173 54.579 54.579 53.046 1.533 19854 9950 1 10 . 1 1 173 173 ASN CB C 173 36.424 36.424 38.931 -2.507 19854 9951 1 10 . 1 1 173 173 ASN H H 173 8.016 8.016 8.369 -0.353 19854 9952 1 10 . 1 1 174 174 LEU N N 174 109.248 109.248 123.129 -13.881 19854 9953 1 10 . 1 1 174 174 LEU C C 174 176.566 176.566 175.716 0.850 19854 9954 1 10 . 1 1 174 174 LEU CA C 174 56.336 56.336 56.017 0.319 19854 9955 1 10 . 1 1 174 174 LEU CB C 174 44.037 44.037 42.775 1.262 19854 9956 1 10 . 1 1 174 174 LEU H H 174 7.871 7.871 7.254 0.617 19854 9957 1 10 . 1 1 175 175 GLU N N 175 125.185 125.185 125.248 -0.063 19854 9958 1 10 . 1 1 175 175 GLU C C 175 177.445 177.445 174.916 2.529 19854 9959 1 10 . 1 1 175 175 GLU CA C 175 76.247 76.247 54.065 22.182 19854 9960 1 10 . 1 1 175 175 GLU CB C 175 28.811 28.811 33.907 -5.096 19854 9961 1 10 . 1 1 175 175 GLU H H 175 9.127 9.127 8.185 0.942 19854 9962 1 10 . 1 1 176 176 PHE N N 176 136.873 136.873 123.148 13.725 19854 9963 1 10 . 1 1 176 176 PHE C C 176 178.617 178.617 175.874 2.743 19854 9964 1 10 . 1 1 176 176 PHE CA C 176 59.264 59.264 58.318 0.946 19854 9965 1 10 . 1 1 176 176 PHE CB C 176 44.623 44.623 40.231 4.392 19854 9966 1 10 . 1 1 176 176 PHE H H 176 10.058 10.058 8.652 1.406 19854 9967 1 10 . 1 1 177 177 VAL N N 177 118.877 118.877 124.355 -5.478 19854 9968 1 10 . 1 1 177 177 VAL C C 177 177.445 177.445 174.312 3.133 19854 9969 1 10 . 1 1 177 177 VAL CA C 177 62.777 62.777 59.160 3.617 19854 9970 1 10 . 1 1 177 177 VAL CB C 177 34.668 34.668 33.917 0.751 19854 9971 1 10 . 1 1 177 177 VAL H H 177 7.789 7.789 7.968 -0.179 19854 9972 1 10 . 1 1 178 178 ALA N N 178 123.859 123.859 126.508 -2.649 19854 9973 1 10 . 1 1 178 178 ALA C C 178 177.144 177.144 177.089 0.055 19854 9974 1 10 . 1 1 178 178 ALA CA C 178 54.000 54.000 54.795 -0.796 19854 9975 1 10 . 1 1 178 178 ALA CB C 178 15.035 15.035 18.950 -3.915 19854 9976 1 10 . 1 1 178 178 ALA H H 178 7.683 7.683 8.232 -0.549 19854 9977 1 10 . 1 1 179 179 MET N N 179 121.668 121.668 117.155 4.513 19854 9978 1 10 . 1 1 179 179 MET C C 179 177.144 177.144 173.413 3.731 19854 9979 1 10 . 1 1 179 179 MET CA C 179 60.445 60.445 52.956 7.489 19854 9980 1 10 . 1 1 179 179 MET CB C 179 39.351 39.351 33.172 6.179 19854 9981 1 10 . 1 1 179 179 MET H H 179 7.648 7.648 7.749 -0.101 19854 9982 1 10 . 1 1 180 180 PRO C C 180 177.445 177.445 175.408 2.037 19854 9983 1 10 . 1 1 180 180 PRO CA C 180 64.844 64.844 62.410 2.434 19854 9984 1 10 . 1 1 180 180 PRO CB C 180 29.974 29.974 32.828 -2.854 19854 9985 1 10 . 1 1 181 181 ALA N N 181 128.439 128.439 123.445 4.994 19854 9986 1 10 . 1 1 181 181 ALA C C 181 176.273 176.273 177.427 -1.154 19854 9987 1 10 . 1 1 181 181 ALA CA C 181 58.092 58.092 52.172 5.920 19854 9988 1 10 . 1 1 181 181 ALA CB C 181 21.198 21.198 19.428 1.770 19854 9989 1 10 . 1 1 181 181 ALA H H 181 8.673 8.673 8.163 0.510 19854 9990 1 10 . 1 1 182 182 LEU N N 182 122.130 122.130 122.367 -0.237 19854 9991 1 10 . 1 1 182 182 LEU C C 182 177.445 177.445 177.011 0.434 19854 9992 1 10 . 1 1 182 182 LEU CA C 182 55.164 55.164 54.154 1.010 19854 9993 1 10 . 1 1 182 182 LEU CB C 182 42.866 42.866 43.167 -0.301 19854 9994 1 10 . 1 1 182 182 LEU H H 182 8.821 8.821 8.329 0.492 19854 9995 1 10 . 1 1 183 183 ALA N N 183 121.004 121.004 126.646 -5.642 19854 9996 1 10 . 1 1 183 183 ALA C C 183 178.617 178.617 175.659 2.958 19854 9997 1 10 . 1 1 183 183 ALA CA C 183 57.808 57.808 50.059 7.748 19854 9998 1 10 . 1 1 183 183 ALA CB C 183 24.117 24.117 18.655 5.462 19854 9999 1 10 . 1 1 183 183 ALA H H 183 8.356 8.356 8.230 0.126 19854 10000 1 10 . 1 1 184 184 PRO C C 184 177.152 177.152 175.012 2.140 19854 10001 1 10 . 1 1 184 184 PRO CA C 184 64.258 64.258 61.908 2.350 19854 10002 1 10 . 1 1 184 184 PRO CB C 184 29.681 29.681 31.410 -1.730 19854 10003 1 10 . 1 1 185 185 PRO C C 185 175.686 175.686 176.754 -1.068 19854 10004 1 10 . 1 1 185 185 PRO CA C 185 63.379 63.379 62.374 1.005 19854 10005 1 10 . 1 1 185 185 PRO CB C 185 35.248 35.248 32.366 2.882 19854 10006 1 10 . 1 1 186 186 GLU N N 186 120.539 120.539 121.885 -1.346 19854 10007 1 10 . 1 1 186 186 GLU C C 186 176.273 176.273 176.391 -0.118 19854 10008 1 10 . 1 1 186 186 GLU CA C 186 58.101 58.101 57.831 0.270 19854 10009 1 10 . 1 1 186 186 GLU CB C 186 35.836 35.836 30.112 5.724 19854 10010 1 10 . 1 1 186 186 GLU H H 186 8.086 8.086 8.319 -0.233 19854 10011 1 10 . 1 1 187 187 VAL N N 187 124.455 124.455 118.490 5.965 19854 10012 1 10 . 1 1 187 187 VAL C C 187 178.910 178.910 175.197 3.713 19854 10013 1 10 . 1 1 187 187 VAL CA C 187 63.363 63.363 62.841 0.522 19854 10014 1 10 . 1 1 187 187 VAL CB C 187 34.082 34.082 31.179 2.903 19854 10015 1 10 . 1 1 187 187 VAL H H 187 8.622 8.622 8.276 0.346 19854 10016 1 10 . 1 1 188 188 VAL N N 188 128.572 128.572 121.949 6.623 19854 10017 1 10 . 1 1 188 188 VAL C C 188 178.324 178.324 176.445 1.879 19854 10018 1 10 . 1 1 188 188 VAL CA C 188 68.634 68.634 61.504 7.130 19854 10019 1 10 . 1 1 188 188 VAL CB C 188 31.154 31.154 33.200 -2.046 19854 10020 1 10 . 1 1 188 188 VAL H H 188 8.497 8.497 8.082 0.415 19854 10021 1 10 . 1 1 189 189 MET N N 189 122.795 122.795 120.304 2.491 19854 10022 1 10 . 1 1 189 189 MET C C 189 177.445 177.445 176.181 1.264 19854 10023 1 10 . 1 1 189 189 MET CA C 189 55.164 55.164 56.957 -1.793 19854 10024 1 10 . 1 1 189 189 MET CB C 189 35.253 35.253 31.314 3.938 19854 10025 1 10 . 1 1 189 189 MET H H 189 6.991 6.991 8.437 -1.446 19854 10026 1 10 . 1 1 190 190 ASP N N 190 114.959 114.959 117.928 -2.969 19854 10027 1 10 . 1 1 190 190 ASP C C 190 175.686 175.686 175.238 0.448 19854 10028 1 10 . 1 1 190 190 ASP CA C 190 51.065 51.065 54.441 -3.376 19854 10029 1 10 . 1 1 190 190 ASP CB C 190 41.695 41.695 39.568 2.127 19854 10030 1 10 . 1 1 190 190 ASP H H 190 7.210 7.210 8.653 -1.443 19854 10031 1 10 . 1 1 191 191 PRO C C 191 176.566 176.566 178.438 -1.872 19854 10032 1 10 . 1 1 191 191 PRO CA C 191 63.965 63.965 64.854 -0.889 19854 10033 1 10 . 1 1 191 191 PRO CB C 191 31.146 31.146 31.944 -0.798 19854 10034 1 10 . 1 1 192 192 ALA N N 192 109.513 109.513 122.163 -12.650 19854 10035 1 10 . 1 1 192 192 ALA CA C 192 53.993 53.993 54.382 -0.389 19854 10036 1 10 . 1 1 192 192 ALA CB C 192 19.441 19.441 18.251 1.190 19854 10037 1 10 . 1 1 192 192 ALA H H 192 7.394 7.394 8.243 -0.849 19854 10038 1 10 . 1 1 193 193 LEU N N 193 119.009 119.009 118.352 0.657 19854 10039 1 10 . 1 1 193 193 LEU C C 193 175.979 175.979 176.562 -0.583 19854 10040 1 10 . 1 1 193 193 LEU CA C 193 56.336 56.336 55.058 1.278 19854 10041 1 10 . 1 1 193 193 LEU CB C 193 42.866 42.866 41.575 1.291 19854 10042 1 10 . 1 1 193 193 LEU H H 193 8.340 8.340 7.801 0.539 19854 10043 1 10 . 1 1 194 194 ALA N N 194 121.666 121.666 120.084 1.582 19854 10044 1 10 . 1 1 194 194 ALA C C 194 166.896 166.896 178.152 -11.256 19854 10045 1 10 . 1 1 194 194 ALA CA C 194 55.164 55.164 52.942 2.222 19854 10046 1 10 . 1 1 194 194 ALA CB C 194 16.513 16.513 19.140 -2.627 19854 10047 1 10 . 1 1 194 194 ALA H H 194 8.176 8.176 7.332 0.844 19854 10048 1 10 . 1 1 195 195 ALA N N 195 119.541 119.541 121.610 -2.069 19854 10049 1 10 . 1 1 195 195 ALA C C 195 173.928 173.928 178.890 -4.962 19854 10050 1 10 . 1 1 195 195 ALA CA C 195 57.507 57.507 54.116 3.391 19854 10051 1 10 . 1 1 195 195 ALA CB C 195 19.441 19.441 17.074 2.367 19854 10052 1 10 . 1 1 195 195 ALA H H 195 8.364 8.364 8.881 -0.517 19854 10053 1 10 . 1 1 196 196 GLN N N 196 107.322 107.322 119.383 -12.061 19854 10054 1 10 . 1 1 196 196 GLN C C 196 176.273 176.273 177.453 -1.180 19854 10055 1 10 . 1 1 196 196 GLN CA C 196 56.921 56.921 58.267 -1.346 19854 10056 1 10 . 1 1 196 196 GLN CB C 196 29.983 29.983 28.567 1.416 19854 10057 1 10 . 1 1 196 196 GLN H H 196 7.910 7.910 7.781 0.129 19854 10058 1 10 . 1 1 197 197 TYR N N 197 119.277 119.277 118.367 0.910 19854 10059 1 10 . 1 1 197 197 TYR C C 197 178.316 178.316 178.514 -0.198 19854 10060 1 10 . 1 1 197 197 TYR CA C 197 56.343 56.343 61.647 -5.304 19854 10061 1 10 . 1 1 197 197 TYR CB C 197 43.453 43.453 37.659 5.794 19854 10062 1 10 . 1 1 197 197 TYR H H 197 8.180 8.180 8.096 0.084 19854 10063 1 10 . 1 1 198 198 GLU N N 198 110.244 110.244 119.326 -9.082 19854 10064 1 10 . 1 1 198 198 GLU C C 198 176.273 176.273 178.988 -2.715 19854 10065 1 10 . 1 1 198 198 GLU CA C 198 53.407 53.407 59.467 -6.060 19854 10066 1 10 . 1 1 198 198 GLU CB C 198 30.568 30.568 29.202 1.366 19854 10067 1 10 . 1 1 198 198 GLU H H 198 7.523 7.523 8.180 -0.657 19854 10068 1 10 . 1 1 199 199 HIS N N 199 119.211 119.211 119.793 -0.582 19854 10069 1 10 . 1 1 199 199 HIS C C 199 178.902 178.902 177.159 1.743 19854 10070 1 10 . 1 1 199 199 HIS CA C 199 58.687 58.687 59.370 -0.683 19854 10071 1 10 . 1 1 199 199 HIS CB C 199 34.957 34.957 29.785 5.172 19854 10072 1 10 . 1 1 199 199 HIS H H 199 8.258 8.258 7.649 0.609 19854 10073 1 10 . 1 1 200 200 ASP N N 200 124.722 124.722 120.051 4.671 19854 10074 1 10 . 1 1 200 200 ASP C C 200 176.705 176.705 178.948 -2.243 19854 10075 1 10 . 1 1 200 200 ASP CA C 200 58.687 58.687 57.313 1.374 19854 10076 1 10 . 1 1 200 200 ASP CB C 200 39.644 39.644 40.422 -0.778 19854 10077 1 10 . 1 1 200 200 ASP H H 200 8.086 8.086 8.316 -0.230 19854 10078 1 10 . 1 1 201 201 LEU N N 201 116.353 116.353 120.238 -3.885 19854 10079 1 10 . 1 1 201 201 LEU C C 201 178.910 178.910 178.991 -0.081 19854 10080 1 10 . 1 1 201 201 LEU CA C 201 61.606 61.606 58.216 3.390 19854 10081 1 10 . 1 1 201 201 LEU CB C 201 41.109 41.109 41.823 -0.714 19854 10082 1 10 . 1 1 201 201 LEU H H 201 7.722 7.722 8.156 -0.434 19854 10083 1 10 . 1 1 202 202 GLU N N 202 118.080 118.080 119.716 -1.636 19854 10084 1 10 . 1 1 202 202 GLU C C 202 176.566 176.566 179.281 -2.715 19854 10085 1 10 . 1 1 202 202 GLU CA C 202 56.921 56.921 59.451 -2.530 19854 10086 1 10 . 1 1 202 202 GLU CB C 202 30.568 30.568 29.567 1.001 19854 10087 1 10 . 1 1 202 202 GLU H H 202 8.857 8.857 7.885 0.972 19854 10088 1 10 . 1 1 203 203 VAL N N 203 129.369 129.369 119.862 9.507 19854 10089 1 10 . 1 1 203 203 VAL C C 203 178.617 178.617 177.822 0.795 19854 10090 1 10 . 1 1 203 203 VAL CA C 203 64.534 64.534 66.473 -1.939 19854 10091 1 10 . 1 1 203 203 VAL CB C 203 27.640 27.640 31.119 -3.479 19854 10092 1 10 . 1 1 203 203 VAL H H 203 9.283 9.283 7.740 1.543 19854 10093 1 10 . 1 1 204 204 ALA N N 204 109.580 109.580 121.966 -12.386 19854 10094 1 10 . 1 1 204 204 ALA C C 204 176.859 176.859 179.437 -2.578 19854 10095 1 10 . 1 1 204 204 ALA CA C 204 54.579 54.579 55.013 -0.434 19854 10096 1 10 . 1 1 204 204 ALA CB C 204 18.270 18.270 18.229 0.041 19854 10097 1 10 . 1 1 204 204 ALA H H 204 8.528 8.528 8.058 0.470 19854 10098 1 10 . 1 1 205 205 GLN N N 205 123.328 123.328 116.328 7.000 19854 10099 1 10 . 1 1 205 205 GLN C C 205 177.418 177.418 178.179 -0.761 19854 10100 1 10 . 1 1 205 205 GLN CA C 205 57.515 57.515 58.485 -0.970 19854 10101 1 10 . 1 1 205 205 GLN CB C 205 33.785 33.785 29.057 4.728 19854 10102 1 10 . 1 1 205 205 GLN H H 205 8.160 8.160 8.025 0.135 19854 10103 1 10 . 1 1 206 206 THR N N 206 120.271 120.271 113.789 6.482 19854 10104 1 10 . 1 1 206 206 THR C C 206 176.273 176.273 175.445 0.828 19854 10105 1 10 . 1 1 206 206 THR CA C 206 67.462 67.462 64.629 2.833 19854 10106 1 10 . 1 1 206 206 THR CB C 206 70.390 70.390 69.112 1.278 19854 10107 1 10 . 1 1 206 206 THR H H 206 7.585 7.585 7.761 -0.176 19854 10108 1 10 . 1 1 207 207 THR N N 207 111.970 111.970 118.680 -6.710 19854 10109 1 10 . 1 1 207 207 THR C C 207 176.566 176.566 174.096 2.470 19854 10110 1 10 . 1 1 207 207 THR CA C 207 64.534 64.534 63.370 1.163 19854 10111 1 10 . 1 1 207 207 THR CB C 207 72.733 72.733 69.557 3.176 19854 10112 1 10 . 1 1 207 207 THR H H 207 7.468 7.468 7.599 -0.131 19854 10113 1 10 . 1 1 208 208 ALA N N 208 115.623 115.623 128.503 -12.880 19854 10114 1 10 . 1 1 208 208 ALA C C 208 168.947 168.947 177.274 -8.327 19854 10115 1 10 . 1 1 208 208 ALA CA C 208 55.164 55.164 52.073 3.091 19854 10116 1 10 . 1 1 208 208 ALA CB C 208 22.369 22.369 19.497 2.872 19854 10117 1 10 . 1 1 208 208 ALA H H 208 7.390 7.390 8.240 -0.850 19854 10118 1 10 . 1 1 209 209 LEU N N 209 117.814 117.814 124.164 -6.350 19854 10119 1 10 . 1 1 209 209 LEU C C 209 176.273 176.273 175.256 1.017 19854 10120 1 10 . 1 1 209 209 LEU CA C 209 58.678 58.678 52.777 5.901 19854 10121 1 10 . 1 1 209 209 LEU CB C 209 46.380 46.380 42.518 3.862 19854 10122 1 10 . 1 1 209 209 LEU H H 209 7.652 7.652 8.193 -0.541 19854 10123 1 10 . 1 1 210 210 PRO C C 210 176.566 176.566 175.399 1.167 19854 10124 1 10 . 1 1 210 210 PRO CA C 210 63.086 63.086 62.169 0.917 19854 10125 1 10 . 1 1 210 210 PRO CB C 210 31.146 31.146 32.643 -1.497 19854 10126 1 10 . 1 1 211 211 ASP N N 211 122.863 122.863 120.533 2.330 19854 10127 1 10 . 1 1 211 211 ASP C C 211 175.686 175.686 175.468 0.218 19854 10128 1 10 . 1 1 211 211 ASP CA C 211 56.343 56.343 54.527 1.816 19854 10129 1 10 . 1 1 211 211 ASP CB C 211 41.402 41.402 41.128 0.274 19854 10130 1 10 . 1 1 211 211 ASP H H 211 8.360 8.360 8.347 0.013 19854 10131 1 10 . 1 1 212 212 GLU N N 212 131.162 131.162 125.089 6.073 19854 10132 1 10 . 1 1 212 212 GLU C C 212 176.273 176.273 176.439 -0.166 19854 10133 1 10 . 1 1 212 212 GLU CA C 212 55.164 55.164 57.629 -2.465 19854 10134 1 10 . 1 1 212 212 GLU CB C 212 30.568 30.568 31.251 -0.683 19854 10135 1 10 . 1 1 212 212 GLU H H 212 8.399 8.399 8.662 -0.263 19854 10136 1 10 . 1 1 213 213 ASP N N 213 122.797 122.797 115.866 6.931 19854 10137 1 10 . 1 1 213 213 ASP C C 213 177.152 177.152 177.401 -0.249 19854 10138 1 10 . 1 1 213 213 ASP CA C 213 61.914 61.914 53.615 8.299 19854 10139 1 10 . 1 1 213 213 ASP CB C 213 49.607 49.607 41.429 8.178 19854 10140 1 10 . 1 1 213 213 ASP H H 213 8.168 8.168 8.437 -0.269 19854 10141 1 10 . 1 1 214 214 ASP N N 214 112.369 112.369 121.768 -9.399 19854 10142 1 10 . 1 1 214 214 ASP C C 214 178.910 178.910 177.254 1.656 19854 10143 1 10 . 1 1 214 214 ASP CA C 214 54.579 54.579 56.811 -2.232 19854 10144 1 10 . 1 1 214 214 ASP CB C 214 39.353 39.353 40.357 -1.004 19854 10145 1 10 . 1 1 214 214 ASP H H 214 7.464 7.464 8.115 -0.651 19854 10146 1 10 . 1 1 215 215 ASP N N 215 127.244 127.244 118.840 8.404 19854 10147 1 10 . 1 1 215 215 ASP C C 215 176.859 176.859 177.051 -0.192 19854 10148 1 10 . 1 1 215 215 ASP CA C 215 54.579 54.579 55.877 -1.298 19854 10149 1 10 . 1 1 215 215 ASP CB C 215 40.524 40.524 40.925 -0.401 19854 10150 1 10 . 1 1 215 215 ASP H H 215 8.301 8.301 8.176 0.125 19854 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 201 7.688 0.382 7.697 19854 2 1 1 "Average Difference" HA 28 0.447 -0.329 0.309 19854 3 1 1 "Average Difference" C 209 3.487 0.137 3.493 19854 4 1 1 "Average Difference" CA 210 4.553 -0.665 4.515 19854 5 1 1 "Average Difference" CB 194 4.088 -0.999 3.974 19854 6 1 1 "Average Difference" HN 201 0.944 0.076 0.943 19854 7 1 2 "Average Difference" N 201 7.813 0.344 7.825 19854 8 1 2 "Average Difference" HA 28 0.445 -0.313 0.322 19854 9 1 2 "Average Difference" C 209 3.486 0.133 3.491 19854 10 1 2 "Average Difference" CA 210 4.562 -0.680 4.522 19854 11 1 2 "Average Difference" CB 194 4.070 -0.942 3.970 19854 12 1 2 "Average Difference" HN 201 0.948 0.085 0.947 19854 13 1 3 "Average Difference" N 201 7.711 0.447 7.718 19854 14 1 3 "Average Difference" HA 28 0.454 -0.324 0.323 19854 15 1 3 "Average Difference" C 209 3.478 0.139 3.484 19854 16 1 3 "Average Difference" CA 210 4.587 -0.659 4.551 19854 17 1 3 "Average Difference" CB 194 4.086 -1.021 3.967 19854 18 1 3 "Average Difference" HN 201 0.948 0.089 0.946 19854 19 1 4 "Average Difference" N 201 7.771 0.356 7.782 19854 20 1 4 "Average Difference" HA 28 0.447 -0.339 0.298 19854 21 1 4 "Average Difference" C 209 3.462 0.109 3.468 19854 22 1 4 "Average Difference" CA 210 4.574 -0.643 4.540 19854 23 1 4 "Average Difference" CB 194 4.063 -1.017 3.943 19854 24 1 4 "Average Difference" HN 201 0.957 0.084 0.955 19854 25 1 5 "Average Difference" N 201 7.766 0.343 7.778 19854 26 1 5 "Average Difference" HA 28 0.436 -0.303 0.319 19854 27 1 5 "Average Difference" C 209 3.451 0.108 3.457 19854 28 1 5 "Average Difference" CA 210 4.610 -0.635 4.577 19854 29 1 5 "Average Difference" CB 194 4.073 -1.009 3.957 19854 30 1 5 "Average Difference" HN 201 0.960 0.090 0.958 19854 31 1 6 "Average Difference" N 201 7.527 0.476 7.531 19854 32 1 6 "Average Difference" HA 28 0.493 -0.362 0.341 19854 33 1 6 "Average Difference" C 209 3.497 0.145 3.502 19854 34 1 6 "Average Difference" CA 210 4.606 -0.665 4.568 19854 35 1 6 "Average Difference" CB 194 4.061 -1.004 3.945 19854 36 1 6 "Average Difference" HN 201 0.946 0.101 0.943 19854 37 1 7 "Average Difference" N 201 7.689 0.468 7.694 19854 38 1 7 "Average Difference" HA 28 0.451 -0.341 0.300 19854 39 1 7 "Average Difference" C 209 3.503 0.111 3.509 19854 40 1 7 "Average Difference" CA 210 4.599 -0.651 4.564 19854 41 1 7 "Average Difference" CB 194 4.039 -0.947 3.937 19854 42 1 7 "Average Difference" HN 201 0.951 0.102 0.948 19854 43 1 8 "Average Difference" N 201 7.623 0.382 7.633 19854 44 1 8 "Average Difference" HA 28 0.457 -0.344 0.307 19854 45 1 8 "Average Difference" C 209 3.501 0.156 3.506 19854 46 1 8 "Average Difference" CA 210 4.639 -0.627 4.608 19854 47 1 8 "Average Difference" CB 194 4.084 -0.969 3.978 19854 48 1 8 "Average Difference" HN 201 0.950 0.104 0.946 19854 49 1 9 "Average Difference" N 201 7.730 0.501 7.733 19854 50 1 9 "Average Difference" HA 28 0.483 -0.340 0.349 19854 51 1 9 "Average Difference" C 209 3.471 0.110 3.478 19854 52 1 9 "Average Difference" CA 210 4.622 -0.694 4.581 19854 53 1 9 "Average Difference" CB 194 4.066 -0.977 3.957 19854 54 1 9 "Average Difference" HN 201 0.944 0.107 0.940 19854 55 1 10 "Average Difference" N 201 7.723 0.612 7.718 19854 56 1 10 "Average Difference" HA 28 0.491 -0.340 0.360 19854 57 1 10 "Average Difference" C 209 3.502 0.137 3.508 19854 58 1 10 "Average Difference" CA 210 4.634 -0.679 4.595 19854 59 1 10 "Average Difference" CB 194 4.047 -0.985 3.935 19854 60 1 10 "Average Difference" HN 201 0.942 0.106 0.939 19854 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 19854 _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 2 131.228 131.228 123.523 7.705 19854 2 1 . 1 1 2 2 ALA C C 2 187.031 187.031 179.310 7.721 19854 3 1 . 1 1 2 2 ALA CA C 2 53.407 53.407 55.146 -1.739 19854 4 1 . 1 1 2 2 ALA CB C 2 20.027 20.027 18.214 1.813 19854 5 1 . 1 1 2 2 ALA H H 2 10.644 10.644 8.414 2.230 19854 6 1 . 1 1 3 3 ALA N N 3 124.521 124.521 120.736 3.785 19854 7 1 . 1 1 3 3 ALA C C 3 176.566 176.566 179.168 -2.602 19854 8 1 . 1 1 3 3 ALA CA C 3 49.894 49.894 54.413 -4.519 19854 9 1 . 1 1 3 3 ALA CB C 3 18.270 18.270 18.038 0.232 19854 10 1 . 1 1 3 3 ALA H H 3 8.669 8.669 8.160 0.509 19854 11 1 . 1 1 4 4 GLN N N 4 118.080 118.080 116.833 1.247 19854 12 1 . 1 1 4 4 GLN C C 4 176.273 176.273 177.000 -0.727 19854 13 1 . 1 1 4 4 GLN CA C 4 54.579 54.579 56.636 -2.057 19854 14 1 . 1 1 4 4 GLN CB C 4 27.054 27.054 29.161 -2.107 19854 15 1 . 1 1 4 4 GLN H H 4 8.919 8.919 8.149 0.770 19854 16 1 . 1 1 5 5 GLY N N 5 121.002 121.002 106.074 14.928 19854 17 1 . 1 1 5 5 GLY C C 5 181.877 181.877 173.676 8.201 19854 18 1 . 1 1 5 5 GLY CA C 5 45.794 45.794 44.864 0.930 19854 19 1 . 1 1 5 5 GLY H H 5 8.082 8.082 7.978 0.104 19854 20 1 . 1 1 6 6 GLU N N 6 129.435 129.435 121.864 7.570 19854 21 1 . 1 1 6 6 GLU C C 6 176.566 176.566 175.097 1.469 19854 22 1 . 1 1 6 6 GLU CA C 6 56.336 56.336 53.026 3.310 19854 23 1 . 1 1 6 6 GLU CB C 6 28.811 28.811 30.292 -1.481 19854 24 1 . 1 1 6 6 GLU H H 6 9.267 9.267 7.883 1.384 19854 25 1 . 1 1 7 7 PRO C C 7 176.566 176.566 176.838 -0.272 19854 26 1 . 1 1 7 7 PRO CA C 7 63.672 63.672 64.602 -0.930 19854 27 1 . 1 1 7 7 PRO CB C 7 31.146 31.146 32.024 -0.878 19854 28 1 . 1 1 8 8 GLN N N 8 112.502 112.502 114.420 -1.917 19854 29 1 . 1 1 8 8 GLN C C 8 177.445 177.445 175.260 2.185 19854 30 1 . 1 1 8 8 GLN CA C 8 50.479 50.479 56.617 -6.139 19854 31 1 . 1 1 8 8 GLN CB C 8 28.811 28.811 30.622 -1.811 19854 32 1 . 1 1 8 8 GLN H H 8 6.220 6.220 8.263 -2.043 19854 33 1 . 1 1 9 9 VAL N N 9 117.416 117.416 117.888 -0.472 19854 34 1 . 1 1 9 9 VAL C C 9 178.324 178.324 173.803 4.521 19854 35 1 . 1 1 9 9 VAL CA C 9 63.363 63.363 60.657 2.706 19854 36 1 . 1 1 9 9 VAL CB C 9 34.668 34.668 34.437 0.231 19854 37 1 . 1 1 9 9 VAL H H 9 6.561 6.561 7.715 -1.153 19854 38 1 . 1 1 10 10 GLN N N 10 113.896 113.896 123.497 -9.601 19854 39 1 . 1 1 10 10 GLN C C 10 176.273 176.273 174.395 1.878 19854 40 1 . 1 1 10 10 GLN CA C 10 55.164 55.164 53.963 1.201 19854 41 1 . 1 1 10 10 GLN CB C 10 28.226 28.226 32.296 -4.070 19854 42 1 . 1 1 10 10 GLN H H 10 7.847 7.847 8.024 -0.177 19854 43 1 . 1 1 11 11 PHE N N 11 118.744 118.744 124.414 -5.670 19854 44 1 . 1 1 11 11 PHE C C 11 176.566 176.566 174.772 1.795 19854 45 1 . 1 1 11 11 PHE CA C 11 59.849 59.849 56.421 3.428 19854 46 1 . 1 1 11 11 PHE CB C 11 41.109 41.109 42.341 -1.232 19854 47 1 . 1 1 11 11 PHE H H 11 8.262 8.262 9.011 -0.749 19854 48 1 . 1 1 12 12 LYS N N 12 129.437 129.437 125.630 3.807 19854 49 1 . 1 1 12 12 LYS C C 12 178.609 178.609 174.966 3.643 19854 50 1 . 1 1 12 12 LYS CA C 12 57.808 57.808 55.842 1.966 19854 51 1 . 1 1 12 12 LYS H H 12 10.015 10.015 8.827 1.188 19854 52 1 . 1 1 13 13 LEU N N 13 112.103 112.103 129.234 -17.131 19854 53 1 . 1 1 13 13 LEU C C 13 177.738 177.738 174.804 2.933 19854 54 1 . 1 1 13 13 LEU CA C 13 54.579 54.579 53.472 1.107 19854 55 1 . 1 1 13 13 LEU CB C 13 42.866 42.866 45.613 -2.747 19854 56 1 . 1 1 13 13 LEU H H 13 6.905 6.905 8.988 -2.083 19854 57 1 . 1 1 14 14 VAL N N 14 127.310 127.310 126.296 1.014 19854 58 1 . 1 1 14 14 VAL C C 14 175.393 175.393 174.278 1.115 19854 59 1 . 1 1 14 14 VAL CA C 14 70.976 70.976 61.712 9.264 19854 60 1 . 1 1 14 14 VAL CB C 14 28.811 28.811 33.391 -4.580 19854 61 1 . 1 1 14 14 VAL H H 14 8.305 8.305 8.767 -0.462 19854 62 1 . 1 1 15 15 LEU N N 15 128.640 128.640 130.832 -2.192 19854 63 1 . 1 1 15 15 LEU C C 15 177.730 177.730 175.286 2.444 19854 64 1 . 1 1 15 15 LEU CA C 15 55.758 55.758 53.431 2.327 19854 65 1 . 1 1 15 15 LEU H H 15 7.718 7.718 8.992 -1.274 19854 66 1 . 1 1 16 16 VAL N N 16 121.267 121.267 121.011 0.256 19854 67 1 . 1 1 16 16 VAL C C 16 178.324 178.324 174.394 3.930 19854 68 1 . 1 1 16 16 VAL CA C 16 63.363 63.363 58.581 4.782 19854 69 1 . 1 1 16 16 VAL CB C 16 35.839 35.839 35.189 0.650 19854 70 1 . 1 1 16 16 VAL H H 16 8.935 8.935 8.858 0.077 19854 71 1 . 1 1 17 17 GLY N N 17 127.908 127.908 106.963 20.945 19854 72 1 . 1 1 17 17 GLY C C 17 174.514 174.514 172.983 1.531 19854 73 1 . 1 1 17 17 GLY CA C 17 42.281 42.281 44.598 -2.317 19854 74 1 . 1 1 17 17 GLY H H 17 9.682 9.682 6.824 2.858 19854 75 1 . 1 1 18 18 ASP N N 18 125.054 125.054 121.101 3.953 19854 76 1 . 1 1 18 18 ASP C C 18 176.851 176.851 177.554 -0.704 19854 77 1 . 1 1 18 18 ASP CA C 18 57.515 57.515 54.505 3.010 19854 78 1 . 1 1 18 18 ASP CB C 18 46.090 46.090 42.011 4.079 19854 79 1 . 1 1 18 18 ASP H H 18 8.282 8.282 8.373 -0.091 19854 80 1 . 1 1 19 19 GLY N N 19 120.670 120.670 106.658 14.012 19854 81 1 . 1 1 19 19 GLY C C 19 178.324 178.324 174.881 3.443 19854 82 1 . 1 1 19 19 GLY CA C 19 42.281 42.281 45.586 -3.305 19854 83 1 . 1 1 19 19 GLY H H 19 8.825 8.825 8.660 0.165 19854 84 1 . 1 1 20 20 GLY N N 20 129.369 129.369 112.464 16.905 19854 85 1 . 1 1 20 20 GLY C C 20 174.221 174.221 175.813 -1.592 19854 86 1 . 1 1 20 20 GLY CA C 20 41.695 41.695 45.499 -3.804 19854 87 1 . 1 1 20 20 GLY H H 20 8.477 8.477 8.292 0.185 19854 88 1 . 1 1 21 21 THR N N 21 122.199 122.199 115.471 6.728 19854 89 1 . 1 1 21 21 THR C C 21 171.291 171.291 175.036 -3.745 19854 90 1 . 1 1 21 21 THR CA C 21 61.914 61.914 65.428 -3.514 19854 91 1 . 1 1 21 21 THR CB C 21 65.137 65.137 69.275 -4.138 19854 92 1 . 1 1 21 21 THR H H 21 8.059 8.059 7.588 0.471 19854 93 1 . 1 1 22 22 GLY N N 22 112.369 112.369 107.155 5.214 19854 94 1 . 1 1 22 22 GLY C C 22 184.807 184.807 175.345 9.462 19854 95 1 . 1 1 22 22 GLY CA C 22 45.209 45.209 45.151 0.058 19854 96 1 . 1 1 22 22 GLY H H 22 6.772 6.772 8.330 -1.558 19854 97 1 . 1 1 23 23 LYS N N 23 122.066 122.066 120.548 1.518 19854 98 1 . 1 1 23 23 LYS C C 23 178.589 178.589 178.082 0.507 19854 99 1 . 1 1 23 23 LYS CA C 23 58.101 58.101 59.665 -1.564 19854 100 1 . 1 1 23 23 LYS CB C 23 40.230 40.230 32.243 7.987 19854 101 1 . 1 1 23 23 LYS H H 23 7.441 7.441 8.018 -0.577 19854 102 1 . 1 1 24 24 THR N N 24 114.627 114.627 114.469 0.158 19854 103 1 . 1 1 24 24 THR C C 24 178.324 178.324 176.739 1.585 19854 104 1 . 1 1 24 24 THR CA C 24 62.192 62.192 67.196 -5.004 19854 105 1 . 1 1 24 24 THR CB C 24 71.562 71.562 68.117 3.445 19854 106 1 . 1 1 24 24 THR H H 24 8.469 8.469 8.500 -0.031 19854 107 1 . 1 1 25 25 THR N N 25 110.377 110.377 119.356 -8.979 19854 108 1 . 1 1 25 25 THR C C 25 178.324 178.324 176.151 2.173 19854 109 1 . 1 1 25 25 THR CA C 25 64.534 64.534 67.323 -2.789 19854 110 1 . 1 1 25 25 THR CB C 25 71.562 71.562 68.472 3.090 19854 111 1 . 1 1 25 25 THR H H 25 8.415 8.415 8.188 0.227 19854 112 1 . 1 1 26 26 PHE N N 26 114.295 114.295 122.850 -8.555 19854 113 1 . 1 1 26 26 PHE C C 26 174.514 174.514 176.997 -2.483 19854 114 1 . 1 1 26 26 PHE CA C 26 53.407 53.407 61.961 -8.554 19854 115 1 . 1 1 26 26 PHE CB C 26 40.524 40.524 39.033 1.491 19854 116 1 . 1 1 26 26 PHE H H 26 7.707 7.707 8.486 -0.778 19854 117 1 . 1 1 27 27 VAL N N 27 123.525 123.525 120.258 3.267 19854 118 1 . 1 1 27 27 VAL C C 27 178.031 178.031 177.759 0.272 19854 119 1 . 1 1 27 27 VAL CA C 27 67.462 67.462 67.052 0.410 19854 120 1 . 1 1 27 27 VAL CB C 27 29.397 29.397 31.509 -2.112 19854 121 1 . 1 1 27 27 VAL H H 27 6.967 6.967 8.276 -1.308 19854 122 1 . 1 1 28 28 LYS N N 28 114.228 114.228 119.804 -5.576 19854 123 1 . 1 1 28 28 LYS C C 28 176.566 176.566 178.430 -1.864 19854 124 1 . 1 1 28 28 LYS CA C 28 58.092 58.092 59.764 -1.672 19854 125 1 . 1 1 28 28 LYS CB C 28 34.082 34.082 32.060 2.022 19854 126 1 . 1 1 28 28 LYS H H 28 7.429 7.429 8.205 -0.776 19854 127 1 . 1 1 29 29 ARG N N 29 112.037 112.037 119.609 -7.572 19854 128 1 . 1 1 29 29 ARG C C 29 174.221 174.221 179.046 -4.825 19854 129 1 . 1 1 29 29 ARG CA C 29 72.147 72.147 58.918 13.229 19854 130 1 . 1 1 29 29 ARG CB C 29 37.596 37.596 29.643 7.953 19854 131 1 . 1 1 29 29 ARG H H 29 6.803 6.803 7.993 -1.190 19854 132 1 . 1 1 30 30 HIS N N 30 122.396 122.396 117.571 4.825 19854 133 1 . 1 1 30 30 HIS C C 30 172.170 172.170 177.074 -4.904 19854 134 1 . 1 1 30 30 HIS CA C 30 51.651 51.651 59.323 -7.672 19854 135 1 . 1 1 30 30 HIS CB C 30 30.568 30.568 29.620 0.948 19854 136 1 . 1 1 30 30 HIS H H 30 7.644 7.644 7.661 -0.017 19854 137 1 . 1 1 31 31 LEU N N 31 110.377 110.377 118.431 -8.054 19854 138 1 . 1 1 31 31 LEU C C 31 178.031 178.031 178.619 -0.588 19854 139 1 . 1 1 31 31 LEU CA C 31 55.164 55.164 57.440 -2.276 19854 140 1 . 1 1 31 31 LEU CB C 31 42.281 42.281 42.220 0.061 19854 141 1 . 1 1 31 31 LEU H H 31 7.894 7.894 8.144 -0.250 19854 142 1 . 1 1 32 32 THR N N 32 121.468 121.468 106.126 15.342 19854 143 1 . 1 1 32 32 THR C C 32 170.705 170.705 175.542 -4.838 19854 144 1 . 1 1 32 32 THR CA C 32 63.668 63.668 61.826 1.842 19854 145 1 . 1 1 32 32 THR CB C 32 75.679 75.679 70.796 4.883 19854 146 1 . 1 1 32 32 THR H H 32 8.372 8.372 8.238 0.134 19854 147 1 . 1 1 33 33 GLY N N 33 127.841 127.841 110.201 17.640 19854 148 1 . 1 1 33 33 GLY C C 33 161.914 161.914 174.030 -12.116 19854 149 1 . 1 1 33 33 GLY CA C 33 42.866 42.866 44.820 -1.954 19854 150 1 . 1 1 33 33 GLY H H 33 9.662 9.662 7.718 1.944 19854 151 1 . 1 1 34 34 GLU N N 34 120.871 120.871 120.344 0.527 19854 152 1 . 1 1 34 34 GLU C C 34 174.508 174.508 175.018 -0.510 19854 153 1 . 1 1 34 34 GLU CA C 34 58.101 58.101 55.876 2.225 19854 154 1 . 1 1 34 34 GLU CB C 34 34.371 34.371 30.682 3.689 19854 155 1 . 1 1 34 34 GLU H H 34 8.211 8.211 7.447 0.764 19854 156 1 . 1 1 35 35 PHE N N 35 111.838 111.838 119.403 -7.565 19854 157 1 . 1 1 35 35 PHE C C 35 174.221 174.221 175.227 -1.006 19854 158 1 . 1 1 35 35 PHE CA C 35 49.308 49.308 56.955 -7.647 19854 159 1 . 1 1 35 35 PHE CB C 35 41.695 41.695 40.700 0.995 19854 160 1 . 1 1 35 35 PHE H H 35 6.772 6.772 8.390 -1.618 19854 161 1 . 1 1 36 36 GLU N N 36 120.672 120.672 125.423 -4.751 19854 162 1 . 1 1 36 36 GLU C C 36 175.686 175.686 176.090 -0.404 19854 163 1 . 1 1 36 36 GLU CA C 36 58.980 58.980 55.228 3.752 19854 164 1 . 1 1 36 36 GLU CB C 36 48.140 48.140 30.388 17.752 19854 165 1 . 1 1 36 36 GLU H H 36 8.293 8.293 8.716 -0.423 19854 166 1 . 1 1 37 37 LYS N N 37 118.810 118.810 125.741 -6.931 19854 167 1 . 1 1 37 37 LYS C C 37 172.756 172.756 176.951 -4.195 19854 168 1 . 1 1 37 37 LYS CA C 37 48.137 48.137 57.315 -9.178 19854 169 1 . 1 1 37 37 LYS CB C 37 37.010 37.010 33.082 3.927 19854 170 1 . 1 1 37 37 LYS H H 37 8.509 8.509 8.590 -0.081 19854 171 1 . 1 1 38 38 LYS N N 38 108.052 108.052 120.260 -12.208 19854 172 1 . 1 1 38 38 LYS C C 38 176.273 176.273 175.601 0.672 19854 173 1 . 1 1 38 38 LYS CA C 38 59.849 59.849 55.973 3.876 19854 174 1 . 1 1 38 38 LYS CB C 38 34.668 34.668 33.051 1.617 19854 175 1 . 1 1 38 38 LYS H H 38 7.715 7.715 7.779 -0.064 19854 176 1 . 1 1 39 39 TYR N N 39 108.650 108.650 124.281 -15.631 19854 177 1 . 1 1 39 39 TYR C C 39 175.686 175.686 175.370 0.316 19854 178 1 . 1 1 39 39 TYR CA C 39 61.020 61.020 58.102 2.918 19854 179 1 . 1 1 39 39 TYR CB C 39 36.424 36.424 39.161 -2.737 19854 180 1 . 1 1 39 39 TYR H H 39 7.362 7.362 8.571 -1.209 19854 181 1 . 1 1 40 40 VAL N N 40 117.947 117.947 126.850 -8.903 19854 182 1 . 1 1 40 40 VAL C C 40 175.393 175.393 174.933 0.460 19854 183 1 . 1 1 40 40 VAL CA C 40 61.020 61.020 60.886 0.135 19854 184 1 . 1 1 40 40 VAL CB C 40 31.154 31.154 34.272 -3.118 19854 185 1 . 1 1 40 40 VAL H H 40 8.442 8.442 8.241 0.201 19854 186 1 . 1 1 42 42 THR N N 42 117.150 117.150 118.209 -1.059 19854 187 1 . 1 1 42 42 THR C C 42 178.910 178.910 173.899 5.011 19854 188 1 . 1 1 42 42 THR CA C 42 60.435 60.435 62.675 -2.240 19854 189 1 . 1 1 42 42 THR CB C 42 70.390 70.390 69.702 0.688 19854 190 1 . 1 1 42 42 THR H H 42 8.192 8.192 8.394 -0.202 19854 191 1 . 1 1 43 43 LEU N N 43 119.209 119.209 127.781 -8.572 19854 192 1 . 1 1 43 43 LEU C C 43 174.807 174.807 177.666 -2.859 19854 193 1 . 1 1 43 43 LEU CA C 43 57.507 57.507 54.441 3.066 19854 194 1 . 1 1 43 43 LEU CB C 43 42.866 42.866 42.845 0.021 19854 195 1 . 1 1 43 43 LEU H H 43 9.260 9.260 8.502 0.758 19854 196 1 . 1 1 44 44 GLY N N 44 114.361 114.361 113.632 0.729 19854 197 1 . 1 1 44 44 GLY C C 44 178.910 178.910 172.768 6.142 19854 198 1 . 1 1 44 44 GLY CA C 44 54.579 54.579 45.943 8.636 19854 199 1 . 1 1 44 44 GLY H H 44 6.979 6.979 8.641 -1.662 19854 200 1 . 1 1 45 45 VAL N N 45 110.244 110.244 123.276 -13.032 19854 201 1 . 1 1 45 45 VAL C C 45 174.807 174.807 174.699 0.108 19854 202 1 . 1 1 45 45 VAL CA C 45 63.363 63.363 60.407 2.956 19854 203 1 . 1 1 45 45 VAL CB C 45 17.099 17.099 34.777 -17.678 19854 204 1 . 1 1 45 45 VAL H H 45 8.309 8.309 8.085 0.224 19854 205 1 . 1 1 46 46 GLU N N 46 130.365 130.365 128.184 2.181 19854 206 1 . 1 1 46 46 GLU C C 46 176.859 176.859 174.472 2.387 19854 207 1 . 1 1 46 46 GLU CA C 46 55.164 55.164 54.523 0.641 19854 208 1 . 1 1 46 46 GLU CB C 46 32.325 32.325 32.329 -0.004 19854 209 1 . 1 1 46 46 GLU H H 46 9.741 9.741 8.861 0.880 19854 210 1 . 1 1 47 47 VAL N N 47 125.254 125.254 125.250 0.004 19854 211 1 . 1 1 47 47 VAL C C 47 175.661 175.661 175.488 0.173 19854 212 1 . 1 1 47 47 VAL CA C 47 63.375 63.375 61.337 2.038 19854 213 1 . 1 1 47 47 VAL CB C 47 37.300 37.300 32.238 5.062 19854 214 1 . 1 1 47 47 VAL H H 47 8.250 8.250 8.142 0.108 19854 215 1 . 1 1 48 48 HIS N N 48 129.236 129.236 127.211 2.025 19854 216 1 . 1 1 48 48 HIS C C 48 169.240 169.240 173.020 -3.780 19854 217 1 . 1 1 48 48 HIS CA C 48 49.894 49.894 53.406 -3.512 19854 218 1 . 1 1 48 48 HIS CB C 48 27.640 27.640 32.315 -4.675 19854 219 1 . 1 1 48 48 HIS H H 48 10.390 10.390 9.194 1.196 19854 220 1 . 1 1 49 49 PRO C C 49 176.273 176.273 175.760 0.513 19854 221 1 . 1 1 49 49 PRO CA C 49 62.500 62.500 62.624 -0.124 19854 222 1 . 1 1 49 49 PRO CB C 49 29.974 29.974 32.366 -2.392 19854 223 1 . 1 1 50 50 LEU N N 50 119.408 119.408 127.130 -7.722 19854 224 1 . 1 1 50 50 LEU C C 50 177.445 177.445 175.002 2.443 19854 225 1 . 1 1 50 50 LEU CA C 50 59.264 59.264 54.296 4.968 19854 226 1 . 1 1 50 50 LEU CB C 50 42.281 42.281 45.451 -3.170 19854 227 1 . 1 1 50 50 LEU H H 50 7.492 7.492 9.026 -1.534 19854 228 1 . 1 1 51 51 VAL N N 51 117.947 117.947 124.525 -6.578 19854 229 1 . 1 1 51 51 VAL C C 51 174.514 174.514 175.284 -0.770 19854 230 1 . 1 1 51 51 VAL CA C 51 64.534 64.534 61.373 3.161 19854 231 1 . 1 1 51 51 VAL CB C 51 37.010 37.010 33.307 3.703 19854 232 1 . 1 1 51 51 VAL H H 51 7.715 7.715 8.164 -0.449 19854 233 1 . 1 1 52 52 PHE N N 52 124.853 124.853 126.228 -1.375 19854 234 1 . 1 1 52 52 PHE C C 52 175.100 175.100 174.369 0.731 19854 235 1 . 1 1 52 52 PHE CA C 52 56.336 56.336 56.548 -0.212 19854 236 1 . 1 1 52 52 PHE CB C 52 39.938 39.938 42.877 -2.939 19854 237 1 . 1 1 52 52 PHE H H 52 8.935 8.935 9.213 -0.278 19854 238 1 . 1 1 53 53 HIS N N 53 120.603 120.603 122.648 -2.045 19854 239 1 . 1 1 53 53 HIS C C 53 170.119 170.119 174.944 -4.825 19854 240 1 . 1 1 53 53 HIS CA C 53 55.164 55.164 55.569 -0.405 19854 241 1 . 1 1 53 53 HIS CB C 53 30.568 30.568 31.307 -0.739 19854 242 1 . 1 1 53 53 HIS H H 53 8.356 8.356 9.243 -0.887 19854 243 1 . 1 1 54 54 THR N N 54 112.634 112.634 116.690 -4.056 19854 244 1 . 1 1 54 54 THR C C 54 178.910 178.910 176.240 2.670 19854 245 1 . 1 1 54 54 THR CA C 54 63.363 63.363 59.331 4.032 19854 246 1 . 1 1 54 54 THR CB C 54 72.733 72.733 71.667 1.066 19854 247 1 . 1 1 54 54 THR H H 54 7.574 7.574 8.352 -0.778 19854 248 1 . 1 1 55 55 ASN N N 55 131.095 131.095 120.145 10.950 19854 249 1 . 1 1 55 55 ASN C C 55 176.273 176.273 176.517 -0.244 19854 250 1 . 1 1 55 55 ASN CA C 55 51.065 51.065 55.825 -4.760 19854 251 1 . 1 1 55 55 ASN CB C 55 37.010 37.010 38.315 -1.305 19854 252 1 . 1 1 55 55 ASN H H 55 10.187 10.187 8.611 1.576 19854 253 1 . 1 1 56 56 ARG N N 56 122.064 122.064 118.435 3.629 19854 254 1 . 1 1 56 56 ARG C C 56 175.100 175.100 176.134 -1.034 19854 255 1 . 1 1 56 56 ARG CA C 56 61.606 61.606 55.605 6.001 19854 256 1 . 1 1 56 56 ARG CB C 56 32.911 32.911 30.258 2.653 19854 257 1 . 1 1 56 56 ARG H H 56 7.433 7.433 7.800 -0.367 19854 258 1 . 1 1 57 57 GLY N N 57 127.709 127.709 108.209 19.500 19854 259 1 . 1 1 57 57 GLY C C 57 175.979 175.979 171.997 3.982 19854 260 1 . 1 1 57 57 GLY CA C 57 42.281 42.281 44.241 -1.960 19854 261 1 . 1 1 57 57 GLY H H 57 9.373 9.373 7.673 1.700 19854 262 1 . 1 1 58 58 PRO C C 58 177.152 177.152 175.990 1.162 19854 263 1 . 1 1 58 58 PRO CA C 58 65.137 65.137 62.994 2.143 19854 264 1 . 1 1 58 58 PRO CB C 58 29.095 29.095 32.132 -3.037 19854 265 1 . 1 1 59 59 ILE N N 59 128.638 128.638 118.548 10.090 19854 266 1 . 1 1 59 59 ILE C C 59 175.979 175.979 174.090 1.889 19854 267 1 . 1 1 59 59 ILE CA C 59 65.120 65.120 59.585 5.535 19854 268 1 . 1 1 59 59 ILE CB C 59 40.524 40.524 42.340 -1.816 19854 269 1 . 1 1 59 59 ILE H H 59 8.794 8.794 8.917 -0.123 19854 270 1 . 1 1 60 60 LYS N N 60 127.711 127.711 124.662 3.049 19854 271 1 . 1 1 60 60 LYS C C 60 178.902 178.902 174.894 4.008 19854 272 1 . 1 1 60 60 LYS CA C 60 74.293 74.293 54.383 19.910 19854 273 1 . 1 1 60 60 LYS CB C 60 32.027 32.027 35.972 -3.945 19854 274 1 . 1 1 60 60 LYS H H 60 8.024 8.024 8.601 -0.577 19854 275 1 . 1 1 61 61 PHE N N 61 120.670 120.670 124.968 -4.298 19854 276 1 . 1 1 61 61 PHE C C 61 175.393 175.393 175.081 0.312 19854 277 1 . 1 1 61 61 PHE CA C 61 57.507 57.507 56.846 0.661 19854 278 1 . 1 1 61 61 PHE CB C 61 41.109 41.109 40.990 0.119 19854 279 1 . 1 1 61 61 PHE H H 61 7.515 7.515 9.543 -2.028 19854 280 1 . 1 1 62 62 ASN N N 62 124.789 124.789 124.023 0.766 19854 281 1 . 1 1 62 62 ASN C C 62 173.336 173.336 174.453 -1.117 19854 282 1 . 1 1 62 62 ASN CA C 62 53.121 53.121 52.405 0.716 19854 283 1 . 1 1 62 62 ASN CB C 62 41.695 41.695 39.282 2.413 19854 284 1 . 1 1 62 62 ASN H H 62 8.325 8.325 9.230 -0.905 19854 285 1 . 1 1 63 63 VAL N N 63 106.127 106.127 127.001 -20.874 19854 286 1 . 1 1 63 63 VAL C C 63 175.100 175.100 175.376 -0.276 19854 287 1 . 1 1 63 63 VAL CA C 63 61.020 61.020 62.852 -1.832 19854 288 1 . 1 1 63 63 VAL CB C 63 31.154 31.154 32.737 -1.583 19854 289 1 . 1 1 63 63 VAL H H 63 8.113 8.113 8.973 -0.860 19854 290 1 . 1 1 64 64 TRP N N 64 129.302 129.302 129.779 -0.477 19854 291 1 . 1 1 64 64 TRP C C 64 177.152 177.152 175.247 1.905 19854 292 1 . 1 1 64 64 TRP CA C 64 59.264 59.264 55.082 4.182 19854 293 1 . 1 1 64 64 TRP CB C 64 29.397 29.397 29.714 -0.317 19854 294 1 . 1 1 64 64 TRP H H 64 8.970 8.970 9.560 -0.590 19854 295 1 . 1 1 65 65 ASP N N 65 119.607 119.607 126.059 -6.452 19854 296 1 . 1 1 65 65 ASP C C 65 174.514 174.514 175.797 -1.283 19854 297 1 . 1 1 65 65 ASP CA C 65 55.164 55.164 53.217 1.947 19854 298 1 . 1 1 65 65 ASP CB C 65 41.109 41.109 43.079 -1.970 19854 299 1 . 1 1 65 65 ASP H H 65 8.638 8.638 9.101 -0.463 19854 300 1 . 1 1 66 66 THR N N 66 122.463 122.463 117.810 4.653 19854 301 1 . 1 1 66 66 THR C C 66 178.617 178.617 174.137 4.480 19854 302 1 . 1 1 66 66 THR CA C 66 68.048 68.048 59.718 8.330 19854 303 1 . 1 1 66 66 THR CB C 66 71.562 71.562 71.151 0.410 19854 304 1 . 1 1 66 66 THR H H 66 8.293 8.293 8.361 -0.068 19854 305 1 . 1 1 67 67 ALA N N 67 104.865 104.865 122.759 -17.894 19854 306 1 . 1 1 67 67 ALA C C 67 177.738 177.738 177.946 -0.208 19854 307 1 . 1 1 67 67 ALA CA C 67 48.722 48.722 51.554 -2.832 19854 308 1 . 1 1 67 67 ALA CB C 67 14.171 14.171 20.056 -5.885 19854 309 1 . 1 1 67 67 ALA H H 67 8.657 8.657 7.950 0.707 19854 310 1 . 1 1 68 68 GLY N N 68 115.357 115.357 110.003 5.354 19854 311 1 . 1 1 68 68 GLY C C 68 189.533 189.533 176.074 13.459 19854 312 1 . 1 1 68 68 GLY CA C 68 45.209 45.209 46.094 -0.885 19854 313 1 . 1 1 68 68 GLY H H 68 10.969 10.969 8.985 1.984 19854 314 1 . 1 1 69 69 GLN N N 69 122.730 122.730 119.889 2.841 19854 315 1 . 1 1 69 69 GLN C C 69 174.508 174.508 176.324 -1.816 19854 316 1 . 1 1 69 69 GLN CA C 69 58.394 58.394 57.534 0.860 19854 317 1 . 1 1 69 69 GLN CB C 69 31.441 31.441 28.731 2.710 19854 318 1 . 1 1 69 69 GLN H H 69 8.336 8.336 8.526 -0.190 19854 319 1 . 1 1 70 70 GLU N N 70 114.826 114.826 120.186 -5.360 19854 320 1 . 1 1 70 70 GLU C C 70 176.273 176.273 175.700 0.573 19854 321 1 . 1 1 70 70 GLU CA C 70 57.507 57.507 56.439 1.068 19854 322 1 . 1 1 70 70 GLU CB C 70 28.811 28.811 30.324 -1.513 19854 323 1 . 1 1 70 70 GLU H H 70 9.651 9.651 8.294 1.357 19854 324 1 . 1 1 71 71 LYS N N 71 116.685 116.685 122.869 -6.184 19854 325 1 . 1 1 71 71 LYS C C 71 175.979 175.979 176.380 -0.400 19854 326 1 . 1 1 71 71 LYS CA C 71 48.722 48.722 56.028 -7.306 19854 327 1 . 1 1 71 71 LYS CB C 71 37.010 37.010 32.921 4.089 19854 328 1 . 1 1 71 71 LYS H H 71 8.712 8.712 8.288 0.424 19854 329 1 . 1 1 72 72 PHE N N 72 114.959 114.959 120.188 -5.229 19854 330 1 . 1 1 72 72 PHE C C 72 175.686 175.686 176.727 -1.041 19854 331 1 . 1 1 72 72 PHE CA C 72 56.336 56.336 58.783 -2.447 19854 332 1 . 1 1 72 72 PHE CB C 72 36.424 36.424 38.889 -2.465 19854 333 1 . 1 1 72 72 PHE H H 72 7.965 7.965 8.046 -0.081 19854 334 1 . 1 1 73 73 GLY N N 73 117.084 117.084 111.647 5.437 19854 335 1 . 1 1 73 73 GLY C C 73 168.068 168.068 174.605 -6.537 19854 336 1 . 1 1 73 73 GLY CA C 73 42.281 42.281 44.886 -2.605 19854 337 1 . 1 1 73 73 GLY H H 73 7.609 7.609 7.818 -0.209 19854 338 1 . 1 1 74 74 GLY N N 74 120.537 120.537 108.093 12.445 19854 339 1 . 1 1 74 74 GLY C C 74 174.514 174.514 176.432 -1.918 19854 340 1 . 1 1 74 74 GLY CA C 74 44.037 44.037 46.512 -2.475 19854 341 1 . 1 1 74 74 GLY H H 74 9.326 9.326 8.649 0.677 19854 342 1 . 1 1 75 75 LEU N N 75 127.177 127.177 120.937 6.240 19854 343 1 . 1 1 75 75 LEU C C 75 178.617 178.617 177.915 0.702 19854 344 1 . 1 1 75 75 LEU CA C 75 53.407 53.407 56.897 -3.490 19854 345 1 . 1 1 75 75 LEU CB C 75 42.281 42.281 41.738 0.543 19854 346 1 . 1 1 75 75 LEU H H 75 7.628 7.628 7.751 -0.123 19854 347 1 . 1 1 76 76 ARG N N 76 116.486 116.486 116.503 -0.017 19854 348 1 . 1 1 76 76 ARG C C 76 176.859 176.859 176.906 -0.047 19854 349 1 . 1 1 76 76 ARG CA C 76 59.264 59.264 55.915 3.349 19854 350 1 . 1 1 76 76 ARG CB C 76 31.154 31.154 29.624 1.530 19854 351 1 . 1 1 76 76 ARG H H 76 7.143 7.143 7.482 -0.339 19854 352 1 . 1 1 77 77 ASP N N 77 129.236 129.236 120.721 8.515 19854 353 1 . 1 1 77 77 ASP C C 77 177.152 177.152 177.926 -0.774 19854 354 1 . 1 1 77 77 ASP CA C 77 52.822 52.822 57.748 -4.926 19854 355 1 . 1 1 77 77 ASP CB C 77 41.695 41.695 40.368 1.327 19854 356 1 . 1 1 77 77 ASP H H 77 8.947 8.947 7.557 1.390 19854 357 1 . 1 1 78 78 GLY N N 78 127.244 127.244 107.312 19.932 19854 358 1 . 1 1 78 78 GLY C C 78 173.928 173.928 176.204 -2.276 19854 359 1 . 1 1 78 78 GLY CA C 78 44.623 44.623 47.055 -2.432 19854 360 1 . 1 1 78 78 GLY H H 78 8.219 8.219 8.448 -0.229 19854 361 1 . 1 1 79 79 TYR N N 79 120.537 120.537 118.809 1.728 19854 362 1 . 1 1 79 79 TYR C C 79 176.273 176.273 177.331 -1.058 19854 363 1 . 1 1 79 79 TYR CA C 79 58.678 58.678 59.050 -0.372 19854 364 1 . 1 1 79 79 TYR CB C 79 40.524 40.524 38.024 2.500 19854 365 1 . 1 1 79 79 TYR H H 79 8.563 8.563 7.425 1.138 19854 366 1 . 1 1 80 80 TYR N N 80 122.132 122.132 117.575 4.557 19854 367 1 . 1 1 80 80 TYR C C 80 175.979 175.979 175.920 0.059 19854 368 1 . 1 1 80 80 TYR CA C 80 62.203 62.203 59.190 3.013 19854 369 1 . 1 1 80 80 TYR CB C 80 41.988 41.988 39.493 2.495 19854 370 1 . 1 1 80 80 TYR H H 80 8.254 8.254 7.590 0.664 19854 371 1 . 1 1 81 81 ILE N N 81 120.072 120.072 120.051 0.020 19854 372 1 . 1 1 81 81 ILE C C 81 177.445 177.445 175.836 1.609 19854 373 1 . 1 1 81 81 ILE CA C 81 67.462 67.462 63.424 4.038 19854 374 1 . 1 1 81 81 ILE CB C 81 41.109 41.109 37.988 3.121 19854 375 1 . 1 1 81 81 ILE H H 81 8.837 8.837 8.001 0.836 19854 376 1 . 1 1 82 82 GLN N N 82 121.601 121.601 120.392 1.209 19854 377 1 . 1 1 82 82 GLN C C 82 173.342 173.342 174.455 -1.113 19854 378 1 . 1 1 82 82 GLN CA C 82 59.859 59.859 56.559 3.300 19854 379 1 . 1 1 82 82 GLN CB C 82 30.855 30.855 26.315 4.540 19854 380 1 . 1 1 82 82 GLN H H 82 8.184 8.184 8.941 -0.757 19854 381 1 . 1 1 83 83 ALA N N 83 109.713 109.713 120.154 -10.441 19854 382 1 . 1 1 83 83 ALA C C 83 175.979 175.979 176.956 -0.977 19854 383 1 . 1 1 83 83 ALA CA C 83 54.579 54.579 52.536 2.043 19854 384 1 . 1 1 83 83 ALA CB C 83 16.513 16.513 19.231 -2.718 19854 385 1 . 1 1 83 83 ALA H H 83 6.306 6.306 7.427 -1.121 19854 386 1 . 1 1 84 84 GLN N N 84 121.203 121.203 120.786 0.417 19854 387 1 . 1 1 84 84 GLN C C 84 177.144 177.144 176.030 1.114 19854 388 1 . 1 1 84 84 GLN CA C 84 60.152 60.152 56.567 3.585 19854 389 1 . 1 1 84 84 GLN CB C 84 34.957 34.957 31.043 3.914 19854 390 1 . 1 1 84 84 GLN H H 84 8.180 8.180 8.633 -0.453 19854 391 1 . 1 1 85 85 CYS N N 85 120.605 120.605 112.075 8.530 19854 392 1 . 1 1 85 85 CYS C C 85 176.566 176.566 172.697 3.869 19854 393 1 . 1 1 85 85 CYS CA C 85 65.430 65.430 56.336 9.094 19854 394 1 . 1 1 85 85 CYS CB C 85 39.644 39.644 31.669 7.975 19854 395 1 . 1 1 85 85 CYS H H 85 8.364 8.364 7.725 0.639 19854 396 1 . 1 1 86 86 ALA N N 86 114.295 114.295 121.710 -7.415 19854 397 1 . 1 1 86 86 ALA CA C 86 57.507 57.507 50.786 6.721 19854 398 1 . 1 1 86 86 ALA CB C 86 21.784 21.784 22.924 -1.140 19854 399 1 . 1 1 86 86 ALA H H 86 6.897 6.897 8.733 -1.836 19854 400 1 . 1 1 87 87 ILE N N 87 120.670 120.670 120.644 0.026 19854 401 1 . 1 1 87 87 ILE C C 87 173.928 173.928 174.639 -0.712 19854 402 1 . 1 1 87 87 ILE CA C 87 61.020 61.020 60.012 1.008 19854 403 1 . 1 1 87 87 ILE CB C 87 39.938 39.938 41.374 -1.436 19854 404 1 . 1 1 87 87 ILE H H 87 8.282 8.282 8.631 -0.349 19854 405 1 . 1 1 88 88 ILE N N 88 120.205 120.205 127.287 -7.082 19854 406 1 . 1 1 88 88 ILE C C 88 173.635 173.635 174.731 -1.096 19854 407 1 . 1 1 88 88 ILE CA C 88 64.534 64.534 60.189 4.345 19854 408 1 . 1 1 88 88 ILE CB C 88 37.596 37.596 40.000 -2.404 19854 409 1 . 1 1 88 88 ILE H H 88 5.528 5.528 8.974 -3.446 19854 410 1 . 1 1 89 89 MET N N 89 120.472 120.472 126.530 -6.058 19854 411 1 . 1 1 89 89 MET C C 89 178.617 178.617 175.050 3.567 19854 412 1 . 1 1 89 89 MET CA C 89 58.980 58.980 54.154 4.826 19854 413 1 . 1 1 89 89 MET CB C 89 34.957 34.957 35.262 -0.305 19854 414 1 . 1 1 89 89 MET H H 89 8.176 8.176 8.650 -0.474 19854 415 1 . 1 1 90 90 PHE N N 90 121.134 121.134 119.316 1.818 19854 416 1 . 1 1 90 90 PHE C C 90 175.393 175.393 173.085 2.308 19854 417 1 . 1 1 90 90 PHE CA C 90 60.435 60.435 55.466 4.969 19854 418 1 . 1 1 90 90 PHE CB C 90 38.767 38.767 42.250 -3.483 19854 419 1 . 1 1 90 90 PHE H H 90 9.334 9.334 8.765 0.569 19854 420 1 . 1 1 91 91 ASP N N 91 120.273 120.273 121.055 -0.781 19854 421 1 . 1 1 91 91 ASP C C 91 177.730 177.730 178.105 -0.375 19854 422 1 . 1 1 91 91 ASP CA C 91 59.859 59.859 52.138 7.721 19854 423 1 . 1 1 91 91 ASP CB C 91 44.039 44.039 42.724 1.315 19854 424 1 . 1 1 91 91 ASP H H 91 7.597 7.597 8.889 -1.292 19854 425 1 . 1 1 92 92 VAL N N 92 115.158 115.158 123.598 -8.440 19854 426 1 . 1 1 92 92 VAL C C 92 173.342 173.342 176.591 -3.249 19854 427 1 . 1 1 92 92 VAL CA C 92 64.534 64.534 64.988 -0.454 19854 428 1 . 1 1 92 92 VAL CB C 92 37.596 37.596 31.348 6.248 19854 429 1 . 1 1 92 92 VAL H H 92 7.738 7.738 8.517 -0.778 19854 430 1 . 1 1 93 93 THR N N 93 127.179 127.179 110.243 16.936 19854 431 1 . 1 1 93 93 THR C C 93 178.902 178.902 174.593 4.309 19854 432 1 . 1 1 93 93 THR CA C 93 64.254 64.254 63.033 1.221 19854 433 1 . 1 1 93 93 THR CB C 93 74.215 74.215 69.112 5.103 19854 434 1 . 1 1 93 93 THR H H 93 7.636 7.636 8.208 -0.572 19854 435 1 . 1 1 94 94 SER N N 94 122.263 122.263 116.334 5.929 19854 436 1 . 1 1 94 94 SER C C 94 163.965 163.965 174.941 -10.976 19854 437 1 . 1 1 94 94 SER CA C 94 59.849 59.849 55.493 4.356 19854 438 1 . 1 1 94 94 SER CB C 94 62.192 62.192 64.238 -2.046 19854 439 1 . 1 1 94 94 SER H H 94 7.628 7.628 7.884 -0.256 19854 440 1 . 1 1 95 95 ARG N N 95 113.099 113.099 128.606 -15.507 19854 441 1 . 1 1 95 95 ARG C C 95 176.273 176.273 177.973 -1.700 19854 442 1 . 1 1 95 95 ARG CA C 95 53.407 53.407 59.538 -6.131 19854 443 1 . 1 1 95 95 ARG CB C 95 31.154 31.154 30.038 1.116 19854 444 1 . 1 1 95 95 ARG H H 95 8.102 8.102 9.071 -0.969 19854 445 1 . 1 1 96 96 VAL N N 96 124.787 124.787 119.165 5.622 19854 446 1 . 1 1 96 96 VAL C C 96 178.031 178.031 177.762 0.269 19854 447 1 . 1 1 96 96 VAL CA C 96 68.634 68.634 66.452 2.182 19854 448 1 . 1 1 96 96 VAL CB C 96 24.126 24.126 31.369 -7.243 19854 449 1 . 1 1 96 96 VAL H H 96 9.146 9.146 8.098 1.048 19854 450 1 . 1 1 97 97 THR N N 97 111.970 111.970 116.248 -4.278 19854 451 1 . 1 1 97 97 THR C C 97 178.031 178.031 176.111 1.920 19854 452 1 . 1 1 97 97 THR CA C 97 63.949 63.949 66.397 -2.448 19854 453 1 . 1 1 97 97 THR CB C 97 70.390 70.390 68.990 1.400 19854 454 1 . 1 1 97 97 THR H H 97 7.984 7.984 7.638 0.346 19854 455 1 . 1 1 98 98 TYR N N 98 113.232 113.232 121.254 -8.022 19854 456 1 . 1 1 98 98 TYR C C 98 176.273 176.273 177.576 -1.303 19854 457 1 . 1 1 98 98 TYR H H 98 7.605 7.605 7.769 -0.164 19854 458 1 . 1 1 99 99 LYS N N 99 123.726 123.726 118.733 4.993 19854 459 1 . 1 1 99 99 LYS C C 99 178.316 178.316 178.455 -0.139 19854 460 1 . 1 1 99 99 LYS CA C 99 58.691 58.691 59.414 -0.723 19854 461 1 . 1 1 99 99 LYS CB C 99 36.127 36.127 32.040 4.087 19854 462 1 . 1 1 99 99 LYS H H 99 8.360 8.360 8.061 0.299 19854 463 1 . 1 1 100 100 ASN N N 100 111.970 111.970 116.164 -4.194 19854 464 1 . 1 1 100 100 ASN C C 100 175.979 175.979 176.752 -0.773 19854 465 1 . 1 1 100 100 ASN CA C 100 53.407 53.407 55.002 -1.595 19854 466 1 . 1 1 100 100 ASN CB C 100 37.596 37.596 38.664 -1.068 19854 467 1 . 1 1 100 100 ASN H H 100 5.778 5.778 7.770 -1.992 19854 468 1 . 1 1 101 101 VAL N N 101 118.877 118.877 121.671 -2.794 19854 469 1 . 1 1 101 101 VAL C C 101 173.635 173.635 175.000 -1.365 19854 470 1 . 1 1 101 101 VAL CA C 101 62.777 62.777 68.457 -5.680 19854 471 1 . 1 1 101 101 VAL CB C 101 27.054 27.054 29.235 -2.181 19854 472 1 . 1 1 101 101 VAL H H 101 7.370 7.370 7.573 -0.203 19854 473 1 . 1 1 102 102 PRO C C 102 176.566 176.566 177.156 -0.590 19854 474 1 . 1 1 102 102 PRO CA C 102 62.500 62.500 65.346 -2.846 19854 475 1 . 1 1 102 102 PRO CB C 102 30.853 30.853 31.057 -0.204 19854 476 1 . 1 1 103 103 ASN N N 103 122.728 122.728 115.217 7.511 19854 477 1 . 1 1 103 103 ASN C C 103 175.100 175.100 176.918 -1.818 19854 478 1 . 1 1 103 103 ASN CA C 103 54.579 54.579 54.742 -0.163 19854 479 1 . 1 1 103 103 ASN CB C 103 38.767 38.767 37.281 1.486 19854 480 1 . 1 1 103 103 ASN H H 103 7.879 7.879 7.364 0.515 19854 481 1 . 1 1 104 104 TRP N N 104 122.730 122.730 120.094 2.637 19854 482 1 . 1 1 104 104 TRP C C 104 174.215 174.215 177.450 -3.235 19854 483 1 . 1 1 104 104 TRP CA C 104 59.273 59.273 60.512 -1.239 19854 484 1 . 1 1 104 104 TRP CB C 104 35.250 35.250 30.029 5.221 19854 485 1 . 1 1 104 104 TRP H H 104 7.902 7.902 7.729 0.173 19854 486 1 . 1 1 105 105 HIS N N 105 120.869 120.869 117.078 3.791 19854 487 1 . 1 1 105 105 HIS C C 105 177.738 177.738 174.361 3.377 19854 488 1 . 1 1 105 105 HIS H H 105 6.971 6.971 8.424 -1.453 19854 489 1 . 1 1 106 106 ARG N N 106 126.314 126.314 122.683 3.631 19854 490 1 . 1 1 106 106 ARG C C 106 176.566 176.566 176.463 0.103 19854 491 1 . 1 1 106 106 ARG CA C 106 62.777 62.777 57.531 5.246 19854 492 1 . 1 1 106 106 ARG CB C 106 29.397 29.397 31.266 -1.869 19854 493 1 . 1 1 106 106 ARG H H 106 7.507 7.507 7.865 -0.358 19854 494 1 . 1 1 107 107 ASP N N 107 119.076 119.076 121.873 -2.797 19854 495 1 . 1 1 107 107 ASP C C 107 176.566 176.566 178.508 -1.942 19854 496 1 . 1 1 107 107 ASP CA C 107 55.164 55.164 57.675 -2.511 19854 497 1 . 1 1 107 107 ASP CB C 107 41.695 41.695 40.924 0.771 19854 498 1 . 1 1 107 107 ASP H H 107 9.076 9.076 7.896 1.180 19854 499 1 . 1 1 108 108 LEU N N 108 113.299 113.299 119.700 -6.400 19854 500 1 . 1 1 108 108 LEU C C 108 176.273 176.273 178.373 -2.101 19854 501 1 . 1 1 108 108 LEU CA C 108 59.264 59.264 58.200 1.064 19854 502 1 . 1 1 108 108 LEU CB C 108 48.722 48.722 41.375 7.347 19854 503 1 . 1 1 108 108 LEU H H 108 6.725 6.725 7.880 -1.155 19854 504 1 . 1 1 109 109 VAL N N 109 121.267 121.267 116.741 4.526 19854 505 1 . 1 1 109 109 VAL C C 109 175.393 175.393 178.419 -3.026 19854 506 1 . 1 1 109 109 VAL CA C 109 63.949 63.949 65.611 -1.662 19854 507 1 . 1 1 109 109 VAL CB C 109 32.911 32.911 31.072 1.839 19854 508 1 . 1 1 109 109 VAL H H 109 8.763 8.763 7.712 1.051 19854 509 1 . 1 1 110 110 ARG N N 110 112.900 112.900 119.976 -7.076 19854 510 1 . 1 1 110 110 ARG C C 110 176.273 176.273 177.979 -1.706 19854 511 1 . 1 1 110 110 ARG CA C 110 57.507 57.507 59.336 -1.829 19854 512 1 . 1 1 110 110 ARG CB C 110 30.568 30.568 30.228 0.340 19854 513 1 . 1 1 110 110 ARG H H 110 7.241 7.241 7.846 -0.605 19854 514 1 . 1 1 111 111 VAL N N 111 115.556 115.556 116.841 -1.285 19854 515 1 . 1 1 111 111 VAL C C 111 177.445 177.445 177.007 0.438 19854 516 1 . 1 1 111 111 VAL CA C 111 59.849 59.849 65.278 -5.429 19854 517 1 . 1 1 111 111 VAL CB C 111 32.911 32.911 32.810 0.101 19854 518 1 . 1 1 111 111 VAL H H 111 7.566 7.566 7.691 -0.125 19854 519 1 . 1 1 112 112 CYS N N 112 114.295 114.295 115.772 -1.477 19854 520 1 . 1 1 112 112 CYS C C 112 169.826 169.826 174.636 -4.811 19854 521 1 . 1 1 112 112 CYS CA C 112 57.507 57.507 59.103 -1.596 19854 522 1 . 1 1 112 112 CYS CB C 112 35.839 35.839 28.909 6.930 19854 523 1 . 1 1 112 112 CYS H H 112 7.425 7.425 8.249 -0.824 19854 524 1 . 1 1 113 113 GLU N N 113 116.486 116.486 117.964 -1.478 19854 525 1 . 1 1 113 113 GLU C C 113 176.566 176.566 175.661 0.905 19854 526 1 . 1 1 113 113 GLU CA C 113 69.219 69.219 58.364 10.855 19854 527 1 . 1 1 113 113 GLU CB C 113 30.568 30.568 28.288 2.280 19854 528 1 . 1 1 113 113 GLU H H 113 7.241 7.241 8.179 -0.938 19854 529 1 . 1 1 114 114 ASN N N 114 129.302 129.302 121.795 7.507 19854 530 1 . 1 1 114 114 ASN C C 114 175.100 175.100 174.783 0.317 19854 531 1 . 1 1 114 114 ASN CA C 114 52.236 52.236 52.969 -0.733 19854 532 1 . 1 1 114 114 ASN CB C 114 39.938 39.938 38.208 1.730 19854 533 1 . 1 1 114 114 ASN H H 114 8.919 8.919 8.318 0.601 19854 534 1 . 1 1 115 115 ILE N N 115 110.443 110.443 120.876 -10.433 19854 535 1 . 1 1 115 115 ILE C C 115 175.100 175.100 173.341 1.759 19854 536 1 . 1 1 115 115 ILE CA C 115 65.705 65.705 57.939 7.766 19854 537 1 . 1 1 115 115 ILE CB C 115 39.353 39.353 39.958 -0.605 19854 538 1 . 1 1 115 115 ILE H H 115 9.287 9.287 7.893 1.394 19854 539 1 . 1 1 116 116 PRO C C 116 175.979 175.979 175.650 0.329 19854 540 1 . 1 1 116 116 PRO CA C 116 63.086 63.086 63.158 -0.072 19854 541 1 . 1 1 116 116 PRO CB C 116 29.681 29.681 32.361 -2.681 19854 542 1 . 1 1 117 117 ILE N N 117 123.591 123.591 124.077 -0.486 19854 543 1 . 1 1 117 117 ILE C C 117 174.807 174.807 175.036 -0.229 19854 544 1 . 1 1 117 117 ILE CA C 117 66.291 66.291 60.319 5.972 19854 545 1 . 1 1 117 117 ILE CB C 117 38.767 38.767 42.247 -3.480 19854 546 1 . 1 1 117 117 ILE H H 117 7.781 7.781 8.532 -0.751 19854 547 1 . 1 1 118 118 VAL N N 118 119.009 119.009 125.801 -6.792 19854 548 1 . 1 1 118 118 VAL C C 118 178.324 178.324 174.771 3.553 19854 549 1 . 1 1 118 118 VAL CA C 118 62.777 62.777 60.784 1.993 19854 550 1 . 1 1 118 118 VAL CB C 118 31.154 31.154 34.059 -2.905 19854 551 1 . 1 1 118 118 VAL H H 118 8.767 8.767 8.700 0.067 19854 552 1 . 1 1 119 119 LEU N N 119 119.408 119.408 126.865 -7.457 19854 553 1 . 1 1 119 119 LEU C C 119 178.031 178.031 176.063 1.968 19854 554 1 . 1 1 119 119 LEU CA C 119 42.866 42.866 53.834 -10.968 19854 555 1 . 1 1 119 119 LEU CB C 119 38.767 38.767 43.729 -4.962 19854 556 1 . 1 1 119 119 LEU H H 119 7.734 7.734 9.211 -1.477 19854 557 1 . 1 1 120 120 CYS N N 120 113.232 113.232 122.313 -9.082 19854 558 1 . 1 1 120 120 CYS C C 120 178.031 178.031 174.232 3.799 19854 559 1 . 1 1 120 120 CYS H H 120 8.317 8.317 9.139 -0.822 19854 560 1 . 1 1 121 121 GLY N N 121 117.349 117.349 113.179 4.170 19854 561 1 . 1 1 121 121 GLY C C 121 176.851 176.851 172.886 3.966 19854 562 1 . 1 1 121 121 GLY CA C 121 41.109 41.109 43.639 -2.530 19854 563 1 . 1 1 121 121 GLY H H 121 7.515 7.515 8.948 -1.433 19854 564 1 . 1 1 122 122 ASN N N 122 125.318 125.318 124.926 0.392 19854 565 1 . 1 1 122 122 ASN C C 122 175.686 175.686 175.655 0.031 19854 566 1 . 1 1 122 122 ASN CA C 122 50.479 50.479 51.528 -1.049 19854 567 1 . 1 1 122 122 ASN CB C 122 39.353 39.353 40.613 -1.260 19854 568 1 . 1 1 122 122 ASN H H 122 9.162 9.162 8.571 0.591 19854 569 1 . 1 1 123 123 LYS N N 123 122.132 122.132 114.335 7.797 19854 570 1 . 1 1 123 123 LYS C C 123 173.043 173.043 177.155 -4.112 19854 571 1 . 1 1 123 123 LYS CA C 123 58.101 58.101 57.526 0.575 19854 572 1 . 1 1 123 123 LYS CB C 123 35.543 35.543 29.870 5.673 19854 573 1 . 1 1 123 123 LYS H H 123 7.953 7.953 8.727 -0.774 19854 574 1 . 1 1 124 124 VAL N N 124 123.726 123.726 113.012 10.714 19854 575 1 . 1 1 124 124 VAL C C 124 175.679 175.679 176.456 -0.777 19854 576 1 . 1 1 124 124 VAL CA C 124 64.840 64.840 64.617 0.223 19854 577 1 . 1 1 124 124 VAL CB C 124 42.574 42.574 31.412 11.162 19854 578 1 . 1 1 124 124 VAL H H 124 8.555 8.555 7.563 0.992 19854 579 1 . 1 1 125 125 ASP N N 125 119.607 119.607 119.800 -0.193 19854 580 1 . 1 1 125 125 ASP C C 125 176.566 176.566 176.926 -0.360 19854 581 1 . 1 1 125 125 ASP CA C 125 55.750 55.750 56.343 -0.593 19854 582 1 . 1 1 125 125 ASP CB C 125 40.524 40.524 40.930 -0.406 19854 583 1 . 1 1 125 125 ASP H H 125 7.875 7.875 8.177 -0.302 19854 584 1 . 1 1 126 126 ILE N N 126 116.088 116.088 120.673 -4.585 19854 585 1 . 1 1 126 126 ILE C C 126 177.152 177.152 176.540 0.612 19854 586 1 . 1 1 126 126 ILE CA C 126 66.291 66.291 61.828 4.463 19854 587 1 . 1 1 126 126 ILE CB C 126 39.353 39.353 38.325 1.028 19854 588 1 . 1 1 126 126 ILE H H 126 7.511 7.511 7.466 0.045 19854 589 1 . 1 1 127 127 LYS N N 127 121.203 121.203 125.771 -4.568 19854 590 1 . 1 1 127 127 LYS C C 127 175.979 175.979 177.208 -1.229 19854 591 1 . 1 1 127 127 LYS CA C 127 58.101 58.101 58.636 -0.535 19854 592 1 . 1 1 127 127 LYS CB C 127 35.834 35.834 32.590 3.245 19854 593 1 . 1 1 127 127 LYS H H 127 8.113 8.113 8.448 -0.335 19854 594 1 . 1 1 128 128 ASP N N 128 118.279 118.279 120.038 -1.759 19854 595 1 . 1 1 128 128 ASP C C 128 176.566 176.566 175.046 1.520 19854 596 1 . 1 1 128 128 ASP CA C 128 53.407 53.407 53.008 0.400 19854 597 1 . 1 1 128 128 ASP CB C 128 40.524 40.524 39.724 0.800 19854 598 1 . 1 1 128 128 ASP H H 128 7.241 7.241 8.217 -0.976 19854 599 1 . 1 1 129 129 ARG N N 129 118.943 118.943 123.004 -4.061 19854 600 1 . 1 1 129 129 ARG C C 129 177.738 177.738 176.495 1.243 19854 601 1 . 1 1 129 129 ARG CA C 129 45.794 45.794 56.428 -10.634 19854 602 1 . 1 1 129 129 ARG CB C 129 31.154 31.154 31.078 0.076 19854 603 1 . 1 1 129 129 ARG H H 129 8.423 8.423 7.836 0.588 19854 604 1 . 1 1 130 130 LYS N N 130 109.381 109.381 122.560 -13.179 19854 605 1 . 1 1 130 130 LYS C C 130 176.566 176.566 176.790 -0.224 19854 606 1 . 1 1 130 130 LYS CA C 130 55.164 55.164 56.892 -1.728 19854 607 1 . 1 1 130 130 LYS CB C 130 36.424 36.424 33.733 2.691 19854 608 1 . 1 1 130 130 LYS H H 130 7.296 7.296 8.433 -1.137 19854 609 1 . 1 1 131 131 VAL N N 131 110.377 110.377 121.448 -11.071 19854 610 1 . 1 1 131 131 VAL C C 131 178.617 178.617 174.725 3.892 19854 611 1 . 1 1 131 131 VAL CA C 131 65.705 65.705 61.750 3.955 19854 612 1 . 1 1 131 131 VAL CB C 131 35.839 35.839 31.375 4.464 19854 613 1 . 1 1 131 131 VAL H H 131 9.283 9.283 8.085 1.198 19854 614 1 . 1 1 132 132 LYS N N 132 110.310 110.310 127.833 -17.523 19854 615 1 . 1 1 132 132 LYS C C 132 176.273 176.273 177.447 -1.174 19854 616 1 . 1 1 132 132 LYS CA C 132 59.849 59.849 55.726 4.123 19854 617 1 . 1 1 132 132 LYS CB C 132 35.253 35.253 33.880 1.373 19854 618 1 . 1 1 132 132 LYS H H 132 9.709 9.709 8.231 1.478 19854 619 1 . 1 1 133 133 ALA N N 133 134.349 134.349 127.085 7.264 19854 620 1 . 1 1 133 133 ALA CA C 133 51.065 51.065 54.852 -3.787 19854 621 1 . 1 1 133 133 ALA CB C 133 12.999 12.999 18.487 -5.487 19854 622 1 . 1 1 133 133 ALA H H 133 6.322 6.322 8.771 -2.449 19854 623 1 . 1 1 134 134 LYS N N 134 117.615 117.615 117.755 -0.140 19854 624 1 . 1 1 134 134 LYS C C 134 176.859 176.859 178.033 -1.174 19854 625 1 . 1 1 134 134 LYS CA C 134 55.750 55.750 58.584 -2.834 19854 626 1 . 1 1 134 134 LYS CB C 134 54.579 54.579 32.347 22.232 19854 627 1 . 1 1 134 134 LYS H H 134 6.549 6.549 8.221 -1.672 19854 628 1 . 1 1 135 135 SER N N 135 109.314 109.314 113.967 -4.653 19854 629 1 . 1 1 135 135 SER C C 135 173.635 173.635 175.039 -1.404 19854 630 1 . 1 1 135 135 SER CA C 135 56.336 56.336 59.776 -3.440 19854 631 1 . 1 1 135 135 SER CB C 135 63.949 63.949 63.149 0.800 19854 632 1 . 1 1 135 135 SER H H 135 7.840 7.840 7.672 0.168 19854 633 1 . 1 1 136 136 ILE N N 136 124.123 124.123 122.041 2.082 19854 634 1 . 1 1 136 136 ILE C C 136 175.100 175.100 175.837 -0.737 19854 635 1 . 1 1 136 136 ILE CA C 136 68.634 68.634 62.823 5.811 19854 636 1 . 1 1 136 136 ILE CB C 136 43.452 43.452 37.951 5.501 19854 637 1 . 1 1 136 136 ILE H H 136 8.098 8.098 7.324 0.774 19854 638 1 . 1 1 137 137 VAL N N 137 113.232 113.232 123.615 -10.383 19854 639 1 . 1 1 137 137 VAL C C 137 176.859 176.859 176.145 0.714 19854 640 1 . 1 1 137 137 VAL CA C 137 64.534 64.534 61.706 2.828 19854 641 1 . 1 1 137 137 VAL CB C 137 34.082 34.082 33.040 1.042 19854 642 1 . 1 1 137 137 VAL H H 137 7.711 7.711 8.116 -0.405 19854 643 1 . 1 1 138 138 PHE N N 138 118.279 118.279 123.108 -4.829 19854 644 1 . 1 1 138 138 PHE C C 138 175.393 175.393 176.256 -0.863 19854 645 1 . 1 1 138 138 PHE CA C 138 58.092 58.092 62.548 -4.456 19854 646 1 . 1 1 138 138 PHE CB C 138 39.353 39.353 39.192 0.161 19854 647 1 . 1 1 138 138 PHE H H 138 8.317 8.317 7.651 0.666 19854 648 1 . 1 1 139 139 HIS N N 139 120.605 120.605 115.869 4.736 19854 649 1 . 1 1 139 139 HIS C C 139 175.979 175.979 177.088 -1.109 19854 650 1 . 1 1 139 139 HIS CA C 139 67.775 67.775 59.284 8.491 19854 651 1 . 1 1 139 139 HIS CB C 139 35.836 35.836 28.905 6.931 19854 652 1 . 1 1 139 139 HIS H H 139 8.094 8.094 8.913 -0.819 19854 653 1 . 1 1 140 140 ARG N N 140 120.140 120.140 120.159 -0.019 19854 654 1 . 1 1 140 140 ARG C C 140 178.023 178.023 179.157 -1.134 19854 655 1 . 1 1 140 140 ARG CA C 140 58.394 58.394 59.118 -0.724 19854 656 1 . 1 1 140 140 ARG CB C 140 39.644 39.644 29.677 9.967 19854 657 1 . 1 1 140 140 ARG H H 140 8.149 8.149 7.027 1.122 19854 658 1 . 1 1 141 141 LYS N N 141 115.623 115.623 119.834 -4.211 19854 659 1 . 1 1 141 141 LYS C C 141 173.635 173.635 178.099 -4.464 19854 660 1 . 1 1 141 141 LYS CA C 141 58.092 58.092 58.748 -0.656 19854 661 1 . 1 1 141 141 LYS CB C 141 33.496 33.496 32.272 1.224 19854 662 1 . 1 1 141 141 LYS H H 141 7.449 7.449 7.473 -0.024 19854 663 1 . 1 1 142 142 LYS N N 142 114.162 114.162 115.700 -1.538 19854 664 1 . 1 1 142 142 LYS C C 142 175.979 175.979 175.876 0.103 19854 665 1 . 1 1 142 142 LYS CA C 142 51.065 51.065 54.955 -3.890 19854 666 1 . 1 1 142 142 LYS CB C 142 34.668 34.668 31.998 2.670 19854 667 1 . 1 1 142 142 LYS H H 142 8.982 8.982 7.673 1.309 19854 668 1 . 1 1 143 143 ASN N N 143 112.103 112.103 115.645 -3.542 19854 669 1 . 1 1 143 143 ASN C C 143 175.100 175.100 174.152 0.948 19854 670 1 . 1 1 143 143 ASN CA C 143 53.407 53.407 53.984 -0.577 19854 671 1 . 1 1 143 143 ASN CB C 143 39.938 39.938 36.476 3.462 19854 672 1 . 1 1 143 143 ASN H H 143 7.402 7.402 7.745 -0.343 19854 673 1 . 1 1 144 144 LEU N N 144 118.810 118.810 116.839 1.971 19854 674 1 . 1 1 144 144 LEU CA C 144 53.993 53.993 53.366 0.627 19854 675 1 . 1 1 144 144 LEU CB C 144 42.866 42.866 44.324 -1.458 19854 676 1 . 1 1 144 144 LEU H H 144 7.793 7.793 8.025 -0.232 19854 677 1 . 1 1 145 145 GLN N N 145 119.607 119.607 118.145 1.462 19854 678 1 . 1 1 145 145 GLN C C 145 176.859 176.859 174.180 2.679 19854 679 1 . 1 1 145 145 GLN CA C 145 55.164 55.164 53.707 1.456 19854 680 1 . 1 1 145 145 GLN CB C 145 29.983 29.983 31.006 -1.024 19854 681 1 . 1 1 145 145 GLN H H 145 7.014 7.014 8.078 -1.063 19854 682 1 . 1 1 146 146 TYR N N 146 119.275 119.275 124.696 -5.421 19854 683 1 . 1 1 146 146 TYR C C 146 174.807 174.807 174.316 0.491 19854 684 1 . 1 1 146 146 TYR CA C 146 62.777 62.777 56.059 6.718 19854 685 1 . 1 1 146 146 TYR CB C 146 41.109 41.109 40.588 0.521 19854 686 1 . 1 1 146 146 TYR H H 146 9.350 9.350 8.169 1.180 19854 687 1 . 1 1 147 147 TYR N N 147 123.658 123.658 125.445 -1.787 19854 688 1 . 1 1 147 147 TYR C C 147 177.738 177.738 173.769 3.969 19854 689 1 . 1 1 147 147 TYR CA C 147 58.092 58.092 56.233 1.859 19854 690 1 . 1 1 147 147 TYR CB C 147 39.938 39.938 42.037 -2.099 19854 691 1 . 1 1 147 147 TYR H H 147 8.340 8.340 8.641 -0.301 19854 692 1 . 1 1 148 148 ASP N N 148 121.267 121.267 123.547 -2.280 19854 693 1 . 1 1 148 148 ASP C C 148 176.859 176.859 175.299 1.559 19854 694 1 . 1 1 148 148 ASP CA C 148 54.579 54.579 54.407 0.172 19854 695 1 . 1 1 148 148 ASP CB C 148 41.109 41.109 41.690 -0.581 19854 696 1 . 1 1 148 148 ASP H H 148 8.911 8.911 8.354 0.557 19854 697 1 . 1 1 149 149 ILE N N 149 119.607 119.607 118.180 1.427 19854 698 1 . 1 1 149 149 ILE C C 149 174.807 174.807 174.275 0.532 19854 699 1 . 1 1 149 149 ILE CA C 149 61.020 61.020 59.115 1.905 19854 700 1 . 1 1 149 149 ILE CB C 149 39.353 39.353 42.631 -3.278 19854 701 1 . 1 1 149 149 ILE H H 149 8.712 8.712 8.645 0.067 19854 702 1 . 1 1 150 150 SER N N 150 117.349 117.349 116.741 0.608 19854 703 1 . 1 1 150 150 SER C C 150 175.686 175.686 174.456 1.230 19854 704 1 . 1 1 150 150 SER CA C 150 60.435 60.435 55.598 4.837 19854 705 1 . 1 1 150 150 SER CB C 150 62.192 62.192 65.387 -3.195 19854 706 1 . 1 1 150 150 SER H H 150 8.454 8.454 8.495 -0.041 19854 707 1 . 1 1 151 151 ALA N N 151 131.162 131.162 131.189 -0.027 19854 708 1 . 1 1 151 151 ALA C C 151 160.742 160.742 179.164 -18.422 19854 709 1 . 1 1 151 151 ALA CA C 151 53.993 53.993 55.166 -1.173 19854 710 1 . 1 1 151 151 ALA CB C 151 22.369 22.369 18.952 3.417 19854 711 1 . 1 1 151 151 ALA H H 151 10.640 10.640 8.961 1.679 19854 712 1 . 1 1 152 152 LYS N N 152 121.400 121.400 117.907 3.493 19854 713 1 . 1 1 152 152 LYS C C 152 174.221 174.221 177.894 -3.673 19854 714 1 . 1 1 152 152 LYS CA C 152 59.849 59.849 58.630 1.219 19854 715 1 . 1 1 152 152 LYS CB C 152 34.668 34.668 32.562 2.106 19854 716 1 . 1 1 152 152 LYS H H 152 9.099 9.099 8.337 0.762 19854 717 1 . 1 1 153 153 SER N N 153 135.212 135.212 110.824 24.388 19854 718 1 . 1 1 153 153 SER C C 153 177.152 177.152 174.485 2.667 19854 719 1 . 1 1 153 153 SER CA C 153 62.192 62.192 58.319 3.873 19854 720 1 . 1 1 153 153 SER CB C 153 66.291 66.291 64.342 1.949 19854 721 1 . 1 1 153 153 SER H H 153 8.935 8.935 7.805 1.130 19854 722 1 . 1 1 154 154 ASN N N 154 119.341 119.341 115.937 3.404 19854 723 1 . 1 1 154 154 ASN C C 154 175.979 175.979 174.141 1.838 19854 724 1 . 1 1 154 154 ASN CA C 154 49.894 49.894 54.657 -4.763 19854 725 1 . 1 1 154 154 ASN CB C 154 39.353 39.353 36.650 2.703 19854 726 1 . 1 1 154 154 ASN H H 154 7.488 7.488 8.305 -0.817 19854 727 1 . 1 1 155 155 TYR N N 155 120.074 120.074 123.046 -2.972 19854 728 1 . 1 1 155 155 TYR C C 155 177.144 177.144 175.326 1.818 19854 729 1 . 1 1 155 155 TYR CA C 155 60.738 60.738 59.735 1.003 19854 730 1 . 1 1 155 155 TYR CB C 155 41.402 41.402 38.593 2.809 19854 731 1 . 1 1 155 155 TYR H H 155 7.945 7.945 7.527 0.418 19854 732 1 . 1 1 156 156 ASN N N 156 124.058 124.058 122.723 1.335 19854 733 1 . 1 1 156 156 ASN C C 156 175.679 175.679 175.750 -0.071 19854 734 1 . 1 1 156 156 ASN CA C 156 53.121 53.121 54.400 -1.279 19854 735 1 . 1 1 156 156 ASN CB C 156 38.179 38.179 35.873 2.306 19854 736 1 . 1 1 156 156 ASN H H 156 8.192 8.192 8.804 -0.612 19854 737 1 . 1 1 157 157 PHE N N 157 123.459 123.459 117.988 5.471 19854 738 1 . 1 1 157 157 PHE C C 157 174.221 174.221 176.128 -1.907 19854 739 1 . 1 1 157 157 PHE CA C 157 57.507 57.507 60.929 -3.422 19854 740 1 . 1 1 157 157 PHE CB C 157 39.353 39.353 38.775 0.578 19854 741 1 . 1 1 157 157 PHE H H 157 7.429 7.429 7.934 -0.505 19854 742 1 . 1 1 158 158 GLU N N 158 112.568 112.568 116.611 -4.043 19854 743 1 . 1 1 158 158 GLU C C 158 176.566 176.566 177.627 -1.061 19854 744 1 . 1 1 158 158 GLU CA C 158 72.147 72.147 57.025 15.122 19854 745 1 . 1 1 158 158 GLU CB C 158 27.640 27.640 28.784 -1.144 19854 746 1 . 1 1 158 158 GLU H H 158 7.495 7.495 8.227 -0.732 19854 747 1 . 1 1 159 159 LYS N N 159 113.232 113.232 119.931 -6.699 19854 748 1 . 1 1 159 159 LYS C C 159 176.566 176.566 175.799 0.767 19854 749 1 . 1 1 159 159 LYS CA C 159 53.993 53.993 61.469 -7.476 19854 750 1 . 1 1 159 159 LYS CB C 159 33.496 33.496 30.054 3.442 19854 751 1 . 1 1 159 159 LYS H H 159 6.862 6.862 7.412 -0.550 19854 752 1 . 1 1 160 160 PRO C C 160 176.273 176.273 178.580 -2.307 19854 753 1 . 1 1 160 160 PRO CA C 160 64.258 64.258 65.643 -1.385 19854 754 1 . 1 1 160 160 PRO CB C 160 32.318 32.318 31.107 1.211 19854 755 1 . 1 1 161 161 PHE N N 161 123.726 123.726 116.627 7.099 19854 756 1 . 1 1 161 161 PHE C C 161 176.851 176.851 177.559 -0.708 19854 757 1 . 1 1 161 161 PHE CA C 161 60.445 60.445 61.758 -1.313 19854 758 1 . 1 1 161 161 PHE CB C 161 40.816 40.816 37.716 3.100 19854 759 1 . 1 1 161 161 PHE H H 161 8.215 8.215 7.289 0.926 19854 760 1 . 1 1 162 162 LEU N N 162 110.177 110.177 119.300 -9.123 19854 761 1 . 1 1 162 162 LEU C C 162 176.273 176.273 178.722 -2.449 19854 762 1 . 1 1 162 162 LEU CA C 162 55.750 55.750 57.926 -2.176 19854 763 1 . 1 1 162 162 LEU CB C 162 44.037 44.037 41.459 2.578 19854 764 1 . 1 1 162 162 LEU H H 162 7.527 7.527 7.844 -0.317 19854 765 1 . 1 1 163 163 TRP N N 163 123.525 123.525 121.378 2.147 19854 766 1 . 1 1 163 163 TRP C C 163 177.152 177.152 178.023 -0.871 19854 767 1 . 1 1 163 163 TRP CA C 163 61.606 61.606 61.583 0.023 19854 768 1 . 1 1 163 163 TRP CB C 163 28.811 28.811 29.695 -0.884 19854 769 1 . 1 1 163 163 TRP H H 163 7.476 7.476 8.303 -0.827 19854 770 1 . 1 1 164 164 LEU N N 164 119.740 119.740 118.931 0.809 19854 771 1 . 1 1 164 164 LEU C C 164 175.686 175.686 178.856 -3.170 19854 772 1 . 1 1 164 164 LEU CA C 164 61.020 61.020 57.779 3.241 19854 773 1 . 1 1 164 164 LEU CB C 164 45.794 45.794 41.381 4.413 19854 774 1 . 1 1 164 164 LEU H H 164 9.412 9.412 8.064 1.348 19854 775 1 . 1 1 165 165 ALA N N 165 118.013 118.013 121.449 -3.436 19854 776 1 . 1 1 165 165 ALA C C 165 165.723 165.723 179.520 -13.797 19854 777 1 . 1 1 165 165 ALA CA C 165 52.236 52.236 55.215 -2.979 19854 778 1 . 1 1 165 165 ALA CB C 165 21.784 21.784 18.172 3.612 19854 779 1 . 1 1 165 165 ALA H H 165 7.707 7.707 8.288 -0.581 19854 780 1 . 1 1 166 166 ARG N N 166 122.994 122.994 118.382 4.612 19854 781 1 . 1 1 166 166 ARG C C 166 175.979 175.979 178.859 -2.880 19854 782 1 . 1 1 166 166 ARG CA C 166 49.308 49.308 59.241 -9.933 19854 783 1 . 1 1 166 166 ARG CB C 166 29.397 29.397 30.075 -0.678 19854 784 1 . 1 1 166 166 ARG H H 166 8.692 8.692 8.084 0.608 19854 785 1 . 1 1 167 167 LYS N N 167 112.568 112.568 120.050 -7.482 19854 786 1 . 1 1 167 167 LYS C C 167 176.273 176.273 179.257 -2.984 19854 787 1 . 1 1 167 167 LYS CA C 167 58.092 58.092 58.726 -0.634 19854 788 1 . 1 1 167 167 LYS CB C 167 34.668 34.668 31.761 2.907 19854 789 1 . 1 1 167 167 LYS H H 167 6.819 6.819 7.433 -0.614 19854 790 1 . 1 1 168 168 LEU N N 168 114.959 114.959 119.636 -4.677 19854 791 1 . 1 1 168 168 LEU C C 168 177.738 177.738 179.011 -1.272 19854 792 1 . 1 1 168 168 LEU CA C 168 56.921 56.921 57.553 -0.632 19854 793 1 . 1 1 168 168 LEU CB C 168 41.695 41.695 41.726 -0.031 19854 794 1 . 1 1 168 168 LEU H H 168 7.269 7.269 7.790 -0.521 19854 795 1 . 1 1 169 169 ILE N N 169 122.199 122.199 116.509 5.690 19854 796 1 . 1 1 169 169 ILE C C 169 177.445 177.445 177.155 0.291 19854 797 1 . 1 1 169 169 ILE CA C 169 63.375 63.375 63.261 0.114 19854 798 1 . 1 1 169 169 ILE CB C 169 42.281 42.281 38.653 3.628 19854 799 1 . 1 1 169 169 ILE H H 169 8.360 8.360 8.086 0.274 19854 800 1 . 1 1 170 170 GLY N N 170 113.099 113.099 106.642 6.457 19854 801 1 . 1 1 170 170 GLY C C 170 162.496 162.496 173.829 -11.333 19854 802 1 . 1 1 170 170 GLY CA C 170 44.037 44.037 44.880 -0.843 19854 803 1 . 1 1 170 170 GLY H H 170 6.686 6.686 7.979 -1.293 19854 804 1 . 1 1 171 171 ASP N N 171 113.232 113.232 121.622 -8.390 19854 805 1 . 1 1 171 171 ASP C C 171 178.910 178.910 175.764 3.146 19854 806 1 . 1 1 171 171 ASP CA C 171 50.479 50.479 50.499 -0.020 19854 807 1 . 1 1 171 171 ASP CB C 171 41.109 41.109 41.985 -0.876 19854 808 1 . 1 1 171 171 ASP H H 171 6.815 6.815 7.632 -0.817 19854 809 1 . 1 1 172 172 PRO C C 172 176.566 176.566 177.100 -0.534 19854 810 1 . 1 1 172 172 PRO CA C 172 63.965 63.965 64.240 -0.274 19854 811 1 . 1 1 172 172 PRO CB C 172 31.732 31.732 32.202 -0.470 19854 812 1 . 1 1 173 173 ASN N N 173 109.779 109.779 115.781 -6.002 19854 813 1 . 1 1 173 173 ASN C C 173 175.979 175.979 175.051 0.928 19854 814 1 . 1 1 173 173 ASN CA C 173 54.579 54.579 52.859 1.720 19854 815 1 . 1 1 173 173 ASN CB C 173 36.424 36.424 39.130 -2.706 19854 816 1 . 1 1 173 173 ASN H H 173 8.016 8.016 8.390 -0.374 19854 817 1 . 1 1 174 174 LEU N N 174 109.248 109.248 122.581 -13.333 19854 818 1 . 1 1 174 174 LEU C C 174 176.566 176.566 175.477 1.089 19854 819 1 . 1 1 174 174 LEU CA C 174 56.336 56.336 56.067 0.269 19854 820 1 . 1 1 174 174 LEU CB C 174 44.037 44.037 42.615 1.422 19854 821 1 . 1 1 174 174 LEU H H 174 7.871 7.871 7.295 0.576 19854 822 1 . 1 1 175 175 GLU N N 175 125.185 125.185 123.766 1.419 19854 823 1 . 1 1 175 175 GLU C C 175 177.445 177.445 174.858 2.587 19854 824 1 . 1 1 175 175 GLU CA C 175 76.247 76.247 54.190 22.057 19854 825 1 . 1 1 175 175 GLU CB C 175 28.811 28.811 33.944 -5.133 19854 826 1 . 1 1 175 175 GLU H H 175 9.127 9.127 8.213 0.914 19854 827 1 . 1 1 176 176 PHE N N 176 136.873 136.873 123.644 13.229 19854 828 1 . 1 1 176 176 PHE C C 176 178.617 178.617 175.556 3.061 19854 829 1 . 1 1 176 176 PHE CA C 176 59.264 59.264 58.389 0.875 19854 830 1 . 1 1 176 176 PHE CB C 176 44.623 44.623 40.114 4.509 19854 831 1 . 1 1 176 176 PHE H H 176 10.058 10.058 8.674 1.384 19854 832 1 . 1 1 177 177 VAL N N 177 118.877 118.877 123.947 -5.070 19854 833 1 . 1 1 177 177 VAL C C 177 177.445 177.445 174.364 3.081 19854 834 1 . 1 1 177 177 VAL CA C 177 62.777 62.777 59.370 3.407 19854 835 1 . 1 1 177 177 VAL CB C 177 34.668 34.668 34.265 0.403 19854 836 1 . 1 1 177 177 VAL H H 177 7.789 7.789 8.016 -0.227 19854 837 1 . 1 1 178 178 ALA N N 178 123.859 123.859 127.063 -3.204 19854 838 1 . 1 1 178 178 ALA C C 178 177.144 177.144 177.082 0.062 19854 839 1 . 1 1 178 178 ALA CA C 178 54.000 54.000 54.349 -0.349 19854 840 1 . 1 1 178 178 ALA CB C 178 15.035 15.035 18.731 -3.696 19854 841 1 . 1 1 178 178 ALA H H 178 7.683 7.683 8.160 -0.477 19854 842 1 . 1 1 179 179 MET N N 179 121.668 121.668 116.887 4.781 19854 843 1 . 1 1 179 179 MET C C 179 177.144 177.144 173.386 3.759 19854 844 1 . 1 1 179 179 MET CA C 179 60.445 60.445 53.648 6.797 19854 845 1 . 1 1 179 179 MET CB C 179 39.351 39.351 33.196 6.155 19854 846 1 . 1 1 179 179 MET H H 179 7.648 7.648 7.793 -0.145 19854 847 1 . 1 1 180 180 PRO C C 180 177.445 177.445 175.508 1.937 19854 848 1 . 1 1 180 180 PRO CA C 180 64.844 64.844 62.545 2.299 19854 849 1 . 1 1 180 180 PRO CB C 180 29.974 29.974 32.596 -2.622 19854 850 1 . 1 1 181 181 ALA N N 181 128.439 128.439 124.686 3.753 19854 851 1 . 1 1 181 181 ALA C C 181 176.273 176.273 177.429 -1.156 19854 852 1 . 1 1 181 181 ALA CA C 181 58.092 58.092 51.844 6.248 19854 853 1 . 1 1 181 181 ALA CB C 181 21.198 21.198 19.439 1.759 19854 854 1 . 1 1 181 181 ALA H H 181 8.673 8.673 8.228 0.445 19854 855 1 . 1 1 182 182 LEU N N 182 122.130 122.130 122.554 -0.424 19854 856 1 . 1 1 182 182 LEU C C 182 177.445 177.445 176.959 0.486 19854 857 1 . 1 1 182 182 LEU CA C 182 55.164 55.164 54.381 0.783 19854 858 1 . 1 1 182 182 LEU CB C 182 42.866 42.866 42.975 -0.108 19854 859 1 . 1 1 182 182 LEU H H 182 8.821 8.821 8.406 0.415 19854 860 1 . 1 1 183 183 ALA N N 183 121.004 121.004 126.888 -5.884 19854 861 1 . 1 1 183 183 ALA C C 183 178.617 178.617 175.697 2.920 19854 862 1 . 1 1 183 183 ALA CA C 183 57.808 57.808 50.312 7.496 19854 863 1 . 1 1 183 183 ALA CB C 183 24.117 24.117 18.751 5.366 19854 864 1 . 1 1 183 183 ALA H H 183 8.356 8.356 8.270 0.087 19854 865 1 . 1 1 184 184 PRO C C 184 177.152 177.152 175.233 1.919 19854 866 1 . 1 1 184 184 PRO CA C 184 64.258 64.258 61.880 2.378 19854 867 1 . 1 1 184 184 PRO CB C 184 29.681 29.681 31.462 -1.781 19854 868 1 . 1 1 185 185 PRO C C 185 175.686 175.686 177.037 -1.351 19854 869 1 . 1 1 185 185 PRO CA C 185 63.379 63.379 62.538 0.841 19854 870 1 . 1 1 185 185 PRO CB C 185 35.248 35.248 32.500 2.747 19854 871 1 . 1 1 186 186 GLU N N 186 120.539 120.539 121.069 -0.530 19854 872 1 . 1 1 186 186 GLU C C 186 176.273 176.273 176.131 0.142 19854 873 1 . 1 1 186 186 GLU CA C 186 58.101 58.101 57.637 0.464 19854 874 1 . 1 1 186 186 GLU CB C 186 35.836 35.836 29.814 6.022 19854 875 1 . 1 1 186 186 GLU H H 186 8.086 8.086 8.491 -0.405 19854 876 1 . 1 1 187 187 VAL N N 187 124.455 124.455 117.577 6.878 19854 877 1 . 1 1 187 187 VAL C C 187 178.910 178.910 175.120 3.790 19854 878 1 . 1 1 187 187 VAL CA C 187 63.363 63.363 62.800 0.563 19854 879 1 . 1 1 187 187 VAL CB C 187 34.082 34.082 31.375 2.707 19854 880 1 . 1 1 187 187 VAL H H 187 8.622 8.622 7.924 0.698 19854 881 1 . 1 1 188 188 VAL N N 188 128.572 128.572 123.103 5.469 19854 882 1 . 1 1 188 188 VAL C C 188 178.324 178.324 176.635 1.689 19854 883 1 . 1 1 188 188 VAL CA C 188 68.634 68.634 62.091 6.544 19854 884 1 . 1 1 188 188 VAL CB C 188 31.154 31.154 32.874 -1.720 19854 885 1 . 1 1 188 188 VAL H H 188 8.497 8.497 7.955 0.542 19854 886 1 . 1 1 189 189 MET N N 189 122.795 122.795 118.934 3.861 19854 887 1 . 1 1 189 189 MET C C 189 177.445 177.445 175.736 1.709 19854 888 1 . 1 1 189 189 MET CA C 189 55.164 55.164 56.985 -1.821 19854 889 1 . 1 1 189 189 MET CB C 189 35.253 35.253 32.157 3.096 19854 890 1 . 1 1 189 189 MET H H 189 6.991 6.991 8.226 -1.235 19854 891 1 . 1 1 190 190 ASP N N 190 114.959 114.959 116.971 -2.012 19854 892 1 . 1 1 190 190 ASP C C 190 175.686 175.686 175.637 0.049 19854 893 1 . 1 1 190 190 ASP CA C 190 51.065 51.065 55.093 -4.028 19854 894 1 . 1 1 190 190 ASP CB C 190 41.695 41.695 39.435 2.260 19854 895 1 . 1 1 190 190 ASP H H 190 7.210 7.210 8.644 -1.434 19854 896 1 . 1 1 191 191 PRO C C 191 176.566 176.566 177.862 -1.296 19854 897 1 . 1 1 191 191 PRO CA C 191 63.965 63.965 64.894 -0.929 19854 898 1 . 1 1 191 191 PRO CB C 191 31.146 31.146 31.610 -0.464 19854 899 1 . 1 1 192 192 ALA N N 192 109.513 109.513 120.691 -11.178 19854 900 1 . 1 1 192 192 ALA CA C 192 53.993 53.993 54.085 -0.092 19854 901 1 . 1 1 192 192 ALA CB C 192 19.441 19.441 18.402 1.039 19854 902 1 . 1 1 192 192 ALA H H 192 7.394 7.394 8.137 -0.742 19854 903 1 . 1 1 193 193 LEU N N 193 119.009 119.009 118.173 0.836 19854 904 1 . 1 1 193 193 LEU C C 193 175.979 175.979 176.993 -1.014 19854 905 1 . 1 1 193 193 LEU CA C 193 56.336 56.336 55.571 0.765 19854 906 1 . 1 1 193 193 LEU CB C 193 42.866 42.866 41.939 0.927 19854 907 1 . 1 1 193 193 LEU H H 193 8.340 8.340 7.844 0.496 19854 908 1 . 1 1 194 194 ALA N N 194 121.666 121.666 119.537 2.129 19854 909 1 . 1 1 194 194 ALA C C 194 166.896 166.896 178.044 -11.148 19854 910 1 . 1 1 194 194 ALA CA C 194 55.164 55.164 52.623 2.541 19854 911 1 . 1 1 194 194 ALA CB C 194 16.513 16.513 19.311 -2.798 19854 912 1 . 1 1 194 194 ALA H H 194 8.176 8.176 7.552 0.624 19854 913 1 . 1 1 195 195 ALA N N 195 119.541 119.541 120.561 -1.020 19854 914 1 . 1 1 195 195 ALA C C 195 173.928 173.928 179.112 -5.184 19854 915 1 . 1 1 195 195 ALA CA C 195 57.507 57.507 54.286 3.221 19854 916 1 . 1 1 195 195 ALA CB C 195 19.441 19.441 17.189 2.252 19854 917 1 . 1 1 195 195 ALA H H 195 8.364 8.364 8.816 -0.452 19854 918 1 . 1 1 196 196 GLN N N 196 107.322 107.322 119.300 -11.978 19854 919 1 . 1 1 196 196 GLN C C 196 176.273 176.273 177.777 -1.504 19854 920 1 . 1 1 196 196 GLN CA C 196 56.921 56.921 58.503 -1.582 19854 921 1 . 1 1 196 196 GLN CB C 196 29.983 29.983 28.705 1.278 19854 922 1 . 1 1 196 196 GLN H H 196 7.910 7.910 7.834 0.076 19854 923 1 . 1 1 197 197 TYR N N 197 119.277 119.277 118.717 0.560 19854 924 1 . 1 1 197 197 TYR C C 197 178.316 178.316 178.207 0.109 19854 925 1 . 1 1 197 197 TYR CA C 197 56.343 56.343 60.959 -4.616 19854 926 1 . 1 1 197 197 TYR CB C 197 43.453 43.453 37.834 5.619 19854 927 1 . 1 1 197 197 TYR H H 197 8.180 8.180 8.236 -0.056 19854 928 1 . 1 1 198 198 GLU N N 198 110.244 110.244 118.819 -8.575 19854 929 1 . 1 1 198 198 GLU C C 198 176.273 176.273 178.696 -2.423 19854 930 1 . 1 1 198 198 GLU CA C 198 53.407 53.407 59.546 -6.139 19854 931 1 . 1 1 198 198 GLU CB C 198 30.568 30.568 29.231 1.337 19854 932 1 . 1 1 198 198 GLU H H 198 7.523 7.523 8.117 -0.594 19854 933 1 . 1 1 199 199 HIS N N 199 119.211 119.211 119.428 -0.217 19854 934 1 . 1 1 199 199 HIS C C 199 178.902 178.902 177.201 1.701 19854 935 1 . 1 1 199 199 HIS CA C 199 58.687 58.687 59.650 -0.963 19854 936 1 . 1 1 199 199 HIS CB C 199 34.957 34.957 29.760 5.197 19854 937 1 . 1 1 199 199 HIS H H 199 8.258 8.258 7.845 0.412 19854 938 1 . 1 1 200 200 ASP N N 200 124.722 124.722 119.946 4.776 19854 939 1 . 1 1 200 200 ASP C C 200 176.705 176.705 178.819 -2.114 19854 940 1 . 1 1 200 200 ASP CA C 200 58.687 58.687 57.251 1.436 19854 941 1 . 1 1 200 200 ASP CB C 200 39.644 39.644 40.398 -0.754 19854 942 1 . 1 1 200 200 ASP H H 200 8.086 8.086 7.960 0.126 19854 943 1 . 1 1 201 201 LEU N N 201 116.353 116.353 120.248 -3.895 19854 944 1 . 1 1 201 201 LEU C C 201 178.910 178.910 179.094 -0.183 19854 945 1 . 1 1 201 201 LEU CA C 201 61.606 61.606 58.191 3.415 19854 946 1 . 1 1 201 201 LEU CB C 201 41.109 41.109 41.754 -0.645 19854 947 1 . 1 1 201 201 LEU H H 201 7.722 7.722 8.021 -0.299 19854 948 1 . 1 1 202 202 GLU N N 202 118.080 118.080 119.374 -1.294 19854 949 1 . 1 1 202 202 GLU C C 202 176.566 176.566 179.279 -2.713 19854 950 1 . 1 1 202 202 GLU CA C 202 56.921 56.921 59.391 -2.470 19854 951 1 . 1 1 202 202 GLU CB C 202 30.568 30.568 29.459 1.109 19854 952 1 . 1 1 202 202 GLU H H 202 8.857 8.857 7.980 0.877 19854 953 1 . 1 1 203 203 VAL N N 203 129.369 129.369 119.232 10.137 19854 954 1 . 1 1 203 203 VAL C C 203 178.617 178.617 177.715 0.902 19854 955 1 . 1 1 203 203 VAL CA C 203 64.534 64.534 66.435 -1.901 19854 956 1 . 1 1 203 203 VAL CB C 203 27.640 27.640 31.008 -3.368 19854 957 1 . 1 1 203 203 VAL H H 203 9.283 9.283 7.645 1.638 19854 958 1 . 1 1 204 204 ALA N N 204 109.580 109.580 122.054 -12.474 19854 959 1 . 1 1 204 204 ALA C C 204 176.859 176.859 179.360 -2.501 19854 960 1 . 1 1 204 204 ALA CA C 204 54.579 54.579 54.884 -0.305 19854 961 1 . 1 1 204 204 ALA CB C 204 18.270 18.270 18.417 -0.147 19854 962 1 . 1 1 204 204 ALA H H 204 8.528 8.528 7.876 0.652 19854 963 1 . 1 1 205 205 GLN N N 205 123.328 123.328 116.476 6.852 19854 964 1 . 1 1 205 205 GLN C C 205 177.418 177.418 178.096 -0.678 19854 965 1 . 1 1 205 205 GLN CA C 205 57.515 57.515 58.324 -0.809 19854 966 1 . 1 1 205 205 GLN CB C 205 33.785 33.785 29.068 4.717 19854 967 1 . 1 1 205 205 GLN H H 205 8.160 8.160 7.979 0.181 19854 968 1 . 1 1 206 206 THR N N 206 120.271 120.271 113.975 6.296 19854 969 1 . 1 1 206 206 THR C C 206 176.273 176.273 175.351 0.922 19854 970 1 . 1 1 206 206 THR CA C 206 67.462 67.462 64.727 2.735 19854 971 1 . 1 1 206 206 THR CB C 206 70.390 70.390 69.096 1.294 19854 972 1 . 1 1 206 206 THR H H 206 7.585 7.585 7.832 -0.247 19854 973 1 . 1 1 207 207 THR N N 207 111.970 111.970 119.089 -7.119 19854 974 1 . 1 1 207 207 THR C C 207 176.566 176.566 173.822 2.744 19854 975 1 . 1 1 207 207 THR CA C 207 64.534 64.534 63.636 0.898 19854 976 1 . 1 1 207 207 THR CB C 207 72.733 72.733 69.453 3.280 19854 977 1 . 1 1 207 207 THR H H 207 7.468 7.468 7.585 -0.117 19854 978 1 . 1 1 208 208 ALA N N 208 115.623 115.623 128.734 -13.111 19854 979 1 . 1 1 208 208 ALA C C 208 168.947 168.947 176.976 -8.029 19854 980 1 . 1 1 208 208 ALA CA C 208 55.164 55.164 51.759 3.405 19854 981 1 . 1 1 208 208 ALA CB C 208 22.369 22.369 19.757 2.612 19854 982 1 . 1 1 208 208 ALA H H 208 7.390 7.390 8.258 -0.868 19854 983 1 . 1 1 209 209 LEU N N 209 117.814 117.814 123.842 -6.028 19854 984 1 . 1 1 209 209 LEU C C 209 176.273 176.273 175.393 0.880 19854 985 1 . 1 1 209 209 LEU CA C 209 58.678 58.678 52.584 6.094 19854 986 1 . 1 1 209 209 LEU CB C 209 46.380 46.380 42.371 4.009 19854 987 1 . 1 1 209 209 LEU H H 209 7.652 7.652 8.285 -0.633 19854 988 1 . 1 1 210 210 PRO C C 210 176.566 176.566 175.519 1.047 19854 989 1 . 1 1 210 210 PRO CA C 210 63.086 63.086 62.402 0.684 19854 990 1 . 1 1 210 210 PRO CB C 210 31.146 31.146 32.094 -0.948 19854 991 1 . 1 1 211 211 ASP N N 211 122.863 122.863 121.814 1.049 19854 992 1 . 1 1 211 211 ASP C C 211 175.686 175.686 175.883 -0.197 19854 993 1 . 1 1 211 211 ASP CA C 211 56.343 56.343 53.920 2.423 19854 994 1 . 1 1 211 211 ASP CB C 211 41.402 41.402 41.399 0.003 19854 995 1 . 1 1 211 211 ASP H H 211 8.360 8.360 8.285 0.074 19854 996 1 . 1 1 212 212 GLU N N 212 131.162 131.162 125.439 5.723 19854 997 1 . 1 1 212 212 GLU C C 212 176.273 176.273 176.328 -0.055 19854 998 1 . 1 1 212 212 GLU CA C 212 55.164 55.164 57.636 -2.472 19854 999 1 . 1 1 212 212 GLU CB C 212 30.568 30.568 31.324 -0.756 19854 1000 1 . 1 1 212 212 GLU H H 212 8.399 8.399 8.533 -0.134 19854 1001 1 . 1 1 213 213 ASP N N 213 122.797 122.797 116.100 6.698 19854 1002 1 . 1 1 213 213 ASP C C 213 177.152 177.152 176.882 0.269 19854 1003 1 . 1 1 213 213 ASP CA C 213 61.914 61.914 53.420 8.494 19854 1004 1 . 1 1 213 213 ASP CB C 213 49.607 49.607 40.889 8.719 19854 1005 1 . 1 1 213 213 ASP H H 213 8.168 8.168 8.296 -0.128 19854 1006 1 . 1 1 214 214 ASP N N 214 112.369 112.369 121.659 -9.289 19854 1007 1 . 1 1 214 214 ASP C C 214 178.910 178.910 177.160 1.750 19854 1008 1 . 1 1 214 214 ASP CA C 214 54.579 54.579 56.896 -2.317 19854 1009 1 . 1 1 214 214 ASP CB C 214 39.353 39.353 40.403 -1.050 19854 1010 1 . 1 1 214 214 ASP H H 214 7.464 7.464 8.202 -0.738 19854 1011 1 . 1 1 215 215 ASP N N 215 127.244 127.244 119.001 8.242 19854 1012 1 . 1 1 215 215 ASP C C 215 176.859 176.859 177.119 -0.260 19854 1013 1 . 1 1 215 215 ASP CA C 215 54.579 54.579 55.862 -1.283 19854 1014 1 . 1 1 215 215 ASP CB C 215 40.524 40.524 40.990 -0.466 19854 1015 1 . 1 1 215 215 ASP H H 215 8.301 8.301 8.277 0.024 19854 stop_ save_