data_17934 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17934 _Entry.PDB_ID 2LJG 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 17934 _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 13 13 LYS N N 13 120.778 120.778 121.592 -0.814 17934 2 1 1 . 1 1 13 13 LYS C C 13 176.476 176.476 175.918 0.558 17934 3 1 1 . 1 1 13 13 LYS CA C 13 58.601 58.601 55.883 2.717 17934 4 1 1 . 1 1 13 13 LYS CB C 13 32.820 32.820 33.590 -0.770 17934 5 1 1 . 1 1 13 13 LYS H H 13 7.984 7.984 8.074 -0.090 17934 6 1 1 . 1 1 15 15 ILE HA H 15 3.820 3.820 3.987 -0.167 17934 7 1 1 . 1 1 15 15 ILE C C 15 176.376 176.376 175.976 0.400 17934 8 1 1 . 1 1 15 15 ILE CA C 15 63.570 63.570 62.882 0.688 17934 9 1 1 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.721 1.659 17934 10 1 1 . 1 1 16 16 ALA N N 16 121.364 121.364 119.338 2.026 17934 11 1 1 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.468 -0.030 17934 12 1 1 . 1 1 16 16 ALA C C 16 177.494 177.494 177.615 -0.121 17934 13 1 1 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.636 0.340 17934 14 1 1 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.652 0.680 17934 15 1 1 . 1 1 16 16 ALA H H 16 8.081 8.081 7.800 0.281 17934 16 1 1 . 1 1 17 17 GLN N N 17 118.109 118.109 116.267 1.842 17934 17 1 1 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.562 0.011 17934 18 1 1 . 1 1 17 17 GLN C C 17 173.632 173.632 174.458 -0.826 17934 19 1 1 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.424 -0.573 17934 20 1 1 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.778 -0.301 17934 21 1 1 . 1 1 17 17 GLN H H 17 7.550 7.550 8.103 -0.553 17934 22 1 1 . 1 1 18 18 SER N N 18 112.384 112.384 113.307 -0.923 17934 23 1 1 . 1 1 18 18 SER HA H 18 4.388 4.388 4.684 -0.296 17934 24 1 1 . 1 1 18 18 SER C C 18 173.780 173.780 172.260 1.520 17934 25 1 1 . 1 1 18 18 SER CA C 18 57.664 57.664 57.791 -0.127 17934 26 1 1 . 1 1 18 18 SER CB C 18 65.164 65.164 66.232 -1.068 17934 27 1 1 . 1 1 18 18 SER H H 18 7.666 7.666 8.120 -0.454 17934 28 1 1 . 1 1 19 19 CYS N N 19 120.116 120.116 120.070 0.046 17934 29 1 1 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.513 -0.183 17934 30 1 1 . 1 1 19 19 CYS C C 19 180.387 180.387 173.358 7.029 17934 31 1 1 . 1 1 19 19 CYS CA C 19 58.601 58.601 57.722 0.879 17934 32 1 1 . 1 1 19 19 CYS CB C 19 30.008 30.008 29.478 0.530 17934 33 1 1 . 1 1 19 19 CYS H H 19 8.835 8.835 8.788 0.047 17934 34 1 1 . 1 1 20 20 ASP N N 20 124.416 124.416 123.247 1.169 17934 35 1 1 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.756 -0.780 17934 36 1 1 . 1 1 20 20 ASP CB C 20 42.195 42.195 44.823 -2.628 17934 37 1 1 . 1 1 20 20 ASP H H 20 7.847 7.847 7.764 0.083 17934 38 1 1 . 1 1 21 21 TYR N N 21 121.296 121.296 120.764 0.532 17934 39 1 1 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.749 -0.019 17934 40 1 1 . 1 1 21 21 TYR C C 21 175.793 175.793 174.474 1.319 17934 41 1 1 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.489 0.711 17934 42 1 1 . 1 1 21 21 TYR CB C 21 43.240 43.240 43.059 0.181 17934 43 1 1 . 1 1 21 21 TYR H H 21 9.070 9.070 8.747 0.323 17934 44 1 1 . 1 1 22 22 LYS N N 22 122.820 122.820 122.588 0.232 17934 45 1 1 . 1 1 22 22 LYS HA H 22 5.192 5.192 4.878 0.314 17934 46 1 1 . 1 1 22 22 LYS C C 22 175.793 175.793 175.866 -0.073 17934 47 1 1 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.807 0.451 17934 48 1 1 . 1 1 22 22 LYS CB C 22 33.758 33.758 31.756 2.002 17934 49 1 1 . 1 1 22 22 LYS H H 22 8.711 8.711 8.689 0.022 17934 50 1 1 . 1 1 23 23 ALA N N 23 123.073 123.073 127.923 -4.850 17934 51 1 1 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.253 0.477 17934 52 1 1 . 1 1 23 23 ALA C C 23 174.515 174.515 175.528 -1.013 17934 53 1 1 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.212 1.358 17934 54 1 1 . 1 1 23 23 ALA CB C 23 21.628 21.628 21.930 -0.302 17934 55 1 1 . 1 1 23 23 ALA H H 23 8.727 8.727 8.729 -0.002 17934 56 1 1 . 1 1 24 24 ALA N N 24 122.486 122.486 123.355 -0.869 17934 57 1 1 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.403 0.778 17934 58 1 1 . 1 1 24 24 ALA C C 24 176.835 176.835 175.969 0.866 17934 59 1 1 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.080 0.490 17934 60 1 1 . 1 1 24 24 ALA CB C 24 20.120 20.120 19.868 0.252 17934 61 1 1 . 1 1 24 24 ALA H H 24 8.675 8.675 8.026 0.649 17934 62 1 1 . 1 1 25 25 TYR N N 25 122.698 122.698 125.511 -2.813 17934 63 1 1 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.608 0.402 17934 64 1 1 . 1 1 25 25 TYR CA C 25 54.340 54.340 58.860 -4.520 17934 65 1 1 . 1 1 25 25 TYR CB C 25 39.850 39.850 38.715 1.135 17934 66 1 1 . 1 1 25 25 TYR H H 25 8.270 8.270 8.420 -0.150 17934 67 1 1 . 1 1 26 26 LEU N N 26 127.997 127.997 129.265 -1.268 17934 68 1 1 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.131 -0.211 17934 69 1 1 . 1 1 26 26 LEU C C 26 175.983 175.983 176.400 -0.417 17934 70 1 1 . 1 1 26 26 LEU CA C 26 56.726 56.726 55.989 0.738 17934 71 1 1 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.197 -2.127 17934 72 1 1 . 1 1 26 26 LEU H H 26 8.700 8.700 7.749 0.951 17934 73 1 1 . 1 1 27 27 GLY N N 27 102.901 102.901 101.144 1.757 17934 74 1 1 . 1 1 27 27 GLY C C 27 176.219 176.219 171.042 5.177 17934 75 1 1 . 1 1 27 27 GLY CA C 27 43.601 43.601 44.743 -1.142 17934 76 1 1 . 1 1 27 27 GLY H H 27 5.891 5.891 7.424 -1.533 17934 77 1 1 . 1 1 28 28 SER N N 28 111.551 111.551 114.271 -2.720 17934 78 1 1 . 1 1 28 28 SER HA H 28 5.785 5.785 5.017 0.768 17934 79 1 1 . 1 1 28 28 SER CA C 28 56.258 56.258 57.611 -1.353 17934 80 1 1 . 1 1 28 28 SER CB C 28 65.632 65.632 65.981 -0.349 17934 81 1 1 . 1 1 28 28 SER H H 28 7.981 7.981 8.233 -0.252 17934 82 1 1 . 1 1 29 29 MET N N 29 119.493 119.493 123.629 -4.136 17934 83 1 1 . 1 1 29 29 MET HA H 29 4.725 4.725 4.637 0.088 17934 84 1 1 . 1 1 29 29 MET C C 29 174.143 174.143 174.551 -0.408 17934 85 1 1 . 1 1 29 29 MET CA C 29 54.036 54.036 54.120 -0.084 17934 86 1 1 . 1 1 29 29 MET CB C 29 37.268 37.268 36.798 0.470 17934 87 1 1 . 1 1 29 29 MET H H 29 8.704 8.704 8.816 -0.112 17934 88 1 1 . 1 1 30 30 LEU N N 30 128.150 128.150 124.555 3.595 17934 89 1 1 . 1 1 30 30 LEU HA H 30 3.785 3.785 3.906 -0.121 17934 90 1 1 . 1 1 30 30 LEU C C 30 175.857 175.857 174.910 0.947 17934 91 1 1 . 1 1 30 30 LEU CA C 30 56.250 56.250 54.690 1.560 17934 92 1 1 . 1 1 30 30 LEU CB C 30 42.660 42.660 42.111 0.549 17934 93 1 1 . 1 1 30 30 LEU H H 30 8.630 8.630 8.368 0.262 17934 94 1 1 . 1 1 31 31 ILE N N 31 127.723 127.723 127.764 -0.041 17934 95 1 1 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.216 -0.026 17934 96 1 1 . 1 1 31 31 ILE C C 31 174.881 174.881 174.600 0.281 17934 97 1 1 . 1 1 31 31 ILE CA C 31 57.660 57.660 58.666 -1.006 17934 98 1 1 . 1 1 31 31 ILE CB C 31 37.110 37.110 36.849 0.261 17934 99 1 1 . 1 1 31 31 ILE H H 31 8.560 8.560 8.471 0.089 17934 100 1 1 . 1 1 32 32 LYS HA H 32 4.055 4.055 3.808 0.247 17934 101 1 1 . 1 1 32 32 LYS C C 32 176.272 176.272 176.250 0.022 17934 102 1 1 . 1 1 32 32 LYS CA C 32 58.601 58.601 55.535 3.066 17934 103 1 1 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.811 0.009 17934 104 1 1 . 1 1 33 33 GLU N N 33 118.638 118.638 117.677 0.961 17934 105 1 1 . 1 1 33 33 GLU HA H 33 4.388 4.388 3.796 0.592 17934 106 1 1 . 1 1 33 33 GLU C C 33 173.962 173.962 175.167 -1.205 17934 107 1 1 . 1 1 33 33 GLU CA C 33 54.851 54.851 56.956 -2.105 17934 108 1 1 . 1 1 33 33 GLU CB C 33 30.945 30.945 28.658 2.287 17934 109 1 1 . 1 1 33 33 GLU H H 33 7.723 7.723 7.838 -0.115 17934 110 1 1 . 1 1 34 34 LEU N N 34 126.535 126.535 119.745 6.790 17934 111 1 1 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.399 -0.454 17934 112 1 1 . 1 1 34 34 LEU C C 34 176.870 176.870 176.305 0.565 17934 113 1 1 . 1 1 34 34 LEU CA C 34 54.850 54.850 54.204 0.646 17934 114 1 1 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.940 -1.220 17934 115 1 1 . 1 1 34 34 LEU H H 34 8.446 8.446 7.588 0.858 17934 116 1 1 . 1 1 35 35 ARG N N 35 128.447 128.447 124.195 4.252 17934 117 1 1 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.534 0.021 17934 118 1 1 . 1 1 35 35 ARG C C 35 176.110 176.110 175.045 1.065 17934 119 1 1 . 1 1 35 35 ARG CA C 35 54.851 54.851 55.450 -0.599 17934 120 1 1 . 1 1 35 35 ARG CB C 35 30.477 30.477 30.329 0.148 17934 121 1 1 . 1 1 35 35 ARG H H 35 8.680 8.680 8.462 0.218 17934 122 1 1 . 1 1 36 36 GLY N N 36 107.406 107.406 112.007 -4.601 17934 123 1 1 . 1 1 36 36 GLY CA C 36 45.906 45.906 44.970 0.936 17934 124 1 1 . 1 1 36 36 GLY H H 36 7.182 7.182 7.771 -0.589 17934 125 1 1 . 1 1 37 37 THR HA H 37 4.060 4.060 4.112 -0.052 17934 126 1 1 . 1 1 37 37 THR C C 37 176.634 176.634 175.855 0.779 17934 127 1 1 . 1 1 37 37 THR CA C 37 65.632 65.632 63.478 2.154 17934 128 1 1 . 1 1 37 37 THR CB C 37 68.445 68.445 68.593 -0.148 17934 129 1 1 . 1 1 38 38 GLU N N 38 122.251 122.251 120.976 1.275 17934 130 1 1 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.958 0.168 17934 131 1 1 . 1 1 38 38 GLU C C 38 179.981 179.981 178.127 1.854 17934 132 1 1 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.773 0.235 17934 133 1 1 . 1 1 38 38 GLU CB C 38 29.539 29.539 29.350 0.189 17934 134 1 1 . 1 1 38 38 GLU H H 38 8.450 8.450 8.882 -0.432 17934 135 1 1 . 1 1 39 39 SER N N 39 115.966 115.966 113.829 2.137 17934 136 1 1 . 1 1 39 39 SER C C 39 175.991 175.991 176.689 -0.698 17934 137 1 1 . 1 1 39 39 SER CA C 39 62.820 62.820 61.870 0.950 17934 138 1 1 . 1 1 39 39 SER H H 39 7.522 7.522 7.752 -0.230 17934 139 1 1 . 1 1 40 40 THR HA H 40 4.049 4.049 3.892 0.157 17934 140 1 1 . 1 1 40 40 THR C C 40 175.972 175.972 177.027 -1.055 17934 141 1 1 . 1 1 40 40 THR CA C 40 66.101 66.101 65.144 0.957 17934 142 1 1 . 1 1 40 40 THR CB C 40 67.976 67.976 68.146 -0.170 17934 143 1 1 . 1 1 41 41 GLN N N 41 120.354 120.354 120.148 0.206 17934 144 1 1 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.065 -0.306 17934 145 1 1 . 1 1 41 41 GLN C C 41 178.483 178.483 178.013 0.470 17934 146 1 1 . 1 1 41 41 GLN CA C 41 60.476 60.476 58.521 1.955 17934 147 1 1 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.517 -0.385 17934 148 1 1 . 1 1 41 41 GLN H H 41 8.271 8.271 8.284 -0.013 17934 149 1 1 . 1 1 42 42 ASP N N 42 120.757 120.757 121.443 -0.686 17934 150 1 1 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.444 -0.085 17934 151 1 1 . 1 1 42 42 ASP C C 42 177.480 177.480 177.981 -0.501 17934 152 1 1 . 1 1 42 42 ASP CA C 42 57.664 57.664 56.935 0.729 17934 153 1 1 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.789 1.406 17934 154 1 1 . 1 1 42 42 ASP H H 42 7.954 7.954 8.086 -0.132 17934 155 1 1 . 1 1 43 43 ALA N N 43 120.587 120.587 122.023 -1.436 17934 156 1 1 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.187 -0.197 17934 157 1 1 . 1 1 43 43 ALA C C 43 179.767 179.767 179.518 0.249 17934 158 1 1 . 1 1 43 43 ALA CA C 43 55.320 55.320 55.059 0.261 17934 159 1 1 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.343 0.887 17934 160 1 1 . 1 1 43 43 ALA H H 43 7.842 7.842 8.473 -0.631 17934 161 1 1 . 1 1 44 44 CYS N N 44 115.428 115.428 117.931 -2.503 17934 162 1 1 . 1 1 44 44 CYS HA H 44 3.895 3.895 3.878 0.017 17934 163 1 1 . 1 1 44 44 CYS C C 44 176.076 176.076 176.495 -0.419 17934 164 1 1 . 1 1 44 44 CYS CA C 44 64.695 64.695 63.740 0.955 17934 165 1 1 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.793 -0.129 17934 166 1 1 . 1 1 44 44 CYS H H 44 7.900 7.900 8.444 -0.544 17934 167 1 1 . 1 1 45 45 ALA N N 45 120.487 120.487 122.225 -1.738 17934 168 1 1 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.916 0.084 17934 169 1 1 . 1 1 45 45 ALA C C 45 173.506 173.506 178.692 -5.186 17934 170 1 1 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.208 0.112 17934 171 1 1 . 1 1 45 45 ALA CB C 45 17.940 17.940 17.994 -0.054 17934 172 1 1 . 1 1 45 45 ALA H H 45 7.250 7.250 7.872 -0.622 17934 173 1 1 . 1 1 46 46 LYS N N 46 119.267 119.267 119.255 0.012 17934 174 1 1 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.892 0.055 17934 175 1 1 . 1 1 46 46 LYS C C 46 179.561 179.561 178.552 1.009 17934 176 1 1 . 1 1 46 46 LYS H H 46 8.102 8.102 8.166 -0.064 17934 177 1 1 . 1 1 47 47 MET N N 47 118.009 118.009 118.758 -0.749 17934 178 1 1 . 1 1 47 47 MET HA H 47 4.214 4.214 4.062 0.152 17934 179 1 1 . 1 1 47 47 MET C C 47 179.526 179.526 177.856 1.670 17934 180 1 1 . 1 1 47 47 MET CA C 47 57.195 57.195 58.680 -1.485 17934 181 1 1 . 1 1 47 47 MET CB C 47 30.945 30.945 32.563 -1.618 17934 182 1 1 . 1 1 47 47 MET H H 47 8.585 8.585 8.304 0.281 17934 183 1 1 . 1 1 48 48 ARG N N 48 119.962 119.962 119.768 0.194 17934 184 1 1 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.848 0.008 17934 185 1 1 . 1 1 48 48 ARG C C 48 178.875 178.875 178.463 0.412 17934 186 1 1 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.436 1.509 17934 187 1 1 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.747 0.730 17934 188 1 1 . 1 1 48 48 ARG H H 48 8.190 8.190 8.314 -0.124 17934 189 1 1 . 1 1 49 49 ALA N N 49 120.640 120.640 121.215 -0.575 17934 190 1 1 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.172 -0.429 17934 191 1 1 . 1 1 49 49 ALA C C 49 180.169 180.169 179.298 0.871 17934 192 1 1 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.489 0.362 17934 193 1 1 . 1 1 49 49 ALA CB C 49 17.821 17.821 18.833 -1.012 17934 194 1 1 . 1 1 49 49 ALA H H 49 7.671 7.671 8.238 -0.567 17934 195 1 1 . 1 1 50 50 ASN N N 50 116.063 116.063 117.148 -1.085 17934 196 1 1 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.424 0.050 17934 197 1 1 . 1 1 50 50 ASN C C 50 177.084 177.084 177.106 -0.022 17934 198 1 1 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.605 0.184 17934 199 1 1 . 1 1 50 50 ASN CB C 50 38.914 38.914 37.966 0.948 17934 200 1 1 . 1 1 50 50 ASN H H 50 7.893 7.893 8.363 -0.470 17934 201 1 1 . 1 1 51 51 CYS N N 51 116.884 116.884 117.828 -0.944 17934 202 1 1 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.245 0.061 17934 203 1 1 . 1 1 51 51 CYS C C 51 175.002 175.002 176.564 -1.562 17934 204 1 1 . 1 1 51 51 CYS CA C 51 61.414 61.414 61.301 0.113 17934 205 1 1 . 1 1 51 51 CYS CB C 51 27.664 27.664 27.941 -0.277 17934 206 1 1 . 1 1 51 51 CYS H H 51 7.770 7.770 8.667 -0.897 17934 207 1 1 . 1 1 52 52 GLN N N 52 117.831 117.831 119.289 -1.458 17934 208 1 1 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.014 0.214 17934 209 1 1 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.321 -1.595 17934 210 1 1 . 1 1 52 52 GLN CB C 52 29.070 29.070 28.480 0.590 17934 211 1 1 . 1 1 52 52 GLN H H 52 7.796 7.796 8.049 -0.253 17934 212 1 1 . 1 1 53 53 LYS N N 53 118.841 118.841 117.947 0.894 17934 213 1 1 . 1 1 53 53 LYS CA C 53 57.195 57.195 57.962 -0.768 17934 214 1 1 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.737 0.552 17934 215 1 1 . 1 1 53 53 LYS H H 53 7.686 7.686 7.515 0.171 17934 216 1 1 . 1 1 55 55 THR HA H 55 4.304 4.304 4.005 0.299 17934 217 1 1 . 1 1 55 55 THR CA C 55 63.757 63.757 64.933 -1.176 17934 218 1 1 . 1 1 55 55 THR CB C 55 68.914 68.914 68.875 0.039 17934 219 1 1 . 1 1 56 56 GLU N N 56 120.861 120.861 119.146 1.715 17934 220 1 1 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.153 -0.006 17934 221 1 1 . 1 1 56 56 GLU C C 56 177.656 177.656 177.588 0.068 17934 222 1 1 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.807 -0.674 17934 223 1 1 . 1 1 56 56 GLU CB C 56 30.008 30.008 28.952 1.056 17934 224 1 1 . 1 1 56 56 GLU H H 56 8.311 8.311 8.572 -0.261 17934 225 1 1 . 1 1 57 57 GLN N N 57 118.397 118.397 117.079 1.318 17934 226 1 1 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.244 -0.102 17934 227 1 1 . 1 1 57 57 GLN C C 57 177.275 177.275 177.739 -0.464 17934 228 1 1 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.325 0.339 17934 229 1 1 . 1 1 57 57 GLN CB C 57 29.070 29.070 29.304 -0.234 17934 230 1 1 . 1 1 57 57 GLN H H 57 7.899 7.899 8.118 -0.219 17934 231 1 1 . 1 1 58 58 MET N N 58 118.897 118.897 117.261 1.636 17934 232 1 1 . 1 1 58 58 MET HA H 58 4.350 4.350 4.327 0.023 17934 233 1 1 . 1 1 58 58 MET C C 58 177.172 177.172 176.257 0.915 17934 234 1 1 . 1 1 58 58 MET CA C 58 56.726 56.726 58.137 -1.411 17934 235 1 1 . 1 1 58 58 MET CB C 58 32.196 32.196 33.961 -1.765 17934 236 1 1 . 1 1 58 58 MET H H 58 8.036 8.036 7.480 0.556 17934 237 1 1 . 1 1 59 59 LYS N N 59 119.779 119.779 118.830 0.949 17934 238 1 1 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.469 -0.238 17934 239 1 1 . 1 1 59 59 LYS C C 59 176.676 176.676 175.413 1.263 17934 240 1 1 . 1 1 59 59 LYS CA C 59 57.195 57.195 55.925 1.270 17934 241 1 1 . 1 1 59 59 LYS CB C 59 32.820 32.820 33.268 -0.448 17934 242 1 1 . 1 1 59 59 LYS H H 59 7.901 7.901 8.001 -0.100 17934 243 1 1 . 1 1 60 60 LYS N N 60 119.993 119.993 119.075 0.918 17934 244 1 1 . 1 1 60 60 LYS HA H 60 4.335 4.335 3.985 0.350 17934 245 1 1 . 1 1 60 60 LYS C C 60 176.336 176.336 175.273 1.063 17934 246 1 1 . 1 1 60 60 LYS CA C 60 56.258 56.258 56.982 -0.724 17934 247 1 1 . 1 1 60 60 LYS CB C 60 32.820 32.820 31.408 1.412 17934 248 1 1 . 1 1 60 60 LYS H H 60 7.877 7.877 8.651 -0.774 17934 249 1 1 . 1 1 61 61 VAL N N 61 122.649 122.649 116.594 6.055 17934 250 1 1 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.591 -0.211 17934 251 1 1 . 1 1 61 61 VAL C C 61 174.210 174.210 174.455 -0.245 17934 252 1 1 . 1 1 61 61 VAL CA C 61 60.000 60.000 59.549 0.451 17934 253 1 1 . 1 1 61 61 VAL CB C 61 32.350 32.350 32.838 -0.488 17934 254 1 1 . 1 1 61 61 VAL H H 61 7.708 7.708 8.007 -0.299 17934 255 1 1 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.712 -0.049 17934 256 1 1 . 1 1 62 62 PRO C C 62 176.656 176.656 176.616 0.040 17934 257 1 1 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.679 0.141 17934 258 1 1 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.510 -0.627 17934 259 1 1 . 1 1 63 63 THR N N 63 117.155 117.155 118.624 -1.469 17934 260 1 1 . 1 1 63 63 THR HA H 63 4.830 4.830 4.616 0.214 17934 261 1 1 . 1 1 63 63 THR C C 63 174.682 174.682 173.868 0.814 17934 262 1 1 . 1 1 63 63 THR CA C 63 62.820 62.820 63.242 -0.423 17934 263 1 1 . 1 1 63 63 THR CB C 63 69.382 69.382 70.104 -0.722 17934 264 1 1 . 1 1 63 63 THR H H 63 8.303 8.303 8.620 -0.317 17934 265 1 1 . 1 1 64 64 ILE N N 64 121.004 121.004 120.448 0.556 17934 266 1 1 . 1 1 64 64 ILE CA C 64 58.600 58.600 59.774 -1.174 17934 267 1 1 . 1 1 64 64 ILE CB C 64 42.690 42.690 42.266 0.424 17934 268 1 1 . 1 1 64 64 ILE H H 64 9.348 9.348 8.885 0.463 17934 269 1 1 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.126 0.614 17934 270 1 1 . 1 1 65 65 ILE C C 65 175.378 175.378 174.605 0.773 17934 271 1 1 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.595 -1.515 17934 272 1 1 . 1 1 65 65 ILE CB C 65 38.750 38.750 36.940 1.810 17934 273 1 1 . 1 1 66 66 LEU N N 66 110.343 110.343 129.834 -19.491 17934 274 1 1 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.809 0.041 17934 275 1 1 . 1 1 66 66 LEU C C 66 174.982 174.982 175.505 -0.523 17934 276 1 1 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.108 -0.198 17934 277 1 1 . 1 1 66 66 LEU CB C 66 44.230 44.230 43.072 1.158 17934 278 1 1 . 1 1 66 66 LEU H H 66 9.610 9.610 9.173 0.437 17934 279 1 1 . 1 1 67 67 SER N N 67 120.990 120.990 120.329 0.661 17934 280 1 1 . 1 1 67 67 SER HA H 67 5.405 5.405 5.179 0.226 17934 281 1 1 . 1 1 67 67 SER C C 67 174.405 174.405 173.032 1.373 17934 282 1 1 . 1 1 67 67 SER CA C 67 57.195 57.195 57.011 0.184 17934 283 1 1 . 1 1 67 67 SER CB C 67 64.695 64.695 64.782 -0.087 17934 284 1 1 . 1 1 67 67 SER H H 67 9.260 9.260 9.124 0.136 17934 285 1 1 . 1 1 68 68 VAL N N 68 128.176 128.176 127.350 0.826 17934 286 1 1 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.507 -0.014 17934 287 1 1 . 1 1 68 68 VAL C C 68 173.891 173.891 173.280 0.611 17934 288 1 1 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.667 1.683 17934 289 1 1 . 1 1 68 68 VAL CB C 68 33.750 33.750 33.776 -0.026 17934 290 1 1 . 1 1 68 68 VAL H H 68 9.225 9.225 9.058 0.167 17934 291 1 1 . 1 1 69 69 SER N N 69 121.697 121.697 123.374 -1.677 17934 292 1 1 . 1 1 69 69 SER HA H 69 4.837 4.837 4.910 -0.073 17934 293 1 1 . 1 1 69 69 SER C C 69 173.188 173.188 174.643 -1.455 17934 294 1 1 . 1 1 69 69 SER CA C 69 57.195 57.195 55.803 1.392 17934 295 1 1 . 1 1 69 69 SER CB C 69 67.976 67.976 65.798 2.178 17934 296 1 1 . 1 1 69 69 SER H H 69 8.869 8.869 8.795 0.074 17934 297 1 1 . 1 1 70 70 ALA N N 70 118.689 118.689 126.123 -7.434 17934 298 1 1 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.233 -0.083 17934 299 1 1 . 1 1 70 70 ALA C C 70 176.714 176.714 177.967 -1.253 17934 300 1 1 . 1 1 70 70 ALA CA C 70 53.910 53.910 53.934 -0.024 17934 301 1 1 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.517 0.083 17934 302 1 1 . 1 1 70 70 ALA H H 70 8.810 8.810 9.037 -0.227 17934 303 1 1 . 1 1 71 71 LYS N N 71 112.633 112.633 116.967 -4.334 17934 304 1 1 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.416 -0.141 17934 305 1 1 . 1 1 71 71 LYS C C 71 177.033 177.033 176.098 0.935 17934 306 1 1 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.724 1.471 17934 307 1 1 . 1 1 71 71 LYS CB C 71 33.289 33.289 33.563 -0.274 17934 308 1 1 . 1 1 71 71 LYS H H 71 7.830 7.830 7.684 0.146 17934 309 1 1 . 1 1 72 72 GLY N N 72 108.432 108.432 106.577 1.855 17934 310 1 1 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.013 0.463 17934 311 1 1 . 1 1 72 72 GLY H H 72 7.685 7.685 7.685 0.000 17934 312 1 1 . 1 1 73 73 VAL N N 73 120.414 120.414 117.006 3.408 17934 313 1 1 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.794 0.206 17934 314 1 1 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.032 1.438 17934 315 1 1 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.205 0.425 17934 316 1 1 . 1 1 73 73 VAL H H 73 8.620 8.620 8.041 0.579 17934 317 1 1 . 1 1 74 74 LYS N N 74 125.257 125.257 122.957 2.300 17934 318 1 1 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.458 0.558 17934 319 1 1 . 1 1 74 74 LYS CA C 74 54.383 54.383 53.794 0.590 17934 320 1 1 . 1 1 74 74 LYS CB C 74 36.570 36.570 36.021 0.549 17934 321 1 1 . 1 1 74 74 LYS H H 74 8.783 8.783 8.039 0.744 17934 322 1 1 . 1 1 75 75 PHE N N 75 119.414 119.414 118.300 1.114 17934 323 1 1 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.601 0.099 17934 324 1 1 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.225 -2.305 17934 325 1 1 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.142 -0.532 17934 326 1 1 . 1 1 75 75 PHE H H 75 8.432 8.432 8.812 -0.380 17934 327 1 1 . 1 1 76 76 ILE N N 76 121.430 121.430 122.014 -0.584 17934 328 1 1 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.871 -0.031 17934 329 1 1 . 1 1 76 76 ILE C C 76 175.249 175.249 174.352 0.897 17934 330 1 1 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.795 -0.725 17934 331 1 1 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.895 -0.675 17934 332 1 1 . 1 1 76 76 ILE H H 76 8.960 8.960 8.477 0.483 17934 333 1 1 . 1 1 77 77 ASP N N 77 125.744 125.744 123.478 2.266 17934 334 1 1 . 1 1 77 77 ASP HA H 77 4.563 4.563 4.970 -0.407 17934 335 1 1 . 1 1 77 77 ASP C C 77 177.569 177.569 175.616 1.953 17934 336 1 1 . 1 1 77 77 ASP CA C 77 55.789 55.789 53.532 2.257 17934 337 1 1 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.753 -0.152 17934 338 1 1 . 1 1 77 77 ASP H H 77 8.750 8.750 8.803 -0.053 17934 339 1 1 . 1 1 78 78 ALA N N 78 128.632 128.632 128.443 0.189 17934 340 1 1 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.236 -0.266 17934 341 1 1 . 1 1 78 78 ALA C C 78 178.052 178.052 178.276 -0.224 17934 342 1 1 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.456 0.374 17934 343 1 1 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.891 -0.098 17934 344 1 1 . 1 1 78 78 ALA H H 78 8.700 8.700 8.844 -0.144 17934 345 1 1 . 1 1 79 79 THR N N 79 113.087 113.087 113.423 -0.336 17934 346 1 1 . 1 1 79 79 THR HA H 79 4.194 4.194 4.339 -0.145 17934 347 1 1 . 1 1 79 79 THR C C 79 175.587 175.587 175.734 -0.147 17934 348 1 1 . 1 1 79 79 THR CA C 79 64.695 64.695 64.938 -0.242 17934 349 1 1 . 1 1 79 79 THR CB C 79 69.382 69.382 69.176 0.206 17934 350 1 1 . 1 1 79 79 THR H H 79 8.779 8.779 8.063 0.716 17934 351 1 1 . 1 1 80 80 ASN N N 80 118.434 118.434 116.455 1.979 17934 352 1 1 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.720 0.017 17934 353 1 1 . 1 1 80 80 ASN CA C 80 53.445 53.445 53.300 0.145 17934 354 1 1 . 1 1 80 80 ASN CB C 80 39.383 39.383 38.833 0.550 17934 355 1 1 . 1 1 80 80 ASN H H 80 8.584 8.584 7.888 0.696 17934 356 1 1 . 1 1 81 81 LYS N N 81 112.429 112.429 114.592 -2.163 17934 357 1 1 . 1 1 81 81 LYS C C 81 174.909 174.909 175.277 -0.368 17934 358 1 1 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.657 0.007 17934 359 1 1 . 1 1 81 81 LYS CB C 81 28.602 28.602 29.967 -1.365 17934 360 1 1 . 1 1 81 81 LYS H H 81 7.966 7.966 8.316 -0.350 17934 361 1 1 . 1 1 82 82 ASN N N 82 116.806 116.806 115.933 0.873 17934 362 1 1 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.757 -0.167 17934 363 1 1 . 1 1 82 82 ASN C C 82 174.999 174.999 173.767 1.232 17934 364 1 1 . 1 1 82 82 ASN CA C 82 52.976 52.976 51.824 1.152 17934 365 1 1 . 1 1 82 82 ASN CB C 82 38.445 38.445 41.156 -2.711 17934 366 1 1 . 1 1 82 82 ASN H H 82 8.455 8.455 7.572 0.883 17934 367 1 1 . 1 1 83 83 ILE N N 83 122.447 122.447 119.867 2.580 17934 368 1 1 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.340 -0.310 17934 369 1 1 . 1 1 83 83 ILE C C 83 176.572 176.572 175.431 1.141 17934 370 1 1 . 1 1 83 83 ILE CA C 83 62.350 62.350 60.058 2.292 17934 371 1 1 . 1 1 83 83 ILE CB C 83 37.970 37.970 36.804 1.166 17934 372 1 1 . 1 1 83 83 ILE H H 83 8.650 8.650 8.358 0.292 17934 373 1 1 . 1 1 84 84 ILE N N 84 129.339 129.339 128.091 1.248 17934 374 1 1 . 1 1 84 84 ILE HA H 84 3.920 3.920 3.961 -0.041 17934 375 1 1 . 1 1 84 84 ILE C C 84 175.873 175.873 175.787 0.086 17934 376 1 1 . 1 1 84 84 ILE CA C 84 62.810 62.810 63.868 -1.058 17934 377 1 1 . 1 1 84 84 ILE CB C 84 38.840 38.840 39.054 -0.214 17934 378 1 1 . 1 1 84 84 ILE H H 84 8.930 8.930 8.850 0.080 17934 379 1 1 . 1 1 85 85 ALA N N 85 118.867 118.867 120.043 -1.176 17934 380 1 1 . 1 1 85 85 ALA C C 85 174.100 174.100 174.401 -0.301 17934 381 1 1 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.382 -0.812 17934 382 1 1 . 1 1 85 85 ALA H H 85 7.048 7.048 8.010 -0.962 17934 383 1 1 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.966 0.188 17934 384 1 1 . 1 1 87 87 HIS C C 87 174.986 174.986 174.655 0.331 17934 385 1 1 . 1 1 87 87 HIS CB C 87 34.350 34.350 32.333 2.017 17934 386 1 1 . 1 1 88 88 GLU N N 88 125.372 125.372 120.855 4.517 17934 387 1 1 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.244 0.277 17934 388 1 1 . 1 1 88 88 GLU C C 88 179.047 179.047 176.959 2.088 17934 389 1 1 . 1 1 88 88 GLU CA C 88 56.726 56.726 56.575 0.151 17934 390 1 1 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.050 0.426 17934 391 1 1 . 1 1 88 88 GLU H H 88 9.106 9.106 8.729 0.377 17934 392 1 1 . 1 1 89 89 ILE N N 89 124.132 124.132 121.620 2.512 17934 393 1 1 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.913 0.106 17934 394 1 1 . 1 1 89 89 ILE C C 89 176.095 176.095 177.271 -1.176 17934 395 1 1 . 1 1 89 89 ILE CA C 89 62.351 62.351 64.117 -1.766 17934 396 1 1 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.187 0.727 17934 397 1 1 . 1 1 89 89 ILE H H 89 8.055 8.055 8.797 -0.742 17934 398 1 1 . 1 1 90 90 ARG N N 90 116.949 116.949 115.472 1.477 17934 399 1 1 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.301 0.037 17934 400 1 1 . 1 1 90 90 ARG C C 90 176.578 176.578 176.584 -0.006 17934 401 1 1 . 1 1 90 90 ARG CA C 90 57.664 57.664 58.114 -0.450 17934 402 1 1 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.026 0.044 17934 403 1 1 . 1 1 90 90 ARG H H 90 8.045 8.045 8.493 -0.448 17934 404 1 1 . 1 1 91 91 ASN N N 91 116.320 116.320 116.963 -0.643 17934 405 1 1 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.670 0.483 17934 406 1 1 . 1 1 91 91 ASN C C 91 174.595 174.595 175.704 -1.109 17934 407 1 1 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.550 -2.042 17934 408 1 1 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.928 -0.076 17934 409 1 1 . 1 1 91 91 ASN H H 91 8.067 8.067 7.770 0.297 17934 410 1 1 . 1 1 92 92 ILE N N 92 122.441 122.441 120.824 1.617 17934 411 1 1 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.883 1.190 17934 412 1 1 . 1 1 92 92 ILE C C 92 175.229 175.229 175.329 -0.100 17934 413 1 1 . 1 1 92 92 ILE CA C 92 61.880 61.880 63.061 -1.181 17934 414 1 1 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.561 2.289 17934 415 1 1 . 1 1 92 92 ILE H H 92 7.483 7.483 7.819 -0.336 17934 416 1 1 . 1 1 93 93 SER N N 93 120.329 120.329 123.285 -2.956 17934 417 1 1 . 1 1 93 93 SER HA H 93 4.684 4.684 4.242 0.442 17934 418 1 1 . 1 1 93 93 SER C C 93 180.744 180.744 174.080 6.664 17934 419 1 1 . 1 1 93 93 SER CA C 93 57.664 57.664 59.762 -2.098 17934 420 1 1 . 1 1 93 93 SER CB C 93 66.570 66.570 64.534 2.035 17934 421 1 1 . 1 1 93 93 SER H H 93 9.545 9.545 8.202 1.343 17934 422 1 1 . 1 1 94 94 CYS N N 94 110.900 110.900 118.328 -7.428 17934 423 1 1 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.543 -0.731 17934 424 1 1 . 1 1 94 94 CYS C C 94 173.973 173.973 172.758 1.215 17934 425 1 1 . 1 1 94 94 CYS CA C 94 59.539 59.539 58.268 1.271 17934 426 1 1 . 1 1 94 94 CYS CB C 94 26.258 26.258 31.380 -5.122 17934 427 1 1 . 1 1 94 94 CYS H H 94 8.858 8.858 7.686 1.172 17934 428 1 1 . 1 1 95 95 ALA N N 95 121.379 121.379 123.080 -1.701 17934 429 1 1 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.603 -0.173 17934 430 1 1 . 1 1 95 95 ALA C C 95 178.098 178.098 175.075 3.023 17934 431 1 1 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.749 0.901 17934 432 1 1 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.507 -2.207 17934 433 1 1 . 1 1 95 95 ALA H H 95 8.360 8.360 8.338 0.022 17934 434 1 1 . 1 1 96 96 ALA N N 96 122.576 122.576 124.928 -2.352 17934 435 1 1 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.715 -0.035 17934 436 1 1 . 1 1 96 96 ALA C C 96 175.716 175.716 175.002 0.714 17934 437 1 1 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.154 1.286 17934 438 1 1 . 1 1 96 96 ALA CB C 96 22.700 22.700 22.396 0.304 17934 439 1 1 . 1 1 96 96 ALA H H 96 9.080 9.080 8.483 0.597 17934 440 1 1 . 1 1 97 97 GLN N N 97 116.903 116.903 119.761 -2.858 17934 441 1 1 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.693 0.237 17934 442 1 1 . 1 1 97 97 GLN C C 97 175.270 175.270 173.403 1.867 17934 443 1 1 . 1 1 97 97 GLN CA C 97 54.851 54.851 54.140 0.711 17934 444 1 1 . 1 1 97 97 GLN CB C 97 33.758 33.758 32.187 1.571 17934 445 1 1 . 1 1 97 97 GLN H H 97 8.369 8.369 8.185 0.184 17934 446 1 1 . 1 1 98 98 ASP N N 98 124.971 124.971 122.061 2.910 17934 447 1 1 . 1 1 98 98 ASP C C 98 175.217 175.217 176.213 -0.996 17934 448 1 1 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.223 -0.184 17934 449 1 1 . 1 1 98 98 ASP CB C 98 42.195 42.195 41.589 0.606 17934 450 1 1 . 1 1 98 98 ASP H H 98 8.395 8.395 8.222 0.173 17934 451 1 1 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.377 -0.143 17934 452 1 1 . 1 1 99 99 PRO C C 99 178.433 178.433 177.367 1.066 17934 453 1 1 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.819 -0.124 17934 454 1 1 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.172 0.180 17934 455 1 1 . 1 1 100 100 GLU N N 100 116.223 116.223 118.960 -2.737 17934 456 1 1 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.150 0.070 17934 457 1 1 . 1 1 100 100 GLU C C 100 176.678 176.678 175.632 1.046 17934 458 1 1 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.290 -1.564 17934 459 1 1 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.661 2.284 17934 460 1 1 . 1 1 100 100 GLU H H 100 8.643 8.643 8.771 -0.128 17934 461 1 1 . 1 1 101 101 ASP N N 101 119.053 119.053 118.693 0.360 17934 462 1 1 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.847 -0.304 17934 463 1 1 . 1 1 101 101 ASP C C 101 174.771 174.771 176.471 -1.700 17934 464 1 1 . 1 1 101 101 ASP CA C 101 53.914 53.914 52.554 1.360 17934 465 1 1 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.021 0.768 17934 466 1 1 . 1 1 101 101 ASP H H 101 7.597 7.597 7.998 -0.401 17934 467 1 1 . 1 1 102 102 LEU N N 102 123.986 123.986 120.816 3.170 17934 468 1 1 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.180 0.210 17934 469 1 1 . 1 1 102 102 LEU C C 102 177.141 177.141 178.200 -1.059 17934 470 1 1 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.697 -0.037 17934 471 1 1 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.314 1.346 17934 472 1 1 . 1 1 102 102 LEU H H 102 8.534 8.534 7.691 0.843 17934 473 1 1 . 1 1 103 103 SER N N 103 112.339 112.339 112.551 -0.212 17934 474 1 1 . 1 1 103 103 SER HA H 103 4.290 4.290 4.236 0.054 17934 475 1 1 . 1 1 103 103 SER C C 103 174.106 174.106 175.147 -1.041 17934 476 1 1 . 1 1 103 103 SER CA C 103 60.945 60.945 60.846 0.099 17934 477 1 1 . 1 1 103 103 SER CB C 103 63.757 63.757 63.453 0.304 17934 478 1 1 . 1 1 103 103 SER H H 103 7.867 7.867 8.261 -0.394 17934 479 1 1 . 1 1 104 104 THR N N 104 123.070 123.070 116.886 6.184 17934 480 1 1 . 1 1 104 104 THR HA H 104 5.373 5.373 4.586 0.787 17934 481 1 1 . 1 1 104 104 THR C C 104 180.693 180.693 173.154 7.539 17934 482 1 1 . 1 1 104 104 THR CA C 104 63.289 63.289 61.813 1.476 17934 483 1 1 . 1 1 104 104 THR CB C 104 69.382 69.382 69.184 0.198 17934 484 1 1 . 1 1 104 104 THR H H 104 8.830 8.830 8.003 0.827 17934 485 1 1 . 1 1 105 105 PHE N N 105 122.582 122.582 123.538 -0.956 17934 486 1 1 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.916 0.554 17934 487 1 1 . 1 1 105 105 PHE C C 105 179.211 179.211 172.087 7.124 17934 488 1 1 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.479 -0.159 17934 489 1 1 . 1 1 105 105 PHE CB C 105 41.790 41.790 42.006 -0.216 17934 490 1 1 . 1 1 105 105 PHE H H 105 9.170 9.170 8.624 0.546 17934 491 1 1 . 1 1 106 106 ALA N N 106 119.567 119.567 122.161 -2.594 17934 492 1 1 . 1 1 106 106 ALA C C 106 175.603 175.603 175.353 0.250 17934 493 1 1 . 1 1 106 106 ALA H H 106 8.770 8.770 9.027 -0.257 17934 494 1 1 . 1 1 107 107 TYR N N 107 109.933 109.933 119.100 -9.167 17934 495 1 1 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.064 -0.144 17934 496 1 1 . 1 1 107 107 TYR C C 107 180.426 180.426 172.825 7.601 17934 497 1 1 . 1 1 107 107 TYR CA C 107 57.080 57.080 54.804 2.276 17934 498 1 1 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.221 -0.432 17934 499 1 1 . 1 1 107 107 TYR H H 107 7.950 7.950 8.674 -0.724 17934 500 1 1 . 1 1 108 108 ILE N N 108 120.613 120.613 121.989 -1.376 17934 501 1 1 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.366 1.004 17934 502 1 1 . 1 1 108 108 ILE C C 108 176.212 176.212 175.665 0.547 17934 503 1 1 . 1 1 108 108 ILE CA C 108 59.540 59.540 61.017 -1.478 17934 504 1 1 . 1 1 108 108 ILE CB C 108 39.380 39.380 39.626 -0.246 17934 505 1 1 . 1 1 108 108 ILE H H 108 8.869 8.869 8.262 0.607 17934 506 1 1 . 1 1 109 109 THR N N 109 116.505 116.505 121.475 -4.970 17934 507 1 1 . 1 1 109 109 THR HA H 109 5.669 5.669 4.589 1.080 17934 508 1 1 . 1 1 109 109 THR C C 109 173.505 173.505 173.192 0.313 17934 509 1 1 . 1 1 109 109 THR CA C 109 59.070 59.070 60.277 -1.207 17934 510 1 1 . 1 1 109 109 THR H H 109 9.489 9.489 7.998 1.491 17934 511 1 1 . 1 1 110 110 LYS N N 110 122.960 122.960 120.577 2.383 17934 512 1 1 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.005 0.456 17934 513 1 1 . 1 1 110 110 LYS C C 110 175.937 175.937 176.284 -0.347 17934 514 1 1 . 1 1 110 110 LYS CA C 110 55.789 55.789 56.302 -0.513 17934 515 1 1 . 1 1 110 110 LYS CB C 110 34.227 34.227 32.823 1.404 17934 516 1 1 . 1 1 110 110 LYS H H 110 7.831 7.831 8.383 -0.552 17934 517 1 1 . 1 1 111 111 ASP N N 111 127.409 127.409 122.749 4.660 17934 518 1 1 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.033 0.748 17934 519 1 1 . 1 1 111 111 ASP C C 111 176.396 176.396 177.573 -1.177 17934 520 1 1 . 1 1 111 111 ASP CA C 111 53.914 53.914 53.879 0.035 17934 521 1 1 . 1 1 111 111 ASP CB C 111 43.133 43.133 41.467 1.667 17934 522 1 1 . 1 1 111 111 ASP H H 111 8.769 8.769 7.755 1.014 17934 523 1 1 . 1 1 112 112 LEU N N 112 125.913 125.913 121.939 3.974 17934 524 1 1 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.136 0.014 17934 525 1 1 . 1 1 112 112 LEU C C 112 178.553 178.553 177.433 1.120 17934 526 1 1 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.268 -0.078 17934 527 1 1 . 1 1 112 112 LEU CB C 112 41.790 41.790 42.446 -0.656 17934 528 1 1 . 1 1 112 112 LEU H H 112 8.593 8.593 8.495 0.098 17934 529 1 1 . 1 1 113 113 LYS N N 113 117.189 117.189 116.418 0.771 17934 530 1 1 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.255 0.007 17934 531 1 1 . 1 1 113 113 LYS C C 113 177.180 177.180 175.592 1.588 17934 532 1 1 . 1 1 113 113 LYS CA C 113 58.133 58.133 56.436 1.697 17934 533 1 1 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.822 -0.002 17934 534 1 1 . 1 1 113 113 LYS H H 113 8.207 8.207 7.851 0.356 17934 535 1 1 . 1 1 114 114 SER N N 114 112.492 112.492 110.482 2.010 17934 536 1 1 . 1 1 114 114 SER CA C 114 58.601 58.601 58.679 -0.078 17934 537 1 1 . 1 1 114 114 SER CB C 114 65.164 65.164 61.323 3.841 17934 538 1 1 . 1 1 114 114 SER H H 114 7.755 7.755 7.567 0.188 17934 539 1 1 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.540 -0.151 17934 540 1 1 . 1 1 115 115 ASN C C 115 174.203 174.203 175.241 -1.038 17934 541 1 1 . 1 1 115 115 ASN CA C 115 54.383 54.383 54.962 -0.580 17934 542 1 1 . 1 1 115 115 ASN CB C 115 37.977 37.977 39.566 -1.589 17934 543 1 1 . 1 1 116 116 HIS N N 116 116.822 116.822 115.022 1.800 17934 544 1 1 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.872 0.058 17934 545 1 1 . 1 1 116 116 HIS C C 116 173.898 173.898 174.412 -0.514 17934 546 1 1 . 1 1 116 116 HIS CA C 116 54.910 54.910 55.094 -0.184 17934 547 1 1 . 1 1 116 116 HIS CB C 116 32.650 32.650 32.895 -0.245 17934 548 1 1 . 1 1 116 116 HIS H H 116 7.690 7.690 8.115 -0.425 17934 549 1 1 . 1 1 117 117 HIS N N 117 118.253 118.253 119.623 -1.370 17934 550 1 1 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.516 0.804 17934 551 1 1 . 1 1 117 117 HIS C C 117 173.695 173.695 174.900 -1.205 17934 552 1 1 . 1 1 117 117 HIS CA C 117 56.350 56.350 57.543 -1.193 17934 553 1 1 . 1 1 117 117 HIS CB C 117 32.350 32.350 29.608 2.742 17934 554 1 1 . 1 1 117 117 HIS H H 117 8.340 8.340 9.008 -0.668 17934 555 1 1 . 1 1 118 118 TYR N N 118 118.301 118.301 124.033 -5.732 17934 556 1 1 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.689 0.321 17934 557 1 1 . 1 1 118 118 TYR C C 118 173.530 173.530 174.474 -0.944 17934 558 1 1 . 1 1 118 118 TYR CA C 118 56.730 56.730 57.260 -0.529 17934 559 1 1 . 1 1 118 118 TYR CB C 118 43.240 43.240 41.737 1.503 17934 560 1 1 . 1 1 118 118 TYR H H 118 9.080 9.080 8.662 0.418 17934 561 1 1 . 1 1 119 119 CYS N N 119 121.015 121.015 119.705 1.310 17934 562 1 1 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.570 0.493 17934 563 1 1 . 1 1 119 119 CYS C C 119 180.664 180.664 172.841 7.823 17934 564 1 1 . 1 1 119 119 CYS CA C 119 56.726 56.726 56.659 0.067 17934 565 1 1 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.889 0.650 17934 566 1 1 . 1 1 119 119 CYS H H 119 9.120 9.120 8.748 0.372 17934 567 1 1 . 1 1 120 120 HIS N N 120 110.134 110.134 126.912 -16.778 17934 568 1 1 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.484 0.215 17934 569 1 1 . 1 1 120 120 HIS C C 120 180.776 180.776 173.088 7.688 17934 570 1 1 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.084 1.236 17934 571 1 1 . 1 1 120 120 HIS CB C 120 32.352 32.352 32.337 0.015 17934 572 1 1 . 1 1 120 120 HIS H H 120 8.482 8.482 8.576 -0.094 17934 573 1 1 . 1 1 121 121 VAL N N 121 120.855 120.855 121.971 -1.116 17934 574 1 1 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.424 -0.074 17934 575 1 1 . 1 1 121 121 VAL C C 121 173.419 173.419 172.695 0.724 17934 576 1 1 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.354 1.056 17934 577 1 1 . 1 1 121 121 VAL CB C 121 33.280 33.280 34.085 -0.805 17934 578 1 1 . 1 1 121 121 VAL H H 121 7.929 7.929 8.184 -0.255 17934 579 1 1 . 1 1 122 122 PHE N N 122 124.384 124.384 128.341 -3.957 17934 580 1 1 . 1 1 122 122 PHE HA H 122 5.420 5.420 4.931 0.489 17934 581 1 1 . 1 1 122 122 PHE C C 122 174.876 174.876 174.400 0.476 17934 582 1 1 . 1 1 122 122 PHE CA C 122 55.320 55.320 55.807 -0.487 17934 583 1 1 . 1 1 122 122 PHE CB C 122 44.540 44.540 43.176 1.363 17934 584 1 1 . 1 1 122 122 PHE H H 122 8.910 8.910 9.223 -0.313 17934 585 1 1 . 1 1 123 123 THR N N 123 112.451 112.451 119.485 -7.034 17934 586 1 1 . 1 1 123 123 THR HA H 123 5.147 5.147 4.459 0.688 17934 587 1 1 . 1 1 123 123 THR C C 123 174.096 174.096 173.265 0.831 17934 588 1 1 . 1 1 123 123 THR CA C 123 61.843 61.843 61.584 0.259 17934 589 1 1 . 1 1 123 123 THR CB C 123 71.218 71.218 69.310 1.908 17934 590 1 1 . 1 1 123 123 THR H H 123 8.668 8.668 8.796 -0.128 17934 591 1 1 . 1 1 124 124 ALA N N 124 128.922 128.922 129.891 -0.969 17934 592 1 1 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.162 0.558 17934 593 1 1 . 1 1 124 124 ALA C C 124 177.168 177.168 176.539 0.629 17934 594 1 1 . 1 1 124 124 ALA CA C 124 50.890 50.890 50.744 0.146 17934 595 1 1 . 1 1 124 124 ALA CB C 124 21.100 21.100 19.958 1.142 17934 596 1 1 . 1 1 124 124 ALA H H 124 9.180 9.180 8.141 1.039 17934 597 1 1 . 1 1 125 125 PHE N N 125 115.427 115.427 118.204 -2.777 17934 598 1 1 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.443 -0.153 17934 599 1 1 . 1 1 125 125 PHE C C 125 174.703 174.703 175.476 -0.773 17934 600 1 1 . 1 1 125 125 PHE CA C 125 60.470 60.470 59.030 1.440 17934 601 1 1 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.542 -1.482 17934 602 1 1 . 1 1 125 125 PHE H H 125 8.560 8.560 8.158 0.402 17934 603 1 1 . 1 1 126 126 ASP N N 126 115.745 115.745 119.522 -3.777 17934 604 1 1 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.889 -0.046 17934 605 1 1 . 1 1 126 126 ASP C C 126 176.532 176.532 176.399 0.133 17934 606 1 1 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.064 0.381 17934 607 1 1 . 1 1 126 126 ASP CB C 126 44.070 44.070 42.947 1.123 17934 608 1 1 . 1 1 126 126 ASP H H 126 7.417 7.417 7.629 -0.212 17934 609 1 1 . 1 1 127 127 VAL N N 127 121.923 121.923 124.882 -2.959 17934 610 1 1 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.569 0.021 17934 611 1 1 . 1 1 127 127 VAL C C 127 176.863 176.863 177.379 -0.516 17934 612 1 1 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.547 -0.917 17934 613 1 1 . 1 1 127 127 VAL CB C 127 31.830 31.830 31.913 -0.083 17934 614 1 1 . 1 1 127 127 VAL H H 127 8.508 8.508 8.696 -0.188 17934 615 1 1 . 1 1 128 128 ASN N N 128 118.851 118.851 118.589 0.262 17934 616 1 1 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.432 0.044 17934 617 1 1 . 1 1 128 128 ASN C C 128 178.251 178.251 177.349 0.902 17934 618 1 1 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.196 0.062 17934 619 1 1 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.119 -0.142 17934 620 1 1 . 1 1 128 128 ASN H H 128 8.207 8.207 8.263 -0.056 17934 621 1 1 . 1 1 129 129 LEU N N 129 122.549 122.549 119.943 2.606 17934 622 1 1 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.671 0.538 17934 623 1 1 . 1 1 129 129 LEU C C 129 178.003 178.003 178.151 -0.148 17934 624 1 1 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.145 0.045 17934 625 1 1 . 1 1 129 129 LEU CB C 129 41.790 41.790 40.492 1.298 17934 626 1 1 . 1 1 129 129 LEU H H 129 8.223 8.223 7.941 0.282 17934 627 1 1 . 1 1 130 130 ALA N N 130 120.036 120.036 122.131 -2.095 17934 628 1 1 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.952 -0.642 17934 629 1 1 . 1 1 130 130 ALA C C 130 178.172 178.172 179.198 -1.026 17934 630 1 1 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.455 0.325 17934 631 1 1 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.252 0.818 17934 632 1 1 . 1 1 130 130 ALA H H 130 7.360 7.360 8.462 -1.102 17934 633 1 1 . 1 1 131 131 ALA N N 131 116.989 116.989 120.427 -3.438 17934 634 1 1 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.963 -0.253 17934 635 1 1 . 1 1 131 131 ALA C C 131 180.163 180.163 180.037 0.126 17934 636 1 1 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.609 1.171 17934 637 1 1 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.055 -0.225 17934 638 1 1 . 1 1 131 131 ALA H H 131 7.360 7.360 8.489 -1.129 17934 639 1 1 . 1 1 132 132 GLU N N 132 119.462 119.462 119.276 0.186 17934 640 1 1 . 1 1 132 132 GLU HA H 132 3.888 3.888 4.087 -0.199 17934 641 1 1 . 1 1 132 132 GLU C C 132 179.243 179.243 178.933 0.310 17934 642 1 1 . 1 1 132 132 GLU CA C 132 59.539 59.539 58.874 0.665 17934 643 1 1 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.511 0.028 17934 644 1 1 . 1 1 132 132 GLU H H 132 7.673 7.673 8.174 -0.501 17934 645 1 1 . 1 1 133 133 ILE N N 133 123.218 123.218 121.543 1.675 17934 646 1 1 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.686 -0.906 17934 647 1 1 . 1 1 133 133 ILE C C 133 177.421 177.421 178.231 -0.810 17934 648 1 1 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.430 1.060 17934 649 1 1 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.900 -1.250 17934 650 1 1 . 1 1 133 133 ILE H H 133 8.154 8.154 8.305 -0.151 17934 651 1 1 . 1 1 134 134 ILE N N 134 118.244 118.244 119.484 -1.240 17934 652 1 1 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.328 0.212 17934 653 1 1 . 1 1 134 134 ILE C C 134 179.385 179.385 177.554 1.831 17934 654 1 1 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.350 -1.069 17934 655 1 1 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.815 -0.715 17934 656 1 1 . 1 1 134 134 ILE H H 134 7.376 7.376 8.296 -0.920 17934 657 1 1 . 1 1 135 135 LEU N N 135 123.061 123.061 120.968 2.093 17934 658 1 1 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.784 0.406 17934 659 1 1 . 1 1 135 135 LEU C C 135 179.858 179.858 178.599 1.259 17934 660 1 1 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.697 -0.507 17934 661 1 1 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.851 0.009 17934 662 1 1 . 1 1 135 135 LEU H H 135 8.036 8.036 8.118 -0.082 17934 663 1 1 . 1 1 136 136 THR N N 136 119.647 119.647 115.406 4.241 17934 664 1 1 . 1 1 136 136 THR HA H 136 3.725 3.725 3.891 -0.166 17934 665 1 1 . 1 1 136 136 THR C C 136 176.088 176.088 176.507 -0.419 17934 666 1 1 . 1 1 136 136 THR CA C 136 58.601 58.601 66.912 -8.310 17934 667 1 1 . 1 1 136 136 THR CB C 136 67.976 67.976 68.890 -0.914 17934 668 1 1 . 1 1 136 136 THR H H 136 8.508 8.508 8.256 0.252 17934 669 1 1 . 1 1 137 137 LEU N N 137 123.182 123.182 121.856 1.326 17934 670 1 1 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.761 -0.021 17934 671 1 1 . 1 1 137 137 LEU C C 137 178.341 178.341 178.972 -0.631 17934 672 1 1 . 1 1 137 137 LEU CA C 137 58.260 58.260 57.965 0.295 17934 673 1 1 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.537 0.013 17934 674 1 1 . 1 1 137 137 LEU H H 137 8.520 8.520 8.202 0.318 17934 675 1 1 . 1 1 138 138 GLY N N 138 105.266 105.266 105.603 -0.337 17934 676 1 1 . 1 1 138 138 GLY C C 138 176.973 176.973 176.058 0.915 17934 677 1 1 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.265 0.086 17934 678 1 1 . 1 1 138 138 GLY H H 138 7.858 7.858 8.191 -0.333 17934 679 1 1 . 1 1 139 139 GLN N N 139 123.485 123.485 122.436 1.049 17934 680 1 1 . 1 1 139 139 GLN C C 139 177.891 177.891 178.411 -0.520 17934 681 1 1 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.533 0.068 17934 682 1 1 . 1 1 139 139 GLN CB C 139 28.133 28.133 27.809 0.324 17934 683 1 1 . 1 1 139 139 GLN H H 139 8.195 8.195 8.638 -0.443 17934 684 1 1 . 1 1 140 140 ALA N N 140 122.754 122.754 121.113 1.641 17934 685 1 1 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.203 -0.494 17934 686 1 1 . 1 1 140 140 ALA C C 140 178.987 178.987 179.122 -0.135 17934 687 1 1 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.198 1.582 17934 688 1 1 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.212 -0.802 17934 689 1 1 . 1 1 140 140 ALA H H 140 8.530 8.530 8.434 0.096 17934 690 1 1 . 1 1 141 141 PHE N N 141 116.275 116.275 119.531 -3.256 17934 691 1 1 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.416 -0.326 17934 692 1 1 . 1 1 141 141 PHE C C 141 178.129 178.129 176.620 1.509 17934 693 1 1 . 1 1 141 141 PHE CA C 141 61.240 61.240 60.252 0.988 17934 694 1 1 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.601 -0.218 17934 695 1 1 . 1 1 141 141 PHE H H 141 7.920 7.920 8.098 -0.178 17934 696 1 1 . 1 1 142 142 GLU N N 142 119.967 119.967 119.614 0.353 17934 697 1 1 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.688 0.539 17934 698 1 1 . 1 1 142 142 GLU C C 142 179.250 179.250 177.603 1.647 17934 699 1 1 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.171 1.368 17934 700 1 1 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.944 -0.405 17934 701 1 1 . 1 1 142 142 GLU H H 142 7.713 7.713 8.300 -0.587 17934 702 1 1 . 1 1 143 143 VAL N N 143 120.189 120.189 120.056 0.133 17934 703 1 1 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.644 0.039 17934 704 1 1 . 1 1 143 143 VAL C C 143 178.066 178.066 175.683 2.383 17934 705 1 1 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.066 2.504 17934 706 1 1 . 1 1 143 143 VAL CB C 143 31.883 31.883 31.449 0.434 17934 707 1 1 . 1 1 143 143 VAL H H 143 8.608 8.608 7.634 0.974 17934 708 1 1 . 1 1 144 144 ALA N N 144 121.753 121.753 120.541 1.212 17934 709 1 1 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.152 -0.152 17934 710 1 1 . 1 1 144 144 ALA C C 144 180.776 180.776 176.292 4.484 17934 711 1 1 . 1 1 144 144 ALA CA C 144 55.780 55.780 51.282 4.497 17934 712 1 1 . 1 1 144 144 ALA CB C 144 18.770 18.770 19.816 -1.046 17934 713 1 1 . 1 1 144 144 ALA H H 144 8.399 8.399 7.130 1.269 17934 714 1 1 . 1 1 145 145 TYR N N 145 119.962 119.962 121.597 -1.635 17934 715 1 1 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.265 -0.075 17934 716 1 1 . 1 1 145 145 TYR C C 145 177.645 177.645 177.037 0.608 17934 717 1 1 . 1 1 145 145 TYR CA C 145 60.880 60.880 57.257 3.623 17934 718 1 1 . 1 1 145 145 TYR CB C 145 37.980 37.980 38.982 -1.002 17934 719 1 1 . 1 1 145 145 TYR H H 145 8.190 8.190 8.408 -0.218 17934 720 1 2 . 1 1 13 13 LYS N N 13 120.778 120.778 119.821 0.957 17934 721 1 2 . 1 1 13 13 LYS C C 13 176.476 176.476 176.209 0.267 17934 722 1 2 . 1 1 13 13 LYS CA C 13 58.601 58.601 57.184 1.417 17934 723 1 2 . 1 1 13 13 LYS CB C 13 32.820 32.820 32.631 0.189 17934 724 1 2 . 1 1 13 13 LYS H H 13 7.984 7.984 8.056 -0.072 17934 725 1 2 . 1 1 15 15 ILE HA H 15 3.820 3.820 4.154 -0.334 17934 726 1 2 . 1 1 15 15 ILE C C 15 176.376 176.376 176.191 0.185 17934 727 1 2 . 1 1 15 15 ILE CA C 15 63.570 63.570 62.205 1.365 17934 728 1 2 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.620 1.760 17934 729 1 2 . 1 1 16 16 ALA N N 16 121.364 121.364 120.614 0.750 17934 730 1 2 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.455 -0.017 17934 731 1 2 . 1 1 16 16 ALA C C 16 177.494 177.494 177.972 -0.478 17934 732 1 2 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.868 0.108 17934 733 1 2 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.732 0.601 17934 734 1 2 . 1 1 16 16 ALA H H 16 8.081 8.081 8.093 -0.012 17934 735 1 2 . 1 1 17 17 GLN N N 17 118.109 118.109 115.780 2.329 17934 736 1 2 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.510 0.063 17934 737 1 2 . 1 1 17 17 GLN C C 17 173.632 173.632 174.651 -1.019 17934 738 1 2 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.068 -0.217 17934 739 1 2 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.078 0.399 17934 740 1 2 . 1 1 17 17 GLN H H 17 7.550 7.550 8.214 -0.664 17934 741 1 2 . 1 1 18 18 SER N N 18 112.384 112.384 113.693 -1.309 17934 742 1 2 . 1 1 18 18 SER HA H 18 4.388 4.388 4.996 -0.608 17934 743 1 2 . 1 1 18 18 SER C C 18 173.780 173.780 172.039 1.741 17934 744 1 2 . 1 1 18 18 SER CA C 18 57.664 57.664 58.063 -0.399 17934 745 1 2 . 1 1 18 18 SER CB C 18 65.164 65.164 65.243 -0.079 17934 746 1 2 . 1 1 18 18 SER H H 18 7.666 7.666 7.975 -0.309 17934 747 1 2 . 1 1 19 19 CYS N N 19 120.116 120.116 119.699 0.417 17934 748 1 2 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.637 -0.307 17934 749 1 2 . 1 1 19 19 CYS C C 19 180.387 180.387 173.123 7.264 17934 750 1 2 . 1 1 19 19 CYS CA C 19 58.601 58.601 57.656 0.945 17934 751 1 2 . 1 1 19 19 CYS CB C 19 30.008 30.008 30.830 -0.822 17934 752 1 2 . 1 1 19 19 CYS H H 19 8.835 8.835 8.889 -0.054 17934 753 1 2 . 1 1 20 20 ASP N N 20 124.416 124.416 121.211 3.205 17934 754 1 2 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.544 -0.568 17934 755 1 2 . 1 1 20 20 ASP CB C 20 42.195 42.195 43.824 -1.629 17934 756 1 2 . 1 1 20 20 ASP H H 20 7.847 7.847 7.813 0.034 17934 757 1 2 . 1 1 21 21 TYR N N 21 121.296 121.296 121.500 -0.204 17934 758 1 2 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.756 -0.026 17934 759 1 2 . 1 1 21 21 TYR C C 21 175.793 175.793 174.312 1.481 17934 760 1 2 . 1 1 21 21 TYR CA C 21 57.200 57.200 57.113 0.087 17934 761 1 2 . 1 1 21 21 TYR CB C 21 43.240 43.240 42.960 0.280 17934 762 1 2 . 1 1 21 21 TYR H H 21 9.070 9.070 8.957 0.113 17934 763 1 2 . 1 1 22 22 LYS N N 22 122.820 122.820 123.519 -0.699 17934 764 1 2 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.112 0.080 17934 765 1 2 . 1 1 22 22 LYS C C 22 175.793 175.793 175.367 0.426 17934 766 1 2 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.666 0.592 17934 767 1 2 . 1 1 22 22 LYS CB C 22 33.758 33.758 32.998 0.759 17934 768 1 2 . 1 1 22 22 LYS H H 22 8.711 8.711 8.769 -0.058 17934 769 1 2 . 1 1 23 23 ALA N N 23 123.073 123.073 127.266 -4.193 17934 770 1 2 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.407 0.323 17934 771 1 2 . 1 1 23 23 ALA C C 23 174.515 174.515 175.417 -0.902 17934 772 1 2 . 1 1 23 23 ALA CA C 23 51.570 51.570 49.922 1.648 17934 773 1 2 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.514 -0.886 17934 774 1 2 . 1 1 23 23 ALA H H 23 8.727 8.727 8.588 0.139 17934 775 1 2 . 1 1 24 24 ALA N N 24 122.486 122.486 124.011 -1.525 17934 776 1 2 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.480 0.701 17934 777 1 2 . 1 1 24 24 ALA C C 24 176.835 176.835 176.042 0.793 17934 778 1 2 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.148 0.422 17934 779 1 2 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.045 0.075 17934 780 1 2 . 1 1 24 24 ALA H H 24 8.675 8.675 8.569 0.106 17934 781 1 2 . 1 1 25 25 TYR N N 25 122.698 122.698 126.080 -3.382 17934 782 1 2 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.276 0.734 17934 783 1 2 . 1 1 25 25 TYR CA C 25 54.340 54.340 57.896 -3.556 17934 784 1 2 . 1 1 25 25 TYR CB C 25 39.850 39.850 38.263 1.587 17934 785 1 2 . 1 1 25 25 TYR H H 25 8.270 8.270 8.649 -0.379 17934 786 1 2 . 1 1 26 26 LEU N N 26 127.997 127.997 129.038 -1.041 17934 787 1 2 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.160 -0.240 17934 788 1 2 . 1 1 26 26 LEU C C 26 175.983 175.983 176.892 -0.909 17934 789 1 2 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.351 0.375 17934 790 1 2 . 1 1 26 26 LEU CB C 26 41.070 41.070 42.955 -1.885 17934 791 1 2 . 1 1 26 26 LEU H H 26 8.700 8.700 8.208 0.492 17934 792 1 2 . 1 1 27 27 GLY N N 27 102.901 102.901 101.532 1.369 17934 793 1 2 . 1 1 27 27 GLY C C 27 176.219 176.219 171.531 4.688 17934 794 1 2 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.055 -1.454 17934 795 1 2 . 1 1 27 27 GLY H H 27 5.891 5.891 7.718 -1.827 17934 796 1 2 . 1 1 28 28 SER N N 28 111.551 111.551 113.705 -2.154 17934 797 1 2 . 1 1 28 28 SER HA H 28 5.785 5.785 5.215 0.570 17934 798 1 2 . 1 1 28 28 SER CA C 28 56.258 56.258 57.388 -1.130 17934 799 1 2 . 1 1 28 28 SER CB C 28 65.632 65.632 66.049 -0.417 17934 800 1 2 . 1 1 28 28 SER H H 28 7.981 7.981 8.363 -0.382 17934 801 1 2 . 1 1 29 29 MET N N 29 119.493 119.493 122.815 -3.322 17934 802 1 2 . 1 1 29 29 MET HA H 29 4.725 4.725 4.708 0.017 17934 803 1 2 . 1 1 29 29 MET C C 29 174.143 174.143 174.128 0.015 17934 804 1 2 . 1 1 29 29 MET CA C 29 54.036 54.036 53.865 0.170 17934 805 1 2 . 1 1 29 29 MET CB C 29 37.268 37.268 36.342 0.926 17934 806 1 2 . 1 1 29 29 MET H H 29 8.704 8.704 8.837 -0.133 17934 807 1 2 . 1 1 30 30 LEU N N 30 128.150 128.150 124.086 4.064 17934 808 1 2 . 1 1 30 30 LEU HA H 30 3.785 3.785 4.048 -0.263 17934 809 1 2 . 1 1 30 30 LEU C C 30 175.857 175.857 175.041 0.816 17934 810 1 2 . 1 1 30 30 LEU CA C 30 56.250 56.250 53.798 2.452 17934 811 1 2 . 1 1 30 30 LEU CB C 30 42.660 42.660 42.304 0.356 17934 812 1 2 . 1 1 30 30 LEU H H 30 8.630 8.630 8.308 0.322 17934 813 1 2 . 1 1 31 31 ILE N N 31 127.723 127.723 125.065 2.658 17934 814 1 2 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.391 -0.201 17934 815 1 2 . 1 1 31 31 ILE C C 31 174.881 174.881 173.655 1.226 17934 816 1 2 . 1 1 31 31 ILE CA C 31 57.660 57.660 58.788 -1.127 17934 817 1 2 . 1 1 31 31 ILE CB C 31 37.110 37.110 41.299 -4.189 17934 818 1 2 . 1 1 31 31 ILE H H 31 8.560 8.560 8.513 0.047 17934 819 1 2 . 1 1 32 32 LYS HA H 32 4.055 4.055 4.105 -0.050 17934 820 1 2 . 1 1 32 32 LYS C C 32 176.272 176.272 176.143 0.129 17934 821 1 2 . 1 1 32 32 LYS CA C 32 58.601 58.601 55.466 3.135 17934 822 1 2 . 1 1 32 32 LYS CB C 32 32.820 32.820 33.640 -0.820 17934 823 1 2 . 1 1 33 33 GLU N N 33 118.638 118.638 121.068 -2.430 17934 824 1 2 . 1 1 33 33 GLU HA H 33 4.388 4.388 3.964 0.424 17934 825 1 2 . 1 1 33 33 GLU C C 33 173.962 173.962 174.530 -0.568 17934 826 1 2 . 1 1 33 33 GLU CA C 33 54.851 54.851 56.731 -1.880 17934 827 1 2 . 1 1 33 33 GLU CB C 33 30.945 30.945 28.968 1.976 17934 828 1 2 . 1 1 33 33 GLU H H 33 7.723 7.723 8.629 -0.906 17934 829 1 2 . 1 1 34 34 LEU N N 34 126.535 126.535 120.453 6.082 17934 830 1 2 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.160 -0.215 17934 831 1 2 . 1 1 34 34 LEU C C 34 176.870 176.870 177.571 -0.701 17934 832 1 2 . 1 1 34 34 LEU CA C 34 54.850 54.850 55.040 -0.190 17934 833 1 2 . 1 1 34 34 LEU CB C 34 41.720 41.720 41.433 0.287 17934 834 1 2 . 1 1 34 34 LEU H H 34 8.446 8.446 8.128 0.318 17934 835 1 2 . 1 1 35 35 ARG N N 35 128.447 128.447 125.865 2.582 17934 836 1 2 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.594 -0.039 17934 837 1 2 . 1 1 35 35 ARG C C 35 176.110 176.110 175.729 0.381 17934 838 1 2 . 1 1 35 35 ARG CA C 35 54.851 54.851 55.252 -0.401 17934 839 1 2 . 1 1 35 35 ARG CB C 35 30.477 30.477 30.186 0.291 17934 840 1 2 . 1 1 35 35 ARG H H 35 8.680 8.680 8.773 -0.093 17934 841 1 2 . 1 1 36 36 GLY N N 36 107.406 107.406 114.274 -6.868 17934 842 1 2 . 1 1 36 36 GLY CA C 36 45.906 45.906 44.443 1.463 17934 843 1 2 . 1 1 36 36 GLY H H 36 7.182 7.182 8.314 -1.132 17934 844 1 2 . 1 1 37 37 THR HA H 37 4.060 4.060 4.077 -0.017 17934 845 1 2 . 1 1 37 37 THR C C 37 176.634 176.634 175.242 1.392 17934 846 1 2 . 1 1 37 37 THR CA C 37 65.632 65.632 63.668 1.964 17934 847 1 2 . 1 1 37 37 THR CB C 37 68.445 68.445 68.812 -0.367 17934 848 1 2 . 1 1 38 38 GLU N N 38 122.251 122.251 123.091 -0.840 17934 849 1 2 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.847 0.279 17934 850 1 2 . 1 1 38 38 GLU C C 38 179.981 179.981 178.050 1.931 17934 851 1 2 . 1 1 38 38 GLU CA C 38 60.008 60.008 60.028 -0.020 17934 852 1 2 . 1 1 38 38 GLU CB C 38 29.539 29.539 29.285 0.254 17934 853 1 2 . 1 1 38 38 GLU H H 38 8.450 8.450 8.810 -0.360 17934 854 1 2 . 1 1 39 39 SER N N 39 115.966 115.966 114.347 1.619 17934 855 1 2 . 1 1 39 39 SER C C 39 175.991 175.991 176.605 -0.614 17934 856 1 2 . 1 1 39 39 SER CA C 39 62.820 62.820 61.605 1.215 17934 857 1 2 . 1 1 39 39 SER H H 39 7.522 7.522 8.067 -0.545 17934 858 1 2 . 1 1 40 40 THR HA H 40 4.049 4.049 3.789 0.260 17934 859 1 2 . 1 1 40 40 THR C C 40 175.972 175.972 176.699 -0.727 17934 860 1 2 . 1 1 40 40 THR CA C 40 66.101 66.101 66.927 -0.826 17934 861 1 2 . 1 1 40 40 THR CB C 40 67.976 67.976 68.602 -0.626 17934 862 1 2 . 1 1 41 41 GLN N N 41 120.354 120.354 117.697 2.657 17934 863 1 2 . 1 1 41 41 GLN HA H 41 3.759 3.759 3.955 -0.196 17934 864 1 2 . 1 1 41 41 GLN C C 41 178.483 178.483 178.143 0.340 17934 865 1 2 . 1 1 41 41 GLN CA C 41 60.476 60.476 59.478 0.998 17934 866 1 2 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.075 0.058 17934 867 1 2 . 1 1 41 41 GLN H H 41 8.271 8.271 8.703 -0.432 17934 868 1 2 . 1 1 42 42 ASP N N 42 120.757 120.757 120.796 -0.039 17934 869 1 2 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.352 0.007 17934 870 1 2 . 1 1 42 42 ASP C C 42 177.480 177.480 178.061 -0.581 17934 871 1 2 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.209 0.455 17934 872 1 2 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.357 1.838 17934 873 1 2 . 1 1 42 42 ASP H H 42 7.954 7.954 7.838 0.116 17934 874 1 2 . 1 1 43 43 ALA N N 43 120.587 120.587 121.165 -0.578 17934 875 1 2 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.167 -0.177 17934 876 1 2 . 1 1 43 43 ALA C C 43 179.767 179.767 180.084 -0.317 17934 877 1 2 . 1 1 43 43 ALA CA C 43 55.320 55.320 54.792 0.528 17934 878 1 2 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.068 1.162 17934 879 1 2 . 1 1 43 43 ALA H H 43 7.842 7.842 8.099 -0.257 17934 880 1 2 . 1 1 44 44 CYS N N 44 115.428 115.428 118.858 -3.430 17934 881 1 2 . 1 1 44 44 CYS HA H 44 3.895 3.895 3.911 -0.016 17934 882 1 2 . 1 1 44 44 CYS C C 44 176.076 176.076 176.582 -0.506 17934 883 1 2 . 1 1 44 44 CYS CA C 44 64.695 64.695 64.165 0.530 17934 884 1 2 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.520 0.144 17934 885 1 2 . 1 1 44 44 CYS H H 44 7.900 7.900 8.025 -0.125 17934 886 1 2 . 1 1 45 45 ALA N N 45 120.487 120.487 121.991 -1.504 17934 887 1 2 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.994 0.006 17934 888 1 2 . 1 1 45 45 ALA C C 45 173.506 173.506 178.778 -5.272 17934 889 1 2 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.225 0.095 17934 890 1 2 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.114 -0.174 17934 891 1 2 . 1 1 45 45 ALA H H 45 7.250 7.250 8.631 -1.381 17934 892 1 2 . 1 1 46 46 LYS N N 46 119.267 119.267 119.142 0.125 17934 893 1 2 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.893 0.054 17934 894 1 2 . 1 1 46 46 LYS C C 46 179.561 179.561 178.571 0.990 17934 895 1 2 . 1 1 46 46 LYS H H 46 8.102 8.102 8.173 -0.071 17934 896 1 2 . 1 1 47 47 MET N N 47 118.009 118.009 118.842 -0.833 17934 897 1 2 . 1 1 47 47 MET HA H 47 4.214 4.214 4.093 0.121 17934 898 1 2 . 1 1 47 47 MET C C 47 179.526 179.526 178.186 1.340 17934 899 1 2 . 1 1 47 47 MET CA C 47 57.195 57.195 58.719 -1.524 17934 900 1 2 . 1 1 47 47 MET CB C 47 30.945 30.945 32.652 -1.707 17934 901 1 2 . 1 1 47 47 MET H H 47 8.585 8.585 7.979 0.606 17934 902 1 2 . 1 1 48 48 ARG N N 48 119.962 119.962 118.016 1.946 17934 903 1 2 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.918 -0.062 17934 904 1 2 . 1 1 48 48 ARG C C 48 178.875 178.875 177.797 1.078 17934 905 1 2 . 1 1 48 48 ARG CA C 48 60.945 60.945 58.935 2.010 17934 906 1 2 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.745 0.732 17934 907 1 2 . 1 1 48 48 ARG H H 48 8.190 8.190 8.525 -0.335 17934 908 1 2 . 1 1 49 49 ALA N N 49 120.640 120.640 119.236 1.404 17934 909 1 2 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.137 -0.394 17934 910 1 2 . 1 1 49 49 ALA C C 49 180.169 180.169 179.334 0.835 17934 911 1 2 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.263 0.588 17934 912 1 2 . 1 1 49 49 ALA CB C 49 17.821 17.821 19.370 -1.550 17934 913 1 2 . 1 1 49 49 ALA H H 49 7.671 7.671 8.130 -0.459 17934 914 1 2 . 1 1 50 50 ASN N N 50 116.063 116.063 118.231 -2.168 17934 915 1 2 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.514 -0.040 17934 916 1 2 . 1 1 50 50 ASN C C 50 177.084 177.084 177.455 -0.371 17934 917 1 2 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.275 0.514 17934 918 1 2 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.150 0.764 17934 919 1 2 . 1 1 50 50 ASN H H 50 7.893 7.893 8.276 -0.383 17934 920 1 2 . 1 1 51 51 CYS N N 51 116.884 116.884 119.321 -2.437 17934 921 1 2 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.228 0.078 17934 922 1 2 . 1 1 51 51 CYS C C 51 175.002 175.002 174.716 0.286 17934 923 1 2 . 1 1 51 51 CYS CA C 51 61.414 61.414 58.937 2.477 17934 924 1 2 . 1 1 51 51 CYS CB C 51 27.664 27.664 26.870 0.794 17934 925 1 2 . 1 1 51 51 CYS H H 51 7.770 7.770 8.469 -0.699 17934 926 1 2 . 1 1 52 52 GLN N N 52 117.831 117.831 119.632 -1.801 17934 927 1 2 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.083 0.145 17934 928 1 2 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.077 -1.351 17934 929 1 2 . 1 1 52 52 GLN CB C 52 29.070 29.070 28.111 0.959 17934 930 1 2 . 1 1 52 52 GLN H H 52 7.796 7.796 8.171 -0.375 17934 931 1 2 . 1 1 53 53 LYS N N 53 118.841 118.841 119.928 -1.087 17934 932 1 2 . 1 1 53 53 LYS CA C 53 57.195 57.195 58.034 -0.839 17934 933 1 2 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.833 0.457 17934 934 1 2 . 1 1 53 53 LYS H H 53 7.686 7.686 7.684 0.002 17934 935 1 2 . 1 1 55 55 THR HA H 55 4.304 4.304 4.279 0.025 17934 936 1 2 . 1 1 55 55 THR CA C 55 63.757 63.757 62.649 1.108 17934 937 1 2 . 1 1 55 55 THR CB C 55 68.914 68.914 69.187 -0.273 17934 938 1 2 . 1 1 56 56 GLU N N 56 120.861 120.861 121.581 -0.720 17934 939 1 2 . 1 1 56 56 GLU HA H 56 4.147 4.147 3.976 0.171 17934 940 1 2 . 1 1 56 56 GLU C C 56 177.656 177.656 178.189 -0.533 17934 941 1 2 . 1 1 56 56 GLU CA C 56 58.133 58.133 59.416 -1.282 17934 942 1 2 . 1 1 56 56 GLU CB C 56 30.008 30.008 29.238 0.770 17934 943 1 2 . 1 1 56 56 GLU H H 56 8.311 8.311 8.588 -0.277 17934 944 1 2 . 1 1 57 57 GLN N N 57 118.397 118.397 116.894 1.503 17934 945 1 2 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.312 -0.170 17934 946 1 2 . 1 1 57 57 GLN C C 57 177.275 177.275 176.659 0.616 17934 947 1 2 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.729 -0.065 17934 948 1 2 . 1 1 57 57 GLN CB C 57 29.070 29.070 28.697 0.373 17934 949 1 2 . 1 1 57 57 GLN H H 57 7.899 7.899 7.944 -0.045 17934 950 1 2 . 1 1 58 58 MET N N 58 118.897 118.897 117.503 1.394 17934 951 1 2 . 1 1 58 58 MET HA H 58 4.350 4.350 4.363 -0.013 17934 952 1 2 . 1 1 58 58 MET C C 58 177.172 177.172 177.896 -0.724 17934 953 1 2 . 1 1 58 58 MET CA C 58 56.726 56.726 57.579 -0.853 17934 954 1 2 . 1 1 58 58 MET CB C 58 32.196 32.196 33.618 -1.422 17934 955 1 2 . 1 1 58 58 MET H H 58 8.036 8.036 7.747 0.289 17934 956 1 2 . 1 1 59 59 LYS N N 59 119.779 119.779 116.625 3.154 17934 957 1 2 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.001 0.230 17934 958 1 2 . 1 1 59 59 LYS C C 59 176.676 176.676 177.337 -0.661 17934 959 1 2 . 1 1 59 59 LYS CA C 59 57.195 57.195 58.061 -0.866 17934 960 1 2 . 1 1 59 59 LYS CB C 59 32.820 32.820 32.536 0.284 17934 961 1 2 . 1 1 59 59 LYS H H 59 7.901 7.901 7.940 -0.039 17934 962 1 2 . 1 1 60 60 LYS N N 60 119.993 119.993 119.862 0.131 17934 963 1 2 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.441 -0.106 17934 964 1 2 . 1 1 60 60 LYS C C 60 176.336 176.336 174.004 2.332 17934 965 1 2 . 1 1 60 60 LYS CA C 60 56.258 56.258 55.522 0.736 17934 966 1 2 . 1 1 60 60 LYS CB C 60 32.820 32.820 33.683 -0.863 17934 967 1 2 . 1 1 60 60 LYS H H 60 7.877 7.877 7.661 0.216 17934 968 1 2 . 1 1 61 61 VAL N N 61 122.649 122.649 122.654 -0.005 17934 969 1 2 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.575 -0.195 17934 970 1 2 . 1 1 61 61 VAL C C 61 174.210 174.210 173.681 0.529 17934 971 1 2 . 1 1 61 61 VAL CA C 61 60.000 60.000 58.157 1.843 17934 972 1 2 . 1 1 61 61 VAL CB C 61 32.350 32.350 34.804 -2.454 17934 973 1 2 . 1 1 61 61 VAL H H 61 7.708 7.708 8.136 -0.428 17934 974 1 2 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.713 -0.050 17934 975 1 2 . 1 1 62 62 PRO C C 62 176.656 176.656 176.527 0.129 17934 976 1 2 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.530 0.290 17934 977 1 2 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.812 -0.930 17934 978 1 2 . 1 1 63 63 THR N N 63 117.155 117.155 117.493 -0.338 17934 979 1 2 . 1 1 63 63 THR HA H 63 4.830 4.830 4.600 0.230 17934 980 1 2 . 1 1 63 63 THR C C 63 174.682 174.682 173.562 1.120 17934 981 1 2 . 1 1 63 63 THR CA C 63 62.820 62.820 62.410 0.410 17934 982 1 2 . 1 1 63 63 THR CB C 63 69.382 69.382 70.052 -0.670 17934 983 1 2 . 1 1 63 63 THR H H 63 8.303 8.303 8.432 -0.129 17934 984 1 2 . 1 1 64 64 ILE N N 64 121.004 121.004 120.657 0.347 17934 985 1 2 . 1 1 64 64 ILE CA C 64 58.600 58.600 59.258 -0.658 17934 986 1 2 . 1 1 64 64 ILE CB C 64 42.690 42.690 42.216 0.474 17934 987 1 2 . 1 1 64 64 ILE H H 64 9.348 9.348 8.665 0.683 17934 988 1 2 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.134 0.606 17934 989 1 2 . 1 1 65 65 ILE C C 65 175.378 175.378 174.688 0.690 17934 990 1 2 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.090 -1.010 17934 991 1 2 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.784 0.966 17934 992 1 2 . 1 1 66 66 LEU N N 66 110.343 110.343 129.570 -19.227 17934 993 1 2 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.885 -0.035 17934 994 1 2 . 1 1 66 66 LEU C C 66 174.982 174.982 175.544 -0.562 17934 995 1 2 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.148 -0.238 17934 996 1 2 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.444 1.786 17934 997 1 2 . 1 1 66 66 LEU H H 66 9.610 9.610 9.248 0.362 17934 998 1 2 . 1 1 67 67 SER N N 67 120.990 120.990 119.618 1.372 17934 999 1 2 . 1 1 67 67 SER HA H 67 5.405 5.405 5.062 0.343 17934 1000 1 2 . 1 1 67 67 SER C C 67 174.405 174.405 173.331 1.074 17934 1001 1 2 . 1 1 67 67 SER CA C 67 57.195 57.195 56.642 0.553 17934 1002 1 2 . 1 1 67 67 SER CB C 67 64.695 64.695 64.778 -0.083 17934 1003 1 2 . 1 1 67 67 SER H H 67 9.260 9.260 8.755 0.505 17934 1004 1 2 . 1 1 68 68 VAL N N 68 128.176 128.176 126.076 2.100 17934 1005 1 2 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.362 0.131 17934 1006 1 2 . 1 1 68 68 VAL C C 68 173.891 173.891 173.370 0.521 17934 1007 1 2 . 1 1 68 68 VAL CA C 68 62.350 62.350 61.193 1.157 17934 1008 1 2 . 1 1 68 68 VAL CB C 68 33.750 33.750 34.483 -0.733 17934 1009 1 2 . 1 1 68 68 VAL H H 68 9.225 9.225 8.793 0.432 17934 1010 1 2 . 1 1 69 69 SER N N 69 121.697 121.697 124.027 -2.330 17934 1011 1 2 . 1 1 69 69 SER HA H 69 4.837 4.837 4.957 -0.120 17934 1012 1 2 . 1 1 69 69 SER C C 69 173.188 173.188 175.050 -1.862 17934 1013 1 2 . 1 1 69 69 SER CA C 69 57.195 57.195 56.021 1.174 17934 1014 1 2 . 1 1 69 69 SER CB C 69 67.976 67.976 65.601 2.375 17934 1015 1 2 . 1 1 69 69 SER H H 69 8.869 8.869 8.865 0.004 17934 1016 1 2 . 1 1 70 70 ALA N N 70 118.689 118.689 127.457 -8.768 17934 1017 1 2 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.259 -0.109 17934 1018 1 2 . 1 1 70 70 ALA C C 70 176.714 176.714 176.590 0.124 17934 1019 1 2 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.191 -0.281 17934 1020 1 2 . 1 1 70 70 ALA CB C 70 18.600 18.600 19.137 -0.537 17934 1021 1 2 . 1 1 70 70 ALA H H 70 8.810 8.810 8.261 0.549 17934 1022 1 2 . 1 1 71 71 LYS N N 71 112.633 112.633 112.702 -0.069 17934 1023 1 2 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.409 -0.134 17934 1024 1 2 . 1 1 71 71 LYS C C 71 177.033 177.033 175.639 1.394 17934 1025 1 2 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.739 1.456 17934 1026 1 2 . 1 1 71 71 LYS CB C 71 33.289 33.289 33.294 -0.005 17934 1027 1 2 . 1 1 71 71 LYS H H 71 7.830 7.830 8.075 -0.245 17934 1028 1 2 . 1 1 72 72 GLY N N 72 108.432 108.432 107.839 0.593 17934 1029 1 2 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.462 0.014 17934 1030 1 2 . 1 1 72 72 GLY H H 72 7.685 7.685 7.723 -0.038 17934 1031 1 2 . 1 1 73 73 VAL N N 73 120.414 120.414 119.837 0.577 17934 1032 1 2 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.515 0.485 17934 1033 1 2 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.853 0.617 17934 1034 1 2 . 1 1 73 73 VAL CB C 73 35.630 35.630 34.962 0.668 17934 1035 1 2 . 1 1 73 73 VAL H H 73 8.620 8.620 7.964 0.656 17934 1036 1 2 . 1 1 74 74 LYS N N 74 125.257 125.257 126.416 -1.159 17934 1037 1 2 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.384 0.632 17934 1038 1 2 . 1 1 74 74 LYS CA C 74 54.383 54.383 54.723 -0.340 17934 1039 1 2 . 1 1 74 74 LYS CB C 74 36.570 36.570 35.024 1.546 17934 1040 1 2 . 1 1 74 74 LYS H H 74 8.783 8.783 7.363 1.420 17934 1041 1 2 . 1 1 75 75 PHE N N 75 119.414 119.414 118.218 1.196 17934 1042 1 2 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.726 -0.026 17934 1043 1 2 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.311 -2.391 17934 1044 1 2 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.744 -1.134 17934 1045 1 2 . 1 1 75 75 PHE H H 75 8.432 8.432 9.110 -0.678 17934 1046 1 2 . 1 1 76 76 ILE N N 76 121.430 121.430 121.043 0.387 17934 1047 1 2 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.722 0.118 17934 1048 1 2 . 1 1 76 76 ILE C C 76 175.249 175.249 174.186 1.063 17934 1049 1 2 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.976 -0.906 17934 1050 1 2 . 1 1 76 76 ILE CB C 76 41.220 41.220 42.271 -1.051 17934 1051 1 2 . 1 1 76 76 ILE H H 76 8.960 8.960 8.639 0.321 17934 1052 1 2 . 1 1 77 77 ASP N N 77 125.744 125.744 122.865 2.879 17934 1053 1 2 . 1 1 77 77 ASP HA H 77 4.563 4.563 4.934 -0.371 17934 1054 1 2 . 1 1 77 77 ASP C C 77 177.569 177.569 175.963 1.606 17934 1055 1 2 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.520 3.269 17934 1056 1 2 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.387 0.214 17934 1057 1 2 . 1 1 77 77 ASP H H 77 8.750 8.750 8.573 0.177 17934 1058 1 2 . 1 1 78 78 ALA N N 78 128.632 128.632 128.292 0.340 17934 1059 1 2 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.253 -0.283 17934 1060 1 2 . 1 1 78 78 ALA C C 78 178.052 178.052 178.044 0.008 17934 1061 1 2 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.111 0.719 17934 1062 1 2 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.752 0.041 17934 1063 1 2 . 1 1 78 78 ALA H H 78 8.700 8.700 8.755 -0.055 17934 1064 1 2 . 1 1 79 79 THR N N 79 113.087 113.087 112.741 0.346 17934 1065 1 2 . 1 1 79 79 THR HA H 79 4.194 4.194 4.280 -0.086 17934 1066 1 2 . 1 1 79 79 THR C C 79 175.587 175.587 175.699 -0.112 17934 1067 1 2 . 1 1 79 79 THR CA C 79 64.695 64.695 65.065 -0.370 17934 1068 1 2 . 1 1 79 79 THR CB C 79 69.382 69.382 69.396 -0.014 17934 1069 1 2 . 1 1 79 79 THR H H 79 8.779 8.779 8.021 0.758 17934 1070 1 2 . 1 1 80 80 ASN N N 80 118.434 118.434 116.570 1.864 17934 1071 1 2 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.710 0.027 17934 1072 1 2 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.678 0.767 17934 1073 1 2 . 1 1 80 80 ASN CB C 80 39.383 39.383 38.606 0.777 17934 1074 1 2 . 1 1 80 80 ASN H H 80 8.584 8.584 8.251 0.333 17934 1075 1 2 . 1 1 81 81 LYS N N 81 112.429 112.429 115.078 -2.649 17934 1076 1 2 . 1 1 81 81 LYS C C 81 174.909 174.909 175.401 -0.492 17934 1077 1 2 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.502 0.162 17934 1078 1 2 . 1 1 81 81 LYS CB C 81 28.602 28.602 29.645 -1.043 17934 1079 1 2 . 1 1 81 81 LYS H H 81 7.966 7.966 8.354 -0.388 17934 1080 1 2 . 1 1 82 82 ASN N N 82 116.806 116.806 116.451 0.355 17934 1081 1 2 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.682 -0.092 17934 1082 1 2 . 1 1 82 82 ASN C C 82 174.999 174.999 173.564 1.435 17934 1083 1 2 . 1 1 82 82 ASN CA C 82 52.976 52.976 51.703 1.273 17934 1084 1 2 . 1 1 82 82 ASN CB C 82 38.445 38.445 40.909 -2.464 17934 1085 1 2 . 1 1 82 82 ASN H H 82 8.455 8.455 7.553 0.902 17934 1086 1 2 . 1 1 83 83 ILE N N 83 122.447 122.447 121.010 1.437 17934 1087 1 2 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.237 -0.207 17934 1088 1 2 . 1 1 83 83 ILE C C 83 176.572 176.572 175.761 0.811 17934 1089 1 2 . 1 1 83 83 ILE CA C 83 62.350 62.350 59.688 2.662 17934 1090 1 2 . 1 1 83 83 ILE CB C 83 37.970 37.970 36.511 1.459 17934 1091 1 2 . 1 1 83 83 ILE H H 83 8.650 8.650 8.373 0.277 17934 1092 1 2 . 1 1 84 84 ILE N N 84 129.339 129.339 128.205 1.134 17934 1093 1 2 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.046 -0.126 17934 1094 1 2 . 1 1 84 84 ILE C C 84 175.873 175.873 175.964 -0.091 17934 1095 1 2 . 1 1 84 84 ILE CA C 84 62.810 62.810 63.188 -0.378 17934 1096 1 2 . 1 1 84 84 ILE CB C 84 38.840 38.840 39.551 -0.711 17934 1097 1 2 . 1 1 84 84 ILE H H 84 8.930 8.930 8.878 0.052 17934 1098 1 2 . 1 1 85 85 ALA N N 85 118.867 118.867 117.330 1.537 17934 1099 1 2 . 1 1 85 85 ALA C C 85 174.100 174.100 174.752 -0.652 17934 1100 1 2 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.119 -0.549 17934 1101 1 2 . 1 1 85 85 ALA H H 85 7.048 7.048 8.091 -1.043 17934 1102 1 2 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.796 0.358 17934 1103 1 2 . 1 1 87 87 HIS C C 87 174.986 174.986 173.452 1.534 17934 1104 1 2 . 1 1 87 87 HIS CB C 87 34.350 34.350 34.366 -0.016 17934 1105 1 2 . 1 1 88 88 GLU N N 88 125.372 125.372 123.264 2.108 17934 1106 1 2 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.174 0.347 17934 1107 1 2 . 1 1 88 88 GLU C C 88 179.047 179.047 177.587 1.460 17934 1108 1 2 . 1 1 88 88 GLU CA C 88 56.726 56.726 57.046 -0.320 17934 1109 1 2 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.360 0.116 17934 1110 1 2 . 1 1 88 88 GLU H H 88 9.106 9.106 8.339 0.767 17934 1111 1 2 . 1 1 89 89 ILE N N 89 124.132 124.132 125.545 -1.413 17934 1112 1 2 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.923 0.096 17934 1113 1 2 . 1 1 89 89 ILE C C 89 176.095 176.095 177.247 -1.152 17934 1114 1 2 . 1 1 89 89 ILE CA C 89 62.351 62.351 64.984 -2.633 17934 1115 1 2 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.378 0.536 17934 1116 1 2 . 1 1 89 89 ILE H H 89 8.055 8.055 8.938 -0.883 17934 1117 1 2 . 1 1 90 90 ARG N N 90 116.949 116.949 118.684 -1.735 17934 1118 1 2 . 1 1 90 90 ARG HA H 90 4.338 4.338 3.962 0.376 17934 1119 1 2 . 1 1 90 90 ARG C C 90 176.578 176.578 175.869 0.709 17934 1120 1 2 . 1 1 90 90 ARG CA C 90 57.664 57.664 57.281 0.383 17934 1121 1 2 . 1 1 90 90 ARG CB C 90 29.070 29.070 28.924 0.146 17934 1122 1 2 . 1 1 90 90 ARG H H 90 8.045 8.045 8.267 -0.222 17934 1123 1 2 . 1 1 91 91 ASN N N 91 116.320 116.320 116.936 -0.616 17934 1124 1 2 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.858 0.295 17934 1125 1 2 . 1 1 91 91 ASN C C 91 174.595 174.595 175.087 -0.492 17934 1126 1 2 . 1 1 91 91 ASN CA C 91 52.508 52.508 52.383 0.125 17934 1127 1 2 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.273 0.579 17934 1128 1 2 . 1 1 91 91 ASN H H 91 8.067 8.067 7.850 0.217 17934 1129 1 2 . 1 1 92 92 ILE N N 92 122.441 122.441 124.076 -1.635 17934 1130 1 2 . 1 1 92 92 ILE HA H 92 5.073 5.073 4.121 0.952 17934 1131 1 2 . 1 1 92 92 ILE C C 92 175.229 175.229 176.497 -1.268 17934 1132 1 2 . 1 1 92 92 ILE CA C 92 61.880 61.880 63.154 -1.274 17934 1133 1 2 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.606 2.244 17934 1134 1 2 . 1 1 92 92 ILE H H 92 7.483 7.483 7.978 -0.495 17934 1135 1 2 . 1 1 93 93 SER N N 93 120.329 120.329 122.745 -2.416 17934 1136 1 2 . 1 1 93 93 SER HA H 93 4.684 4.684 4.338 0.346 17934 1137 1 2 . 1 1 93 93 SER C C 93 180.744 180.744 174.697 6.047 17934 1138 1 2 . 1 1 93 93 SER CA C 93 57.664 57.664 61.265 -3.601 17934 1139 1 2 . 1 1 93 93 SER CB C 93 66.570 66.570 63.776 2.794 17934 1140 1 2 . 1 1 93 93 SER H H 93 9.545 9.545 8.763 0.782 17934 1141 1 2 . 1 1 94 94 CYS N N 94 110.900 110.900 115.148 -4.248 17934 1142 1 2 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.563 -0.751 17934 1143 1 2 . 1 1 94 94 CYS C C 94 173.973 173.973 172.577 1.396 17934 1144 1 2 . 1 1 94 94 CYS CA C 94 59.539 59.539 58.383 1.156 17934 1145 1 2 . 1 1 94 94 CYS CB C 94 26.258 26.258 29.830 -3.572 17934 1146 1 2 . 1 1 94 94 CYS H H 94 8.858 8.858 8.091 0.767 17934 1147 1 2 . 1 1 95 95 ALA N N 95 121.379 121.379 122.396 -1.017 17934 1148 1 2 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.608 -0.178 17934 1149 1 2 . 1 1 95 95 ALA C C 95 178.098 178.098 174.728 3.370 17934 1150 1 2 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.789 0.861 17934 1151 1 2 . 1 1 95 95 ALA CB C 95 19.300 19.300 22.270 -2.970 17934 1152 1 2 . 1 1 95 95 ALA H H 95 8.360 8.360 8.241 0.119 17934 1153 1 2 . 1 1 96 96 ALA N N 96 122.576 122.576 122.199 0.377 17934 1154 1 2 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.740 -0.060 17934 1155 1 2 . 1 1 96 96 ALA C C 96 175.716 175.716 174.508 1.208 17934 1156 1 2 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.949 0.491 17934 1157 1 2 . 1 1 96 96 ALA CB C 96 22.700 22.700 21.442 1.258 17934 1158 1 2 . 1 1 96 96 ALA H H 96 9.080 9.080 8.832 0.248 17934 1159 1 2 . 1 1 97 97 GLN N N 97 116.903 116.903 120.249 -3.346 17934 1160 1 2 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.752 0.178 17934 1161 1 2 . 1 1 97 97 GLN C C 97 175.270 175.270 174.062 1.208 17934 1162 1 2 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.603 1.248 17934 1163 1 2 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.420 2.338 17934 1164 1 2 . 1 1 97 97 GLN H H 97 8.369 8.369 8.252 0.117 17934 1165 1 2 . 1 1 98 98 ASP N N 98 124.971 124.971 121.496 3.475 17934 1166 1 2 . 1 1 98 98 ASP C C 98 175.217 175.217 176.133 -0.916 17934 1167 1 2 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.228 -0.189 17934 1168 1 2 . 1 1 98 98 ASP CB C 98 42.195 42.195 41.776 0.419 17934 1169 1 2 . 1 1 98 98 ASP H H 98 8.395 8.395 8.242 0.153 17934 1170 1 2 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.360 -0.126 17934 1171 1 2 . 1 1 99 99 PRO C C 99 178.433 178.433 177.658 0.775 17934 1172 1 2 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.750 -0.055 17934 1173 1 2 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.125 0.227 17934 1174 1 2 . 1 1 100 100 GLU N N 100 116.223 116.223 118.403 -2.180 17934 1175 1 2 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.131 0.089 17934 1176 1 2 . 1 1 100 100 GLU C C 100 176.678 176.678 175.930 0.748 17934 1177 1 2 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.459 -1.734 17934 1178 1 2 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.863 2.082 17934 1179 1 2 . 1 1 100 100 GLU H H 100 8.643 8.643 8.698 -0.055 17934 1180 1 2 . 1 1 101 101 ASP N N 101 119.053 119.053 118.796 0.257 17934 1181 1 2 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.862 -0.319 17934 1182 1 2 . 1 1 101 101 ASP C C 101 174.771 174.771 176.812 -2.041 17934 1183 1 2 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.097 0.817 17934 1184 1 2 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.713 0.076 17934 1185 1 2 . 1 1 101 101 ASP H H 101 7.597 7.597 8.019 -0.422 17934 1186 1 2 . 1 1 102 102 LEU N N 102 123.986 123.986 119.074 4.912 17934 1187 1 2 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.463 -0.073 17934 1188 1 2 . 1 1 102 102 LEU C C 102 177.141 177.141 177.566 -0.425 17934 1189 1 2 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.193 0.467 17934 1190 1 2 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.369 1.291 17934 1191 1 2 . 1 1 102 102 LEU H H 102 8.534 8.534 7.496 1.038 17934 1192 1 2 . 1 1 103 103 SER N N 103 112.339 112.339 115.037 -2.698 17934 1193 1 2 . 1 1 103 103 SER HA H 103 4.290 4.290 4.383 -0.093 17934 1194 1 2 . 1 1 103 103 SER C C 103 174.106 174.106 174.741 -0.635 17934 1195 1 2 . 1 1 103 103 SER CA C 103 60.945 60.945 60.998 -0.053 17934 1196 1 2 . 1 1 103 103 SER CB C 103 63.757 63.757 63.400 0.357 17934 1197 1 2 . 1 1 103 103 SER H H 103 7.867 7.867 8.332 -0.465 17934 1198 1 2 . 1 1 104 104 THR N N 104 123.070 123.070 115.641 7.429 17934 1199 1 2 . 1 1 104 104 THR HA H 104 5.373 5.373 4.400 0.973 17934 1200 1 2 . 1 1 104 104 THR C C 104 180.693 180.693 172.635 8.058 17934 1201 1 2 . 1 1 104 104 THR CA C 104 63.289 63.289 62.825 0.465 17934 1202 1 2 . 1 1 104 104 THR CB C 104 69.382 69.382 70.917 -1.535 17934 1203 1 2 . 1 1 104 104 THR H H 104 8.830 8.830 7.944 0.886 17934 1204 1 2 . 1 1 105 105 PHE N N 105 122.582 122.582 120.450 2.132 17934 1205 1 2 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.857 0.613 17934 1206 1 2 . 1 1 105 105 PHE C C 105 179.211 179.211 172.075 7.136 17934 1207 1 2 . 1 1 105 105 PHE CA C 105 55.320 55.320 56.135 -0.815 17934 1208 1 2 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.105 0.685 17934 1209 1 2 . 1 1 105 105 PHE H H 105 9.170 9.170 8.626 0.544 17934 1210 1 2 . 1 1 106 106 ALA N N 106 119.567 119.567 120.937 -1.370 17934 1211 1 2 . 1 1 106 106 ALA C C 106 175.603 175.603 174.848 0.755 17934 1212 1 2 . 1 1 106 106 ALA H H 106 8.770 8.770 9.063 -0.293 17934 1213 1 2 . 1 1 107 107 TYR N N 107 109.933 109.933 117.739 -7.806 17934 1214 1 2 . 1 1 107 107 TYR HA H 107 4.920 4.920 4.922 -0.002 17934 1215 1 2 . 1 1 107 107 TYR C C 107 180.426 180.426 172.575 7.851 17934 1216 1 2 . 1 1 107 107 TYR CA C 107 57.080 57.080 56.011 1.069 17934 1217 1 2 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.208 -0.419 17934 1218 1 2 . 1 1 107 107 TYR H H 107 7.950 7.950 8.679 -0.729 17934 1219 1 2 . 1 1 108 108 ILE N N 108 120.613 120.613 117.616 2.997 17934 1220 1 2 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.746 0.624 17934 1221 1 2 . 1 1 108 108 ILE C C 108 176.212 176.212 175.556 0.656 17934 1222 1 2 . 1 1 108 108 ILE CA C 108 59.540 59.540 58.929 0.611 17934 1223 1 2 . 1 1 108 108 ILE CB C 108 39.380 39.380 39.758 -0.378 17934 1224 1 2 . 1 1 108 108 ILE H H 108 8.869 8.869 8.522 0.347 17934 1225 1 2 . 1 1 109 109 THR N N 109 116.505 116.505 114.873 1.632 17934 1226 1 2 . 1 1 109 109 THR HA H 109 5.669 5.669 4.675 0.994 17934 1227 1 2 . 1 1 109 109 THR C C 109 173.505 173.505 173.911 -0.406 17934 1228 1 2 . 1 1 109 109 THR CA C 109 59.070 59.070 61.135 -2.065 17934 1229 1 2 . 1 1 109 109 THR H H 109 9.489 9.489 8.049 1.440 17934 1230 1 2 . 1 1 110 110 LYS N N 110 122.960 122.960 123.223 -0.263 17934 1231 1 2 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.005 0.455 17934 1232 1 2 . 1 1 110 110 LYS C C 110 175.937 175.937 175.963 -0.026 17934 1233 1 2 . 1 1 110 110 LYS CA C 110 55.789 55.789 57.606 -1.817 17934 1234 1 2 . 1 1 110 110 LYS CB C 110 34.227 34.227 32.456 1.771 17934 1235 1 2 . 1 1 110 110 LYS H H 110 7.831 7.831 8.753 -0.922 17934 1236 1 2 . 1 1 111 111 ASP N N 111 127.409 127.409 122.096 5.313 17934 1237 1 2 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.870 -0.089 17934 1238 1 2 . 1 1 111 111 ASP C C 111 176.396 176.396 177.405 -1.009 17934 1239 1 2 . 1 1 111 111 ASP CA C 111 53.914 53.914 52.460 1.454 17934 1240 1 2 . 1 1 111 111 ASP CB C 111 43.133 43.133 42.372 0.761 17934 1241 1 2 . 1 1 111 111 ASP H H 111 8.769 8.769 8.566 0.203 17934 1242 1 2 . 1 1 112 112 LEU N N 112 125.913 125.913 118.109 7.804 17934 1243 1 2 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.110 0.040 17934 1244 1 2 . 1 1 112 112 LEU C C 112 178.553 178.553 177.486 1.067 17934 1245 1 2 . 1 1 112 112 LEU CA C 112 57.190 57.190 58.066 -0.876 17934 1246 1 2 . 1 1 112 112 LEU CB C 112 41.790 41.790 41.590 0.200 17934 1247 1 2 . 1 1 112 112 LEU H H 112 8.593 8.593 8.506 0.087 17934 1248 1 2 . 1 1 113 113 LYS N N 113 117.189 117.189 116.514 0.675 17934 1249 1 2 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.137 0.125 17934 1250 1 2 . 1 1 113 113 LYS C C 113 177.180 177.180 176.421 0.759 17934 1251 1 2 . 1 1 113 113 LYS CA C 113 58.133 58.133 56.491 1.642 17934 1252 1 2 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.451 0.369 17934 1253 1 2 . 1 1 113 113 LYS H H 113 8.207 8.207 7.617 0.590 17934 1254 1 2 . 1 1 114 114 SER N N 114 112.492 112.492 113.610 -1.118 17934 1255 1 2 . 1 1 114 114 SER CA C 114 58.601 58.601 58.862 -0.261 17934 1256 1 2 . 1 1 114 114 SER CB C 114 65.164 65.164 62.250 2.914 17934 1257 1 2 . 1 1 114 114 SER H H 114 7.755 7.755 8.189 -0.434 17934 1258 1 2 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.794 -0.405 17934 1259 1 2 . 1 1 115 115 ASN C C 115 174.203 174.203 175.014 -0.811 17934 1260 1 2 . 1 1 115 115 ASN CA C 115 54.383 54.383 53.773 0.611 17934 1261 1 2 . 1 1 115 115 ASN CB C 115 37.977 37.977 39.703 -1.726 17934 1262 1 2 . 1 1 116 116 HIS N N 116 116.822 116.822 115.365 1.457 17934 1263 1 2 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.695 0.235 17934 1264 1 2 . 1 1 116 116 HIS C C 116 173.898 173.898 173.319 0.579 17934 1265 1 2 . 1 1 116 116 HIS CA C 116 54.910 54.910 55.825 -0.915 17934 1266 1 2 . 1 1 116 116 HIS CB C 116 32.650 32.650 32.270 0.380 17934 1267 1 2 . 1 1 116 116 HIS H H 116 7.690 7.690 7.825 -0.135 17934 1268 1 2 . 1 1 117 117 HIS N N 117 118.253 118.253 119.536 -1.283 17934 1269 1 2 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.873 0.447 17934 1270 1 2 . 1 1 117 117 HIS C C 117 173.695 173.695 173.691 0.004 17934 1271 1 2 . 1 1 117 117 HIS CA C 117 56.350 56.350 55.765 0.585 17934 1272 1 2 . 1 1 117 117 HIS CB C 117 32.350 32.350 30.090 2.260 17934 1273 1 2 . 1 1 117 117 HIS H H 117 8.340 8.340 8.832 -0.492 17934 1274 1 2 . 1 1 118 118 TYR N N 118 118.301 118.301 123.696 -5.395 17934 1275 1 2 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.899 0.111 17934 1276 1 2 . 1 1 118 118 TYR C C 118 173.530 173.530 174.820 -1.290 17934 1277 1 2 . 1 1 118 118 TYR CA C 118 56.730 56.730 56.688 0.042 17934 1278 1 2 . 1 1 118 118 TYR CB C 118 43.240 43.240 40.313 2.927 17934 1279 1 2 . 1 1 118 118 TYR H H 118 9.080 9.080 8.771 0.309 17934 1280 1 2 . 1 1 119 119 CYS N N 119 121.015 121.015 120.868 0.147 17934 1281 1 2 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.421 0.642 17934 1282 1 2 . 1 1 119 119 CYS C C 119 180.664 180.664 173.465 7.199 17934 1283 1 2 . 1 1 119 119 CYS CA C 119 56.726 56.726 57.695 -0.969 17934 1284 1 2 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.853 0.686 17934 1285 1 2 . 1 1 119 119 CYS H H 119 9.120 9.120 8.932 0.188 17934 1286 1 2 . 1 1 120 120 HIS N N 120 110.134 110.134 122.807 -12.673 17934 1287 1 2 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.697 0.002 17934 1288 1 2 . 1 1 120 120 HIS C C 120 180.776 180.776 173.320 7.456 17934 1289 1 2 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.041 1.279 17934 1290 1 2 . 1 1 120 120 HIS CB C 120 32.352 32.352 30.991 1.361 17934 1291 1 2 . 1 1 120 120 HIS H H 120 8.482 8.482 8.847 -0.365 17934 1292 1 2 . 1 1 121 121 VAL N N 121 120.855 120.855 123.369 -2.514 17934 1293 1 2 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.037 0.313 17934 1294 1 2 . 1 1 121 121 VAL C C 121 173.419 173.419 172.776 0.643 17934 1295 1 2 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.033 1.377 17934 1296 1 2 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.102 0.178 17934 1297 1 2 . 1 1 121 121 VAL H H 121 7.929 7.929 8.486 -0.557 17934 1298 1 2 . 1 1 122 122 PHE N N 122 124.384 124.384 127.682 -3.298 17934 1299 1 2 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.226 0.194 17934 1300 1 2 . 1 1 122 122 PHE C C 122 174.876 174.876 174.561 0.315 17934 1301 1 2 . 1 1 122 122 PHE CA C 122 55.320 55.320 54.522 0.798 17934 1302 1 2 . 1 1 122 122 PHE CB C 122 44.540 44.540 43.040 1.500 17934 1303 1 2 . 1 1 122 122 PHE H H 122 8.910 8.910 8.930 -0.020 17934 1304 1 2 . 1 1 123 123 THR N N 123 112.451 112.451 112.795 -0.344 17934 1305 1 2 . 1 1 123 123 THR HA H 123 5.147 5.147 4.513 0.634 17934 1306 1 2 . 1 1 123 123 THR C C 123 174.096 174.096 172.805 1.291 17934 1307 1 2 . 1 1 123 123 THR CA C 123 61.843 61.843 59.489 2.354 17934 1308 1 2 . 1 1 123 123 THR CB C 123 71.218 71.218 70.854 0.364 17934 1309 1 2 . 1 1 123 123 THR H H 123 8.668 8.668 8.890 -0.222 17934 1310 1 2 . 1 1 124 124 ALA N N 124 128.922 128.922 125.365 3.557 17934 1311 1 2 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.528 0.192 17934 1312 1 2 . 1 1 124 124 ALA C C 124 177.168 177.168 176.276 0.892 17934 1313 1 2 . 1 1 124 124 ALA CA C 124 50.890 50.890 49.898 0.992 17934 1314 1 2 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.322 -0.222 17934 1315 1 2 . 1 1 124 124 ALA H H 124 9.180 9.180 8.576 0.604 17934 1316 1 2 . 1 1 125 125 PHE N N 125 115.427 115.427 119.051 -3.624 17934 1317 1 2 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.256 0.034 17934 1318 1 2 . 1 1 125 125 PHE C C 125 174.703 174.703 175.449 -0.746 17934 1319 1 2 . 1 1 125 125 PHE CA C 125 60.470 60.470 57.854 2.616 17934 1320 1 2 . 1 1 125 125 PHE CB C 125 38.060 38.060 38.761 -0.701 17934 1321 1 2 . 1 1 125 125 PHE H H 125 8.560 8.560 8.317 0.243 17934 1322 1 2 . 1 1 126 126 ASP N N 126 115.745 115.745 118.659 -2.914 17934 1323 1 2 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.905 -0.062 17934 1324 1 2 . 1 1 126 126 ASP C C 126 176.532 176.532 176.282 0.250 17934 1325 1 2 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.373 0.072 17934 1326 1 2 . 1 1 126 126 ASP CB C 126 44.070 44.070 44.173 -0.103 17934 1327 1 2 . 1 1 126 126 ASP H H 126 7.417 7.417 7.661 -0.244 17934 1328 1 2 . 1 1 127 127 VAL N N 127 121.923 121.923 124.936 -3.013 17934 1329 1 2 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.716 -0.126 17934 1330 1 2 . 1 1 127 127 VAL C C 127 176.863 176.863 177.127 -0.264 17934 1331 1 2 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.569 -0.939 17934 1332 1 2 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.328 -0.498 17934 1333 1 2 . 1 1 127 127 VAL H H 127 8.508 8.508 8.630 -0.122 17934 1334 1 2 . 1 1 128 128 ASN N N 128 118.851 118.851 117.564 1.287 17934 1335 1 2 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.333 0.143 17934 1336 1 2 . 1 1 128 128 ASN C C 128 178.251 178.251 177.135 1.116 17934 1337 1 2 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.072 0.186 17934 1338 1 2 . 1 1 128 128 ASN CB C 128 37.977 37.977 37.875 0.102 17934 1339 1 2 . 1 1 128 128 ASN H H 128 8.207 8.207 8.580 -0.373 17934 1340 1 2 . 1 1 129 129 LEU N N 129 122.549 122.549 120.829 1.720 17934 1341 1 2 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.576 0.634 17934 1342 1 2 . 1 1 129 129 LEU C C 129 178.003 178.003 177.873 0.130 17934 1343 1 2 . 1 1 129 129 LEU CA C 129 57.190 57.190 58.036 -0.846 17934 1344 1 2 . 1 1 129 129 LEU CB C 129 41.790 41.790 41.730 0.060 17934 1345 1 2 . 1 1 129 129 LEU H H 129 8.223 8.223 7.768 0.455 17934 1346 1 2 . 1 1 130 130 ALA N N 130 120.036 120.036 121.437 -1.401 17934 1347 1 2 . 1 1 130 130 ALA HA H 130 3.310 3.310 4.075 -0.765 17934 1348 1 2 . 1 1 130 130 ALA C C 130 178.172 178.172 179.132 -0.960 17934 1349 1 2 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.364 0.416 17934 1350 1 2 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.123 0.947 17934 1351 1 2 . 1 1 130 130 ALA H H 130 7.360 7.360 8.010 -0.650 17934 1352 1 2 . 1 1 131 131 ALA N N 131 116.989 116.989 119.240 -2.251 17934 1353 1 2 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.918 -0.208 17934 1354 1 2 . 1 1 131 131 ALA C C 131 180.163 180.163 179.688 0.475 17934 1355 1 2 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.549 1.231 17934 1356 1 2 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.072 -0.242 17934 1357 1 2 . 1 1 131 131 ALA H H 131 7.360 7.360 8.166 -0.806 17934 1358 1 2 . 1 1 132 132 GLU N N 132 119.462 119.462 119.869 -0.407 17934 1359 1 2 . 1 1 132 132 GLU HA H 132 3.888 3.888 4.098 -0.210 17934 1360 1 2 . 1 1 132 132 GLU C C 132 179.243 179.243 178.759 0.484 17934 1361 1 2 . 1 1 132 132 GLU CA C 132 59.539 59.539 58.742 0.797 17934 1362 1 2 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.359 0.180 17934 1363 1 2 . 1 1 132 132 GLU H H 132 7.673 7.673 8.199 -0.526 17934 1364 1 2 . 1 1 133 133 ILE N N 133 123.218 123.218 121.090 2.128 17934 1365 1 2 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.667 -0.887 17934 1366 1 2 . 1 1 133 133 ILE C C 133 177.421 177.421 178.025 -0.604 17934 1367 1 2 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.372 1.118 17934 1368 1 2 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.760 -1.110 17934 1369 1 2 . 1 1 133 133 ILE H H 133 8.154 8.154 8.142 0.012 17934 1370 1 2 . 1 1 134 134 ILE N N 134 118.244 118.244 119.497 -1.253 17934 1371 1 2 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.440 0.100 17934 1372 1 2 . 1 1 134 134 ILE C C 134 179.385 179.385 177.703 1.682 17934 1373 1 2 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.456 -1.176 17934 1374 1 2 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.750 -0.650 17934 1375 1 2 . 1 1 134 134 ILE H H 134 7.376 7.376 7.924 -0.548 17934 1376 1 2 . 1 1 135 135 LEU N N 135 123.061 123.061 121.389 1.672 17934 1377 1 2 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.842 0.348 17934 1378 1 2 . 1 1 135 135 LEU C C 135 179.858 179.858 178.625 1.233 17934 1379 1 2 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.905 -0.715 17934 1380 1 2 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.784 0.076 17934 1381 1 2 . 1 1 135 135 LEU H H 135 8.036 8.036 8.127 -0.091 17934 1382 1 2 . 1 1 136 136 THR N N 136 119.647 119.647 115.546 4.101 17934 1383 1 2 . 1 1 136 136 THR HA H 136 3.725 3.725 3.911 -0.186 17934 1384 1 2 . 1 1 136 136 THR C C 136 176.088 176.088 176.627 -0.539 17934 1385 1 2 . 1 1 136 136 THR CA C 136 58.601 58.601 67.453 -8.852 17934 1386 1 2 . 1 1 136 136 THR CB C 136 67.976 67.976 68.767 -0.791 17934 1387 1 2 . 1 1 136 136 THR H H 136 8.508 8.508 8.204 0.304 17934 1388 1 2 . 1 1 137 137 LEU N N 137 123.182 123.182 121.960 1.222 17934 1389 1 2 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.793 -0.053 17934 1390 1 2 . 1 1 137 137 LEU C C 137 178.341 178.341 178.975 -0.634 17934 1391 1 2 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.393 -0.133 17934 1392 1 2 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.573 -0.023 17934 1393 1 2 . 1 1 137 137 LEU H H 137 8.520 8.520 8.205 0.315 17934 1394 1 2 . 1 1 138 138 GLY N N 138 105.266 105.266 105.281 -0.015 17934 1395 1 2 . 1 1 138 138 GLY C C 138 176.973 176.973 176.125 0.848 17934 1396 1 2 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.140 0.211 17934 1397 1 2 . 1 1 138 138 GLY H H 138 7.858 7.858 8.188 -0.330 17934 1398 1 2 . 1 1 139 139 GLN N N 139 123.485 123.485 122.318 1.167 17934 1399 1 2 . 1 1 139 139 GLN C C 139 177.891 177.891 178.474 -0.583 17934 1400 1 2 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.455 0.147 17934 1401 1 2 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.194 -0.061 17934 1402 1 2 . 1 1 139 139 GLN H H 139 8.195 8.195 8.547 -0.352 17934 1403 1 2 . 1 1 140 140 ALA N N 140 122.754 122.754 121.069 1.685 17934 1404 1 2 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.262 -0.553 17934 1405 1 2 . 1 1 140 140 ALA C C 140 178.987 178.987 179.318 -0.331 17934 1406 1 2 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.522 1.258 17934 1407 1 2 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.225 -0.815 17934 1408 1 2 . 1 1 140 140 ALA H H 140 8.530 8.530 8.469 0.061 17934 1409 1 2 . 1 1 141 141 PHE N N 141 116.275 116.275 119.703 -3.428 17934 1410 1 2 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.178 -0.088 17934 1411 1 2 . 1 1 141 141 PHE C C 141 178.129 178.129 176.617 1.512 17934 1412 1 2 . 1 1 141 141 PHE CA C 141 61.240 61.240 60.450 0.790 17934 1413 1 2 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.475 -0.092 17934 1414 1 2 . 1 1 141 141 PHE H H 141 7.920 7.920 8.047 -0.127 17934 1415 1 2 . 1 1 142 142 GLU N N 142 119.967 119.967 119.276 0.691 17934 1416 1 2 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.939 0.288 17934 1417 1 2 . 1 1 142 142 GLU C C 142 179.250 179.250 179.021 0.229 17934 1418 1 2 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.247 1.292 17934 1419 1 2 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.600 -0.061 17934 1420 1 2 . 1 1 142 142 GLU H H 142 7.713 7.713 8.611 -0.898 17934 1421 1 2 . 1 1 143 143 VAL N N 143 120.189 120.189 119.553 0.636 17934 1422 1 2 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.780 -0.097 17934 1423 1 2 . 1 1 143 143 VAL C C 143 178.066 178.066 176.176 1.890 17934 1424 1 2 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.121 2.449 17934 1425 1 2 . 1 1 143 143 VAL CB C 143 31.883 31.883 32.068 -0.185 17934 1426 1 2 . 1 1 143 143 VAL H H 143 8.608 8.608 7.668 0.940 17934 1427 1 2 . 1 1 144 144 ALA N N 144 121.753 121.753 121.526 0.227 17934 1428 1 2 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.258 -0.258 17934 1429 1 2 . 1 1 144 144 ALA C C 144 180.776 180.776 176.063 4.713 17934 1430 1 2 . 1 1 144 144 ALA CA C 144 55.780 55.780 52.326 3.454 17934 1431 1 2 . 1 1 144 144 ALA CB C 144 18.770 18.770 19.541 -0.771 17934 1432 1 2 . 1 1 144 144 ALA H H 144 8.399 8.399 7.299 1.100 17934 1433 1 2 . 1 1 145 145 TYR N N 145 119.962 119.962 116.411 3.551 17934 1434 1 2 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.772 -0.582 17934 1435 1 2 . 1 1 145 145 TYR C C 145 177.645 177.645 174.438 3.207 17934 1436 1 2 . 1 1 145 145 TYR CA C 145 60.880 60.880 56.104 4.776 17934 1437 1 2 . 1 1 145 145 TYR CB C 145 37.980 37.980 40.283 -2.303 17934 1438 1 2 . 1 1 145 145 TYR H H 145 8.190 8.190 8.138 0.052 17934 1439 1 3 . 1 1 13 13 LYS N N 13 120.778 120.778 124.408 -3.630 17934 1440 1 3 . 1 1 13 13 LYS C C 13 176.476 176.476 176.749 -0.273 17934 1441 1 3 . 1 1 13 13 LYS CA C 13 58.601 58.601 55.493 3.108 17934 1442 1 3 . 1 1 13 13 LYS CB C 13 32.820 32.820 32.657 0.163 17934 1443 1 3 . 1 1 13 13 LYS H H 13 7.984 7.984 8.578 -0.594 17934 1444 1 3 . 1 1 15 15 ILE HA H 15 3.820 3.820 4.115 -0.295 17934 1445 1 3 . 1 1 15 15 ILE C C 15 176.376 176.376 176.850 -0.474 17934 1446 1 3 . 1 1 15 15 ILE CA C 15 63.570 63.570 60.917 2.652 17934 1447 1 3 . 1 1 15 15 ILE CB C 15 39.380 39.380 36.308 3.072 17934 1448 1 3 . 1 1 16 16 ALA N N 16 121.364 121.364 119.835 1.529 17934 1449 1 3 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.452 -0.014 17934 1450 1 3 . 1 1 16 16 ALA C C 16 177.494 177.494 177.413 0.081 17934 1451 1 3 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.688 0.288 17934 1452 1 3 . 1 1 16 16 ALA CB C 16 20.333 20.333 20.350 -0.017 17934 1453 1 3 . 1 1 16 16 ALA H H 16 8.081 8.081 7.326 0.755 17934 1454 1 3 . 1 1 17 17 GLN N N 17 118.109 118.109 116.296 1.813 17934 1455 1 3 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.507 0.066 17934 1456 1 3 . 1 1 17 17 GLN C C 17 173.632 173.632 174.657 -1.025 17934 1457 1 3 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.163 -0.312 17934 1458 1 3 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.300 0.177 17934 1459 1 3 . 1 1 17 17 GLN H H 17 7.550 7.550 8.239 -0.689 17934 1460 1 3 . 1 1 18 18 SER N N 18 112.384 112.384 112.800 -0.416 17934 1461 1 3 . 1 1 18 18 SER HA H 18 4.388 4.388 4.745 -0.357 17934 1462 1 3 . 1 1 18 18 SER C C 18 173.780 173.780 172.089 1.691 17934 1463 1 3 . 1 1 18 18 SER CA C 18 57.664 57.664 57.913 -0.249 17934 1464 1 3 . 1 1 18 18 SER CB C 18 65.164 65.164 65.165 -0.001 17934 1465 1 3 . 1 1 18 18 SER H H 18 7.666 7.666 7.954 -0.288 17934 1466 1 3 . 1 1 19 19 CYS N N 19 120.116 120.116 120.877 -0.761 17934 1467 1 3 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.553 -0.223 17934 1468 1 3 . 1 1 19 19 CYS C C 19 180.387 180.387 173.022 7.365 17934 1469 1 3 . 1 1 19 19 CYS CA C 19 58.601 58.601 58.645 -0.044 17934 1470 1 3 . 1 1 19 19 CYS CB C 19 30.008 30.008 31.163 -1.155 17934 1471 1 3 . 1 1 19 19 CYS H H 19 8.835 8.835 8.687 0.148 17934 1472 1 3 . 1 1 20 20 ASP N N 20 124.416 124.416 120.911 3.505 17934 1473 1 3 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.011 -0.035 17934 1474 1 3 . 1 1 20 20 ASP CB C 20 42.195 42.195 45.437 -3.242 17934 1475 1 3 . 1 1 20 20 ASP H H 20 7.847 7.847 7.749 0.098 17934 1476 1 3 . 1 1 21 21 TYR N N 21 121.296 121.296 119.821 1.475 17934 1477 1 3 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.726 0.004 17934 1478 1 3 . 1 1 21 21 TYR C C 21 175.793 175.793 174.245 1.548 17934 1479 1 3 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.911 0.289 17934 1480 1 3 . 1 1 21 21 TYR CB C 21 43.240 43.240 42.718 0.522 17934 1481 1 3 . 1 1 21 21 TYR H H 21 9.070 9.070 8.654 0.416 17934 1482 1 3 . 1 1 22 22 LYS N N 22 122.820 122.820 122.132 0.688 17934 1483 1 3 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.256 -0.064 17934 1484 1 3 . 1 1 22 22 LYS C C 22 175.793 175.793 175.727 0.066 17934 1485 1 3 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.920 0.338 17934 1486 1 3 . 1 1 22 22 LYS CB C 22 33.758 33.758 32.938 0.820 17934 1487 1 3 . 1 1 22 22 LYS H H 22 8.711 8.711 8.690 0.021 17934 1488 1 3 . 1 1 23 23 ALA N N 23 123.073 123.073 126.790 -3.717 17934 1489 1 3 . 1 1 23 23 ALA HA H 23 4.730 4.730 3.985 0.745 17934 1490 1 3 . 1 1 23 23 ALA C C 23 174.515 174.515 175.182 -0.667 17934 1491 1 3 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.082 1.488 17934 1492 1 3 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.852 -1.224 17934 1493 1 3 . 1 1 23 23 ALA H H 23 8.727 8.727 8.755 -0.028 17934 1494 1 3 . 1 1 24 24 ALA N N 24 122.486 122.486 123.282 -0.796 17934 1495 1 3 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.822 0.359 17934 1496 1 3 . 1 1 24 24 ALA C C 24 176.835 176.835 176.085 0.750 17934 1497 1 3 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.552 0.018 17934 1498 1 3 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.309 -0.189 17934 1499 1 3 . 1 1 24 24 ALA H H 24 8.675 8.675 8.494 0.181 17934 1500 1 3 . 1 1 25 25 TYR N N 25 122.698 122.698 125.778 -3.080 17934 1501 1 3 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.251 0.759 17934 1502 1 3 . 1 1 25 25 TYR CA C 25 54.340 54.340 55.337 -0.997 17934 1503 1 3 . 1 1 25 25 TYR CB C 25 39.850 39.850 37.964 1.886 17934 1504 1 3 . 1 1 25 25 TYR H H 25 8.270 8.270 8.449 -0.179 17934 1505 1 3 . 1 1 26 26 LEU N N 26 127.997 127.997 128.747 -0.750 17934 1506 1 3 . 1 1 26 26 LEU HA H 26 3.920 3.920 3.925 -0.005 17934 1507 1 3 . 1 1 26 26 LEU C C 26 175.983 175.983 176.522 -0.539 17934 1508 1 3 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.278 0.448 17934 1509 1 3 . 1 1 26 26 LEU CB C 26 41.070 41.070 42.758 -1.688 17934 1510 1 3 . 1 1 26 26 LEU H H 26 8.700 8.700 7.983 0.717 17934 1511 1 3 . 1 1 27 27 GLY N N 27 102.901 102.901 101.799 1.102 17934 1512 1 3 . 1 1 27 27 GLY C C 27 176.219 176.219 171.312 4.907 17934 1513 1 3 . 1 1 27 27 GLY CA C 27 43.601 43.601 44.616 -1.015 17934 1514 1 3 . 1 1 27 27 GLY H H 27 5.891 5.891 7.779 -1.888 17934 1515 1 3 . 1 1 28 28 SER N N 28 111.551 111.551 114.423 -2.872 17934 1516 1 3 . 1 1 28 28 SER HA H 28 5.785 5.785 5.320 0.465 17934 1517 1 3 . 1 1 28 28 SER CA C 28 56.258 56.258 57.438 -1.180 17934 1518 1 3 . 1 1 28 28 SER CB C 28 65.632 65.632 66.393 -0.761 17934 1519 1 3 . 1 1 28 28 SER H H 28 7.981 7.981 8.208 -0.227 17934 1520 1 3 . 1 1 29 29 MET N N 29 119.493 119.493 122.295 -2.802 17934 1521 1 3 . 1 1 29 29 MET HA H 29 4.725 4.725 4.736 -0.011 17934 1522 1 3 . 1 1 29 29 MET C C 29 174.143 174.143 174.852 -0.709 17934 1523 1 3 . 1 1 29 29 MET CA C 29 54.036 54.036 54.352 -0.316 17934 1524 1 3 . 1 1 29 29 MET CB C 29 37.268 37.268 36.707 0.561 17934 1525 1 3 . 1 1 29 29 MET H H 29 8.704 8.704 8.947 -0.243 17934 1526 1 3 . 1 1 30 30 LEU N N 30 128.150 128.150 125.622 2.528 17934 1527 1 3 . 1 1 30 30 LEU HA H 30 3.785 3.785 3.793 -0.008 17934 1528 1 3 . 1 1 30 30 LEU C C 30 175.857 175.857 175.322 0.535 17934 1529 1 3 . 1 1 30 30 LEU CA C 30 56.250 56.250 55.070 1.180 17934 1530 1 3 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.605 1.055 17934 1531 1 3 . 1 1 30 30 LEU H H 30 8.630 8.630 8.567 0.063 17934 1532 1 3 . 1 1 31 31 ILE N N 31 127.723 127.723 128.112 -0.389 17934 1533 1 3 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.264 -0.074 17934 1534 1 3 . 1 1 31 31 ILE C C 31 174.881 174.881 175.453 -0.572 17934 1535 1 3 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.356 -1.696 17934 1536 1 3 . 1 1 31 31 ILE CB C 31 37.110 37.110 37.212 -0.101 17934 1537 1 3 . 1 1 31 31 ILE H H 31 8.560 8.560 8.601 -0.041 17934 1538 1 3 . 1 1 32 32 LYS HA H 32 4.055 4.055 4.011 0.044 17934 1539 1 3 . 1 1 32 32 LYS C C 32 176.272 176.272 176.591 -0.319 17934 1540 1 3 . 1 1 32 32 LYS CA C 32 58.601 58.601 58.715 -0.114 17934 1541 1 3 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.505 0.315 17934 1542 1 3 . 1 1 33 33 GLU N N 33 118.638 118.638 119.683 -1.045 17934 1543 1 3 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.303 0.085 17934 1544 1 3 . 1 1 33 33 GLU C C 33 173.962 173.962 175.196 -1.234 17934 1545 1 3 . 1 1 33 33 GLU CA C 33 54.851 54.851 55.520 -0.668 17934 1546 1 3 . 1 1 33 33 GLU CB C 33 30.945 30.945 29.363 1.582 17934 1547 1 3 . 1 1 33 33 GLU H H 33 7.723 7.723 8.058 -0.335 17934 1548 1 3 . 1 1 34 34 LEU N N 34 126.535 126.535 124.785 1.750 17934 1549 1 3 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.382 -0.437 17934 1550 1 3 . 1 1 34 34 LEU C C 34 176.870 176.870 176.559 0.311 17934 1551 1 3 . 1 1 34 34 LEU CA C 34 54.850 54.850 54.490 0.360 17934 1552 1 3 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.123 -0.403 17934 1553 1 3 . 1 1 34 34 LEU H H 34 8.446 8.446 8.409 0.037 17934 1554 1 3 . 1 1 35 35 ARG N N 35 128.447 128.447 122.648 5.799 17934 1555 1 3 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.554 0.001 17934 1556 1 3 . 1 1 35 35 ARG C C 35 176.110 176.110 176.323 -0.213 17934 1557 1 3 . 1 1 35 35 ARG CA C 35 54.851 54.851 55.100 -0.249 17934 1558 1 3 . 1 1 35 35 ARG CB C 35 30.477 30.477 30.948 -0.471 17934 1559 1 3 . 1 1 35 35 ARG H H 35 8.680 8.680 8.623 0.057 17934 1560 1 3 . 1 1 36 36 GLY N N 36 107.406 107.406 112.816 -5.410 17934 1561 1 3 . 1 1 36 36 GLY CA C 36 45.906 45.906 45.535 0.371 17934 1562 1 3 . 1 1 36 36 GLY H H 36 7.182 7.182 8.701 -1.519 17934 1563 1 3 . 1 1 37 37 THR HA H 37 4.060 4.060 4.124 -0.064 17934 1564 1 3 . 1 1 37 37 THR C C 37 176.634 176.634 176.113 0.521 17934 1565 1 3 . 1 1 37 37 THR CA C 37 65.632 65.632 64.176 1.456 17934 1566 1 3 . 1 1 37 37 THR CB C 37 68.445 68.445 68.786 -0.341 17934 1567 1 3 . 1 1 38 38 GLU N N 38 122.251 122.251 122.667 -0.416 17934 1568 1 3 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.905 0.221 17934 1569 1 3 . 1 1 38 38 GLU C C 38 179.981 179.981 178.392 1.589 17934 1570 1 3 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.678 0.330 17934 1571 1 3 . 1 1 38 38 GLU CB C 38 29.539 29.539 28.830 0.709 17934 1572 1 3 . 1 1 38 38 GLU H H 38 8.450 8.450 8.349 0.101 17934 1573 1 3 . 1 1 39 39 SER N N 39 115.966 115.966 113.871 2.095 17934 1574 1 3 . 1 1 39 39 SER C C 39 175.991 175.991 176.420 -0.429 17934 1575 1 3 . 1 1 39 39 SER CA C 39 62.820 62.820 62.416 0.404 17934 1576 1 3 . 1 1 39 39 SER H H 39 7.522 7.522 7.718 -0.196 17934 1577 1 3 . 1 1 40 40 THR HA H 40 4.049 4.049 4.110 -0.061 17934 1578 1 3 . 1 1 40 40 THR C C 40 175.972 175.972 177.271 -1.299 17934 1579 1 3 . 1 1 40 40 THR CA C 40 66.101 66.101 65.321 0.780 17934 1580 1 3 . 1 1 40 40 THR CB C 40 67.976 67.976 68.417 -0.441 17934 1581 1 3 . 1 1 41 41 GLN N N 41 120.354 120.354 119.152 1.202 17934 1582 1 3 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.202 -0.443 17934 1583 1 3 . 1 1 41 41 GLN C C 41 178.483 178.483 178.394 0.089 17934 1584 1 3 . 1 1 41 41 GLN CA C 41 60.476 60.476 58.264 2.212 17934 1585 1 3 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.324 -0.191 17934 1586 1 3 . 1 1 41 41 GLN H H 41 8.271 8.271 8.176 0.095 17934 1587 1 3 . 1 1 42 42 ASP N N 42 120.757 120.757 121.096 -0.339 17934 1588 1 3 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.464 -0.105 17934 1589 1 3 . 1 1 42 42 ASP C C 42 177.480 177.480 178.027 -0.547 17934 1590 1 3 . 1 1 42 42 ASP CA C 42 57.664 57.664 56.899 0.765 17934 1591 1 3 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.712 1.483 17934 1592 1 3 . 1 1 42 42 ASP H H 42 7.954 7.954 8.090 -0.136 17934 1593 1 3 . 1 1 43 43 ALA N N 43 120.587 120.587 122.191 -1.604 17934 1594 1 3 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.184 -0.194 17934 1595 1 3 . 1 1 43 43 ALA C C 43 179.767 179.767 179.624 0.143 17934 1596 1 3 . 1 1 43 43 ALA CA C 43 55.320 55.320 55.145 0.175 17934 1597 1 3 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.404 0.826 17934 1598 1 3 . 1 1 43 43 ALA H H 43 7.842 7.842 8.367 -0.525 17934 1599 1 3 . 1 1 44 44 CYS N N 44 115.428 115.428 117.785 -2.357 17934 1600 1 3 . 1 1 44 44 CYS HA H 44 3.895 3.895 3.935 -0.040 17934 1601 1 3 . 1 1 44 44 CYS C C 44 176.076 176.076 176.634 -0.558 17934 1602 1 3 . 1 1 44 44 CYS CA C 44 64.695 64.695 63.612 1.083 17934 1603 1 3 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.845 -0.181 17934 1604 1 3 . 1 1 44 44 CYS H H 44 7.900 7.900 8.425 -0.525 17934 1605 1 3 . 1 1 45 45 ALA N N 45 120.487 120.487 122.461 -1.974 17934 1606 1 3 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.947 0.053 17934 1607 1 3 . 1 1 45 45 ALA C C 45 173.506 173.506 178.898 -5.392 17934 1608 1 3 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.288 0.031 17934 1609 1 3 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.065 -0.125 17934 1610 1 3 . 1 1 45 45 ALA H H 45 7.250 7.250 8.056 -0.806 17934 1611 1 3 . 1 1 46 46 LYS N N 46 119.267 119.267 119.585 -0.318 17934 1612 1 3 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.938 0.009 17934 1613 1 3 . 1 1 46 46 LYS C C 46 179.561 179.561 178.825 0.736 17934 1614 1 3 . 1 1 46 46 LYS H H 46 8.102 8.102 8.236 -0.134 17934 1615 1 3 . 1 1 47 47 MET N N 47 118.009 118.009 118.170 -0.161 17934 1616 1 3 . 1 1 47 47 MET HA H 47 4.214 4.214 4.048 0.166 17934 1617 1 3 . 1 1 47 47 MET C C 47 179.526 179.526 178.116 1.410 17934 1618 1 3 . 1 1 47 47 MET CA C 47 57.195 57.195 58.659 -1.464 17934 1619 1 3 . 1 1 47 47 MET CB C 47 30.945 30.945 32.614 -1.669 17934 1620 1 3 . 1 1 47 47 MET H H 47 8.585 8.585 8.136 0.449 17934 1621 1 3 . 1 1 48 48 ARG N N 48 119.962 119.962 119.848 0.114 17934 1622 1 3 . 1 1 48 48 ARG HA H 48 3.856 3.856 4.000 -0.144 17934 1623 1 3 . 1 1 48 48 ARG C C 48 178.875 178.875 178.426 0.449 17934 1624 1 3 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.468 1.477 17934 1625 1 3 . 1 1 48 48 ARG CB C 48 30.477 30.477 30.047 0.430 17934 1626 1 3 . 1 1 48 48 ARG H H 48 8.190 8.190 8.445 -0.255 17934 1627 1 3 . 1 1 49 49 ALA N N 49 120.640 120.640 119.964 0.676 17934 1628 1 3 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.344 -0.601 17934 1629 1 3 . 1 1 49 49 ALA C C 49 180.169 180.169 178.964 1.205 17934 1630 1 3 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.168 0.683 17934 1631 1 3 . 1 1 49 49 ALA CB C 49 17.821 17.821 18.479 -0.658 17934 1632 1 3 . 1 1 49 49 ALA H H 49 7.671 7.671 8.428 -0.757 17934 1633 1 3 . 1 1 50 50 ASN N N 50 116.063 116.063 116.365 -0.302 17934 1634 1 3 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.706 -0.232 17934 1635 1 3 . 1 1 50 50 ASN C C 50 177.084 177.084 176.103 0.981 17934 1636 1 3 . 1 1 50 50 ASN CA C 50 55.789 55.789 54.858 0.931 17934 1637 1 3 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.783 0.131 17934 1638 1 3 . 1 1 50 50 ASN H H 50 7.893 7.893 8.234 -0.341 17934 1639 1 3 . 1 1 51 51 CYS N N 51 116.884 116.884 118.149 -1.265 17934 1640 1 3 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.446 -0.140 17934 1641 1 3 . 1 1 51 51 CYS C C 51 175.002 175.002 176.490 -1.488 17934 1642 1 3 . 1 1 51 51 CYS CA C 51 61.414 61.414 60.322 1.092 17934 1643 1 3 . 1 1 51 51 CYS CB C 51 27.664 27.664 28.474 -0.810 17934 1644 1 3 . 1 1 51 51 CYS H H 51 7.770 7.770 8.326 -0.556 17934 1645 1 3 . 1 1 52 52 GLN N N 52 117.831 117.831 121.640 -3.809 17934 1646 1 3 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.066 0.162 17934 1647 1 3 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.414 -1.688 17934 1648 1 3 . 1 1 52 52 GLN CB C 52 29.070 29.070 27.926 1.144 17934 1649 1 3 . 1 1 52 52 GLN H H 52 7.796 7.796 8.121 -0.325 17934 1650 1 3 . 1 1 53 53 LYS N N 53 118.841 118.841 116.230 2.611 17934 1651 1 3 . 1 1 53 53 LYS CA C 53 57.195 57.195 57.671 -0.476 17934 1652 1 3 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.259 1.030 17934 1653 1 3 . 1 1 53 53 LYS H H 53 7.686 7.686 7.886 -0.200 17934 1654 1 3 . 1 1 55 55 THR HA H 55 4.304 4.304 4.190 0.114 17934 1655 1 3 . 1 1 55 55 THR CA C 55 63.757 63.757 64.222 -0.465 17934 1656 1 3 . 1 1 55 55 THR CB C 55 68.914 68.914 68.574 0.340 17934 1657 1 3 . 1 1 56 56 GLU N N 56 120.861 120.861 119.996 0.865 17934 1658 1 3 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.160 -0.013 17934 1659 1 3 . 1 1 56 56 GLU C C 56 177.656 177.656 177.319 0.337 17934 1660 1 3 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.412 -0.279 17934 1661 1 3 . 1 1 56 56 GLU CB C 56 30.008 30.008 28.642 1.366 17934 1662 1 3 . 1 1 56 56 GLU H H 56 8.311 8.311 8.444 -0.133 17934 1663 1 3 . 1 1 57 57 GLN N N 57 118.397 118.397 119.107 -0.710 17934 1664 1 3 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.158 -0.016 17934 1665 1 3 . 1 1 57 57 GLN C C 57 177.275 177.275 177.210 0.065 17934 1666 1 3 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.937 -0.273 17934 1667 1 3 . 1 1 57 57 GLN CB C 57 29.070 29.070 29.108 -0.038 17934 1668 1 3 . 1 1 57 57 GLN H H 57 7.899 7.899 8.062 -0.162 17934 1669 1 3 . 1 1 58 58 MET N N 58 118.897 118.897 113.686 5.211 17934 1670 1 3 . 1 1 58 58 MET HA H 58 4.350 4.350 4.574 -0.224 17934 1671 1 3 . 1 1 58 58 MET C C 58 177.172 177.172 176.475 0.697 17934 1672 1 3 . 1 1 58 58 MET CA C 58 56.726 56.726 55.721 1.005 17934 1673 1 3 . 1 1 58 58 MET CB C 58 32.196 32.196 33.685 -1.489 17934 1674 1 3 . 1 1 58 58 MET H H 58 8.036 8.036 7.495 0.541 17934 1675 1 3 . 1 1 59 59 LYS N N 59 119.779 119.779 119.687 0.092 17934 1676 1 3 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.002 0.229 17934 1677 1 3 . 1 1 59 59 LYS C C 59 176.676 176.676 174.823 1.853 17934 1678 1 3 . 1 1 59 59 LYS CA C 59 57.195 57.195 57.691 -0.496 17934 1679 1 3 . 1 1 59 59 LYS CB C 59 32.820 32.820 30.684 2.136 17934 1680 1 3 . 1 1 59 59 LYS H H 59 7.901 7.901 8.043 -0.142 17934 1681 1 3 . 1 1 60 60 LYS N N 60 119.993 119.993 115.522 4.471 17934 1682 1 3 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.319 0.016 17934 1683 1 3 . 1 1 60 60 LYS C C 60 176.336 176.336 173.847 2.489 17934 1684 1 3 . 1 1 60 60 LYS CA C 60 56.258 56.258 55.675 0.583 17934 1685 1 3 . 1 1 60 60 LYS CB C 60 32.820 32.820 34.438 -1.618 17934 1686 1 3 . 1 1 60 60 LYS H H 60 7.877 7.877 7.492 0.385 17934 1687 1 3 . 1 1 61 61 VAL N N 61 122.649 122.649 121.172 1.477 17934 1688 1 3 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.470 -0.090 17934 1689 1 3 . 1 1 61 61 VAL C C 61 174.210 174.210 174.195 0.015 17934 1690 1 3 . 1 1 61 61 VAL CA C 61 60.000 60.000 59.261 0.739 17934 1691 1 3 . 1 1 61 61 VAL CB C 61 32.350 32.350 33.815 -1.464 17934 1692 1 3 . 1 1 61 61 VAL H H 61 7.708 7.708 8.188 -0.480 17934 1693 1 3 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.684 -0.021 17934 1694 1 3 . 1 1 62 62 PRO C C 62 176.656 176.656 176.281 0.375 17934 1695 1 3 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.565 0.255 17934 1696 1 3 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.835 -0.952 17934 1697 1 3 . 1 1 63 63 THR N N 63 117.155 117.155 117.462 -0.307 17934 1698 1 3 . 1 1 63 63 THR HA H 63 4.830 4.830 4.852 -0.022 17934 1699 1 3 . 1 1 63 63 THR C C 63 174.682 174.682 173.804 0.878 17934 1700 1 3 . 1 1 63 63 THR CA C 63 62.820 62.820 62.969 -0.149 17934 1701 1 3 . 1 1 63 63 THR CB C 63 69.382 69.382 70.430 -1.048 17934 1702 1 3 . 1 1 63 63 THR H H 63 8.303 8.303 8.649 -0.346 17934 1703 1 3 . 1 1 64 64 ILE N N 64 121.004 121.004 120.463 0.541 17934 1704 1 3 . 1 1 64 64 ILE CA C 64 58.600 58.600 59.746 -1.146 17934 1705 1 3 . 1 1 64 64 ILE CB C 64 42.690 42.690 42.480 0.210 17934 1706 1 3 . 1 1 64 64 ILE H H 64 9.348 9.348 8.858 0.490 17934 1707 1 3 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.174 0.566 17934 1708 1 3 . 1 1 65 65 ILE C C 65 175.378 175.378 174.558 0.820 17934 1709 1 3 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.076 -0.996 17934 1710 1 3 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.897 0.853 17934 1711 1 3 . 1 1 66 66 LEU N N 66 110.343 110.343 129.812 -19.469 17934 1712 1 3 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.780 0.070 17934 1713 1 3 . 1 1 66 66 LEU C C 66 174.982 174.982 175.568 -0.586 17934 1714 1 3 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.382 -0.472 17934 1715 1 3 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.865 1.365 17934 1716 1 3 . 1 1 66 66 LEU H H 66 9.610 9.610 9.175 0.435 17934 1717 1 3 . 1 1 67 67 SER N N 67 120.990 120.990 119.691 1.299 17934 1718 1 3 . 1 1 67 67 SER HA H 67 5.405 5.405 4.995 0.410 17934 1719 1 3 . 1 1 67 67 SER C C 67 174.405 174.405 173.090 1.315 17934 1720 1 3 . 1 1 67 67 SER CA C 67 57.195 57.195 56.749 0.445 17934 1721 1 3 . 1 1 67 67 SER CB C 67 64.695 64.695 64.555 0.140 17934 1722 1 3 . 1 1 67 67 SER H H 67 9.260 9.260 8.603 0.657 17934 1723 1 3 . 1 1 68 68 VAL N N 68 128.176 128.176 126.597 1.579 17934 1724 1 3 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.337 0.156 17934 1725 1 3 . 1 1 68 68 VAL C C 68 173.891 173.891 172.993 0.898 17934 1726 1 3 . 1 1 68 68 VAL CA C 68 62.350 62.350 61.035 1.315 17934 1727 1 3 . 1 1 68 68 VAL CB C 68 33.750 33.750 34.209 -0.459 17934 1728 1 3 . 1 1 68 68 VAL H H 68 9.225 9.225 9.075 0.150 17934 1729 1 3 . 1 1 69 69 SER N N 69 121.697 121.697 123.556 -1.859 17934 1730 1 3 . 1 1 69 69 SER HA H 69 4.837 4.837 4.877 -0.040 17934 1731 1 3 . 1 1 69 69 SER C C 69 173.188 173.188 174.827 -1.639 17934 1732 1 3 . 1 1 69 69 SER CA C 69 57.195 57.195 55.327 1.868 17934 1733 1 3 . 1 1 69 69 SER CB C 69 67.976 67.976 65.256 2.720 17934 1734 1 3 . 1 1 69 69 SER H H 69 8.869 8.869 8.791 0.078 17934 1735 1 3 . 1 1 70 70 ALA N N 70 118.689 118.689 128.391 -9.702 17934 1736 1 3 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.236 -0.086 17934 1737 1 3 . 1 1 70 70 ALA C C 70 176.714 176.714 177.165 -0.451 17934 1738 1 3 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.040 -0.130 17934 1739 1 3 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.889 -0.289 17934 1740 1 3 . 1 1 70 70 ALA H H 70 8.810 8.810 9.270 -0.460 17934 1741 1 3 . 1 1 71 71 LYS N N 71 112.633 112.633 115.725 -3.092 17934 1742 1 3 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.356 -0.081 17934 1743 1 3 . 1 1 71 71 LYS C C 71 177.033 177.033 175.815 1.218 17934 1744 1 3 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.951 1.244 17934 1745 1 3 . 1 1 71 71 LYS CB C 71 33.289 33.289 32.884 0.405 17934 1746 1 3 . 1 1 71 71 LYS H H 71 7.830 7.830 8.233 -0.403 17934 1747 1 3 . 1 1 72 72 GLY N N 72 108.432 108.432 107.191 1.241 17934 1748 1 3 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.148 0.328 17934 1749 1 3 . 1 1 72 72 GLY H H 72 7.685 7.685 7.692 -0.007 17934 1750 1 3 . 1 1 73 73 VAL N N 73 120.414 120.414 116.539 3.875 17934 1751 1 3 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.653 0.347 17934 1752 1 3 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.370 1.099 17934 1753 1 3 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.011 0.619 17934 1754 1 3 . 1 1 73 73 VAL H H 73 8.620 8.620 7.849 0.771 17934 1755 1 3 . 1 1 74 74 LYS N N 74 125.257 125.257 125.234 0.023 17934 1756 1 3 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.611 0.405 17934 1757 1 3 . 1 1 74 74 LYS CA C 74 54.383 54.383 53.956 0.427 17934 1758 1 3 . 1 1 74 74 LYS CB C 74 36.570 36.570 36.358 0.212 17934 1759 1 3 . 1 1 74 74 LYS H H 74 8.783 8.783 7.490 1.293 17934 1760 1 3 . 1 1 75 75 PHE N N 75 119.414 119.414 118.457 0.957 17934 1761 1 3 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.499 0.201 17934 1762 1 3 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.693 -2.773 17934 1763 1 3 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.188 -0.578 17934 1764 1 3 . 1 1 75 75 PHE H H 75 8.432 8.432 8.919 -0.487 17934 1765 1 3 . 1 1 76 76 ILE N N 76 121.430 121.430 120.928 0.502 17934 1766 1 3 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.737 0.103 17934 1767 1 3 . 1 1 76 76 ILE C C 76 175.249 175.249 174.245 1.004 17934 1768 1 3 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.574 -0.504 17934 1769 1 3 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.695 -0.475 17934 1770 1 3 . 1 1 76 76 ILE H H 76 8.960 8.960 8.323 0.637 17934 1771 1 3 . 1 1 77 77 ASP N N 77 125.744 125.744 123.829 1.915 17934 1772 1 3 . 1 1 77 77 ASP HA H 77 4.563 4.563 5.014 -0.451 17934 1773 1 3 . 1 1 77 77 ASP C C 77 177.569 177.569 175.733 1.836 17934 1774 1 3 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.821 2.968 17934 1775 1 3 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.353 0.248 17934 1776 1 3 . 1 1 77 77 ASP H H 77 8.750 8.750 8.253 0.497 17934 1777 1 3 . 1 1 78 78 ALA N N 78 128.632 128.632 128.695 -0.063 17934 1778 1 3 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.366 -0.396 17934 1779 1 3 . 1 1 78 78 ALA C C 78 178.052 178.052 178.253 -0.201 17934 1780 1 3 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.041 0.789 17934 1781 1 3 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.622 0.171 17934 1782 1 3 . 1 1 78 78 ALA H H 78 8.700 8.700 8.822 -0.122 17934 1783 1 3 . 1 1 79 79 THR N N 79 113.087 113.087 114.130 -1.043 17934 1784 1 3 . 1 1 79 79 THR HA H 79 4.194 4.194 4.257 -0.063 17934 1785 1 3 . 1 1 79 79 THR C C 79 175.587 175.587 175.924 -0.337 17934 1786 1 3 . 1 1 79 79 THR CA C 79 64.695 64.695 65.621 -0.926 17934 1787 1 3 . 1 1 79 79 THR CB C 79 69.382 69.382 69.519 -0.137 17934 1788 1 3 . 1 1 79 79 THR H H 79 8.779 8.779 8.441 0.338 17934 1789 1 3 . 1 1 80 80 ASN N N 80 118.434 118.434 117.665 0.769 17934 1790 1 3 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.803 -0.066 17934 1791 1 3 . 1 1 80 80 ASN CA C 80 53.445 53.445 53.234 0.211 17934 1792 1 3 . 1 1 80 80 ASN CB C 80 39.383 39.383 39.247 0.136 17934 1793 1 3 . 1 1 80 80 ASN H H 80 8.584 8.584 8.291 0.293 17934 1794 1 3 . 1 1 81 81 LYS N N 81 112.429 112.429 114.834 -2.405 17934 1795 1 3 . 1 1 81 81 LYS C C 81 174.909 174.909 175.430 -0.521 17934 1796 1 3 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.596 0.068 17934 1797 1 3 . 1 1 81 81 LYS CB C 81 28.602 28.602 30.035 -1.433 17934 1798 1 3 . 1 1 81 81 LYS H H 81 7.966 7.966 8.492 -0.526 17934 1799 1 3 . 1 1 82 82 ASN N N 82 116.806 116.806 116.272 0.534 17934 1800 1 3 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.777 -0.187 17934 1801 1 3 . 1 1 82 82 ASN C C 82 174.999 174.999 174.346 0.653 17934 1802 1 3 . 1 1 82 82 ASN CA C 82 52.976 52.976 51.860 1.116 17934 1803 1 3 . 1 1 82 82 ASN CB C 82 38.445 38.445 40.756 -2.311 17934 1804 1 3 . 1 1 82 82 ASN H H 82 8.455 8.455 7.669 0.786 17934 1805 1 3 . 1 1 83 83 ILE N N 83 122.447 122.447 121.919 0.528 17934 1806 1 3 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.175 -0.145 17934 1807 1 3 . 1 1 83 83 ILE C C 83 176.572 176.572 176.051 0.521 17934 1808 1 3 . 1 1 83 83 ILE CA C 83 62.350 62.350 61.542 0.808 17934 1809 1 3 . 1 1 83 83 ILE CB C 83 37.970 37.970 37.307 0.663 17934 1810 1 3 . 1 1 83 83 ILE H H 83 8.650 8.650 8.470 0.180 17934 1811 1 3 . 1 1 84 84 ILE N N 84 129.339 129.339 128.756 0.583 17934 1812 1 3 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.077 -0.157 17934 1813 1 3 . 1 1 84 84 ILE C C 84 175.873 175.873 175.985 -0.112 17934 1814 1 3 . 1 1 84 84 ILE CA C 84 62.810 62.810 61.582 1.228 17934 1815 1 3 . 1 1 84 84 ILE CB C 84 38.840 38.840 38.342 0.498 17934 1816 1 3 . 1 1 84 84 ILE H H 84 8.930 8.930 8.524 0.406 17934 1817 1 3 . 1 1 85 85 ALA N N 85 118.867 118.867 117.602 1.265 17934 1818 1 3 . 1 1 85 85 ALA C C 85 174.100 174.100 174.571 -0.471 17934 1819 1 3 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.323 -0.753 17934 1820 1 3 . 1 1 85 85 ALA H H 85 7.048 7.048 8.178 -1.130 17934 1821 1 3 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.936 0.218 17934 1822 1 3 . 1 1 87 87 HIS C C 87 174.986 174.986 173.629 1.357 17934 1823 1 3 . 1 1 87 87 HIS CB C 87 34.350 34.350 31.736 2.614 17934 1824 1 3 . 1 1 88 88 GLU N N 88 125.372 125.372 120.134 5.238 17934 1825 1 3 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.288 0.233 17934 1826 1 3 . 1 1 88 88 GLU C C 88 179.047 179.047 178.191 0.856 17934 1827 1 3 . 1 1 88 88 GLU CA C 88 56.726 56.726 56.328 0.398 17934 1828 1 3 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.614 -0.137 17934 1829 1 3 . 1 1 88 88 GLU H H 88 9.106 9.106 8.725 0.381 17934 1830 1 3 . 1 1 89 89 ILE N N 89 124.132 124.132 124.371 -0.239 17934 1831 1 3 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.895 0.124 17934 1832 1 3 . 1 1 89 89 ILE C C 89 176.095 176.095 177.553 -1.458 17934 1833 1 3 . 1 1 89 89 ILE CA C 89 62.351 62.351 64.593 -2.241 17934 1834 1 3 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.007 0.907 17934 1835 1 3 . 1 1 89 89 ILE H H 89 8.055 8.055 8.847 -0.792 17934 1836 1 3 . 1 1 90 90 ARG N N 90 116.949 116.949 116.424 0.525 17934 1837 1 3 . 1 1 90 90 ARG HA H 90 4.338 4.338 3.981 0.357 17934 1838 1 3 . 1 1 90 90 ARG C C 90 176.578 176.578 176.334 0.244 17934 1839 1 3 . 1 1 90 90 ARG CA C 90 57.664 57.664 57.862 -0.198 17934 1840 1 3 . 1 1 90 90 ARG CB C 90 29.070 29.070 28.899 0.171 17934 1841 1 3 . 1 1 90 90 ARG H H 90 8.045 8.045 8.495 -0.450 17934 1842 1 3 . 1 1 91 91 ASN N N 91 116.320 116.320 116.340 -0.020 17934 1843 1 3 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.663 0.490 17934 1844 1 3 . 1 1 91 91 ASN C C 91 174.595 174.595 175.879 -1.284 17934 1845 1 3 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.047 -1.540 17934 1846 1 3 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.708 0.144 17934 1847 1 3 . 1 1 91 91 ASN H H 91 8.067 8.067 7.792 0.275 17934 1848 1 3 . 1 1 92 92 ILE N N 92 122.441 122.441 121.516 0.925 17934 1849 1 3 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.818 1.255 17934 1850 1 3 . 1 1 92 92 ILE C C 92 175.229 175.229 176.260 -1.031 17934 1851 1 3 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.745 -0.865 17934 1852 1 3 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.918 1.932 17934 1853 1 3 . 1 1 92 92 ILE H H 92 7.483 7.483 7.871 -0.388 17934 1854 1 3 . 1 1 93 93 SER N N 93 120.329 120.329 123.786 -3.457 17934 1855 1 3 . 1 1 93 93 SER HA H 93 4.684 4.684 4.321 0.363 17934 1856 1 3 . 1 1 93 93 SER C C 93 180.744 180.744 174.516 6.228 17934 1857 1 3 . 1 1 93 93 SER CA C 93 57.664 57.664 60.571 -2.907 17934 1858 1 3 . 1 1 93 93 SER CB C 93 66.570 66.570 63.898 2.672 17934 1859 1 3 . 1 1 93 93 SER H H 93 9.545 9.545 8.368 1.177 17934 1860 1 3 . 1 1 94 94 CYS N N 94 110.900 110.900 115.823 -4.923 17934 1861 1 3 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.494 -0.682 17934 1862 1 3 . 1 1 94 94 CYS C C 94 173.973 173.973 172.634 1.339 17934 1863 1 3 . 1 1 94 94 CYS CA C 94 59.539 59.539 57.924 1.615 17934 1864 1 3 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.334 -4.076 17934 1865 1 3 . 1 1 94 94 CYS H H 94 8.858 8.858 8.091 0.767 17934 1866 1 3 . 1 1 95 95 ALA N N 95 121.379 121.379 122.780 -1.401 17934 1867 1 3 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.610 -0.180 17934 1868 1 3 . 1 1 95 95 ALA C C 95 178.098 178.098 175.059 3.039 17934 1869 1 3 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.712 0.938 17934 1870 1 3 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.689 -2.389 17934 1871 1 3 . 1 1 95 95 ALA H H 95 8.360 8.360 8.217 0.143 17934 1872 1 3 . 1 1 96 96 ALA N N 96 122.576 122.576 122.636 -0.060 17934 1873 1 3 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.699 -0.019 17934 1874 1 3 . 1 1 96 96 ALA C C 96 175.716 175.716 174.742 0.974 17934 1875 1 3 . 1 1 96 96 ALA CA C 96 52.440 52.440 52.137 0.303 17934 1876 1 3 . 1 1 96 96 ALA CB C 96 22.700 22.700 21.998 0.702 17934 1877 1 3 . 1 1 96 96 ALA H H 96 9.080 9.080 8.743 0.337 17934 1878 1 3 . 1 1 97 97 GLN N N 97 116.903 116.903 121.107 -4.204 17934 1879 1 3 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.783 0.147 17934 1880 1 3 . 1 1 97 97 GLN C C 97 175.270 175.270 174.420 0.850 17934 1881 1 3 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.410 1.441 17934 1882 1 3 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.380 2.378 17934 1883 1 3 . 1 1 97 97 GLN H H 97 8.369 8.369 8.362 0.007 17934 1884 1 3 . 1 1 98 98 ASP N N 98 124.971 124.971 121.073 3.898 17934 1885 1 3 . 1 1 98 98 ASP C C 98 175.217 175.217 175.996 -0.779 17934 1886 1 3 . 1 1 98 98 ASP CA C 98 52.039 52.039 51.721 0.319 17934 1887 1 3 . 1 1 98 98 ASP CB C 98 42.195 42.195 40.082 2.113 17934 1888 1 3 . 1 1 98 98 ASP H H 98 8.395 8.395 8.427 -0.032 17934 1889 1 3 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.376 -0.142 17934 1890 1 3 . 1 1 99 99 PRO C C 99 178.433 178.433 178.293 0.140 17934 1891 1 3 . 1 1 99 99 PRO CA C 99 64.695 64.695 65.134 -0.439 17934 1892 1 3 . 1 1 99 99 PRO CB C 99 32.352 32.352 31.923 0.429 17934 1893 1 3 . 1 1 100 100 GLU N N 100 116.223 116.223 118.630 -2.407 17934 1894 1 3 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.108 0.112 17934 1895 1 3 . 1 1 100 100 GLU C C 100 176.678 176.678 176.261 0.417 17934 1896 1 3 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.577 -1.851 17934 1897 1 3 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.679 2.266 17934 1898 1 3 . 1 1 100 100 GLU H H 100 8.643 8.643 8.787 -0.144 17934 1899 1 3 . 1 1 101 101 ASP N N 101 119.053 119.053 119.538 -0.485 17934 1900 1 3 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.879 -0.336 17934 1901 1 3 . 1 1 101 101 ASP C C 101 174.771 174.771 176.410 -1.639 17934 1902 1 3 . 1 1 101 101 ASP CA C 101 53.914 53.914 52.872 1.042 17934 1903 1 3 . 1 1 101 101 ASP CB C 101 40.789 40.789 41.143 -0.354 17934 1904 1 3 . 1 1 101 101 ASP H H 101 7.597 7.597 8.002 -0.405 17934 1905 1 3 . 1 1 102 102 LEU N N 102 123.986 123.986 121.528 2.458 17934 1906 1 3 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.299 0.091 17934 1907 1 3 . 1 1 102 102 LEU C C 102 177.141 177.141 177.279 -0.138 17934 1908 1 3 . 1 1 102 102 LEU CA C 102 57.660 57.660 56.693 0.967 17934 1909 1 3 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.516 1.144 17934 1910 1 3 . 1 1 102 102 LEU H H 102 8.534 8.534 7.415 1.119 17934 1911 1 3 . 1 1 103 103 SER N N 103 112.339 112.339 110.726 1.613 17934 1912 1 3 . 1 1 103 103 SER HA H 103 4.290 4.290 4.446 -0.156 17934 1913 1 3 . 1 1 103 103 SER C C 103 174.106 174.106 174.685 -0.579 17934 1914 1 3 . 1 1 103 103 SER CA C 103 60.945 60.945 60.812 0.133 17934 1915 1 3 . 1 1 103 103 SER CB C 103 63.757 63.757 63.621 0.136 17934 1916 1 3 . 1 1 103 103 SER H H 103 7.867 7.867 8.303 -0.436 17934 1917 1 3 . 1 1 104 104 THR N N 104 123.070 123.070 117.100 5.970 17934 1918 1 3 . 1 1 104 104 THR HA H 104 5.373 5.373 4.403 0.970 17934 1919 1 3 . 1 1 104 104 THR C C 104 180.693 180.693 173.150 7.543 17934 1920 1 3 . 1 1 104 104 THR CA C 104 63.289 63.289 63.079 0.210 17934 1921 1 3 . 1 1 104 104 THR CB C 104 69.382 69.382 70.130 -0.748 17934 1922 1 3 . 1 1 104 104 THR H H 104 8.830 8.830 7.977 0.853 17934 1923 1 3 . 1 1 105 105 PHE N N 105 122.582 122.582 120.300 2.282 17934 1924 1 3 . 1 1 105 105 PHE HA H 105 5.470 5.470 5.869 -0.399 17934 1925 1 3 . 1 1 105 105 PHE C C 105 179.211 179.211 172.971 6.240 17934 1926 1 3 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.526 -0.206 17934 1927 1 3 . 1 1 105 105 PHE CB C 105 41.790 41.790 42.100 -0.310 17934 1928 1 3 . 1 1 105 105 PHE H H 105 9.170 9.170 8.472 0.698 17934 1929 1 3 . 1 1 106 106 ALA N N 106 119.567 119.567 120.452 -0.885 17934 1930 1 3 . 1 1 106 106 ALA C C 106 175.603 175.603 175.005 0.598 17934 1931 1 3 . 1 1 106 106 ALA H H 106 8.770 8.770 9.211 -0.441 17934 1932 1 3 . 1 1 107 107 TYR N N 107 109.933 109.933 118.947 -9.014 17934 1933 1 3 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.436 -0.516 17934 1934 1 3 . 1 1 107 107 TYR C C 107 180.426 180.426 173.228 7.198 17934 1935 1 3 . 1 1 107 107 TYR CA C 107 57.080 57.080 54.791 2.289 17934 1936 1 3 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.413 -0.624 17934 1937 1 3 . 1 1 107 107 TYR H H 107 7.950 7.950 9.652 -1.702 17934 1938 1 3 . 1 1 108 108 ILE N N 108 120.613 120.613 118.542 2.071 17934 1939 1 3 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.966 0.404 17934 1940 1 3 . 1 1 108 108 ILE C C 108 176.212 176.212 175.868 0.344 17934 1941 1 3 . 1 1 108 108 ILE CA C 108 59.540 59.540 59.095 0.445 17934 1942 1 3 . 1 1 108 108 ILE CB C 108 39.380 39.380 38.600 0.780 17934 1943 1 3 . 1 1 108 108 ILE H H 108 8.869 8.869 8.770 0.099 17934 1944 1 3 . 1 1 109 109 THR N N 109 116.505 116.505 115.292 1.213 17934 1945 1 3 . 1 1 109 109 THR HA H 109 5.669 5.669 4.628 1.041 17934 1946 1 3 . 1 1 109 109 THR C C 109 173.505 173.505 173.255 0.250 17934 1947 1 3 . 1 1 109 109 THR CA C 109 59.070 59.070 60.206 -1.136 17934 1948 1 3 . 1 1 109 109 THR H H 109 9.489 9.489 8.337 1.152 17934 1949 1 3 . 1 1 110 110 LYS N N 110 122.960 122.960 120.034 2.926 17934 1950 1 3 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.428 0.032 17934 1951 1 3 . 1 1 110 110 LYS C C 110 175.937 175.937 175.962 -0.025 17934 1952 1 3 . 1 1 110 110 LYS CA C 110 55.789 55.789 56.378 -0.589 17934 1953 1 3 . 1 1 110 110 LYS CB C 110 34.227 34.227 33.374 0.853 17934 1954 1 3 . 1 1 110 110 LYS H H 110 7.831 7.831 8.139 -0.308 17934 1955 1 3 . 1 1 111 111 ASP N N 111 127.409 127.409 120.600 6.809 17934 1956 1 3 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.690 0.091 17934 1957 1 3 . 1 1 111 111 ASP C C 111 176.396 176.396 177.445 -1.049 17934 1958 1 3 . 1 1 111 111 ASP CA C 111 53.914 53.914 52.146 1.768 17934 1959 1 3 . 1 1 111 111 ASP CB C 111 43.133 43.133 42.498 0.634 17934 1960 1 3 . 1 1 111 111 ASP H H 111 8.769 8.769 8.110 0.659 17934 1961 1 3 . 1 1 112 112 LEU N N 112 125.913 125.913 125.494 0.419 17934 1962 1 3 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.179 -0.029 17934 1963 1 3 . 1 1 112 112 LEU C C 112 178.553 178.553 176.379 2.174 17934 1964 1 3 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.289 -0.099 17934 1965 1 3 . 1 1 112 112 LEU CB C 112 41.790 41.790 42.147 -0.357 17934 1966 1 3 . 1 1 112 112 LEU H H 112 8.593 8.593 8.615 -0.022 17934 1967 1 3 . 1 1 113 113 LYS N N 113 117.189 117.189 118.584 -1.395 17934 1968 1 3 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.336 -0.074 17934 1969 1 3 . 1 1 113 113 LYS C C 113 177.180 177.180 175.303 1.877 17934 1970 1 3 . 1 1 113 113 LYS CA C 113 58.133 58.133 56.578 1.555 17934 1971 1 3 . 1 1 113 113 LYS CB C 113 32.820 32.820 33.010 -0.190 17934 1972 1 3 . 1 1 113 113 LYS H H 113 8.207 8.207 8.299 -0.092 17934 1973 1 3 . 1 1 114 114 SER N N 114 112.492 112.492 112.508 -0.016 17934 1974 1 3 . 1 1 114 114 SER CA C 114 58.601 58.601 57.205 1.396 17934 1975 1 3 . 1 1 114 114 SER CB C 114 65.164 65.164 64.985 0.179 17934 1976 1 3 . 1 1 114 114 SER H H 114 7.755 7.755 7.541 0.214 17934 1977 1 3 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.493 -0.104 17934 1978 1 3 . 1 1 115 115 ASN C C 115 174.203 174.203 175.387 -1.184 17934 1979 1 3 . 1 1 115 115 ASN CA C 115 54.383 54.383 53.977 0.406 17934 1980 1 3 . 1 1 115 115 ASN CB C 115 37.977 37.977 38.087 -0.110 17934 1981 1 3 . 1 1 116 116 HIS N N 116 116.822 116.822 120.041 -3.219 17934 1982 1 3 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.364 0.566 17934 1983 1 3 . 1 1 116 116 HIS C C 116 173.898 173.898 175.858 -1.960 17934 1984 1 3 . 1 1 116 116 HIS CA C 116 54.910 54.910 55.608 -0.698 17934 1985 1 3 . 1 1 116 116 HIS CB C 116 32.650 32.650 30.101 2.549 17934 1986 1 3 . 1 1 116 116 HIS H H 116 7.690 7.690 7.467 0.223 17934 1987 1 3 . 1 1 117 117 HIS N N 117 118.253 118.253 120.016 -1.763 17934 1988 1 3 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.556 0.764 17934 1989 1 3 . 1 1 117 117 HIS C C 117 173.695 173.695 174.739 -1.044 17934 1990 1 3 . 1 1 117 117 HIS CA C 117 56.350 56.350 56.942 -0.592 17934 1991 1 3 . 1 1 117 117 HIS CB C 117 32.350 32.350 28.241 4.109 17934 1992 1 3 . 1 1 117 117 HIS H H 117 8.340 8.340 8.728 -0.388 17934 1993 1 3 . 1 1 118 118 TYR N N 118 118.301 118.301 124.604 -6.303 17934 1994 1 3 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.707 0.303 17934 1995 1 3 . 1 1 118 118 TYR C C 118 173.530 173.530 174.344 -0.814 17934 1996 1 3 . 1 1 118 118 TYR CA C 118 56.730 56.730 57.944 -1.214 17934 1997 1 3 . 1 1 118 118 TYR CB C 118 43.240 43.240 40.578 2.662 17934 1998 1 3 . 1 1 118 118 TYR H H 118 9.080 9.080 8.436 0.644 17934 1999 1 3 . 1 1 119 119 CYS N N 119 121.015 121.015 124.337 -3.322 17934 2000 1 3 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.507 0.556 17934 2001 1 3 . 1 1 119 119 CYS C C 119 180.664 180.664 173.835 6.829 17934 2002 1 3 . 1 1 119 119 CYS CA C 119 56.726 56.726 58.238 -1.512 17934 2003 1 3 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.499 1.040 17934 2004 1 3 . 1 1 119 119 CYS H H 119 9.120 9.120 9.004 0.116 17934 2005 1 3 . 1 1 120 120 HIS N N 120 110.134 110.134 128.763 -18.629 17934 2006 1 3 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.865 -0.166 17934 2007 1 3 . 1 1 120 120 HIS C C 120 180.776 180.776 173.492 7.284 17934 2008 1 3 . 1 1 120 120 HIS CA C 120 55.320 55.320 55.446 -0.126 17934 2009 1 3 . 1 1 120 120 HIS CB C 120 32.352 32.352 32.352 -0.000 17934 2010 1 3 . 1 1 120 120 HIS H H 120 8.482 8.482 9.181 -0.699 17934 2011 1 3 . 1 1 121 121 VAL N N 121 120.855 120.855 125.061 -4.206 17934 2012 1 3 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.553 -0.203 17934 2013 1 3 . 1 1 121 121 VAL C C 121 173.419 173.419 173.155 0.264 17934 2014 1 3 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.773 0.637 17934 2015 1 3 . 1 1 121 121 VAL CB C 121 33.280 33.280 34.324 -1.044 17934 2016 1 3 . 1 1 121 121 VAL H H 121 7.929 7.929 9.036 -1.107 17934 2017 1 3 . 1 1 122 122 PHE N N 122 124.384 124.384 128.191 -3.807 17934 2018 1 3 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.036 0.384 17934 2019 1 3 . 1 1 122 122 PHE C C 122 174.876 174.876 173.976 0.900 17934 2020 1 3 . 1 1 122 122 PHE CA C 122 55.320 55.320 56.312 -0.992 17934 2021 1 3 . 1 1 122 122 PHE CB C 122 44.540 44.540 43.627 0.913 17934 2022 1 3 . 1 1 122 122 PHE H H 122 8.910 8.910 9.304 -0.394 17934 2023 1 3 . 1 1 123 123 THR N N 123 112.451 112.451 116.136 -3.685 17934 2024 1 3 . 1 1 123 123 THR HA H 123 5.147 5.147 4.316 0.831 17934 2025 1 3 . 1 1 123 123 THR C C 123 174.096 174.096 172.690 1.406 17934 2026 1 3 . 1 1 123 123 THR CA C 123 61.843 61.843 59.360 2.483 17934 2027 1 3 . 1 1 123 123 THR CB C 123 71.218 71.218 70.573 0.645 17934 2028 1 3 . 1 1 123 123 THR H H 123 8.668 8.668 8.498 0.170 17934 2029 1 3 . 1 1 124 124 ALA N N 124 128.922 128.922 127.135 1.787 17934 2030 1 3 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.185 0.535 17934 2031 1 3 . 1 1 124 124 ALA C C 124 177.168 177.168 176.670 0.498 17934 2032 1 3 . 1 1 124 124 ALA CA C 124 50.890 50.890 49.572 1.317 17934 2033 1 3 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.111 -0.011 17934 2034 1 3 . 1 1 124 124 ALA H H 124 9.180 9.180 8.147 1.033 17934 2035 1 3 . 1 1 125 125 PHE N N 125 115.427 115.427 116.452 -1.025 17934 2036 1 3 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.509 -0.219 17934 2037 1 3 . 1 1 125 125 PHE C C 125 174.703 174.703 176.023 -1.320 17934 2038 1 3 . 1 1 125 125 PHE CA C 125 60.470 60.470 58.302 2.168 17934 2039 1 3 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.246 -1.186 17934 2040 1 3 . 1 1 125 125 PHE H H 125 8.560 8.560 8.081 0.479 17934 2041 1 3 . 1 1 126 126 ASP N N 126 115.745 115.745 119.807 -4.062 17934 2042 1 3 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.881 -0.038 17934 2043 1 3 . 1 1 126 126 ASP C C 126 176.532 176.532 176.279 0.253 17934 2044 1 3 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.691 -0.246 17934 2045 1 3 . 1 1 126 126 ASP CB C 126 44.070 44.070 43.843 0.227 17934 2046 1 3 . 1 1 126 126 ASP H H 126 7.417 7.417 7.728 -0.311 17934 2047 1 3 . 1 1 127 127 VAL N N 127 121.923 121.923 124.224 -2.301 17934 2048 1 3 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.736 -0.146 17934 2049 1 3 . 1 1 127 127 VAL C C 127 176.863 176.863 177.062 -0.199 17934 2050 1 3 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.152 -0.522 17934 2051 1 3 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.317 -0.487 17934 2052 1 3 . 1 1 127 127 VAL H H 127 8.508 8.508 8.758 -0.250 17934 2053 1 3 . 1 1 128 128 ASN N N 128 118.851 118.851 119.457 -0.606 17934 2054 1 3 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.499 -0.023 17934 2055 1 3 . 1 1 128 128 ASN C C 128 178.251 178.251 177.470 0.781 17934 2056 1 3 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.064 0.194 17934 2057 1 3 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.059 -0.082 17934 2058 1 3 . 1 1 128 128 ASN H H 128 8.207 8.207 8.338 -0.131 17934 2059 1 3 . 1 1 129 129 LEU N N 129 122.549 122.549 119.689 2.860 17934 2060 1 3 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.602 0.608 17934 2061 1 3 . 1 1 129 129 LEU C C 129 178.003 178.003 178.111 -0.108 17934 2062 1 3 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.135 0.055 17934 2063 1 3 . 1 1 129 129 LEU CB C 129 41.790 41.790 41.315 0.475 17934 2064 1 3 . 1 1 129 129 LEU H H 129 8.223 8.223 8.037 0.186 17934 2065 1 3 . 1 1 130 130 ALA N N 130 120.036 120.036 122.199 -2.163 17934 2066 1 3 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.962 -0.652 17934 2067 1 3 . 1 1 130 130 ALA C C 130 178.172 178.172 179.044 -0.872 17934 2068 1 3 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.245 0.535 17934 2069 1 3 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.053 1.017 17934 2070 1 3 . 1 1 130 130 ALA H H 130 7.360 7.360 7.997 -0.637 17934 2071 1 3 . 1 1 131 131 ALA N N 131 116.989 116.989 119.869 -2.880 17934 2072 1 3 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.856 -0.146 17934 2073 1 3 . 1 1 131 131 ALA C C 131 180.163 180.163 179.631 0.532 17934 2074 1 3 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.962 0.818 17934 2075 1 3 . 1 1 131 131 ALA CB C 131 17.830 17.830 17.896 -0.066 17934 2076 1 3 . 1 1 131 131 ALA H H 131 7.360 7.360 8.073 -0.713 17934 2077 1 3 . 1 1 132 132 GLU N N 132 119.462 119.462 119.218 0.244 17934 2078 1 3 . 1 1 132 132 GLU HA H 132 3.888 3.888 4.067 -0.179 17934 2079 1 3 . 1 1 132 132 GLU C C 132 179.243 179.243 178.956 0.287 17934 2080 1 3 . 1 1 132 132 GLU CA C 132 59.539 59.539 58.785 0.755 17934 2081 1 3 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.451 0.088 17934 2082 1 3 . 1 1 132 132 GLU H H 132 7.673 7.673 7.937 -0.264 17934 2083 1 3 . 1 1 133 133 ILE N N 133 123.218 123.218 121.302 1.916 17934 2084 1 3 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.718 -0.938 17934 2085 1 3 . 1 1 133 133 ILE C C 133 177.421 177.421 178.140 -0.719 17934 2086 1 3 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.337 1.153 17934 2087 1 3 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.952 -1.302 17934 2088 1 3 . 1 1 133 133 ILE H H 133 8.154 8.154 8.141 0.013 17934 2089 1 3 . 1 1 134 134 ILE N N 134 118.244 118.244 119.762 -1.518 17934 2090 1 3 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.417 0.123 17934 2091 1 3 . 1 1 134 134 ILE C C 134 179.385 179.385 177.665 1.720 17934 2092 1 3 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.711 -1.431 17934 2093 1 3 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.797 -0.697 17934 2094 1 3 . 1 1 134 134 ILE H H 134 7.376 7.376 7.959 -0.583 17934 2095 1 3 . 1 1 135 135 LEU N N 135 123.061 123.061 121.039 2.022 17934 2096 1 3 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.838 0.352 17934 2097 1 3 . 1 1 135 135 LEU C C 135 179.858 179.858 178.988 0.870 17934 2098 1 3 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.830 -0.640 17934 2099 1 3 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.601 0.259 17934 2100 1 3 . 1 1 135 135 LEU H H 135 8.036 8.036 8.466 -0.429 17934 2101 1 3 . 1 1 136 136 THR N N 136 119.647 119.647 115.426 4.221 17934 2102 1 3 . 1 1 136 136 THR HA H 136 3.725 3.725 3.948 -0.223 17934 2103 1 3 . 1 1 136 136 THR C C 136 176.088 176.088 176.991 -0.903 17934 2104 1 3 . 1 1 136 136 THR CA C 136 58.601 58.601 66.408 -7.807 17934 2105 1 3 . 1 1 136 136 THR CB C 136 67.976 67.976 68.504 -0.528 17934 2106 1 3 . 1 1 136 136 THR H H 136 8.508 8.508 8.170 0.338 17934 2107 1 3 . 1 1 137 137 LEU N N 137 123.182 123.182 121.692 1.490 17934 2108 1 3 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.824 -0.084 17934 2109 1 3 . 1 1 137 137 LEU C C 137 178.341 178.341 178.921 -0.580 17934 2110 1 3 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.120 0.140 17934 2111 1 3 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.504 0.046 17934 2112 1 3 . 1 1 137 137 LEU H H 137 8.520 8.520 8.304 0.216 17934 2113 1 3 . 1 1 138 138 GLY N N 138 105.266 105.266 105.400 -0.134 17934 2114 1 3 . 1 1 138 138 GLY C C 138 176.973 176.973 176.035 0.938 17934 2115 1 3 . 1 1 138 138 GLY CA C 138 47.351 47.351 46.956 0.395 17934 2116 1 3 . 1 1 138 138 GLY H H 138 7.858 7.858 8.077 -0.219 17934 2117 1 3 . 1 1 139 139 GLN N N 139 123.485 123.485 122.029 1.456 17934 2118 1 3 . 1 1 139 139 GLN C C 139 177.891 177.891 178.370 -0.479 17934 2119 1 3 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.867 -0.266 17934 2120 1 3 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.611 -0.478 17934 2121 1 3 . 1 1 139 139 GLN H H 139 8.195 8.195 8.583 -0.388 17934 2122 1 3 . 1 1 140 140 ALA N N 140 122.754 122.754 120.626 2.128 17934 2123 1 3 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.236 -0.527 17934 2124 1 3 . 1 1 140 140 ALA C C 140 178.987 178.987 179.192 -0.205 17934 2125 1 3 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.530 1.250 17934 2126 1 3 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.350 -0.940 17934 2127 1 3 . 1 1 140 140 ALA H H 140 8.530 8.530 8.473 0.057 17934 2128 1 3 . 1 1 141 141 PHE N N 141 116.275 116.275 119.119 -2.844 17934 2129 1 3 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.320 -0.230 17934 2130 1 3 . 1 1 141 141 PHE C C 141 178.129 178.129 176.874 1.255 17934 2131 1 3 . 1 1 141 141 PHE CA C 141 61.240 61.240 60.199 1.041 17934 2132 1 3 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.350 0.033 17934 2133 1 3 . 1 1 141 141 PHE H H 141 7.920 7.920 8.073 -0.153 17934 2134 1 3 . 1 1 142 142 GLU N N 142 119.967 119.967 120.151 -0.184 17934 2135 1 3 . 1 1 142 142 GLU HA H 142 4.227 4.227 4.039 0.188 17934 2136 1 3 . 1 1 142 142 GLU C C 142 179.250 179.250 177.870 1.380 17934 2137 1 3 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.405 1.134 17934 2138 1 3 . 1 1 142 142 GLU CB C 142 29.539 29.539 30.715 -1.176 17934 2139 1 3 . 1 1 142 142 GLU H H 142 7.713 7.713 8.350 -0.637 17934 2140 1 3 . 1 1 143 143 VAL N N 143 120.189 120.189 118.872 1.317 17934 2141 1 3 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.795 -0.112 17934 2142 1 3 . 1 1 143 143 VAL C C 143 178.066 178.066 175.396 2.670 17934 2143 1 3 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.700 1.870 17934 2144 1 3 . 1 1 143 143 VAL CB C 143 31.883 31.883 32.285 -0.402 17934 2145 1 3 . 1 1 143 143 VAL H H 143 8.608 8.608 7.620 0.988 17934 2146 1 3 . 1 1 144 144 ALA N N 144 121.753 121.753 119.876 1.877 17934 2147 1 3 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.403 -0.403 17934 2148 1 3 . 1 1 144 144 ALA C C 144 180.776 180.776 176.042 4.734 17934 2149 1 3 . 1 1 144 144 ALA CA C 144 55.780 55.780 51.418 4.362 17934 2150 1 3 . 1 1 144 144 ALA CB C 144 18.770 18.770 19.348 -0.578 17934 2151 1 3 . 1 1 144 144 ALA H H 144 8.399 8.399 7.200 1.199 17934 2152 1 3 . 1 1 145 145 TYR N N 145 119.962 119.962 123.908 -3.946 17934 2153 1 3 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.200 -0.010 17934 2154 1 3 . 1 1 145 145 TYR C C 145 177.645 177.645 175.721 1.924 17934 2155 1 3 . 1 1 145 145 TYR CA C 145 60.880 60.880 60.795 0.085 17934 2156 1 3 . 1 1 145 145 TYR CB C 145 37.980 37.980 39.834 -1.854 17934 2157 1 3 . 1 1 145 145 TYR H H 145 8.190 8.190 8.787 -0.597 17934 2158 1 4 . 1 1 13 13 LYS N N 13 120.778 120.778 119.555 1.223 17934 2159 1 4 . 1 1 13 13 LYS C C 13 176.476 176.476 176.018 0.458 17934 2160 1 4 . 1 1 13 13 LYS CA C 13 58.601 58.601 57.238 1.363 17934 2161 1 4 . 1 1 13 13 LYS CB C 13 32.820 32.820 33.225 -0.405 17934 2162 1 4 . 1 1 13 13 LYS H H 13 7.984 7.984 8.385 -0.401 17934 2163 1 4 . 1 1 15 15 ILE HA H 15 3.820 3.820 4.027 -0.207 17934 2164 1 4 . 1 1 15 15 ILE C C 15 176.376 176.376 175.647 0.729 17934 2165 1 4 . 1 1 15 15 ILE CA C 15 63.570 63.570 61.936 1.634 17934 2166 1 4 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.291 2.088 17934 2167 1 4 . 1 1 16 16 ALA N N 16 121.364 121.364 121.839 -0.475 17934 2168 1 4 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.449 -0.011 17934 2169 1 4 . 1 1 16 16 ALA C C 16 177.494 177.494 177.609 -0.115 17934 2170 1 4 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.685 0.291 17934 2171 1 4 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.345 0.988 17934 2172 1 4 . 1 1 16 16 ALA H H 16 8.081 8.081 7.815 0.266 17934 2173 1 4 . 1 1 17 17 GLN N N 17 118.109 118.109 116.763 1.346 17934 2174 1 4 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.472 0.101 17934 2175 1 4 . 1 1 17 17 GLN C C 17 173.632 173.632 174.502 -0.870 17934 2176 1 4 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.253 -0.402 17934 2177 1 4 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.441 0.036 17934 2178 1 4 . 1 1 17 17 GLN H H 17 7.550 7.550 8.163 -0.613 17934 2179 1 4 . 1 1 18 18 SER N N 18 112.384 112.384 114.068 -1.684 17934 2180 1 4 . 1 1 18 18 SER HA H 18 4.388 4.388 4.835 -0.447 17934 2181 1 4 . 1 1 18 18 SER C C 18 173.780 173.780 172.749 1.031 17934 2182 1 4 . 1 1 18 18 SER CA C 18 57.664 57.664 57.252 0.412 17934 2183 1 4 . 1 1 18 18 SER CB C 18 65.164 65.164 65.358 -0.194 17934 2184 1 4 . 1 1 18 18 SER H H 18 7.666 7.666 8.076 -0.410 17934 2185 1 4 . 1 1 19 19 CYS N N 19 120.116 120.116 122.972 -2.856 17934 2186 1 4 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.606 -0.276 17934 2187 1 4 . 1 1 19 19 CYS C C 19 180.387 180.387 173.285 7.102 17934 2188 1 4 . 1 1 19 19 CYS CA C 19 58.601 58.601 57.959 0.642 17934 2189 1 4 . 1 1 19 19 CYS CB C 19 30.008 30.008 29.978 0.030 17934 2190 1 4 . 1 1 19 19 CYS H H 19 8.835 8.835 8.795 0.040 17934 2191 1 4 . 1 1 20 20 ASP N N 20 124.416 124.416 122.000 2.416 17934 2192 1 4 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.273 -0.297 17934 2193 1 4 . 1 1 20 20 ASP CB C 20 42.195 42.195 45.348 -3.153 17934 2194 1 4 . 1 1 20 20 ASP H H 20 7.847 7.847 7.990 -0.143 17934 2195 1 4 . 1 1 21 21 TYR N N 21 121.296 121.296 119.191 2.105 17934 2196 1 4 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.645 0.085 17934 2197 1 4 . 1 1 21 21 TYR C C 21 175.793 175.793 174.638 1.155 17934 2198 1 4 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.586 0.614 17934 2199 1 4 . 1 1 21 21 TYR CB C 21 43.240 43.240 42.979 0.261 17934 2200 1 4 . 1 1 21 21 TYR H H 21 9.070 9.070 8.737 0.333 17934 2201 1 4 . 1 1 22 22 LYS N N 22 122.820 122.820 123.074 -0.254 17934 2202 1 4 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.159 0.033 17934 2203 1 4 . 1 1 22 22 LYS C C 22 175.793 175.793 175.910 -0.117 17934 2204 1 4 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.447 0.811 17934 2205 1 4 . 1 1 22 22 LYS CB C 22 33.758 33.758 31.950 1.808 17934 2206 1 4 . 1 1 22 22 LYS H H 22 8.711 8.711 8.629 0.082 17934 2207 1 4 . 1 1 23 23 ALA N N 23 123.073 123.073 127.066 -3.993 17934 2208 1 4 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.164 0.566 17934 2209 1 4 . 1 1 23 23 ALA C C 23 174.515 174.515 175.372 -0.857 17934 2210 1 4 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.080 1.490 17934 2211 1 4 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.477 -0.849 17934 2212 1 4 . 1 1 23 23 ALA H H 23 8.727 8.727 8.548 0.179 17934 2213 1 4 . 1 1 24 24 ALA N N 24 122.486 122.486 121.999 0.487 17934 2214 1 4 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.559 0.622 17934 2215 1 4 . 1 1 24 24 ALA C C 24 176.835 176.835 176.053 0.782 17934 2216 1 4 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.646 -0.076 17934 2217 1 4 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.233 -0.112 17934 2218 1 4 . 1 1 24 24 ALA H H 24 8.675 8.675 8.590 0.085 17934 2219 1 4 . 1 1 25 25 TYR N N 25 122.698 122.698 126.070 -3.372 17934 2220 1 4 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.718 0.292 17934 2221 1 4 . 1 1 25 25 TYR CA C 25 54.340 54.340 56.030 -1.690 17934 2222 1 4 . 1 1 25 25 TYR CB C 25 39.850 39.850 37.989 1.861 17934 2223 1 4 . 1 1 25 25 TYR H H 25 8.270 8.270 8.538 -0.268 17934 2224 1 4 . 1 1 26 26 LEU N N 26 127.997 127.997 129.133 -1.136 17934 2225 1 4 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.060 -0.140 17934 2226 1 4 . 1 1 26 26 LEU C C 26 175.983 175.983 176.948 -0.965 17934 2227 1 4 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.461 0.265 17934 2228 1 4 . 1 1 26 26 LEU CB C 26 41.070 41.070 42.907 -1.837 17934 2229 1 4 . 1 1 26 26 LEU H H 26 8.700 8.700 8.346 0.354 17934 2230 1 4 . 1 1 27 27 GLY N N 27 102.901 102.901 101.274 1.627 17934 2231 1 4 . 1 1 27 27 GLY C C 27 176.219 176.219 171.708 4.511 17934 2232 1 4 . 1 1 27 27 GLY CA C 27 43.601 43.601 44.897 -1.296 17934 2233 1 4 . 1 1 27 27 GLY H H 27 5.891 5.891 7.907 -2.016 17934 2234 1 4 . 1 1 28 28 SER N N 28 111.551 111.551 114.166 -2.615 17934 2235 1 4 . 1 1 28 28 SER HA H 28 5.785 5.785 5.249 0.536 17934 2236 1 4 . 1 1 28 28 SER CA C 28 56.258 56.258 57.274 -1.016 17934 2237 1 4 . 1 1 28 28 SER CB C 28 65.632 65.632 66.545 -0.913 17934 2238 1 4 . 1 1 28 28 SER H H 28 7.981 7.981 8.271 -0.290 17934 2239 1 4 . 1 1 29 29 MET N N 29 119.493 119.493 120.500 -1.007 17934 2240 1 4 . 1 1 29 29 MET HA H 29 4.725 4.725 4.627 0.098 17934 2241 1 4 . 1 1 29 29 MET C C 29 174.143 174.143 173.830 0.313 17934 2242 1 4 . 1 1 29 29 MET CA C 29 54.036 54.036 53.926 0.110 17934 2243 1 4 . 1 1 29 29 MET CB C 29 37.268 37.268 36.600 0.668 17934 2244 1 4 . 1 1 29 29 MET H H 29 8.704 8.704 8.822 -0.118 17934 2245 1 4 . 1 1 30 30 LEU N N 30 128.150 128.150 122.589 5.561 17934 2246 1 4 . 1 1 30 30 LEU HA H 30 3.785 3.785 3.341 0.444 17934 2247 1 4 . 1 1 30 30 LEU C C 30 175.857 175.857 175.048 0.809 17934 2248 1 4 . 1 1 30 30 LEU CA C 30 56.250 56.250 54.352 1.898 17934 2249 1 4 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.288 1.372 17934 2250 1 4 . 1 1 30 30 LEU H H 30 8.630 8.630 8.163 0.467 17934 2251 1 4 . 1 1 31 31 ILE N N 31 127.723 127.723 128.607 -0.884 17934 2252 1 4 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.021 0.169 17934 2253 1 4 . 1 1 31 31 ILE C C 31 174.881 174.881 174.796 0.085 17934 2254 1 4 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.665 -2.005 17934 2255 1 4 . 1 1 31 31 ILE CB C 31 37.110 37.110 38.297 -1.187 17934 2256 1 4 . 1 1 31 31 ILE H H 31 8.560 8.560 8.238 0.322 17934 2257 1 4 . 1 1 32 32 LYS HA H 32 4.055 4.055 3.567 0.488 17934 2258 1 4 . 1 1 32 32 LYS C C 32 176.272 176.272 176.408 -0.136 17934 2259 1 4 . 1 1 32 32 LYS CA C 32 58.601 58.601 58.689 -0.088 17934 2260 1 4 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.799 0.021 17934 2261 1 4 . 1 1 33 33 GLU N N 33 118.638 118.638 118.700 -0.062 17934 2262 1 4 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.312 0.076 17934 2263 1 4 . 1 1 33 33 GLU C C 33 173.962 173.962 175.239 -1.277 17934 2264 1 4 . 1 1 33 33 GLU CA C 33 54.851 54.851 55.809 -0.958 17934 2265 1 4 . 1 1 33 33 GLU CB C 33 30.945 30.945 28.605 2.340 17934 2266 1 4 . 1 1 33 33 GLU H H 33 7.723 7.723 8.103 -0.380 17934 2267 1 4 . 1 1 34 34 LEU N N 34 126.535 126.535 122.491 4.044 17934 2268 1 4 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.847 -0.902 17934 2269 1 4 . 1 1 34 34 LEU C C 34 176.870 176.870 177.172 -0.302 17934 2270 1 4 . 1 1 34 34 LEU CA C 34 54.850 54.850 53.695 1.155 17934 2271 1 4 . 1 1 34 34 LEU CB C 34 41.720 41.720 43.111 -1.391 17934 2272 1 4 . 1 1 34 34 LEU H H 34 8.446 8.446 8.287 0.159 17934 2273 1 4 . 1 1 35 35 ARG N N 35 128.447 128.447 123.191 5.256 17934 2274 1 4 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.601 -0.046 17934 2275 1 4 . 1 1 35 35 ARG C C 35 176.110 176.110 176.670 -0.560 17934 2276 1 4 . 1 1 35 35 ARG CA C 35 54.851 54.851 55.044 -0.193 17934 2277 1 4 . 1 1 35 35 ARG CB C 35 30.477 30.477 29.027 1.450 17934 2278 1 4 . 1 1 35 35 ARG H H 35 8.680 8.680 8.703 -0.023 17934 2279 1 4 . 1 1 36 36 GLY N N 36 107.406 107.406 112.710 -5.304 17934 2280 1 4 . 1 1 36 36 GLY CA C 36 45.906 45.906 44.526 1.380 17934 2281 1 4 . 1 1 36 36 GLY H H 36 7.182 7.182 8.116 -0.934 17934 2282 1 4 . 1 1 37 37 THR HA H 37 4.060 4.060 4.111 -0.051 17934 2283 1 4 . 1 1 37 37 THR C C 37 176.634 176.634 175.932 0.702 17934 2284 1 4 . 1 1 37 37 THR CA C 37 65.632 65.632 63.602 2.030 17934 2285 1 4 . 1 1 37 37 THR CB C 37 68.445 68.445 68.890 -0.445 17934 2286 1 4 . 1 1 38 38 GLU N N 38 122.251 122.251 122.727 -0.476 17934 2287 1 4 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.921 0.205 17934 2288 1 4 . 1 1 38 38 GLU C C 38 179.981 179.981 178.175 1.806 17934 2289 1 4 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.421 0.587 17934 2290 1 4 . 1 1 38 38 GLU CB C 38 29.539 29.539 29.016 0.523 17934 2291 1 4 . 1 1 38 38 GLU H H 38 8.450 8.450 8.572 -0.122 17934 2292 1 4 . 1 1 39 39 SER N N 39 115.966 115.966 114.049 1.917 17934 2293 1 4 . 1 1 39 39 SER C C 39 175.991 175.991 176.282 -0.291 17934 2294 1 4 . 1 1 39 39 SER CA C 39 62.820 62.820 62.046 0.774 17934 2295 1 4 . 1 1 39 39 SER H H 39 7.522 7.522 7.710 -0.188 17934 2296 1 4 . 1 1 40 40 THR HA H 40 4.049 4.049 3.942 0.107 17934 2297 1 4 . 1 1 40 40 THR C C 40 175.972 175.972 176.828 -0.856 17934 2298 1 4 . 1 1 40 40 THR CA C 40 66.101 66.101 65.708 0.393 17934 2299 1 4 . 1 1 40 40 THR CB C 40 67.976 67.976 68.161 -0.185 17934 2300 1 4 . 1 1 41 41 GLN N N 41 120.354 120.354 120.226 0.128 17934 2301 1 4 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.066 -0.307 17934 2302 1 4 . 1 1 41 41 GLN C C 41 178.483 178.483 178.433 0.050 17934 2303 1 4 . 1 1 41 41 GLN CA C 41 60.476 60.476 58.759 1.717 17934 2304 1 4 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.421 -0.288 17934 2305 1 4 . 1 1 41 41 GLN H H 41 8.271 8.271 8.387 -0.116 17934 2306 1 4 . 1 1 42 42 ASP N N 42 120.757 120.757 121.395 -0.638 17934 2307 1 4 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.420 -0.061 17934 2308 1 4 . 1 1 42 42 ASP C C 42 177.480 177.480 177.830 -0.350 17934 2309 1 4 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.233 0.431 17934 2310 1 4 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.736 1.458 17934 2311 1 4 . 1 1 42 42 ASP H H 42 7.954 7.954 8.127 -0.173 17934 2312 1 4 . 1 1 43 43 ALA N N 43 120.587 120.587 122.022 -1.435 17934 2313 1 4 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.207 -0.217 17934 2314 1 4 . 1 1 43 43 ALA C C 43 179.767 179.767 179.392 0.375 17934 2315 1 4 . 1 1 43 43 ALA CA C 43 55.320 55.320 54.964 0.356 17934 2316 1 4 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.210 1.020 17934 2317 1 4 . 1 1 43 43 ALA H H 43 7.842 7.842 8.225 -0.383 17934 2318 1 4 . 1 1 44 44 CYS N N 44 115.428 115.428 117.616 -2.188 17934 2319 1 4 . 1 1 44 44 CYS HA H 44 3.895 3.895 3.996 -0.101 17934 2320 1 4 . 1 1 44 44 CYS C C 44 176.076 176.076 176.019 0.057 17934 2321 1 4 . 1 1 44 44 CYS CA C 44 64.695 64.695 62.618 2.077 17934 2322 1 4 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.969 -0.305 17934 2323 1 4 . 1 1 44 44 CYS H H 44 7.900 7.900 8.462 -0.562 17934 2324 1 4 . 1 1 45 45 ALA N N 45 120.487 120.487 122.141 -1.654 17934 2325 1 4 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.927 0.073 17934 2326 1 4 . 1 1 45 45 ALA C C 45 173.506 173.506 179.242 -5.736 17934 2327 1 4 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.183 0.137 17934 2328 1 4 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.308 -0.368 17934 2329 1 4 . 1 1 45 45 ALA H H 45 7.250 7.250 8.003 -0.753 17934 2330 1 4 . 1 1 46 46 LYS N N 46 119.267 119.267 118.740 0.527 17934 2331 1 4 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.898 0.049 17934 2332 1 4 . 1 1 46 46 LYS C C 46 179.561 179.561 178.904 0.657 17934 2333 1 4 . 1 1 46 46 LYS H H 46 8.102 8.102 8.131 -0.029 17934 2334 1 4 . 1 1 47 47 MET N N 47 118.009 118.009 118.805 -0.796 17934 2335 1 4 . 1 1 47 47 MET HA H 47 4.214 4.214 4.085 0.129 17934 2336 1 4 . 1 1 47 47 MET C C 47 179.526 179.526 178.117 1.409 17934 2337 1 4 . 1 1 47 47 MET CA C 47 57.195 57.195 59.471 -2.276 17934 2338 1 4 . 1 1 47 47 MET CB C 47 30.945 30.945 32.741 -1.796 17934 2339 1 4 . 1 1 47 47 MET H H 47 8.585 8.585 8.006 0.579 17934 2340 1 4 . 1 1 48 48 ARG N N 48 119.962 119.962 119.534 0.428 17934 2341 1 4 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.968 -0.112 17934 2342 1 4 . 1 1 48 48 ARG C C 48 178.875 178.875 178.532 0.343 17934 2343 1 4 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.282 1.663 17934 2344 1 4 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.923 0.554 17934 2345 1 4 . 1 1 48 48 ARG H H 48 8.190 8.190 8.499 -0.309 17934 2346 1 4 . 1 1 49 49 ALA N N 49 120.640 120.640 121.703 -1.063 17934 2347 1 4 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.129 -0.386 17934 2348 1 4 . 1 1 49 49 ALA C C 49 180.169 180.169 178.989 1.180 17934 2349 1 4 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.818 0.033 17934 2350 1 4 . 1 1 49 49 ALA CB C 49 17.821 17.821 18.794 -0.973 17934 2351 1 4 . 1 1 49 49 ALA H H 49 7.671 7.671 8.321 -0.650 17934 2352 1 4 . 1 1 50 50 ASN N N 50 116.063 116.063 116.027 0.036 17934 2353 1 4 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.410 0.064 17934 2354 1 4 . 1 1 50 50 ASN C C 50 177.084 177.084 176.203 0.881 17934 2355 1 4 . 1 1 50 50 ASN CA C 50 55.789 55.789 56.080 -0.291 17934 2356 1 4 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.429 0.485 17934 2357 1 4 . 1 1 50 50 ASN H H 50 7.893 7.893 8.184 -0.291 17934 2358 1 4 . 1 1 51 51 CYS N N 51 116.884 116.884 116.873 0.011 17934 2359 1 4 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.371 -0.065 17934 2360 1 4 . 1 1 51 51 CYS C C 51 175.002 175.002 176.508 -1.506 17934 2361 1 4 . 1 1 51 51 CYS CA C 51 61.414 61.414 60.090 1.324 17934 2362 1 4 . 1 1 51 51 CYS CB C 51 27.664 27.664 28.273 -0.609 17934 2363 1 4 . 1 1 51 51 CYS H H 51 7.770 7.770 8.324 -0.554 17934 2364 1 4 . 1 1 52 52 GLN N N 52 117.831 117.831 119.255 -1.424 17934 2365 1 4 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.010 0.218 17934 2366 1 4 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.484 -1.758 17934 2367 1 4 . 1 1 52 52 GLN CB C 52 29.070 29.070 28.410 0.660 17934 2368 1 4 . 1 1 52 52 GLN H H 52 7.796 7.796 7.616 0.180 17934 2369 1 4 . 1 1 53 53 LYS N N 53 118.841 118.841 116.965 1.876 17934 2370 1 4 . 1 1 53 53 LYS CA C 53 57.195 57.195 57.860 -0.665 17934 2371 1 4 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.552 0.737 17934 2372 1 4 . 1 1 53 53 LYS H H 53 7.686 7.686 7.507 0.179 17934 2373 1 4 . 1 1 55 55 THR HA H 55 4.304 4.304 3.963 0.341 17934 2374 1 4 . 1 1 55 55 THR CA C 55 63.757 63.757 65.580 -1.823 17934 2375 1 4 . 1 1 55 55 THR CB C 55 68.914 68.914 68.489 0.425 17934 2376 1 4 . 1 1 56 56 GLU N N 56 120.861 120.861 119.738 1.123 17934 2377 1 4 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.068 0.079 17934 2378 1 4 . 1 1 56 56 GLU C C 56 177.656 177.656 178.495 -0.839 17934 2379 1 4 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.615 -0.482 17934 2380 1 4 . 1 1 56 56 GLU CB C 56 30.008 30.008 28.610 1.398 17934 2381 1 4 . 1 1 56 56 GLU H H 56 8.311 8.311 8.610 -0.299 17934 2382 1 4 . 1 1 57 57 GLN N N 57 118.397 118.397 118.167 0.230 17934 2383 1 4 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.088 0.054 17934 2384 1 4 . 1 1 57 57 GLN C C 57 177.275 177.275 177.176 0.099 17934 2385 1 4 . 1 1 57 57 GLN CA C 57 57.664 57.664 58.094 -0.430 17934 2386 1 4 . 1 1 57 57 GLN CB C 57 29.070 29.070 28.979 0.091 17934 2387 1 4 . 1 1 57 57 GLN H H 57 7.899 7.899 7.805 0.094 17934 2388 1 4 . 1 1 58 58 MET N N 58 118.897 118.897 113.551 5.346 17934 2389 1 4 . 1 1 58 58 MET HA H 58 4.350 4.350 4.358 -0.008 17934 2390 1 4 . 1 1 58 58 MET C C 58 177.172 177.172 175.365 1.807 17934 2391 1 4 . 1 1 58 58 MET CA C 58 56.726 56.726 56.450 0.276 17934 2392 1 4 . 1 1 58 58 MET CB C 58 32.196 32.196 33.015 -0.819 17934 2393 1 4 . 1 1 58 58 MET H H 58 8.036 8.036 7.497 0.539 17934 2394 1 4 . 1 1 59 59 LYS N N 59 119.779 119.779 120.611 -0.832 17934 2395 1 4 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.359 -0.128 17934 2396 1 4 . 1 1 59 59 LYS C C 59 176.676 176.676 175.756 0.920 17934 2397 1 4 . 1 1 59 59 LYS CA C 59 57.195 57.195 56.094 1.101 17934 2398 1 4 . 1 1 59 59 LYS CB C 59 32.820 32.820 33.492 -0.672 17934 2399 1 4 . 1 1 59 59 LYS H H 59 7.901 7.901 7.134 0.767 17934 2400 1 4 . 1 1 60 60 LYS N N 60 119.993 119.993 118.980 1.013 17934 2401 1 4 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.073 0.262 17934 2402 1 4 . 1 1 60 60 LYS C C 60 176.336 176.336 175.433 0.903 17934 2403 1 4 . 1 1 60 60 LYS CA C 60 56.258 56.258 56.785 -0.527 17934 2404 1 4 . 1 1 60 60 LYS CB C 60 32.820 32.820 31.148 1.672 17934 2405 1 4 . 1 1 60 60 LYS H H 60 7.877 7.877 8.514 -0.637 17934 2406 1 4 . 1 1 61 61 VAL N N 61 122.649 122.649 118.118 4.531 17934 2407 1 4 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.583 -0.203 17934 2408 1 4 . 1 1 61 61 VAL C C 61 174.210 174.210 173.815 0.395 17934 2409 1 4 . 1 1 61 61 VAL CA C 61 60.000 60.000 58.903 1.097 17934 2410 1 4 . 1 1 61 61 VAL CB C 61 32.350 32.350 32.700 -0.351 17934 2411 1 4 . 1 1 61 61 VAL H H 61 7.708 7.708 7.796 -0.088 17934 2412 1 4 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.722 -0.059 17934 2413 1 4 . 1 1 62 62 PRO C C 62 176.656 176.656 176.762 -0.106 17934 2414 1 4 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.642 0.178 17934 2415 1 4 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.076 -0.193 17934 2416 1 4 . 1 1 63 63 THR N N 63 117.155 117.155 119.529 -2.374 17934 2417 1 4 . 1 1 63 63 THR HA H 63 4.830 4.830 4.583 0.247 17934 2418 1 4 . 1 1 63 63 THR C C 63 174.682 174.682 173.908 0.774 17934 2419 1 4 . 1 1 63 63 THR CA C 63 62.820 62.820 63.731 -0.911 17934 2420 1 4 . 1 1 63 63 THR CB C 63 69.382 69.382 69.787 -0.405 17934 2421 1 4 . 1 1 63 63 THR H H 63 8.303 8.303 8.604 -0.301 17934 2422 1 4 . 1 1 64 64 ILE N N 64 121.004 121.004 121.365 -0.361 17934 2423 1 4 . 1 1 64 64 ILE CA C 64 58.600 58.600 59.096 -0.496 17934 2424 1 4 . 1 1 64 64 ILE CB C 64 42.690 42.690 41.906 0.784 17934 2425 1 4 . 1 1 64 64 ILE H H 64 9.348 9.348 8.855 0.493 17934 2426 1 4 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.149 0.591 17934 2427 1 4 . 1 1 65 65 ILE C C 65 175.378 175.378 174.644 0.734 17934 2428 1 4 . 1 1 65 65 ILE CA C 65 60.080 60.080 60.946 -0.866 17934 2429 1 4 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.411 1.339 17934 2430 1 4 . 1 1 66 66 LEU N N 66 110.343 110.343 129.998 -19.655 17934 2431 1 4 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.606 0.244 17934 2432 1 4 . 1 1 66 66 LEU C C 66 174.982 174.982 175.417 -0.435 17934 2433 1 4 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.431 -0.521 17934 2434 1 4 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.470 1.760 17934 2435 1 4 . 1 1 66 66 LEU H H 66 9.610 9.610 9.174 0.436 17934 2436 1 4 . 1 1 67 67 SER N N 67 120.990 120.990 119.819 1.171 17934 2437 1 4 . 1 1 67 67 SER HA H 67 5.405 5.405 4.828 0.577 17934 2438 1 4 . 1 1 67 67 SER C C 67 174.405 174.405 172.791 1.614 17934 2439 1 4 . 1 1 67 67 SER CA C 67 57.195 57.195 56.944 0.251 17934 2440 1 4 . 1 1 67 67 SER CB C 67 64.695 64.695 63.841 0.854 17934 2441 1 4 . 1 1 67 67 SER H H 67 9.260 9.260 8.616 0.644 17934 2442 1 4 . 1 1 68 68 VAL N N 68 128.176 128.176 127.746 0.430 17934 2443 1 4 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.301 0.192 17934 2444 1 4 . 1 1 68 68 VAL C C 68 173.891 173.891 173.312 0.579 17934 2445 1 4 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.752 1.598 17934 2446 1 4 . 1 1 68 68 VAL CB C 68 33.750 33.750 33.741 0.009 17934 2447 1 4 . 1 1 68 68 VAL H H 68 9.225 9.225 9.094 0.131 17934 2448 1 4 . 1 1 69 69 SER N N 69 121.697 121.697 124.456 -2.759 17934 2449 1 4 . 1 1 69 69 SER HA H 69 4.837 4.837 4.878 -0.041 17934 2450 1 4 . 1 1 69 69 SER C C 69 173.188 173.188 174.727 -1.539 17934 2451 1 4 . 1 1 69 69 SER CA C 69 57.195 57.195 56.366 0.829 17934 2452 1 4 . 1 1 69 69 SER CB C 69 67.976 67.976 65.795 2.181 17934 2453 1 4 . 1 1 69 69 SER H H 69 8.869 8.869 8.877 -0.008 17934 2454 1 4 . 1 1 70 70 ALA N N 70 118.689 118.689 126.219 -7.530 17934 2455 1 4 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.196 -0.046 17934 2456 1 4 . 1 1 70 70 ALA C C 70 176.714 176.714 177.438 -0.724 17934 2457 1 4 . 1 1 70 70 ALA CA C 70 53.910 53.910 53.831 0.079 17934 2458 1 4 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.845 -0.245 17934 2459 1 4 . 1 1 70 70 ALA H H 70 8.810 8.810 8.808 0.002 17934 2460 1 4 . 1 1 71 71 LYS N N 71 112.633 112.633 115.193 -2.560 17934 2461 1 4 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.429 -0.154 17934 2462 1 4 . 1 1 71 71 LYS C C 71 177.033 177.033 176.097 0.936 17934 2463 1 4 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.622 1.573 17934 2464 1 4 . 1 1 71 71 LYS CB C 71 33.289 33.289 32.853 0.436 17934 2465 1 4 . 1 1 71 71 LYS H H 71 7.830 7.830 8.019 -0.189 17934 2466 1 4 . 1 1 72 72 GLY N N 72 108.432 108.432 106.354 2.078 17934 2467 1 4 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.152 0.324 17934 2468 1 4 . 1 1 72 72 GLY H H 72 7.685 7.685 7.613 0.072 17934 2469 1 4 . 1 1 73 73 VAL N N 73 120.414 120.414 120.565 -0.151 17934 2470 1 4 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.700 0.300 17934 2471 1 4 . 1 1 73 73 VAL CA C 73 60.470 60.470 60.811 -0.341 17934 2472 1 4 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.441 0.189 17934 2473 1 4 . 1 1 73 73 VAL H H 73 8.620 8.620 7.839 0.781 17934 2474 1 4 . 1 1 74 74 LYS N N 74 125.257 125.257 124.333 0.924 17934 2475 1 4 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.641 0.375 17934 2476 1 4 . 1 1 74 74 LYS CA C 74 54.383 54.383 54.331 0.052 17934 2477 1 4 . 1 1 74 74 LYS CB C 74 36.570 36.570 35.904 0.666 17934 2478 1 4 . 1 1 74 74 LYS H H 74 8.783 8.783 8.546 0.237 17934 2479 1 4 . 1 1 75 75 PHE N N 75 119.414 119.414 117.813 1.601 17934 2480 1 4 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.413 0.287 17934 2481 1 4 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.242 -2.322 17934 2482 1 4 . 1 1 75 75 PHE CB C 75 40.610 40.610 42.569 -1.960 17934 2483 1 4 . 1 1 75 75 PHE H H 75 8.432 8.432 9.094 -0.662 17934 2484 1 4 . 1 1 76 76 ILE N N 76 121.430 121.430 119.955 1.475 17934 2485 1 4 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.958 -0.118 17934 2486 1 4 . 1 1 76 76 ILE C C 76 175.249 175.249 174.640 0.609 17934 2487 1 4 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.978 -0.908 17934 2488 1 4 . 1 1 76 76 ILE CB C 76 41.220 41.220 42.131 -0.911 17934 2489 1 4 . 1 1 76 76 ILE H H 76 8.960 8.960 9.027 -0.067 17934 2490 1 4 . 1 1 77 77 ASP N N 77 125.744 125.744 124.406 1.338 17934 2491 1 4 . 1 1 77 77 ASP HA H 77 4.563 4.563 5.084 -0.521 17934 2492 1 4 . 1 1 77 77 ASP C C 77 177.569 177.569 176.227 1.342 17934 2493 1 4 . 1 1 77 77 ASP CA C 77 55.789 55.789 53.460 2.329 17934 2494 1 4 . 1 1 77 77 ASP CB C 77 43.601 43.601 42.959 0.642 17934 2495 1 4 . 1 1 77 77 ASP H H 77 8.750 8.750 8.896 -0.146 17934 2496 1 4 . 1 1 78 78 ALA N N 78 128.632 128.632 126.854 1.778 17934 2497 1 4 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.235 -0.265 17934 2498 1 4 . 1 1 78 78 ALA C C 78 178.052 178.052 178.337 -0.285 17934 2499 1 4 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.226 0.604 17934 2500 1 4 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.614 0.179 17934 2501 1 4 . 1 1 78 78 ALA H H 78 8.700 8.700 8.828 -0.128 17934 2502 1 4 . 1 1 79 79 THR N N 79 113.087 113.087 114.092 -1.005 17934 2503 1 4 . 1 1 79 79 THR HA H 79 4.194 4.194 4.243 -0.049 17934 2504 1 4 . 1 1 79 79 THR C C 79 175.587 175.587 174.858 0.729 17934 2505 1 4 . 1 1 79 79 THR CA C 79 64.695 64.695 64.900 -0.205 17934 2506 1 4 . 1 1 79 79 THR CB C 79 69.382 69.382 69.112 0.270 17934 2507 1 4 . 1 1 79 79 THR H H 79 8.779 8.779 8.401 0.378 17934 2508 1 4 . 1 1 80 80 ASN N N 80 118.434 118.434 117.209 1.225 17934 2509 1 4 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.824 -0.087 17934 2510 1 4 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.415 1.030 17934 2511 1 4 . 1 1 80 80 ASN CB C 80 39.383 39.383 38.668 0.715 17934 2512 1 4 . 1 1 80 80 ASN H H 80 8.584 8.584 8.182 0.402 17934 2513 1 4 . 1 1 81 81 LYS N N 81 112.429 112.429 117.807 -5.378 17934 2514 1 4 . 1 1 81 81 LYS C C 81 174.909 174.909 175.439 -0.530 17934 2515 1 4 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.683 -0.019 17934 2516 1 4 . 1 1 81 81 LYS CB C 81 28.602 28.602 30.762 -2.159 17934 2517 1 4 . 1 1 81 81 LYS H H 81 7.966 7.966 8.248 -0.282 17934 2518 1 4 . 1 1 82 82 ASN N N 82 116.806 116.806 116.267 0.539 17934 2519 1 4 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.744 -0.154 17934 2520 1 4 . 1 1 82 82 ASN C C 82 174.999 174.999 173.923 1.076 17934 2521 1 4 . 1 1 82 82 ASN CA C 82 52.976 52.976 52.191 0.785 17934 2522 1 4 . 1 1 82 82 ASN CB C 82 38.445 38.445 41.071 -2.626 17934 2523 1 4 . 1 1 82 82 ASN H H 82 8.455 8.455 7.654 0.801 17934 2524 1 4 . 1 1 83 83 ILE N N 83 122.447 122.447 122.600 -0.153 17934 2525 1 4 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.210 -0.180 17934 2526 1 4 . 1 1 83 83 ILE C C 83 176.572 176.572 176.190 0.382 17934 2527 1 4 . 1 1 83 83 ILE CA C 83 62.350 62.350 60.345 2.005 17934 2528 1 4 . 1 1 83 83 ILE CB C 83 37.970 37.970 35.792 2.178 17934 2529 1 4 . 1 1 83 83 ILE H H 83 8.650 8.650 8.607 0.043 17934 2530 1 4 . 1 1 84 84 ILE N N 84 129.339 129.339 125.977 3.362 17934 2531 1 4 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.208 -0.288 17934 2532 1 4 . 1 1 84 84 ILE C C 84 175.873 175.873 176.189 -0.316 17934 2533 1 4 . 1 1 84 84 ILE CA C 84 62.810 62.810 60.471 2.339 17934 2534 1 4 . 1 1 84 84 ILE CB C 84 38.840 38.840 38.261 0.579 17934 2535 1 4 . 1 1 84 84 ILE H H 84 8.930 8.930 8.836 0.094 17934 2536 1 4 . 1 1 85 85 ALA N N 85 118.867 118.867 118.557 0.310 17934 2537 1 4 . 1 1 85 85 ALA C C 85 174.100 174.100 174.633 -0.533 17934 2538 1 4 . 1 1 85 85 ALA CA C 85 51.570 51.570 51.941 -0.371 17934 2539 1 4 . 1 1 85 85 ALA H H 85 7.048 7.048 8.010 -0.962 17934 2540 1 4 . 1 1 87 87 HIS HA H 87 5.154 5.154 5.063 0.091 17934 2541 1 4 . 1 1 87 87 HIS C C 87 174.986 174.986 173.556 1.430 17934 2542 1 4 . 1 1 87 87 HIS CB C 87 34.350 34.350 32.809 1.541 17934 2543 1 4 . 1 1 88 88 GLU N N 88 125.372 125.372 122.107 3.265 17934 2544 1 4 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.275 0.246 17934 2545 1 4 . 1 1 88 88 GLU C C 88 179.047 179.047 177.485 1.562 17934 2546 1 4 . 1 1 88 88 GLU CA C 88 56.726 56.726 56.819 -0.093 17934 2547 1 4 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.628 -0.151 17934 2548 1 4 . 1 1 88 88 GLU H H 88 9.106 9.106 8.851 0.255 17934 2549 1 4 . 1 1 89 89 ILE N N 89 124.132 124.132 122.923 1.209 17934 2550 1 4 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.859 0.160 17934 2551 1 4 . 1 1 89 89 ILE C C 89 176.095 176.095 177.894 -1.799 17934 2552 1 4 . 1 1 89 89 ILE CA C 89 62.351 62.351 65.797 -3.446 17934 2553 1 4 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.190 0.724 17934 2554 1 4 . 1 1 89 89 ILE H H 89 8.055 8.055 8.809 -0.754 17934 2555 1 4 . 1 1 90 90 ARG N N 90 116.949 116.949 114.476 2.473 17934 2556 1 4 . 1 1 90 90 ARG HA H 90 4.338 4.338 3.957 0.381 17934 2557 1 4 . 1 1 90 90 ARG C C 90 176.578 176.578 176.220 0.358 17934 2558 1 4 . 1 1 90 90 ARG CA C 90 57.664 57.664 57.843 -0.179 17934 2559 1 4 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.319 -0.249 17934 2560 1 4 . 1 1 90 90 ARG H H 90 8.045 8.045 8.546 -0.501 17934 2561 1 4 . 1 1 91 91 ASN N N 91 116.320 116.320 116.947 -0.627 17934 2562 1 4 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.797 0.356 17934 2563 1 4 . 1 1 91 91 ASN C C 91 174.595 174.595 175.820 -1.225 17934 2564 1 4 . 1 1 91 91 ASN CA C 91 52.508 52.508 53.580 -1.072 17934 2565 1 4 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.598 0.254 17934 2566 1 4 . 1 1 91 91 ASN H H 91 8.067 8.067 7.904 0.163 17934 2567 1 4 . 1 1 92 92 ILE N N 92 122.441 122.441 122.805 -0.364 17934 2568 1 4 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.934 1.139 17934 2569 1 4 . 1 1 92 92 ILE C C 92 175.229 175.229 176.392 -1.163 17934 2570 1 4 . 1 1 92 92 ILE CA C 92 61.880 61.880 63.032 -1.151 17934 2571 1 4 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.733 2.117 17934 2572 1 4 . 1 1 92 92 ILE H H 92 7.483 7.483 8.068 -0.585 17934 2573 1 4 . 1 1 93 93 SER N N 93 120.329 120.329 123.805 -3.476 17934 2574 1 4 . 1 1 93 93 SER HA H 93 4.684 4.684 4.297 0.387 17934 2575 1 4 . 1 1 93 93 SER C C 93 180.744 180.744 174.460 6.284 17934 2576 1 4 . 1 1 93 93 SER CA C 93 57.664 57.664 61.306 -3.642 17934 2577 1 4 . 1 1 93 93 SER CB C 93 66.570 66.570 63.825 2.744 17934 2578 1 4 . 1 1 93 93 SER H H 93 9.545 9.545 8.465 1.080 17934 2579 1 4 . 1 1 94 94 CYS N N 94 110.900 110.900 114.657 -3.757 17934 2580 1 4 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.483 -0.671 17934 2581 1 4 . 1 1 94 94 CYS C C 94 173.973 173.973 172.748 1.225 17934 2582 1 4 . 1 1 94 94 CYS CA C 94 59.539 59.539 58.103 1.436 17934 2583 1 4 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.482 -4.223 17934 2584 1 4 . 1 1 94 94 CYS H H 94 8.858 8.858 7.992 0.866 17934 2585 1 4 . 1 1 95 95 ALA N N 95 121.379 121.379 123.406 -2.027 17934 2586 1 4 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.634 -0.204 17934 2587 1 4 . 1 1 95 95 ALA C C 95 178.098 178.098 175.078 3.020 17934 2588 1 4 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.958 0.692 17934 2589 1 4 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.691 -2.391 17934 2590 1 4 . 1 1 95 95 ALA H H 95 8.360 8.360 8.246 0.114 17934 2591 1 4 . 1 1 96 96 ALA N N 96 122.576 122.576 121.699 0.877 17934 2592 1 4 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.666 0.014 17934 2593 1 4 . 1 1 96 96 ALA C C 96 175.716 175.716 174.559 1.157 17934 2594 1 4 . 1 1 96 96 ALA CA C 96 52.440 52.440 52.193 0.247 17934 2595 1 4 . 1 1 96 96 ALA CB C 96 22.700 22.700 21.724 0.976 17934 2596 1 4 . 1 1 96 96 ALA H H 96 9.080 9.080 9.000 0.080 17934 2597 1 4 . 1 1 97 97 GLN N N 97 116.903 116.903 120.457 -3.554 17934 2598 1 4 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.734 0.196 17934 2599 1 4 . 1 1 97 97 GLN C C 97 175.270 175.270 174.724 0.546 17934 2600 1 4 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.431 1.420 17934 2601 1 4 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.036 2.722 17934 2602 1 4 . 1 1 97 97 GLN H H 97 8.369 8.369 8.496 -0.127 17934 2603 1 4 . 1 1 98 98 ASP N N 98 124.971 124.971 121.544 3.427 17934 2604 1 4 . 1 1 98 98 ASP C C 98 175.217 175.217 175.894 -0.677 17934 2605 1 4 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.844 -0.805 17934 2606 1 4 . 1 1 98 98 ASP CB C 98 42.195 42.195 42.169 0.027 17934 2607 1 4 . 1 1 98 98 ASP H H 98 8.395 8.395 8.324 0.071 17934 2608 1 4 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.351 -0.117 17934 2609 1 4 . 1 1 99 99 PRO C C 99 178.433 178.433 177.620 0.813 17934 2610 1 4 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.787 -0.092 17934 2611 1 4 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.167 0.185 17934 2612 1 4 . 1 1 100 100 GLU N N 100 116.223 116.223 118.114 -1.891 17934 2613 1 4 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.159 0.061 17934 2614 1 4 . 1 1 100 100 GLU C C 100 176.678 176.678 176.049 0.629 17934 2615 1 4 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.002 -1.276 17934 2616 1 4 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.612 2.333 17934 2617 1 4 . 1 1 100 100 GLU H H 100 8.643 8.643 8.899 -0.256 17934 2618 1 4 . 1 1 101 101 ASP N N 101 119.053 119.053 118.806 0.247 17934 2619 1 4 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.867 -0.324 17934 2620 1 4 . 1 1 101 101 ASP C C 101 174.771 174.771 176.222 -1.451 17934 2621 1 4 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.191 0.723 17934 2622 1 4 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.725 0.064 17934 2623 1 4 . 1 1 101 101 ASP H H 101 7.597 7.597 8.127 -0.530 17934 2624 1 4 . 1 1 102 102 LEU N N 102 123.986 123.986 122.173 1.813 17934 2625 1 4 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.306 0.084 17934 2626 1 4 . 1 1 102 102 LEU C C 102 177.141 177.141 177.693 -0.552 17934 2627 1 4 . 1 1 102 102 LEU CA C 102 57.660 57.660 56.626 1.034 17934 2628 1 4 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.893 0.767 17934 2629 1 4 . 1 1 102 102 LEU H H 102 8.534 8.534 7.634 0.900 17934 2630 1 4 . 1 1 103 103 SER N N 103 112.339 112.339 112.504 -0.165 17934 2631 1 4 . 1 1 103 103 SER HA H 103 4.290 4.290 4.418 -0.128 17934 2632 1 4 . 1 1 103 103 SER C C 103 174.106 174.106 174.604 -0.498 17934 2633 1 4 . 1 1 103 103 SER CA C 103 60.945 60.945 60.841 0.104 17934 2634 1 4 . 1 1 103 103 SER CB C 103 63.757 63.757 63.519 0.238 17934 2635 1 4 . 1 1 103 103 SER H H 103 7.867 7.867 8.415 -0.548 17934 2636 1 4 . 1 1 104 104 THR N N 104 123.070 123.070 115.987 7.083 17934 2637 1 4 . 1 1 104 104 THR HA H 104 5.373 5.373 4.517 0.856 17934 2638 1 4 . 1 1 104 104 THR C C 104 180.693 180.693 172.642 8.051 17934 2639 1 4 . 1 1 104 104 THR CA C 104 63.289 63.289 62.222 1.067 17934 2640 1 4 . 1 1 104 104 THR CB C 104 69.382 69.382 70.984 -1.602 17934 2641 1 4 . 1 1 104 104 THR H H 104 8.830 8.830 8.039 0.791 17934 2642 1 4 . 1 1 105 105 PHE N N 105 122.582 122.582 119.939 2.643 17934 2643 1 4 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.886 0.584 17934 2644 1 4 . 1 1 105 105 PHE C C 105 179.211 179.211 172.429 6.782 17934 2645 1 4 . 1 1 105 105 PHE CA C 105 55.320 55.320 56.116 -0.796 17934 2646 1 4 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.555 0.235 17934 2647 1 4 . 1 1 105 105 PHE H H 105 9.170 9.170 8.573 0.597 17934 2648 1 4 . 1 1 106 106 ALA N N 106 119.567 119.567 122.328 -2.761 17934 2649 1 4 . 1 1 106 106 ALA C C 106 175.603 175.603 175.029 0.574 17934 2650 1 4 . 1 1 106 106 ALA H H 106 8.770 8.770 9.264 -0.494 17934 2651 1 4 . 1 1 107 107 TYR N N 107 109.933 109.933 116.275 -6.342 17934 2652 1 4 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.379 -0.459 17934 2653 1 4 . 1 1 107 107 TYR C C 107 180.426 180.426 172.864 7.562 17934 2654 1 4 . 1 1 107 107 TYR CA C 107 57.080 57.080 55.743 1.337 17934 2655 1 4 . 1 1 107 107 TYR CB C 107 40.789 40.789 40.992 -0.203 17934 2656 1 4 . 1 1 107 107 TYR H H 107 7.950 7.950 9.367 -1.417 17934 2657 1 4 . 1 1 108 108 ILE N N 108 120.613 120.613 117.967 2.646 17934 2658 1 4 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.657 0.713 17934 2659 1 4 . 1 1 108 108 ILE C C 108 176.212 176.212 175.593 0.619 17934 2660 1 4 . 1 1 108 108 ILE CA C 108 59.540 59.540 58.873 0.667 17934 2661 1 4 . 1 1 108 108 ILE CB C 108 39.380 39.380 39.357 0.023 17934 2662 1 4 . 1 1 108 108 ILE H H 108 8.869 8.869 8.759 0.110 17934 2663 1 4 . 1 1 109 109 THR N N 109 116.505 116.505 114.372 2.133 17934 2664 1 4 . 1 1 109 109 THR HA H 109 5.669 5.669 4.557 1.112 17934 2665 1 4 . 1 1 109 109 THR C C 109 173.505 173.505 173.395 0.110 17934 2666 1 4 . 1 1 109 109 THR CA C 109 59.070 59.070 60.547 -1.477 17934 2667 1 4 . 1 1 109 109 THR H H 109 9.489 9.489 8.094 1.395 17934 2668 1 4 . 1 1 110 110 LYS N N 110 122.960 122.960 119.226 3.734 17934 2669 1 4 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.271 0.189 17934 2670 1 4 . 1 1 110 110 LYS C C 110 175.937 175.937 175.741 0.196 17934 2671 1 4 . 1 1 110 110 LYS CA C 110 55.789 55.789 56.547 -0.758 17934 2672 1 4 . 1 1 110 110 LYS CB C 110 34.227 34.227 33.406 0.821 17934 2673 1 4 . 1 1 110 110 LYS H H 110 7.831 7.831 8.252 -0.421 17934 2674 1 4 . 1 1 111 111 ASP N N 111 127.409 127.409 119.370 8.039 17934 2675 1 4 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.863 -0.082 17934 2676 1 4 . 1 1 111 111 ASP C C 111 176.396 176.396 178.231 -1.835 17934 2677 1 4 . 1 1 111 111 ASP CA C 111 53.914 53.914 53.130 0.784 17934 2678 1 4 . 1 1 111 111 ASP CB C 111 43.133 43.133 42.752 0.381 17934 2679 1 4 . 1 1 111 111 ASP H H 111 8.769 8.769 8.666 0.103 17934 2680 1 4 . 1 1 112 112 LEU N N 112 125.913 125.913 122.327 3.586 17934 2681 1 4 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.308 -0.158 17934 2682 1 4 . 1 1 112 112 LEU C C 112 178.553 178.553 176.974 1.579 17934 2683 1 4 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.201 -0.011 17934 2684 1 4 . 1 1 112 112 LEU CB C 112 41.790 41.790 42.054 -0.264 17934 2685 1 4 . 1 1 112 112 LEU H H 112 8.593 8.593 8.643 -0.050 17934 2686 1 4 . 1 1 113 113 LYS N N 113 117.189 117.189 118.390 -1.201 17934 2687 1 4 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.289 -0.027 17934 2688 1 4 . 1 1 113 113 LYS C C 113 177.180 177.180 175.412 1.768 17934 2689 1 4 . 1 1 113 113 LYS CA C 113 58.133 58.133 55.969 2.164 17934 2690 1 4 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.887 -0.067 17934 2691 1 4 . 1 1 113 113 LYS H H 113 8.207 8.207 7.994 0.213 17934 2692 1 4 . 1 1 114 114 SER N N 114 112.492 112.492 113.070 -0.578 17934 2693 1 4 . 1 1 114 114 SER CA C 114 58.601 58.601 58.786 -0.185 17934 2694 1 4 . 1 1 114 114 SER CB C 114 65.164 65.164 61.709 3.455 17934 2695 1 4 . 1 1 114 114 SER H H 114 7.755 7.755 7.966 -0.211 17934 2696 1 4 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.741 -0.352 17934 2697 1 4 . 1 1 115 115 ASN C C 115 174.203 174.203 175.233 -1.030 17934 2698 1 4 . 1 1 115 115 ASN CA C 115 54.383 54.383 53.796 0.587 17934 2699 1 4 . 1 1 115 115 ASN CB C 115 37.977 37.977 39.758 -1.781 17934 2700 1 4 . 1 1 116 116 HIS N N 116 116.822 116.822 115.786 1.036 17934 2701 1 4 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.746 0.184 17934 2702 1 4 . 1 1 116 116 HIS C C 116 173.898 173.898 173.711 0.187 17934 2703 1 4 . 1 1 116 116 HIS CA C 116 54.910 54.910 54.973 -0.063 17934 2704 1 4 . 1 1 116 116 HIS CB C 116 32.650 32.650 32.828 -0.178 17934 2705 1 4 . 1 1 116 116 HIS H H 116 7.690 7.690 8.110 -0.420 17934 2706 1 4 . 1 1 117 117 HIS N N 117 118.253 118.253 120.073 -1.820 17934 2707 1 4 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.697 0.623 17934 2708 1 4 . 1 1 117 117 HIS C C 117 173.695 173.695 173.913 -0.218 17934 2709 1 4 . 1 1 117 117 HIS CA C 117 56.350 56.350 56.126 0.224 17934 2710 1 4 . 1 1 117 117 HIS CB C 117 32.350 32.350 29.242 3.108 17934 2711 1 4 . 1 1 117 117 HIS H H 117 8.340 8.340 8.436 -0.096 17934 2712 1 4 . 1 1 118 118 TYR N N 118 118.301 118.301 126.689 -8.388 17934 2713 1 4 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.815 0.195 17934 2714 1 4 . 1 1 118 118 TYR C C 118 173.530 173.530 174.379 -0.849 17934 2715 1 4 . 1 1 118 118 TYR CA C 118 56.730 56.730 56.639 0.091 17934 2716 1 4 . 1 1 118 118 TYR CB C 118 43.240 43.240 41.552 1.688 17934 2717 1 4 . 1 1 118 118 TYR H H 118 9.080 9.080 8.412 0.668 17934 2718 1 4 . 1 1 119 119 CYS N N 119 121.015 121.015 122.189 -1.174 17934 2719 1 4 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.378 0.685 17934 2720 1 4 . 1 1 119 119 CYS C C 119 180.664 180.664 173.325 7.339 17934 2721 1 4 . 1 1 119 119 CYS CA C 119 56.726 56.726 56.343 0.383 17934 2722 1 4 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.560 0.979 17934 2723 1 4 . 1 1 119 119 CYS H H 119 9.120 9.120 8.921 0.199 17934 2724 1 4 . 1 1 120 120 HIS N N 120 110.134 110.134 124.985 -14.851 17934 2725 1 4 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.954 -0.255 17934 2726 1 4 . 1 1 120 120 HIS C C 120 180.776 180.776 174.068 6.708 17934 2727 1 4 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.732 0.588 17934 2728 1 4 . 1 1 120 120 HIS CB C 120 32.352 32.352 31.293 1.059 17934 2729 1 4 . 1 1 120 120 HIS H H 120 8.482 8.482 8.835 -0.353 17934 2730 1 4 . 1 1 121 121 VAL N N 121 120.855 120.855 122.668 -1.813 17934 2731 1 4 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.445 -0.095 17934 2732 1 4 . 1 1 121 121 VAL C C 121 173.419 173.419 173.052 0.367 17934 2733 1 4 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.943 0.467 17934 2734 1 4 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.513 -0.233 17934 2735 1 4 . 1 1 121 121 VAL H H 121 7.929 7.929 8.698 -0.769 17934 2736 1 4 . 1 1 122 122 PHE N N 122 124.384 124.384 127.665 -3.281 17934 2737 1 4 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.344 0.076 17934 2738 1 4 . 1 1 122 122 PHE C C 122 174.876 174.876 174.383 0.493 17934 2739 1 4 . 1 1 122 122 PHE CA C 122 55.320 55.320 56.225 -0.905 17934 2740 1 4 . 1 1 122 122 PHE CB C 122 44.540 44.540 43.669 0.871 17934 2741 1 4 . 1 1 122 122 PHE H H 122 8.910 8.910 9.176 -0.266 17934 2742 1 4 . 1 1 123 123 THR N N 123 112.451 112.451 113.723 -1.272 17934 2743 1 4 . 1 1 123 123 THR HA H 123 5.147 5.147 4.488 0.659 17934 2744 1 4 . 1 1 123 123 THR C C 123 174.096 174.096 172.271 1.825 17934 2745 1 4 . 1 1 123 123 THR CA C 123 61.843 61.843 59.640 2.203 17934 2746 1 4 . 1 1 123 123 THR CB C 123 71.218 71.218 70.879 0.339 17934 2747 1 4 . 1 1 123 123 THR H H 123 8.668 8.668 9.083 -0.415 17934 2748 1 4 . 1 1 124 124 ALA N N 124 128.922 128.922 126.675 2.247 17934 2749 1 4 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.395 0.325 17934 2750 1 4 . 1 1 124 124 ALA C C 124 177.168 177.168 176.474 0.694 17934 2751 1 4 . 1 1 124 124 ALA CA C 124 50.890 50.890 49.793 1.097 17934 2752 1 4 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.267 -0.167 17934 2753 1 4 . 1 1 124 124 ALA H H 124 9.180 9.180 8.625 0.555 17934 2754 1 4 . 1 1 125 125 PHE N N 125 115.427 115.427 115.872 -0.445 17934 2755 1 4 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.631 -0.341 17934 2756 1 4 . 1 1 125 125 PHE C C 125 174.703 174.703 175.900 -1.197 17934 2757 1 4 . 1 1 125 125 PHE CA C 125 60.470 60.470 57.637 2.833 17934 2758 1 4 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.179 -1.119 17934 2759 1 4 . 1 1 125 125 PHE H H 125 8.560 8.560 8.227 0.333 17934 2760 1 4 . 1 1 126 126 ASP N N 126 115.745 115.745 118.899 -3.154 17934 2761 1 4 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.963 -0.120 17934 2762 1 4 . 1 1 126 126 ASP C C 126 176.532 176.532 176.212 0.320 17934 2763 1 4 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.269 0.176 17934 2764 1 4 . 1 1 126 126 ASP CB C 126 44.070 44.070 44.323 -0.253 17934 2765 1 4 . 1 1 126 126 ASP H H 126 7.417 7.417 7.711 -0.294 17934 2766 1 4 . 1 1 127 127 VAL N N 127 121.923 121.923 123.047 -1.124 17934 2767 1 4 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.768 -0.178 17934 2768 1 4 . 1 1 127 127 VAL C C 127 176.863 176.863 177.131 -0.268 17934 2769 1 4 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.710 -1.080 17934 2770 1 4 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.208 -0.378 17934 2771 1 4 . 1 1 127 127 VAL H H 127 8.508 8.508 8.583 -0.075 17934 2772 1 4 . 1 1 128 128 ASN N N 128 118.851 118.851 118.001 0.850 17934 2773 1 4 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.357 0.119 17934 2774 1 4 . 1 1 128 128 ASN C C 128 178.251 178.251 177.341 0.910 17934 2775 1 4 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.178 0.080 17934 2776 1 4 . 1 1 128 128 ASN CB C 128 37.977 37.977 37.943 0.034 17934 2777 1 4 . 1 1 128 128 ASN H H 128 8.207 8.207 8.389 -0.182 17934 2778 1 4 . 1 1 129 129 LEU N N 129 122.549 122.549 119.151 3.398 17934 2779 1 4 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.963 0.247 17934 2780 1 4 . 1 1 129 129 LEU C C 129 178.003 178.003 178.275 -0.272 17934 2781 1 4 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.881 -0.691 17934 2782 1 4 . 1 1 129 129 LEU CB C 129 41.790 41.790 40.719 1.071 17934 2783 1 4 . 1 1 129 129 LEU H H 129 8.223 8.223 8.188 0.035 17934 2784 1 4 . 1 1 130 130 ALA N N 130 120.036 120.036 122.247 -2.211 17934 2785 1 4 . 1 1 130 130 ALA HA H 130 3.310 3.310 4.095 -0.785 17934 2786 1 4 . 1 1 130 130 ALA C C 130 178.172 178.172 179.102 -0.930 17934 2787 1 4 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.163 0.617 17934 2788 1 4 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.138 0.932 17934 2789 1 4 . 1 1 130 130 ALA H H 130 7.360 7.360 7.981 -0.621 17934 2790 1 4 . 1 1 131 131 ALA N N 131 116.989 116.989 120.230 -3.241 17934 2791 1 4 . 1 1 131 131 ALA HA H 131 3.710 3.710 4.335 -0.625 17934 2792 1 4 . 1 1 131 131 ALA C C 131 180.163 180.163 179.982 0.181 17934 2793 1 4 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.302 1.478 17934 2794 1 4 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.098 -0.268 17934 2795 1 4 . 1 1 131 131 ALA H H 131 7.360 7.360 8.484 -1.124 17934 2796 1 4 . 1 1 132 132 GLU N N 132 119.462 119.462 119.664 -0.202 17934 2797 1 4 . 1 1 132 132 GLU HA H 132 3.888 3.888 3.996 -0.108 17934 2798 1 4 . 1 1 132 132 GLU C C 132 179.243 179.243 178.641 0.602 17934 2799 1 4 . 1 1 132 132 GLU CA C 132 59.539 59.539 59.238 0.301 17934 2800 1 4 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.492 0.046 17934 2801 1 4 . 1 1 132 132 GLU H H 132 7.673 7.673 8.086 -0.413 17934 2802 1 4 . 1 1 133 133 ILE N N 133 123.218 123.218 120.754 2.464 17934 2803 1 4 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.360 -0.580 17934 2804 1 4 . 1 1 133 133 ILE C C 133 177.421 177.421 178.159 -0.738 17934 2805 1 4 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.151 1.339 17934 2806 1 4 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.483 -0.833 17934 2807 1 4 . 1 1 133 133 ILE H H 133 8.154 8.154 7.761 0.393 17934 2808 1 4 . 1 1 134 134 ILE N N 134 118.244 118.244 119.540 -1.296 17934 2809 1 4 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.373 0.167 17934 2810 1 4 . 1 1 134 134 ILE C C 134 179.385 179.385 177.646 1.739 17934 2811 1 4 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.003 -0.723 17934 2812 1 4 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.658 -0.558 17934 2813 1 4 . 1 1 134 134 ILE H H 134 7.376 7.376 7.854 -0.478 17934 2814 1 4 . 1 1 135 135 LEU N N 135 123.061 123.061 121.755 1.306 17934 2815 1 4 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.793 0.397 17934 2816 1 4 . 1 1 135 135 LEU C C 135 179.858 179.858 178.449 1.409 17934 2817 1 4 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.800 -0.610 17934 2818 1 4 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.706 0.154 17934 2819 1 4 . 1 1 135 135 LEU H H 135 8.036 8.036 8.336 -0.300 17934 2820 1 4 . 1 1 136 136 THR N N 136 119.647 119.647 114.929 4.718 17934 2821 1 4 . 1 1 136 136 THR HA H 136 3.725 3.725 3.978 -0.253 17934 2822 1 4 . 1 1 136 136 THR C C 136 176.088 176.088 176.692 -0.604 17934 2823 1 4 . 1 1 136 136 THR CA C 136 58.601 58.601 66.524 -7.923 17934 2824 1 4 . 1 1 136 136 THR CB C 136 67.976 67.976 68.599 -0.623 17934 2825 1 4 . 1 1 136 136 THR H H 136 8.508 8.508 8.269 0.239 17934 2826 1 4 . 1 1 137 137 LEU N N 137 123.182 123.182 121.570 1.612 17934 2827 1 4 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.801 -0.061 17934 2828 1 4 . 1 1 137 137 LEU C C 137 178.341 178.341 178.721 -0.380 17934 2829 1 4 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.189 0.071 17934 2830 1 4 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.493 0.057 17934 2831 1 4 . 1 1 137 137 LEU H H 137 8.520 8.520 8.288 0.232 17934 2832 1 4 . 1 1 138 138 GLY N N 138 105.266 105.266 105.402 -0.136 17934 2833 1 4 . 1 1 138 138 GLY C C 138 176.973 176.973 176.253 0.720 17934 2834 1 4 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.101 0.250 17934 2835 1 4 . 1 1 138 138 GLY H H 138 7.858 7.858 8.360 -0.502 17934 2836 1 4 . 1 1 139 139 GLN N N 139 123.485 123.485 121.104 2.381 17934 2837 1 4 . 1 1 139 139 GLN C C 139 177.891 177.891 178.754 -0.863 17934 2838 1 4 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.518 0.083 17934 2839 1 4 . 1 1 139 139 GLN CB C 139 28.133 28.133 27.970 0.163 17934 2840 1 4 . 1 1 139 139 GLN H H 139 8.195 8.195 8.576 -0.381 17934 2841 1 4 . 1 1 140 140 ALA N N 140 122.754 122.754 123.516 -0.762 17934 2842 1 4 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.114 -0.405 17934 2843 1 4 . 1 1 140 140 ALA C C 140 178.987 178.987 178.659 0.328 17934 2844 1 4 . 1 1 140 140 ALA CA C 140 55.780 55.780 55.020 0.760 17934 2845 1 4 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.545 -1.135 17934 2846 1 4 . 1 1 140 140 ALA H H 140 8.530 8.530 8.477 0.053 17934 2847 1 4 . 1 1 141 141 PHE N N 141 116.275 116.275 119.449 -3.174 17934 2848 1 4 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.270 -0.180 17934 2849 1 4 . 1 1 141 141 PHE C C 141 178.129 178.129 177.434 0.695 17934 2850 1 4 . 1 1 141 141 PHE CA C 141 61.240 61.240 60.711 0.529 17934 2851 1 4 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.020 0.363 17934 2852 1 4 . 1 1 141 141 PHE H H 141 7.920 7.920 8.537 -0.617 17934 2853 1 4 . 1 1 142 142 GLU N N 142 119.967 119.967 120.370 -0.403 17934 2854 1 4 . 1 1 142 142 GLU HA H 142 4.227 4.227 4.149 0.078 17934 2855 1 4 . 1 1 142 142 GLU C C 142 179.250 179.250 177.833 1.417 17934 2856 1 4 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.595 0.944 17934 2857 1 4 . 1 1 142 142 GLU CB C 142 29.539 29.539 30.239 -0.700 17934 2858 1 4 . 1 1 142 142 GLU H H 142 7.713 7.713 8.389 -0.676 17934 2859 1 4 . 1 1 143 143 VAL N N 143 120.189 120.189 120.066 0.123 17934 2860 1 4 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.782 -0.099 17934 2861 1 4 . 1 1 143 143 VAL C C 143 178.066 178.066 175.682 2.384 17934 2862 1 4 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.845 1.725 17934 2863 1 4 . 1 1 143 143 VAL CB C 143 31.883 31.883 32.433 -0.550 17934 2864 1 4 . 1 1 143 143 VAL H H 143 8.608 8.608 7.655 0.953 17934 2865 1 4 . 1 1 144 144 ALA N N 144 121.753 121.753 120.486 1.267 17934 2866 1 4 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.444 -0.444 17934 2867 1 4 . 1 1 144 144 ALA C C 144 180.776 180.776 175.462 5.314 17934 2868 1 4 . 1 1 144 144 ALA CA C 144 55.780 55.780 51.890 3.890 17934 2869 1 4 . 1 1 144 144 ALA CB C 144 18.770 18.770 18.988 -0.218 17934 2870 1 4 . 1 1 144 144 ALA H H 144 8.399 8.399 7.494 0.905 17934 2871 1 4 . 1 1 145 145 TYR N N 145 119.962 119.962 123.252 -3.290 17934 2872 1 4 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.483 -0.293 17934 2873 1 4 . 1 1 145 145 TYR C C 145 177.645 177.645 173.531 4.114 17934 2874 1 4 . 1 1 145 145 TYR CA C 145 60.880 60.880 57.510 3.370 17934 2875 1 4 . 1 1 145 145 TYR CB C 145 37.980 37.980 42.517 -4.537 17934 2876 1 4 . 1 1 145 145 TYR H H 145 8.190 8.190 8.469 -0.279 17934 2877 1 5 . 1 1 13 13 LYS N N 13 120.778 120.778 123.001 -2.223 17934 2878 1 5 . 1 1 13 13 LYS C C 13 176.476 176.476 175.560 0.916 17934 2879 1 5 . 1 1 13 13 LYS CA C 13 58.601 58.601 56.778 1.823 17934 2880 1 5 . 1 1 13 13 LYS CB C 13 32.820 32.820 32.376 0.444 17934 2881 1 5 . 1 1 13 13 LYS H H 13 7.984 7.984 8.448 -0.464 17934 2882 1 5 . 1 1 15 15 ILE HA H 15 3.820 3.820 4.088 -0.268 17934 2883 1 5 . 1 1 15 15 ILE C C 15 176.376 176.376 176.008 0.368 17934 2884 1 5 . 1 1 15 15 ILE CA C 15 63.570 63.570 61.676 1.894 17934 2885 1 5 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.748 1.632 17934 2886 1 5 . 1 1 16 16 ALA N N 16 121.364 121.364 120.717 0.647 17934 2887 1 5 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.534 -0.096 17934 2888 1 5 . 1 1 16 16 ALA C C 16 177.494 177.494 177.748 -0.254 17934 2889 1 5 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.611 0.365 17934 2890 1 5 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.609 0.724 17934 2891 1 5 . 1 1 16 16 ALA H H 16 8.081 8.081 7.728 0.353 17934 2892 1 5 . 1 1 17 17 GLN N N 17 118.109 118.109 115.842 2.267 17934 2893 1 5 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.441 0.132 17934 2894 1 5 . 1 1 17 17 GLN C C 17 173.632 173.632 174.301 -0.669 17934 2895 1 5 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.142 -0.291 17934 2896 1 5 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.750 -0.273 17934 2897 1 5 . 1 1 17 17 GLN H H 17 7.550 7.550 8.173 -0.623 17934 2898 1 5 . 1 1 18 18 SER N N 18 112.384 112.384 114.788 -2.404 17934 2899 1 5 . 1 1 18 18 SER HA H 18 4.388 4.388 5.171 -0.783 17934 2900 1 5 . 1 1 18 18 SER C C 18 173.780 173.780 172.538 1.242 17934 2901 1 5 . 1 1 18 18 SER CA C 18 57.664 57.664 57.733 -0.070 17934 2902 1 5 . 1 1 18 18 SER CB C 18 65.164 65.164 65.189 -0.025 17934 2903 1 5 . 1 1 18 18 SER H H 18 7.666 7.666 7.898 -0.232 17934 2904 1 5 . 1 1 19 19 CYS N N 19 120.116 120.116 123.676 -3.560 17934 2905 1 5 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.399 -0.069 17934 2906 1 5 . 1 1 19 19 CYS C C 19 180.387 180.387 173.765 6.622 17934 2907 1 5 . 1 1 19 19 CYS CA C 19 58.601 58.601 59.006 -0.405 17934 2908 1 5 . 1 1 19 19 CYS CB C 19 30.008 30.008 28.829 1.179 17934 2909 1 5 . 1 1 19 19 CYS H H 19 8.835 8.835 8.636 0.199 17934 2910 1 5 . 1 1 20 20 ASP N N 20 124.416 124.416 125.331 -0.915 17934 2911 1 5 . 1 1 20 20 ASP CA C 20 52.976 52.976 52.761 0.215 17934 2912 1 5 . 1 1 20 20 ASP CB C 20 42.195 42.195 42.834 -0.639 17934 2913 1 5 . 1 1 20 20 ASP H H 20 7.847 7.847 8.407 -0.560 17934 2914 1 5 . 1 1 21 21 TYR N N 21 121.296 121.296 124.394 -3.098 17934 2915 1 5 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.750 -0.020 17934 2916 1 5 . 1 1 21 21 TYR C C 21 175.793 175.793 174.682 1.111 17934 2917 1 5 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.137 1.063 17934 2918 1 5 . 1 1 21 21 TYR CB C 21 43.240 43.240 43.355 -0.115 17934 2919 1 5 . 1 1 21 21 TYR H H 21 9.070 9.070 8.561 0.509 17934 2920 1 5 . 1 1 22 22 LYS N N 22 122.820 122.820 120.634 2.186 17934 2921 1 5 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.281 -0.089 17934 2922 1 5 . 1 1 22 22 LYS C C 22 175.793 175.793 174.650 1.143 17934 2923 1 5 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.165 1.093 17934 2924 1 5 . 1 1 22 22 LYS CB C 22 33.758 33.758 33.840 -0.082 17934 2925 1 5 . 1 1 22 22 LYS H H 22 8.711 8.711 8.581 0.130 17934 2926 1 5 . 1 1 23 23 ALA N N 23 123.073 123.073 126.316 -3.243 17934 2927 1 5 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.677 0.053 17934 2928 1 5 . 1 1 23 23 ALA C C 23 174.515 174.515 175.213 -0.698 17934 2929 1 5 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.492 1.078 17934 2930 1 5 . 1 1 23 23 ALA CB C 23 21.628 21.628 23.144 -1.516 17934 2931 1 5 . 1 1 23 23 ALA H H 23 8.727 8.727 8.910 -0.183 17934 2932 1 5 . 1 1 24 24 ALA N N 24 122.486 122.486 126.785 -4.299 17934 2933 1 5 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.721 0.460 17934 2934 1 5 . 1 1 24 24 ALA C C 24 176.835 176.835 176.350 0.485 17934 2935 1 5 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.775 -0.205 17934 2936 1 5 . 1 1 24 24 ALA CB C 24 20.120 20.120 19.950 0.171 17934 2937 1 5 . 1 1 24 24 ALA H H 24 8.675 8.675 8.759 -0.084 17934 2938 1 5 . 1 1 25 25 TYR N N 25 122.698 122.698 125.467 -2.769 17934 2939 1 5 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.315 0.695 17934 2940 1 5 . 1 1 25 25 TYR CA C 25 54.340 54.340 56.056 -1.716 17934 2941 1 5 . 1 1 25 25 TYR CB C 25 39.850 39.850 37.710 2.140 17934 2942 1 5 . 1 1 25 25 TYR H H 25 8.270 8.270 8.417 -0.147 17934 2943 1 5 . 1 1 26 26 LEU N N 26 127.997 127.997 129.066 -1.069 17934 2944 1 5 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.013 -0.093 17934 2945 1 5 . 1 1 26 26 LEU C C 26 175.983 175.983 176.484 -0.501 17934 2946 1 5 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.066 0.661 17934 2947 1 5 . 1 1 26 26 LEU CB C 26 41.070 41.070 42.831 -1.761 17934 2948 1 5 . 1 1 26 26 LEU H H 26 8.700 8.700 7.780 0.920 17934 2949 1 5 . 1 1 27 27 GLY N N 27 102.901 102.901 102.318 0.583 17934 2950 1 5 . 1 1 27 27 GLY C C 27 176.219 176.219 171.180 5.039 17934 2951 1 5 . 1 1 27 27 GLY CA C 27 43.601 43.601 44.831 -1.230 17934 2952 1 5 . 1 1 27 27 GLY H H 27 5.891 5.891 7.736 -1.845 17934 2953 1 5 . 1 1 28 28 SER N N 28 111.551 111.551 113.523 -1.972 17934 2954 1 5 . 1 1 28 28 SER HA H 28 5.785 5.785 5.463 0.322 17934 2955 1 5 . 1 1 28 28 SER CA C 28 56.258 56.258 56.840 -0.582 17934 2956 1 5 . 1 1 28 28 SER CB C 28 65.632 65.632 66.130 -0.498 17934 2957 1 5 . 1 1 28 28 SER H H 28 7.981 7.981 8.220 -0.239 17934 2958 1 5 . 1 1 29 29 MET N N 29 119.493 119.493 121.129 -1.636 17934 2959 1 5 . 1 1 29 29 MET HA H 29 4.725 4.725 4.725 0.000 17934 2960 1 5 . 1 1 29 29 MET C C 29 174.143 174.143 174.082 0.061 17934 2961 1 5 . 1 1 29 29 MET CA C 29 54.036 54.036 54.159 -0.123 17934 2962 1 5 . 1 1 29 29 MET CB C 29 37.268 37.268 36.197 1.071 17934 2963 1 5 . 1 1 29 29 MET H H 29 8.704 8.704 8.887 -0.183 17934 2964 1 5 . 1 1 30 30 LEU N N 30 128.150 128.150 123.032 5.118 17934 2965 1 5 . 1 1 30 30 LEU HA H 30 3.785 3.785 3.664 0.120 17934 2966 1 5 . 1 1 30 30 LEU C C 30 175.857 175.857 175.121 0.736 17934 2967 1 5 . 1 1 30 30 LEU CA C 30 56.250 56.250 53.842 2.408 17934 2968 1 5 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.635 1.026 17934 2969 1 5 . 1 1 30 30 LEU H H 30 8.630 8.630 8.297 0.333 17934 2970 1 5 . 1 1 31 31 ILE N N 31 127.723 127.723 129.322 -1.599 17934 2971 1 5 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.152 0.038 17934 2972 1 5 . 1 1 31 31 ILE C C 31 174.881 174.881 175.050 -0.169 17934 2973 1 5 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.898 -2.237 17934 2974 1 5 . 1 1 31 31 ILE CB C 31 37.110 37.110 38.201 -1.091 17934 2975 1 5 . 1 1 31 31 ILE H H 31 8.560 8.560 8.528 0.032 17934 2976 1 5 . 1 1 32 32 LYS HA H 32 4.055 4.055 3.937 0.118 17934 2977 1 5 . 1 1 32 32 LYS C C 32 176.272 176.272 176.934 -0.662 17934 2978 1 5 . 1 1 32 32 LYS CA C 32 58.601 58.601 58.682 -0.081 17934 2979 1 5 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.975 -0.155 17934 2980 1 5 . 1 1 33 33 GLU N N 33 118.638 118.638 120.167 -1.529 17934 2981 1 5 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.165 0.223 17934 2982 1 5 . 1 1 33 33 GLU C C 33 173.962 173.962 175.213 -1.251 17934 2983 1 5 . 1 1 33 33 GLU CA C 33 54.851 54.851 55.702 -0.851 17934 2984 1 5 . 1 1 33 33 GLU CB C 33 30.945 30.945 28.968 1.977 17934 2985 1 5 . 1 1 33 33 GLU H H 33 7.723 7.723 8.186 -0.463 17934 2986 1 5 . 1 1 34 34 LEU N N 34 126.535 126.535 124.751 1.784 17934 2987 1 5 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.170 -0.225 17934 2988 1 5 . 1 1 34 34 LEU C C 34 176.870 176.870 177.285 -0.415 17934 2989 1 5 . 1 1 34 34 LEU CA C 34 54.850 54.850 54.930 -0.080 17934 2990 1 5 . 1 1 34 34 LEU CB C 34 41.720 41.720 41.747 -0.027 17934 2991 1 5 . 1 1 34 34 LEU H H 34 8.446 8.446 8.063 0.383 17934 2992 1 5 . 1 1 35 35 ARG N N 35 128.447 128.447 123.996 4.451 17934 2993 1 5 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.481 0.074 17934 2994 1 5 . 1 1 35 35 ARG C C 35 176.110 176.110 176.064 0.046 17934 2995 1 5 . 1 1 35 35 ARG CA C 35 54.851 54.851 54.766 0.085 17934 2996 1 5 . 1 1 35 35 ARG CB C 35 30.477 30.477 31.258 -0.780 17934 2997 1 5 . 1 1 35 35 ARG H H 35 8.680 8.680 8.500 0.180 17934 2998 1 5 . 1 1 36 36 GLY N N 36 107.406 107.406 112.872 -5.466 17934 2999 1 5 . 1 1 36 36 GLY CA C 36 45.906 45.906 45.816 0.090 17934 3000 1 5 . 1 1 36 36 GLY H H 36 7.182 7.182 8.363 -1.181 17934 3001 1 5 . 1 1 37 37 THR HA H 37 4.060 4.060 4.156 -0.096 17934 3002 1 5 . 1 1 37 37 THR C C 37 176.634 176.634 176.278 0.356 17934 3003 1 5 . 1 1 37 37 THR CA C 37 65.632 65.632 64.070 1.562 17934 3004 1 5 . 1 1 37 37 THR CB C 37 68.445 68.445 68.994 -0.549 17934 3005 1 5 . 1 1 38 38 GLU N N 38 122.251 122.251 122.258 -0.007 17934 3006 1 5 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.947 0.179 17934 3007 1 5 . 1 1 38 38 GLU C C 38 179.981 179.981 178.622 1.359 17934 3008 1 5 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.512 0.496 17934 3009 1 5 . 1 1 38 38 GLU CB C 38 29.539 29.539 28.850 0.689 17934 3010 1 5 . 1 1 38 38 GLU H H 38 8.450 8.450 8.431 0.019 17934 3011 1 5 . 1 1 39 39 SER N N 39 115.966 115.966 114.303 1.663 17934 3012 1 5 . 1 1 39 39 SER C C 39 175.991 175.991 176.555 -0.564 17934 3013 1 5 . 1 1 39 39 SER CA C 39 62.820 62.820 62.528 0.292 17934 3014 1 5 . 1 1 39 39 SER H H 39 7.522 7.522 7.780 -0.258 17934 3015 1 5 . 1 1 40 40 THR HA H 40 4.049 4.049 4.056 -0.007 17934 3016 1 5 . 1 1 40 40 THR C C 40 175.972 175.972 177.058 -1.086 17934 3017 1 5 . 1 1 40 40 THR CA C 40 66.101 66.101 65.156 0.945 17934 3018 1 5 . 1 1 40 40 THR CB C 40 67.976 67.976 68.501 -0.525 17934 3019 1 5 . 1 1 41 41 GLN N N 41 120.354 120.354 120.652 -0.298 17934 3020 1 5 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.019 -0.260 17934 3021 1 5 . 1 1 41 41 GLN C C 41 178.483 178.483 177.879 0.604 17934 3022 1 5 . 1 1 41 41 GLN CA C 41 60.476 60.476 58.923 1.553 17934 3023 1 5 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.538 -0.405 17934 3024 1 5 . 1 1 41 41 GLN H H 41 8.271 8.271 8.451 -0.180 17934 3025 1 5 . 1 1 42 42 ASP N N 42 120.757 120.757 121.047 -0.290 17934 3026 1 5 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.413 -0.054 17934 3027 1 5 . 1 1 42 42 ASP C C 42 177.480 177.480 178.096 -0.616 17934 3028 1 5 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.711 -0.047 17934 3029 1 5 . 1 1 42 42 ASP CB C 42 42.195 42.195 41.171 1.024 17934 3030 1 5 . 1 1 42 42 ASP H H 42 7.954 7.954 8.223 -0.269 17934 3031 1 5 . 1 1 43 43 ALA N N 43 120.587 120.587 122.485 -1.898 17934 3032 1 5 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.114 -0.124 17934 3033 1 5 . 1 1 43 43 ALA C C 43 179.767 179.767 179.820 -0.053 17934 3034 1 5 . 1 1 43 43 ALA CA C 43 55.320 55.320 55.197 0.123 17934 3035 1 5 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.337 0.893 17934 3036 1 5 . 1 1 43 43 ALA H H 43 7.842 7.842 8.285 -0.443 17934 3037 1 5 . 1 1 44 44 CYS N N 44 115.428 115.428 118.525 -3.097 17934 3038 1 5 . 1 1 44 44 CYS HA H 44 3.895 3.895 3.996 -0.101 17934 3039 1 5 . 1 1 44 44 CYS C C 44 176.076 176.076 176.315 -0.239 17934 3040 1 5 . 1 1 44 44 CYS CA C 44 64.695 64.695 63.730 0.965 17934 3041 1 5 . 1 1 44 44 CYS CB C 44 27.664 27.664 26.786 0.878 17934 3042 1 5 . 1 1 44 44 CYS H H 44 7.900 7.900 8.403 -0.503 17934 3043 1 5 . 1 1 45 45 ALA N N 45 120.487 120.487 121.440 -0.953 17934 3044 1 5 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.934 0.066 17934 3045 1 5 . 1 1 45 45 ALA C C 45 173.506 173.506 179.161 -5.655 17934 3046 1 5 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.327 -0.007 17934 3047 1 5 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.165 -0.225 17934 3048 1 5 . 1 1 45 45 ALA H H 45 7.250 7.250 8.111 -0.861 17934 3049 1 5 . 1 1 46 46 LYS N N 46 119.267 119.267 119.520 -0.253 17934 3050 1 5 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.928 0.019 17934 3051 1 5 . 1 1 46 46 LYS C C 46 179.561 179.561 178.668 0.893 17934 3052 1 5 . 1 1 46 46 LYS H H 46 8.102 8.102 8.095 0.007 17934 3053 1 5 . 1 1 47 47 MET N N 47 118.009 118.009 118.421 -0.412 17934 3054 1 5 . 1 1 47 47 MET HA H 47 4.214 4.214 4.068 0.146 17934 3055 1 5 . 1 1 47 47 MET C C 47 179.526 179.526 178.594 0.932 17934 3056 1 5 . 1 1 47 47 MET CA C 47 57.195 57.195 59.024 -1.829 17934 3057 1 5 . 1 1 47 47 MET CB C 47 30.945 30.945 32.732 -1.787 17934 3058 1 5 . 1 1 47 47 MET H H 47 8.585 8.585 8.006 0.579 17934 3059 1 5 . 1 1 48 48 ARG N N 48 119.962 119.962 118.173 1.789 17934 3060 1 5 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.913 -0.057 17934 3061 1 5 . 1 1 48 48 ARG C C 48 178.875 178.875 178.539 0.336 17934 3062 1 5 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.436 1.509 17934 3063 1 5 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.819 0.658 17934 3064 1 5 . 1 1 48 48 ARG H H 48 8.190 8.190 8.569 -0.379 17934 3065 1 5 . 1 1 49 49 ALA N N 49 120.640 120.640 122.529 -1.889 17934 3066 1 5 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.309 -0.566 17934 3067 1 5 . 1 1 49 49 ALA C C 49 180.169 180.169 179.160 1.009 17934 3068 1 5 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.806 0.045 17934 3069 1 5 . 1 1 49 49 ALA CB C 49 17.821 17.821 18.305 -0.484 17934 3070 1 5 . 1 1 49 49 ALA H H 49 7.671 7.671 8.406 -0.735 17934 3071 1 5 . 1 1 50 50 ASN N N 50 116.063 116.063 117.267 -1.204 17934 3072 1 5 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.434 0.040 17934 3073 1 5 . 1 1 50 50 ASN C C 50 177.084 177.084 177.501 -0.417 17934 3074 1 5 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.983 -0.195 17934 3075 1 5 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.570 0.344 17934 3076 1 5 . 1 1 50 50 ASN H H 50 7.893 7.893 8.100 -0.207 17934 3077 1 5 . 1 1 51 51 CYS N N 51 116.884 116.884 118.184 -1.300 17934 3078 1 5 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.139 0.167 17934 3079 1 5 . 1 1 51 51 CYS C C 51 175.002 175.002 175.441 -0.439 17934 3080 1 5 . 1 1 51 51 CYS CA C 51 61.414 61.414 62.075 -0.661 17934 3081 1 5 . 1 1 51 51 CYS CB C 51 27.664 27.664 28.705 -1.041 17934 3082 1 5 . 1 1 51 51 CYS H H 51 7.770 7.770 8.424 -0.654 17934 3083 1 5 . 1 1 52 52 GLN N N 52 117.831 117.831 117.225 0.606 17934 3084 1 5 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.087 0.141 17934 3085 1 5 . 1 1 52 52 GLN CA C 52 56.726 56.726 57.762 -1.036 17934 3086 1 5 . 1 1 52 52 GLN CB C 52 29.070 29.070 28.385 0.685 17934 3087 1 5 . 1 1 52 52 GLN H H 52 7.796 7.796 7.747 0.049 17934 3088 1 5 . 1 1 53 53 LYS N N 53 118.841 118.841 119.613 -0.772 17934 3089 1 5 . 1 1 53 53 LYS CA C 53 57.195 57.195 57.306 -0.111 17934 3090 1 5 . 1 1 53 53 LYS CB C 53 33.289 33.289 33.180 0.109 17934 3091 1 5 . 1 1 53 53 LYS H H 53 7.686 7.686 8.116 -0.430 17934 3092 1 5 . 1 1 55 55 THR HA H 55 4.304 4.304 4.010 0.294 17934 3093 1 5 . 1 1 55 55 THR CA C 55 63.757 63.757 64.832 -1.075 17934 3094 1 5 . 1 1 55 55 THR CB C 55 68.914 68.914 68.672 0.242 17934 3095 1 5 . 1 1 56 56 GLU N N 56 120.861 120.861 121.004 -0.143 17934 3096 1 5 . 1 1 56 56 GLU HA H 56 4.147 4.147 3.967 0.180 17934 3097 1 5 . 1 1 56 56 GLU C C 56 177.656 177.656 178.186 -0.530 17934 3098 1 5 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.990 -0.857 17934 3099 1 5 . 1 1 56 56 GLU CB C 56 30.008 30.008 29.235 0.773 17934 3100 1 5 . 1 1 56 56 GLU H H 56 8.311 8.311 7.922 0.389 17934 3101 1 5 . 1 1 57 57 GLN N N 57 118.397 118.397 116.590 1.807 17934 3102 1 5 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.210 -0.068 17934 3103 1 5 . 1 1 57 57 GLN C C 57 177.275 177.275 177.815 -0.540 17934 3104 1 5 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.567 0.097 17934 3105 1 5 . 1 1 57 57 GLN CB C 57 29.070 29.070 29.165 -0.095 17934 3106 1 5 . 1 1 57 57 GLN H H 57 7.899 7.899 7.862 0.037 17934 3107 1 5 . 1 1 58 58 MET N N 58 118.897 118.897 118.364 0.533 17934 3108 1 5 . 1 1 58 58 MET HA H 58 4.350 4.350 4.284 0.066 17934 3109 1 5 . 1 1 58 58 MET C C 58 177.172 177.172 177.251 -0.079 17934 3110 1 5 . 1 1 58 58 MET CA C 58 56.726 56.726 56.486 0.240 17934 3111 1 5 . 1 1 58 58 MET CB C 58 32.196 32.196 32.266 -0.070 17934 3112 1 5 . 1 1 58 58 MET H H 58 8.036 8.036 7.375 0.661 17934 3113 1 5 . 1 1 59 59 LYS N N 59 119.779 119.779 120.273 -0.494 17934 3114 1 5 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.027 0.204 17934 3115 1 5 . 1 1 59 59 LYS C C 59 176.676 176.676 176.715 -0.039 17934 3116 1 5 . 1 1 59 59 LYS CA C 59 57.195 57.195 58.234 -1.039 17934 3117 1 5 . 1 1 59 59 LYS CB C 59 32.820 32.820 32.400 0.420 17934 3118 1 5 . 1 1 59 59 LYS H H 59 7.901 7.901 7.995 -0.094 17934 3119 1 5 . 1 1 60 60 LYS N N 60 119.993 119.993 118.026 1.967 17934 3120 1 5 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.370 -0.035 17934 3121 1 5 . 1 1 60 60 LYS C C 60 176.336 176.336 174.759 1.577 17934 3122 1 5 . 1 1 60 60 LYS CA C 60 56.258 56.258 55.916 0.342 17934 3123 1 5 . 1 1 60 60 LYS CB C 60 32.820 32.820 33.350 -0.530 17934 3124 1 5 . 1 1 60 60 LYS H H 60 7.877 7.877 7.960 -0.083 17934 3125 1 5 . 1 1 61 61 VAL N N 61 122.649 122.649 121.623 1.026 17934 3126 1 5 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.481 -0.101 17934 3127 1 5 . 1 1 61 61 VAL C C 61 174.210 174.210 174.559 -0.349 17934 3128 1 5 . 1 1 61 61 VAL CA C 61 60.000 60.000 59.558 0.442 17934 3129 1 5 . 1 1 61 61 VAL CB C 61 32.350 32.350 33.004 -0.654 17934 3130 1 5 . 1 1 61 61 VAL H H 61 7.708 7.708 8.138 -0.430 17934 3131 1 5 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.632 0.031 17934 3132 1 5 . 1 1 62 62 PRO C C 62 176.656 176.656 176.101 0.555 17934 3133 1 5 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.744 0.076 17934 3134 1 5 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.575 -0.693 17934 3135 1 5 . 1 1 63 63 THR N N 63 117.155 117.155 116.764 0.391 17934 3136 1 5 . 1 1 63 63 THR HA H 63 4.830 4.830 4.638 0.192 17934 3137 1 5 . 1 1 63 63 THR C C 63 174.682 174.682 173.563 1.119 17934 3138 1 5 . 1 1 63 63 THR CA C 63 62.820 62.820 62.767 0.052 17934 3139 1 5 . 1 1 63 63 THR CB C 63 69.382 69.382 70.112 -0.730 17934 3140 1 5 . 1 1 63 63 THR H H 63 8.303 8.303 8.392 -0.089 17934 3141 1 5 . 1 1 64 64 ILE N N 64 121.004 121.004 125.748 -4.744 17934 3142 1 5 . 1 1 64 64 ILE CA C 64 58.600 58.600 58.090 0.510 17934 3143 1 5 . 1 1 64 64 ILE CB C 64 42.690 42.690 41.749 0.941 17934 3144 1 5 . 1 1 64 64 ILE H H 64 9.348 9.348 9.101 0.246 17934 3145 1 5 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.642 0.098 17934 3146 1 5 . 1 1 65 65 ILE C C 65 175.378 175.378 175.025 0.353 17934 3147 1 5 . 1 1 65 65 ILE CA C 65 60.080 60.080 60.340 -0.260 17934 3148 1 5 . 1 1 65 65 ILE CB C 65 38.750 38.750 38.338 0.412 17934 3149 1 5 . 1 1 66 66 LEU N N 66 110.343 110.343 129.200 -18.857 17934 3150 1 5 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.706 0.144 17934 3151 1 5 . 1 1 66 66 LEU C C 66 174.982 174.982 175.588 -0.606 17934 3152 1 5 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.252 -0.341 17934 3153 1 5 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.297 1.933 17934 3154 1 5 . 1 1 66 66 LEU H H 66 9.610 9.610 9.259 0.350 17934 3155 1 5 . 1 1 67 67 SER N N 67 120.990 120.990 119.716 1.274 17934 3156 1 5 . 1 1 67 67 SER HA H 67 5.405 5.405 4.845 0.560 17934 3157 1 5 . 1 1 67 67 SER C C 67 174.405 174.405 173.082 1.323 17934 3158 1 5 . 1 1 67 67 SER CA C 67 57.195 57.195 56.726 0.469 17934 3159 1 5 . 1 1 67 67 SER CB C 67 64.695 64.695 64.135 0.560 17934 3160 1 5 . 1 1 67 67 SER H H 67 9.260 9.260 8.773 0.487 17934 3161 1 5 . 1 1 68 68 VAL N N 68 128.176 128.176 126.780 1.396 17934 3162 1 5 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.217 0.276 17934 3163 1 5 . 1 1 68 68 VAL C C 68 173.891 173.891 173.531 0.360 17934 3164 1 5 . 1 1 68 68 VAL CA C 68 62.350 62.350 61.348 1.002 17934 3165 1 5 . 1 1 68 68 VAL CB C 68 33.750 33.750 33.774 -0.024 17934 3166 1 5 . 1 1 68 68 VAL H H 68 9.225 9.225 8.623 0.602 17934 3167 1 5 . 1 1 69 69 SER N N 69 121.697 121.697 123.874 -2.177 17934 3168 1 5 . 1 1 69 69 SER HA H 69 4.837 4.837 5.109 -0.272 17934 3169 1 5 . 1 1 69 69 SER C C 69 173.188 173.188 175.031 -1.843 17934 3170 1 5 . 1 1 69 69 SER CA C 69 57.195 57.195 55.532 1.663 17934 3171 1 5 . 1 1 69 69 SER CB C 69 67.976 67.976 65.167 2.809 17934 3172 1 5 . 1 1 69 69 SER H H 69 8.869 8.869 8.575 0.294 17934 3173 1 5 . 1 1 70 70 ALA N N 70 118.689 118.689 128.322 -9.633 17934 3174 1 5 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.146 0.004 17934 3175 1 5 . 1 1 70 70 ALA C C 70 176.714 176.714 177.338 -0.624 17934 3176 1 5 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.265 -0.355 17934 3177 1 5 . 1 1 70 70 ALA CB C 70 18.600 18.600 19.028 -0.428 17934 3178 1 5 . 1 1 70 70 ALA H H 70 8.810 8.810 8.408 0.402 17934 3179 1 5 . 1 1 71 71 LYS N N 71 112.633 112.633 113.551 -0.918 17934 3180 1 5 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.379 -0.104 17934 3181 1 5 . 1 1 71 71 LYS C C 71 177.033 177.033 176.264 0.769 17934 3182 1 5 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.693 1.502 17934 3183 1 5 . 1 1 71 71 LYS CB C 71 33.289 33.289 33.012 0.277 17934 3184 1 5 . 1 1 71 71 LYS H H 71 7.830 7.830 8.288 -0.458 17934 3185 1 5 . 1 1 72 72 GLY N N 72 108.432 108.432 106.301 2.131 17934 3186 1 5 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.088 0.388 17934 3187 1 5 . 1 1 72 72 GLY H H 72 7.685 7.685 7.748 -0.063 17934 3188 1 5 . 1 1 73 73 VAL N N 73 120.414 120.414 121.305 -0.891 17934 3189 1 5 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.628 0.372 17934 3190 1 5 . 1 1 73 73 VAL CA C 73 60.470 60.470 60.411 0.059 17934 3191 1 5 . 1 1 73 73 VAL CB C 73 35.630 35.630 34.615 1.015 17934 3192 1 5 . 1 1 73 73 VAL H H 73 8.620 8.620 8.101 0.519 17934 3193 1 5 . 1 1 74 74 LYS N N 74 125.257 125.257 125.876 -0.619 17934 3194 1 5 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.522 0.494 17934 3195 1 5 . 1 1 74 74 LYS CA C 74 54.383 54.383 54.103 0.280 17934 3196 1 5 . 1 1 74 74 LYS CB C 74 36.570 36.570 36.099 0.471 17934 3197 1 5 . 1 1 74 74 LYS H H 74 8.783 8.783 8.480 0.303 17934 3198 1 5 . 1 1 75 75 PHE N N 75 119.414 119.414 119.085 0.329 17934 3199 1 5 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.264 0.436 17934 3200 1 5 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.369 -2.449 17934 3201 1 5 . 1 1 75 75 PHE CB C 75 40.610 40.610 40.821 -0.211 17934 3202 1 5 . 1 1 75 75 PHE H H 75 8.432 8.432 8.838 -0.406 17934 3203 1 5 . 1 1 76 76 ILE N N 76 121.430 121.430 121.607 -0.177 17934 3204 1 5 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.570 0.270 17934 3205 1 5 . 1 1 76 76 ILE C C 76 175.249 175.249 174.486 0.763 17934 3206 1 5 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.731 -0.661 17934 3207 1 5 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.128 0.092 17934 3208 1 5 . 1 1 76 76 ILE H H 76 8.960 8.960 8.281 0.679 17934 3209 1 5 . 1 1 77 77 ASP N N 77 125.744 125.744 123.179 2.565 17934 3210 1 5 . 1 1 77 77 ASP HA H 77 4.563 4.563 5.040 -0.477 17934 3211 1 5 . 1 1 77 77 ASP C C 77 177.569 177.569 175.990 1.579 17934 3212 1 5 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.427 3.362 17934 3213 1 5 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.721 -0.120 17934 3214 1 5 . 1 1 77 77 ASP H H 77 8.750 8.750 8.192 0.558 17934 3215 1 5 . 1 1 78 78 ALA N N 78 128.632 128.632 128.563 0.069 17934 3216 1 5 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.280 -0.310 17934 3217 1 5 . 1 1 78 78 ALA C C 78 178.052 178.052 178.094 -0.042 17934 3218 1 5 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.090 0.740 17934 3219 1 5 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.411 0.382 17934 3220 1 5 . 1 1 78 78 ALA H H 78 8.700 8.700 8.764 -0.064 17934 3221 1 5 . 1 1 79 79 THR N N 79 113.087 113.087 113.331 -0.244 17934 3222 1 5 . 1 1 79 79 THR HA H 79 4.194 4.194 4.185 0.009 17934 3223 1 5 . 1 1 79 79 THR C C 79 175.587 175.587 175.733 -0.146 17934 3224 1 5 . 1 1 79 79 THR CA C 79 64.695 64.695 64.568 0.127 17934 3225 1 5 . 1 1 79 79 THR CB C 79 69.382 69.382 69.006 0.376 17934 3226 1 5 . 1 1 79 79 THR H H 79 8.779 8.779 8.004 0.775 17934 3227 1 5 . 1 1 80 80 ASN N N 80 118.434 118.434 117.027 1.407 17934 3228 1 5 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.856 -0.119 17934 3229 1 5 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.942 0.503 17934 3230 1 5 . 1 1 80 80 ASN CB C 80 39.383 39.383 39.299 0.084 17934 3231 1 5 . 1 1 80 80 ASN H H 80 8.584 8.584 8.010 0.574 17934 3232 1 5 . 1 1 81 81 LYS N N 81 112.429 112.429 115.164 -2.735 17934 3233 1 5 . 1 1 81 81 LYS C C 81 174.909 174.909 175.476 -0.567 17934 3234 1 5 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.476 0.188 17934 3235 1 5 . 1 1 81 81 LYS CB C 81 28.602 28.602 29.994 -1.392 17934 3236 1 5 . 1 1 81 81 LYS H H 81 7.966 7.966 8.293 -0.327 17934 3237 1 5 . 1 1 82 82 ASN N N 82 116.806 116.806 116.626 0.180 17934 3238 1 5 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.705 -0.115 17934 3239 1 5 . 1 1 82 82 ASN C C 82 174.999 174.999 174.032 0.967 17934 3240 1 5 . 1 1 82 82 ASN CA C 82 52.976 52.976 53.330 -0.354 17934 3241 1 5 . 1 1 82 82 ASN CB C 82 38.445 38.445 40.056 -1.611 17934 3242 1 5 . 1 1 82 82 ASN H H 82 8.455 8.455 8.184 0.271 17934 3243 1 5 . 1 1 83 83 ILE N N 83 122.447 122.447 117.960 4.487 17934 3244 1 5 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.421 -0.391 17934 3245 1 5 . 1 1 83 83 ILE C C 83 176.572 176.572 175.196 1.376 17934 3246 1 5 . 1 1 83 83 ILE CA C 83 62.350 62.350 60.338 2.012 17934 3247 1 5 . 1 1 83 83 ILE CB C 83 37.970 37.970 37.768 0.202 17934 3248 1 5 . 1 1 83 83 ILE H H 83 8.650 8.650 8.394 0.256 17934 3249 1 5 . 1 1 84 84 ILE N N 84 129.339 129.339 123.366 5.973 17934 3250 1 5 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.365 -0.445 17934 3251 1 5 . 1 1 84 84 ILE C C 84 175.873 175.873 176.230 -0.357 17934 3252 1 5 . 1 1 84 84 ILE CA C 84 62.810 62.810 60.946 1.864 17934 3253 1 5 . 1 1 84 84 ILE CB C 84 38.840 38.840 38.342 0.498 17934 3254 1 5 . 1 1 84 84 ILE H H 84 8.930 8.930 8.377 0.553 17934 3255 1 5 . 1 1 85 85 ALA N N 85 118.867 118.867 120.064 -1.197 17934 3256 1 5 . 1 1 85 85 ALA C C 85 174.100 174.100 175.031 -0.931 17934 3257 1 5 . 1 1 85 85 ALA CA C 85 51.570 51.570 51.457 0.113 17934 3258 1 5 . 1 1 85 85 ALA H H 85 7.048 7.048 8.061 -1.013 17934 3259 1 5 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.926 0.228 17934 3260 1 5 . 1 1 87 87 HIS C C 87 174.986 174.986 174.489 0.497 17934 3261 1 5 . 1 1 87 87 HIS CB C 87 34.350 34.350 31.537 2.813 17934 3262 1 5 . 1 1 88 88 GLU N N 88 125.372 125.372 121.498 3.874 17934 3263 1 5 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.282 0.239 17934 3264 1 5 . 1 1 88 88 GLU C C 88 179.047 179.047 178.059 0.988 17934 3265 1 5 . 1 1 88 88 GLU CA C 88 56.726 56.726 56.780 -0.054 17934 3266 1 5 . 1 1 88 88 GLU CB C 88 30.477 30.477 29.903 0.574 17934 3267 1 5 . 1 1 88 88 GLU H H 88 9.106 9.106 8.945 0.161 17934 3268 1 5 . 1 1 89 89 ILE N N 89 124.132 124.132 124.756 -0.624 17934 3269 1 5 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.816 0.203 17934 3270 1 5 . 1 1 89 89 ILE C C 89 176.095 176.095 177.272 -1.177 17934 3271 1 5 . 1 1 89 89 ILE CA C 89 62.351 62.351 65.668 -3.317 17934 3272 1 5 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.285 0.629 17934 3273 1 5 . 1 1 89 89 ILE H H 89 8.055 8.055 8.865 -0.810 17934 3274 1 5 . 1 1 90 90 ARG N N 90 116.949 116.949 115.822 1.127 17934 3275 1 5 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.235 0.103 17934 3276 1 5 . 1 1 90 90 ARG C C 90 176.578 176.578 176.588 -0.010 17934 3277 1 5 . 1 1 90 90 ARG CA C 90 57.664 57.664 57.468 0.196 17934 3278 1 5 . 1 1 90 90 ARG CB C 90 29.070 29.070 28.811 0.259 17934 3279 1 5 . 1 1 90 90 ARG H H 90 8.045 8.045 8.612 -0.567 17934 3280 1 5 . 1 1 91 91 ASN N N 91 116.320 116.320 117.024 -0.704 17934 3281 1 5 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.561 0.592 17934 3282 1 5 . 1 1 91 91 ASN C C 91 174.595 174.595 175.788 -1.193 17934 3283 1 5 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.222 -1.714 17934 3284 1 5 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.770 0.082 17934 3285 1 5 . 1 1 91 91 ASN H H 91 8.067 8.067 8.013 0.054 17934 3286 1 5 . 1 1 92 92 ILE N N 92 122.441 122.441 121.756 0.685 17934 3287 1 5 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.600 1.473 17934 3288 1 5 . 1 1 92 92 ILE C C 92 175.229 175.229 175.722 -0.493 17934 3289 1 5 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.685 -0.805 17934 3290 1 5 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.217 2.633 17934 3291 1 5 . 1 1 92 92 ILE H H 92 7.483 7.483 7.701 -0.218 17934 3292 1 5 . 1 1 93 93 SER N N 93 120.329 120.329 122.903 -2.574 17934 3293 1 5 . 1 1 93 93 SER HA H 93 4.684 4.684 4.161 0.523 17934 3294 1 5 . 1 1 93 93 SER C C 93 180.744 180.744 174.223 6.521 17934 3295 1 5 . 1 1 93 93 SER CA C 93 57.664 57.664 61.438 -3.774 17934 3296 1 5 . 1 1 93 93 SER CB C 93 66.570 66.570 63.900 2.670 17934 3297 1 5 . 1 1 93 93 SER H H 93 9.545 9.545 8.303 1.242 17934 3298 1 5 . 1 1 94 94 CYS N N 94 110.900 110.900 115.256 -4.356 17934 3299 1 5 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.543 -0.731 17934 3300 1 5 . 1 1 94 94 CYS C C 94 173.973 173.973 172.809 1.164 17934 3301 1 5 . 1 1 94 94 CYS CA C 94 59.539 59.539 57.268 2.271 17934 3302 1 5 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.647 -4.389 17934 3303 1 5 . 1 1 94 94 CYS H H 94 8.858 8.858 7.889 0.969 17934 3304 1 5 . 1 1 95 95 ALA N N 95 121.379 121.379 123.186 -1.807 17934 3305 1 5 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.671 -0.241 17934 3306 1 5 . 1 1 95 95 ALA C C 95 178.098 178.098 175.147 2.951 17934 3307 1 5 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.955 0.695 17934 3308 1 5 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.622 -2.322 17934 3309 1 5 . 1 1 95 95 ALA H H 95 8.360 8.360 8.466 -0.106 17934 3310 1 5 . 1 1 96 96 ALA N N 96 122.576 122.576 124.907 -2.331 17934 3311 1 5 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.757 -0.077 17934 3312 1 5 . 1 1 96 96 ALA C C 96 175.716 175.716 175.078 0.638 17934 3313 1 5 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.420 1.020 17934 3314 1 5 . 1 1 96 96 ALA CB C 96 22.700 22.700 22.426 0.274 17934 3315 1 5 . 1 1 96 96 ALA H H 96 9.080 9.080 8.608 0.472 17934 3316 1 5 . 1 1 97 97 GLN N N 97 116.903 116.903 119.338 -2.435 17934 3317 1 5 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.659 0.271 17934 3318 1 5 . 1 1 97 97 GLN C C 97 175.270 175.270 173.619 1.651 17934 3319 1 5 . 1 1 97 97 GLN CA C 97 54.851 54.851 54.422 0.429 17934 3320 1 5 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.910 1.848 17934 3321 1 5 . 1 1 97 97 GLN H H 97 8.369 8.369 8.271 0.098 17934 3322 1 5 . 1 1 98 98 ASP N N 98 124.971 124.971 121.931 3.040 17934 3323 1 5 . 1 1 98 98 ASP C C 98 175.217 175.217 176.195 -0.978 17934 3324 1 5 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.483 -0.444 17934 3325 1 5 . 1 1 98 98 ASP CB C 98 42.195 42.195 42.393 -0.198 17934 3326 1 5 . 1 1 98 98 ASP H H 98 8.395 8.395 8.268 0.127 17934 3327 1 5 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.340 -0.106 17934 3328 1 5 . 1 1 99 99 PRO C C 99 178.433 178.433 177.345 1.088 17934 3329 1 5 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.881 -0.186 17934 3330 1 5 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.040 0.312 17934 3331 1 5 . 1 1 100 100 GLU N N 100 116.223 116.223 118.597 -2.374 17934 3332 1 5 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.138 0.082 17934 3333 1 5 . 1 1 100 100 GLU C C 100 176.678 176.678 175.899 0.779 17934 3334 1 5 . 1 1 100 100 GLU CA C 100 56.726 56.726 57.953 -1.227 17934 3335 1 5 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.219 2.726 17934 3336 1 5 . 1 1 100 100 GLU H H 100 8.643 8.643 8.885 -0.242 17934 3337 1 5 . 1 1 101 101 ASP N N 101 119.053 119.053 119.810 -0.757 17934 3338 1 5 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.850 -0.307 17934 3339 1 5 . 1 1 101 101 ASP C C 101 174.771 174.771 176.431 -1.660 17934 3340 1 5 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.449 0.465 17934 3341 1 5 . 1 1 101 101 ASP CB C 101 40.789 40.789 41.247 -0.458 17934 3342 1 5 . 1 1 101 101 ASP H H 101 7.597 7.597 8.169 -0.572 17934 3343 1 5 . 1 1 102 102 LEU N N 102 123.986 123.986 122.691 1.295 17934 3344 1 5 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.354 0.036 17934 3345 1 5 . 1 1 102 102 LEU C C 102 177.141 177.141 177.556 -0.415 17934 3346 1 5 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.040 0.620 17934 3347 1 5 . 1 1 102 102 LEU CB C 102 42.660 42.660 42.011 0.649 17934 3348 1 5 . 1 1 102 102 LEU H H 102 8.534 8.534 7.751 0.783 17934 3349 1 5 . 1 1 103 103 SER N N 103 112.339 112.339 112.214 0.125 17934 3350 1 5 . 1 1 103 103 SER HA H 103 4.290 4.290 4.397 -0.107 17934 3351 1 5 . 1 1 103 103 SER C C 103 174.106 174.106 174.503 -0.397 17934 3352 1 5 . 1 1 103 103 SER CA C 103 60.945 60.945 60.536 0.409 17934 3353 1 5 . 1 1 103 103 SER CB C 103 63.757 63.757 63.314 0.443 17934 3354 1 5 . 1 1 103 103 SER H H 103 7.867 7.867 8.411 -0.544 17934 3355 1 5 . 1 1 104 104 THR N N 104 123.070 123.070 118.361 4.709 17934 3356 1 5 . 1 1 104 104 THR HA H 104 5.373 5.373 4.467 0.906 17934 3357 1 5 . 1 1 104 104 THR C C 104 180.693 180.693 172.953 7.740 17934 3358 1 5 . 1 1 104 104 THR CA C 104 63.289 63.289 62.722 0.567 17934 3359 1 5 . 1 1 104 104 THR CB C 104 69.382 69.382 70.024 -0.642 17934 3360 1 5 . 1 1 104 104 THR H H 104 8.830 8.830 7.855 0.975 17934 3361 1 5 . 1 1 105 105 PHE N N 105 122.582 122.582 123.261 -0.679 17934 3362 1 5 . 1 1 105 105 PHE HA H 105 5.470 5.470 5.000 0.470 17934 3363 1 5 . 1 1 105 105 PHE C C 105 179.211 179.211 172.555 6.656 17934 3364 1 5 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.306 0.014 17934 3365 1 5 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.491 0.299 17934 3366 1 5 . 1 1 105 105 PHE H H 105 9.170 9.170 8.418 0.752 17934 3367 1 5 . 1 1 106 106 ALA N N 106 119.567 119.567 123.870 -4.303 17934 3368 1 5 . 1 1 106 106 ALA C C 106 175.603 175.603 175.496 0.107 17934 3369 1 5 . 1 1 106 106 ALA H H 106 8.770 8.770 8.824 -0.054 17934 3370 1 5 . 1 1 107 107 TYR N N 107 109.933 109.933 119.688 -9.755 17934 3371 1 5 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.390 -0.470 17934 3372 1 5 . 1 1 107 107 TYR C C 107 180.426 180.426 173.306 7.120 17934 3373 1 5 . 1 1 107 107 TYR CA C 107 57.080 57.080 54.530 2.550 17934 3374 1 5 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.376 -0.586 17934 3375 1 5 . 1 1 107 107 TYR H H 107 7.950 7.950 8.718 -0.768 17934 3376 1 5 . 1 1 108 108 ILE N N 108 120.613 120.613 122.624 -2.011 17934 3377 1 5 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.666 0.704 17934 3378 1 5 . 1 1 108 108 ILE C C 108 176.212 176.212 175.793 0.419 17934 3379 1 5 . 1 1 108 108 ILE CA C 108 59.540 59.540 61.254 -1.714 17934 3380 1 5 . 1 1 108 108 ILE CB C 108 39.380 39.380 39.430 -0.050 17934 3381 1 5 . 1 1 108 108 ILE H H 108 8.869 8.869 8.273 0.596 17934 3382 1 5 . 1 1 109 109 THR N N 109 116.505 116.505 119.745 -3.240 17934 3383 1 5 . 1 1 109 109 THR HA H 109 5.669 5.669 4.560 1.109 17934 3384 1 5 . 1 1 109 109 THR C C 109 173.505 173.505 172.650 0.855 17934 3385 1 5 . 1 1 109 109 THR CA C 109 59.070 59.070 60.314 -1.244 17934 3386 1 5 . 1 1 109 109 THR H H 109 9.489 9.489 8.720 0.769 17934 3387 1 5 . 1 1 110 110 LYS N N 110 122.960 122.960 121.957 1.003 17934 3388 1 5 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.882 -0.422 17934 3389 1 5 . 1 1 110 110 LYS C C 110 175.937 175.937 176.121 -0.184 17934 3390 1 5 . 1 1 110 110 LYS CA C 110 55.789 55.789 54.864 0.925 17934 3391 1 5 . 1 1 110 110 LYS CB C 110 34.227 34.227 33.557 0.670 17934 3392 1 5 . 1 1 110 110 LYS H H 110 7.831 7.831 8.320 -0.490 17934 3393 1 5 . 1 1 111 111 ASP N N 111 127.409 127.409 122.162 5.247 17934 3394 1 5 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.782 -0.001 17934 3395 1 5 . 1 1 111 111 ASP C C 111 176.396 176.396 177.414 -1.018 17934 3396 1 5 . 1 1 111 111 ASP CA C 111 53.914 53.914 51.953 1.961 17934 3397 1 5 . 1 1 111 111 ASP CB C 111 43.133 43.133 42.898 0.235 17934 3398 1 5 . 1 1 111 111 ASP H H 111 8.769 8.769 8.177 0.592 17934 3399 1 5 . 1 1 112 112 LEU N N 112 125.913 125.913 116.522 9.391 17934 3400 1 5 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.238 -0.088 17934 3401 1 5 . 1 1 112 112 LEU C C 112 178.553 178.553 177.202 1.351 17934 3402 1 5 . 1 1 112 112 LEU CA C 112 57.190 57.190 56.995 0.195 17934 3403 1 5 . 1 1 112 112 LEU CB C 112 41.790 41.790 41.848 -0.058 17934 3404 1 5 . 1 1 112 112 LEU H H 112 8.593 8.593 8.448 0.145 17934 3405 1 5 . 1 1 113 113 LYS N N 113 117.189 117.189 112.991 4.198 17934 3406 1 5 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.305 -0.043 17934 3407 1 5 . 1 1 113 113 LYS C C 113 177.180 177.180 176.015 1.165 17934 3408 1 5 . 1 1 113 113 LYS CA C 113 58.133 58.133 56.117 2.016 17934 3409 1 5 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.609 0.211 17934 3410 1 5 . 1 1 113 113 LYS H H 113 8.207 8.207 7.986 0.221 17934 3411 1 5 . 1 1 114 114 SER N N 114 112.492 112.492 114.392 -1.900 17934 3412 1 5 . 1 1 114 114 SER CA C 114 58.601 58.601 58.161 0.440 17934 3413 1 5 . 1 1 114 114 SER CB C 114 65.164 65.164 66.152 -0.988 17934 3414 1 5 . 1 1 114 114 SER H H 114 7.755 7.755 7.511 0.244 17934 3415 1 5 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.509 -0.120 17934 3416 1 5 . 1 1 115 115 ASN C C 115 174.203 174.203 175.025 -0.822 17934 3417 1 5 . 1 1 115 115 ASN CA C 115 54.383 54.383 53.949 0.434 17934 3418 1 5 . 1 1 115 115 ASN CB C 115 37.977 37.977 38.482 -0.505 17934 3419 1 5 . 1 1 116 116 HIS N N 116 116.822 116.822 117.619 -0.797 17934 3420 1 5 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.530 0.400 17934 3421 1 5 . 1 1 116 116 HIS C C 116 173.898 173.898 174.793 -0.895 17934 3422 1 5 . 1 1 116 116 HIS CA C 116 54.910 54.910 55.745 -0.834 17934 3423 1 5 . 1 1 116 116 HIS CB C 116 32.650 32.650 31.057 1.593 17934 3424 1 5 . 1 1 116 116 HIS H H 116 7.690 7.690 7.879 -0.189 17934 3425 1 5 . 1 1 117 117 HIS N N 117 118.253 118.253 118.107 0.146 17934 3426 1 5 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.583 0.737 17934 3427 1 5 . 1 1 117 117 HIS C C 117 173.695 173.695 174.381 -0.686 17934 3428 1 5 . 1 1 117 117 HIS CA C 117 56.350 56.350 56.984 -0.634 17934 3429 1 5 . 1 1 117 117 HIS CB C 117 32.350 32.350 29.234 3.116 17934 3430 1 5 . 1 1 117 117 HIS H H 117 8.340 8.340 8.489 -0.149 17934 3431 1 5 . 1 1 118 118 TYR N N 118 118.301 118.301 124.532 -6.231 17934 3432 1 5 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.938 0.072 17934 3433 1 5 . 1 1 118 118 TYR C C 118 173.530 173.530 174.404 -0.874 17934 3434 1 5 . 1 1 118 118 TYR CA C 118 56.730 56.730 57.075 -0.345 17934 3435 1 5 . 1 1 118 118 TYR CB C 118 43.240 43.240 41.823 1.417 17934 3436 1 5 . 1 1 118 118 TYR H H 118 9.080 9.080 8.855 0.225 17934 3437 1 5 . 1 1 119 119 CYS N N 119 121.015 121.015 124.047 -3.032 17934 3438 1 5 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.594 0.469 17934 3439 1 5 . 1 1 119 119 CYS C C 119 180.664 180.664 173.826 6.838 17934 3440 1 5 . 1 1 119 119 CYS CA C 119 56.726 56.726 57.396 -0.670 17934 3441 1 5 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.115 1.424 17934 3442 1 5 . 1 1 119 119 CYS H H 119 9.120 9.120 9.095 0.025 17934 3443 1 5 . 1 1 120 120 HIS N N 120 110.134 110.134 129.554 -19.420 17934 3444 1 5 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.863 -0.164 17934 3445 1 5 . 1 1 120 120 HIS C C 120 180.776 180.776 173.549 7.227 17934 3446 1 5 . 1 1 120 120 HIS CA C 120 55.320 55.320 55.455 -0.135 17934 3447 1 5 . 1 1 120 120 HIS CB C 120 32.352 32.352 31.612 0.740 17934 3448 1 5 . 1 1 120 120 HIS H H 120 8.482 8.482 8.914 -0.432 17934 3449 1 5 . 1 1 121 121 VAL N N 121 120.855 120.855 124.584 -3.729 17934 3450 1 5 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.490 -0.140 17934 3451 1 5 . 1 1 121 121 VAL C C 121 173.419 173.419 173.041 0.378 17934 3452 1 5 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.469 0.941 17934 3453 1 5 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.315 -0.035 17934 3454 1 5 . 1 1 121 121 VAL H H 121 7.929 7.929 8.671 -0.742 17934 3455 1 5 . 1 1 122 122 PHE N N 122 124.384 124.384 128.392 -4.008 17934 3456 1 5 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.171 0.249 17934 3457 1 5 . 1 1 122 122 PHE C C 122 174.876 174.876 174.269 0.607 17934 3458 1 5 . 1 1 122 122 PHE CA C 122 55.320 55.320 56.099 -0.779 17934 3459 1 5 . 1 1 122 122 PHE CB C 122 44.540 44.540 43.538 1.002 17934 3460 1 5 . 1 1 122 122 PHE H H 122 8.910 8.910 9.406 -0.496 17934 3461 1 5 . 1 1 123 123 THR N N 123 112.451 112.451 114.008 -1.557 17934 3462 1 5 . 1 1 123 123 THR HA H 123 5.147 5.147 4.366 0.781 17934 3463 1 5 . 1 1 123 123 THR C C 123 174.096 174.096 173.182 0.914 17934 3464 1 5 . 1 1 123 123 THR CA C 123 61.843 61.843 59.828 2.015 17934 3465 1 5 . 1 1 123 123 THR CB C 123 71.218 71.218 69.991 1.227 17934 3466 1 5 . 1 1 123 123 THR H H 123 8.668 8.668 8.742 -0.074 17934 3467 1 5 . 1 1 124 124 ALA N N 124 128.922 128.922 124.928 3.994 17934 3468 1 5 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.683 0.037 17934 3469 1 5 . 1 1 124 124 ALA C C 124 177.168 177.168 176.919 0.249 17934 3470 1 5 . 1 1 124 124 ALA CA C 124 50.890 50.890 49.985 0.905 17934 3471 1 5 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.164 -0.064 17934 3472 1 5 . 1 1 124 124 ALA H H 124 9.180 9.180 8.672 0.508 17934 3473 1 5 . 1 1 125 125 PHE N N 125 115.427 115.427 117.296 -1.869 17934 3474 1 5 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.523 -0.233 17934 3475 1 5 . 1 1 125 125 PHE C C 125 174.703 174.703 175.491 -0.788 17934 3476 1 5 . 1 1 125 125 PHE CA C 125 60.470 60.470 58.212 2.258 17934 3477 1 5 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.564 -1.504 17934 3478 1 5 . 1 1 125 125 PHE H H 125 8.560 8.560 9.411 -0.851 17934 3479 1 5 . 1 1 126 126 ASP N N 126 115.745 115.745 118.327 -2.582 17934 3480 1 5 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.924 -0.081 17934 3481 1 5 . 1 1 126 126 ASP C C 126 176.532 176.532 176.094 0.438 17934 3482 1 5 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.419 0.026 17934 3483 1 5 . 1 1 126 126 ASP CB C 126 44.070 44.070 44.961 -0.891 17934 3484 1 5 . 1 1 126 126 ASP H H 126 7.417 7.417 7.633 -0.216 17934 3485 1 5 . 1 1 127 127 VAL N N 127 121.923 121.923 122.400 -0.477 17934 3486 1 5 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.844 -0.254 17934 3487 1 5 . 1 1 127 127 VAL C C 127 176.863 176.863 177.424 -0.561 17934 3488 1 5 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.633 -1.003 17934 3489 1 5 . 1 1 127 127 VAL CB C 127 31.830 31.830 31.938 -0.108 17934 3490 1 5 . 1 1 127 127 VAL H H 127 8.508 8.508 8.623 -0.115 17934 3491 1 5 . 1 1 128 128 ASN N N 128 118.851 118.851 118.389 0.462 17934 3492 1 5 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.519 -0.043 17934 3493 1 5 . 1 1 128 128 ASN C C 128 178.251 178.251 177.457 0.794 17934 3494 1 5 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.239 0.019 17934 3495 1 5 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.450 -0.473 17934 3496 1 5 . 1 1 128 128 ASN H H 128 8.207 8.207 8.416 -0.209 17934 3497 1 5 . 1 1 129 129 LEU N N 129 122.549 122.549 121.024 1.525 17934 3498 1 5 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.863 0.347 17934 3499 1 5 . 1 1 129 129 LEU C C 129 178.003 178.003 178.019 -0.016 17934 3500 1 5 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.324 -0.134 17934 3501 1 5 . 1 1 129 129 LEU CB C 129 41.790 41.790 40.786 1.004 17934 3502 1 5 . 1 1 129 129 LEU H H 129 8.223 8.223 7.878 0.345 17934 3503 1 5 . 1 1 130 130 ALA N N 130 120.036 120.036 122.507 -2.471 17934 3504 1 5 . 1 1 130 130 ALA HA H 130 3.310 3.310 4.088 -0.778 17934 3505 1 5 . 1 1 130 130 ALA C C 130 178.172 178.172 179.146 -0.974 17934 3506 1 5 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.484 0.296 17934 3507 1 5 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.391 0.679 17934 3508 1 5 . 1 1 130 130 ALA H H 130 7.360 7.360 8.311 -0.951 17934 3509 1 5 . 1 1 131 131 ALA N N 131 116.989 116.989 120.116 -3.127 17934 3510 1 5 . 1 1 131 131 ALA HA H 131 3.710 3.710 4.072 -0.362 17934 3511 1 5 . 1 1 131 131 ALA C C 131 180.163 180.163 179.979 0.184 17934 3512 1 5 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.545 1.234 17934 3513 1 5 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.179 -0.349 17934 3514 1 5 . 1 1 131 131 ALA H H 131 7.360 7.360 8.214 -0.854 17934 3515 1 5 . 1 1 132 132 GLU N N 132 119.462 119.462 119.409 0.053 17934 3516 1 5 . 1 1 132 132 GLU HA H 132 3.888 3.888 3.996 -0.108 17934 3517 1 5 . 1 1 132 132 GLU C C 132 179.243 179.243 178.770 0.473 17934 3518 1 5 . 1 1 132 132 GLU CA C 132 59.539 59.539 59.426 0.113 17934 3519 1 5 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.508 0.031 17934 3520 1 5 . 1 1 132 132 GLU H H 132 7.673 7.673 8.138 -0.465 17934 3521 1 5 . 1 1 133 133 ILE N N 133 123.218 123.218 121.028 2.190 17934 3522 1 5 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.518 -0.738 17934 3523 1 5 . 1 1 133 133 ILE C C 133 177.421 177.421 178.294 -0.873 17934 3524 1 5 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.211 1.279 17934 3525 1 5 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.413 -0.763 17934 3526 1 5 . 1 1 133 133 ILE H H 133 8.154 8.154 7.994 0.160 17934 3527 1 5 . 1 1 134 134 ILE N N 134 118.244 118.244 119.048 -0.804 17934 3528 1 5 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.586 -0.046 17934 3529 1 5 . 1 1 134 134 ILE C C 134 179.385 179.385 177.596 1.789 17934 3530 1 5 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.354 -1.074 17934 3531 1 5 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.993 -0.893 17934 3532 1 5 . 1 1 134 134 ILE H H 134 7.376 7.376 8.268 -0.892 17934 3533 1 5 . 1 1 135 135 LEU N N 135 123.061 123.061 120.296 2.765 17934 3534 1 5 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.942 0.248 17934 3535 1 5 . 1 1 135 135 LEU C C 135 179.858 179.858 178.976 0.882 17934 3536 1 5 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.571 -0.381 17934 3537 1 5 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.849 0.011 17934 3538 1 5 . 1 1 135 135 LEU H H 135 8.036 8.036 7.837 0.199 17934 3539 1 5 . 1 1 136 136 THR N N 136 119.647 119.647 114.716 4.931 17934 3540 1 5 . 1 1 136 136 THR HA H 136 3.725 3.725 3.959 -0.234 17934 3541 1 5 . 1 1 136 136 THR C C 136 176.088 176.088 176.509 -0.421 17934 3542 1 5 . 1 1 136 136 THR CA C 136 58.601 58.601 67.132 -8.531 17934 3543 1 5 . 1 1 136 136 THR CB C 136 67.976 67.976 68.820 -0.844 17934 3544 1 5 . 1 1 136 136 THR H H 136 8.508 8.508 8.419 0.089 17934 3545 1 5 . 1 1 137 137 LEU N N 137 123.182 123.182 121.301 1.881 17934 3546 1 5 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.967 -0.227 17934 3547 1 5 . 1 1 137 137 LEU C C 137 178.341 178.341 178.624 -0.283 17934 3548 1 5 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.626 -0.366 17934 3549 1 5 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.162 0.388 17934 3550 1 5 . 1 1 137 137 LEU H H 137 8.520 8.520 8.636 -0.116 17934 3551 1 5 . 1 1 138 138 GLY N N 138 105.266 105.266 105.395 -0.129 17934 3552 1 5 . 1 1 138 138 GLY C C 138 176.973 176.973 175.344 1.629 17934 3553 1 5 . 1 1 138 138 GLY CA C 138 47.351 47.351 46.664 0.687 17934 3554 1 5 . 1 1 138 138 GLY H H 138 7.858 7.858 7.860 -0.002 17934 3555 1 5 . 1 1 139 139 GLN N N 139 123.485 123.485 122.678 0.807 17934 3556 1 5 . 1 1 139 139 GLN C C 139 177.891 177.891 178.204 -0.313 17934 3557 1 5 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.194 0.408 17934 3558 1 5 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.572 -0.439 17934 3559 1 5 . 1 1 139 139 GLN H H 139 8.195 8.195 8.399 -0.204 17934 3560 1 5 . 1 1 140 140 ALA N N 140 122.754 122.754 122.810 -0.056 17934 3561 1 5 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.070 -0.361 17934 3562 1 5 . 1 1 140 140 ALA C C 140 178.987 178.987 179.280 -0.293 17934 3563 1 5 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.886 0.894 17934 3564 1 5 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.180 -0.770 17934 3565 1 5 . 1 1 140 140 ALA H H 140 8.530 8.530 8.166 0.364 17934 3566 1 5 . 1 1 141 141 PHE N N 141 116.275 116.275 116.752 -0.477 17934 3567 1 5 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.267 -0.177 17934 3568 1 5 . 1 1 141 141 PHE C C 141 178.129 178.129 177.015 1.114 17934 3569 1 5 . 1 1 141 141 PHE CA C 141 61.240 61.240 59.319 1.921 17934 3570 1 5 . 1 1 141 141 PHE CB C 141 39.383 39.383 38.308 1.075 17934 3571 1 5 . 1 1 141 141 PHE H H 141 7.920 7.920 8.005 -0.085 17934 3572 1 5 . 1 1 142 142 GLU N N 142 119.967 119.967 118.395 1.572 17934 3573 1 5 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.873 0.354 17934 3574 1 5 . 1 1 142 142 GLU C C 142 179.250 179.250 177.797 1.453 17934 3575 1 5 . 1 1 142 142 GLU CA C 142 59.539 59.539 57.630 1.909 17934 3576 1 5 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.252 0.287 17934 3577 1 5 . 1 1 142 142 GLU H H 142 7.713 7.713 7.813 -0.100 17934 3578 1 5 . 1 1 143 143 VAL N N 143 120.189 120.189 118.705 1.484 17934 3579 1 5 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.788 -0.105 17934 3580 1 5 . 1 1 143 143 VAL C C 143 178.066 178.066 176.004 2.062 17934 3581 1 5 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.229 2.341 17934 3582 1 5 . 1 1 143 143 VAL CB C 143 31.883 31.883 32.050 -0.167 17934 3583 1 5 . 1 1 143 143 VAL H H 143 8.608 8.608 7.498 1.110 17934 3584 1 5 . 1 1 144 144 ALA N N 144 121.753 121.753 119.065 2.688 17934 3585 1 5 . 1 1 144 144 ALA HA H 144 4.000 4.000 3.889 0.111 17934 3586 1 5 . 1 1 144 144 ALA C C 144 180.776 180.776 175.904 4.872 17934 3587 1 5 . 1 1 144 144 ALA CA C 144 55.780 55.780 53.210 2.570 17934 3588 1 5 . 1 1 144 144 ALA CB C 144 18.770 18.770 17.206 1.564 17934 3589 1 5 . 1 1 144 144 ALA H H 144 8.399 8.399 7.762 0.637 17934 3590 1 5 . 1 1 145 145 TYR N N 145 119.962 119.962 115.947 4.015 17934 3591 1 5 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.521 -0.331 17934 3592 1 5 . 1 1 145 145 TYR C C 145 177.645 177.645 174.050 3.595 17934 3593 1 5 . 1 1 145 145 TYR CA C 145 60.880 60.880 57.372 3.508 17934 3594 1 5 . 1 1 145 145 TYR CB C 145 37.980 37.980 40.746 -2.766 17934 3595 1 5 . 1 1 145 145 TYR H H 145 8.190 8.190 8.162 0.028 17934 3596 1 6 . 1 1 13 13 LYS N N 13 120.778 120.778 120.338 0.440 17934 3597 1 6 . 1 1 13 13 LYS C C 13 176.476 176.476 175.763 0.713 17934 3598 1 6 . 1 1 13 13 LYS CA C 13 58.601 58.601 55.149 3.452 17934 3599 1 6 . 1 1 13 13 LYS CB C 13 32.820 32.820 34.227 -1.407 17934 3600 1 6 . 1 1 13 13 LYS H H 13 7.984 7.984 7.849 0.135 17934 3601 1 6 . 1 1 15 15 ILE HA H 15 3.820 3.820 3.982 -0.162 17934 3602 1 6 . 1 1 15 15 ILE C C 15 176.376 176.376 176.190 0.186 17934 3603 1 6 . 1 1 15 15 ILE CA C 15 63.570 63.570 63.202 0.368 17934 3604 1 6 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.932 1.448 17934 3605 1 6 . 1 1 16 16 ALA N N 16 121.364 121.364 118.703 2.661 17934 3606 1 6 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.395 0.043 17934 3607 1 6 . 1 1 16 16 ALA C C 16 177.494 177.494 176.893 0.601 17934 3608 1 6 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.568 0.408 17934 3609 1 6 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.035 1.298 17934 3610 1 6 . 1 1 16 16 ALA H H 16 8.081 8.081 7.957 0.124 17934 3611 1 6 . 1 1 17 17 GLN N N 17 118.109 118.109 116.750 1.359 17934 3612 1 6 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.666 -0.093 17934 3613 1 6 . 1 1 17 17 GLN C C 17 173.632 173.632 174.501 -0.869 17934 3614 1 6 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.658 -0.807 17934 3615 1 6 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.394 0.083 17934 3616 1 6 . 1 1 17 17 GLN H H 17 7.550 7.550 8.341 -0.791 17934 3617 1 6 . 1 1 18 18 SER N N 18 112.384 112.384 113.143 -0.759 17934 3618 1 6 . 1 1 18 18 SER HA H 18 4.388 4.388 4.691 -0.303 17934 3619 1 6 . 1 1 18 18 SER C C 18 173.780 173.780 171.990 1.790 17934 3620 1 6 . 1 1 18 18 SER CA C 18 57.664 57.664 58.061 -0.397 17934 3621 1 6 . 1 1 18 18 SER CB C 18 65.164 65.164 65.316 -0.152 17934 3622 1 6 . 1 1 18 18 SER H H 18 7.666 7.666 8.184 -0.518 17934 3623 1 6 . 1 1 19 19 CYS N N 19 120.116 120.116 119.232 0.884 17934 3624 1 6 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.533 -0.203 17934 3625 1 6 . 1 1 19 19 CYS C C 19 180.387 180.387 172.972 7.415 17934 3626 1 6 . 1 1 19 19 CYS CA C 19 58.601 58.601 58.822 -0.221 17934 3627 1 6 . 1 1 19 19 CYS CB C 19 30.008 30.008 31.016 -1.008 17934 3628 1 6 . 1 1 19 19 CYS H H 19 8.835 8.835 9.015 -0.180 17934 3629 1 6 . 1 1 20 20 ASP N N 20 124.416 124.416 122.167 2.249 17934 3630 1 6 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.441 -0.465 17934 3631 1 6 . 1 1 20 20 ASP CB C 20 42.195 42.195 43.785 -1.590 17934 3632 1 6 . 1 1 20 20 ASP H H 20 7.847 7.847 7.900 -0.053 17934 3633 1 6 . 1 1 21 21 TYR N N 21 121.296 121.296 119.856 1.440 17934 3634 1 6 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.697 0.033 17934 3635 1 6 . 1 1 21 21 TYR C C 21 175.793 175.793 174.052 1.741 17934 3636 1 6 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.516 0.684 17934 3637 1 6 . 1 1 21 21 TYR CB C 21 43.240 43.240 43.525 -0.285 17934 3638 1 6 . 1 1 21 21 TYR H H 21 9.070 9.070 8.987 0.083 17934 3639 1 6 . 1 1 22 22 LYS N N 22 122.820 122.820 122.592 0.228 17934 3640 1 6 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.235 -0.043 17934 3641 1 6 . 1 1 22 22 LYS C C 22 175.793 175.793 175.513 0.280 17934 3642 1 6 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.578 0.680 17934 3643 1 6 . 1 1 22 22 LYS CB C 22 33.758 33.758 33.135 0.623 17934 3644 1 6 . 1 1 22 22 LYS H H 22 8.711 8.711 8.764 -0.053 17934 3645 1 6 . 1 1 23 23 ALA N N 23 123.073 123.073 127.320 -4.247 17934 3646 1 6 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.841 -0.111 17934 3647 1 6 . 1 1 23 23 ALA C C 23 174.515 174.515 175.589 -1.074 17934 3648 1 6 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.270 1.300 17934 3649 1 6 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.671 -1.043 17934 3650 1 6 . 1 1 23 23 ALA H H 23 8.727 8.727 8.663 0.064 17934 3651 1 6 . 1 1 24 24 ALA N N 24 122.486 122.486 122.636 -0.150 17934 3652 1 6 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.656 0.525 17934 3653 1 6 . 1 1 24 24 ALA C C 24 176.835 176.835 176.053 0.782 17934 3654 1 6 . 1 1 24 24 ALA CA C 24 51.570 51.570 50.945 0.625 17934 3655 1 6 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.349 -0.229 17934 3656 1 6 . 1 1 24 24 ALA H H 24 8.675 8.675 8.809 -0.134 17934 3657 1 6 . 1 1 25 25 TYR N N 25 122.698 122.698 125.217 -2.519 17934 3658 1 6 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.312 0.698 17934 3659 1 6 . 1 1 25 25 TYR CA C 25 54.340 54.340 58.431 -4.091 17934 3660 1 6 . 1 1 25 25 TYR CB C 25 39.850 39.850 38.271 1.579 17934 3661 1 6 . 1 1 25 25 TYR H H 25 8.270 8.270 8.689 -0.419 17934 3662 1 6 . 1 1 26 26 LEU N N 26 127.997 127.997 129.631 -1.634 17934 3663 1 6 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.266 -0.346 17934 3664 1 6 . 1 1 26 26 LEU C C 26 175.983 175.983 176.945 -0.962 17934 3665 1 6 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.267 0.459 17934 3666 1 6 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.193 -2.123 17934 3667 1 6 . 1 1 26 26 LEU H H 26 8.700 8.700 8.330 0.370 17934 3668 1 6 . 1 1 27 27 GLY N N 27 102.901 102.901 101.985 0.916 17934 3669 1 6 . 1 1 27 27 GLY C C 27 176.219 176.219 171.637 4.582 17934 3670 1 6 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.341 -1.740 17934 3671 1 6 . 1 1 27 27 GLY H H 27 5.891 5.891 7.955 -2.064 17934 3672 1 6 . 1 1 28 28 SER N N 28 111.551 111.551 114.163 -2.612 17934 3673 1 6 . 1 1 28 28 SER HA H 28 5.785 5.785 5.389 0.396 17934 3674 1 6 . 1 1 28 28 SER CA C 28 56.258 56.258 57.544 -1.286 17934 3675 1 6 . 1 1 28 28 SER CB C 28 65.632 65.632 66.460 -0.828 17934 3676 1 6 . 1 1 28 28 SER H H 28 7.981 7.981 8.401 -0.420 17934 3677 1 6 . 1 1 29 29 MET N N 29 119.493 119.493 120.901 -1.408 17934 3678 1 6 . 1 1 29 29 MET HA H 29 4.725 4.725 4.701 0.024 17934 3679 1 6 . 1 1 29 29 MET C C 29 174.143 174.143 174.035 0.108 17934 3680 1 6 . 1 1 29 29 MET CA C 29 54.036 54.036 54.250 -0.214 17934 3681 1 6 . 1 1 29 29 MET CB C 29 37.268 37.268 37.081 0.187 17934 3682 1 6 . 1 1 29 29 MET H H 29 8.704 8.704 8.794 -0.090 17934 3683 1 6 . 1 1 30 30 LEU N N 30 128.150 128.150 120.890 7.260 17934 3684 1 6 . 1 1 30 30 LEU HA H 30 3.785 3.785 4.695 -0.910 17934 3685 1 6 . 1 1 30 30 LEU C C 30 175.857 175.857 176.153 -0.296 17934 3686 1 6 . 1 1 30 30 LEU CA C 30 56.250 56.250 54.161 2.088 17934 3687 1 6 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.396 1.264 17934 3688 1 6 . 1 1 30 30 LEU H H 30 8.630 8.630 8.213 0.417 17934 3689 1 6 . 1 1 31 31 ILE N N 31 127.723 127.723 124.546 3.177 17934 3690 1 6 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.077 0.113 17934 3691 1 6 . 1 1 31 31 ILE C C 31 174.881 174.881 175.602 -0.721 17934 3692 1 6 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.035 -1.375 17934 3693 1 6 . 1 1 31 31 ILE CB C 31 37.110 37.110 36.040 1.070 17934 3694 1 6 . 1 1 31 31 ILE H H 31 8.560 8.560 8.415 0.145 17934 3695 1 6 . 1 1 32 32 LYS HA H 32 4.055 4.055 4.210 -0.155 17934 3696 1 6 . 1 1 32 32 LYS C C 32 176.272 176.272 176.845 -0.573 17934 3697 1 6 . 1 1 32 32 LYS CA C 32 58.601 58.601 58.577 0.024 17934 3698 1 6 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.618 0.202 17934 3699 1 6 . 1 1 33 33 GLU N N 33 118.638 118.638 119.630 -0.992 17934 3700 1 6 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.252 0.136 17934 3701 1 6 . 1 1 33 33 GLU C C 33 173.962 173.962 175.080 -1.118 17934 3702 1 6 . 1 1 33 33 GLU CA C 33 54.851 54.851 55.229 -0.378 17934 3703 1 6 . 1 1 33 33 GLU CB C 33 30.945 30.945 29.766 1.179 17934 3704 1 6 . 1 1 33 33 GLU H H 33 7.723 7.723 8.053 -0.330 17934 3705 1 6 . 1 1 34 34 LEU N N 34 126.535 126.535 125.237 1.298 17934 3706 1 6 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.288 -0.343 17934 3707 1 6 . 1 1 34 34 LEU C C 34 176.870 176.870 176.986 -0.116 17934 3708 1 6 . 1 1 34 34 LEU CA C 34 54.850 54.850 54.515 0.335 17934 3709 1 6 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.303 -0.583 17934 3710 1 6 . 1 1 34 34 LEU H H 34 8.446 8.446 8.433 0.013 17934 3711 1 6 . 1 1 35 35 ARG N N 35 128.447 128.447 124.050 4.397 17934 3712 1 6 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.472 0.083 17934 3713 1 6 . 1 1 35 35 ARG C C 35 176.110 176.110 175.990 0.120 17934 3714 1 6 . 1 1 35 35 ARG CA C 35 54.851 54.851 54.877 -0.026 17934 3715 1 6 . 1 1 35 35 ARG CB C 35 30.477 30.477 31.078 -0.601 17934 3716 1 6 . 1 1 35 35 ARG H H 35 8.680 8.680 8.717 -0.037 17934 3717 1 6 . 1 1 36 36 GLY N N 36 107.406 107.406 114.601 -7.195 17934 3718 1 6 . 1 1 36 36 GLY CA C 36 45.906 45.906 45.683 0.223 17934 3719 1 6 . 1 1 36 36 GLY H H 36 7.182 7.182 8.481 -1.299 17934 3720 1 6 . 1 1 37 37 THR HA H 37 4.060 4.060 4.102 -0.042 17934 3721 1 6 . 1 1 37 37 THR C C 37 176.634 176.634 175.920 0.714 17934 3722 1 6 . 1 1 37 37 THR CA C 37 65.632 65.632 64.088 1.544 17934 3723 1 6 . 1 1 37 37 THR CB C 37 68.445 68.445 68.226 0.219 17934 3724 1 6 . 1 1 38 38 GLU N N 38 122.251 122.251 122.379 -0.128 17934 3725 1 6 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.942 0.184 17934 3726 1 6 . 1 1 38 38 GLU C C 38 179.981 179.981 178.707 1.274 17934 3727 1 6 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.613 0.395 17934 3728 1 6 . 1 1 38 38 GLU CB C 38 29.539 29.539 28.836 0.703 17934 3729 1 6 . 1 1 38 38 GLU H H 38 8.450 8.450 8.350 0.100 17934 3730 1 6 . 1 1 39 39 SER N N 39 115.966 115.966 114.036 1.930 17934 3731 1 6 . 1 1 39 39 SER C C 39 175.991 175.991 176.549 -0.558 17934 3732 1 6 . 1 1 39 39 SER CA C 39 62.820 62.820 61.800 1.020 17934 3733 1 6 . 1 1 39 39 SER H H 39 7.522 7.522 7.766 -0.244 17934 3734 1 6 . 1 1 40 40 THR HA H 40 4.049 4.049 3.876 0.173 17934 3735 1 6 . 1 1 40 40 THR C C 40 175.972 175.972 176.814 -0.842 17934 3736 1 6 . 1 1 40 40 THR CA C 40 66.101 66.101 65.177 0.924 17934 3737 1 6 . 1 1 40 40 THR CB C 40 67.976 67.976 68.406 -0.430 17934 3738 1 6 . 1 1 41 41 GLN N N 41 120.354 120.354 120.005 0.349 17934 3739 1 6 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.129 -0.370 17934 3740 1 6 . 1 1 41 41 GLN C C 41 178.483 178.483 178.237 0.246 17934 3741 1 6 . 1 1 41 41 GLN CA C 41 60.476 60.476 58.576 1.900 17934 3742 1 6 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.366 -0.233 17934 3743 1 6 . 1 1 41 41 GLN H H 41 8.271 8.271 8.462 -0.191 17934 3744 1 6 . 1 1 42 42 ASP N N 42 120.757 120.757 121.835 -1.078 17934 3745 1 6 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.362 -0.003 17934 3746 1 6 . 1 1 42 42 ASP C C 42 177.480 177.480 177.803 -0.323 17934 3747 1 6 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.886 -0.222 17934 3748 1 6 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.936 1.259 17934 3749 1 6 . 1 1 42 42 ASP H H 42 7.954 7.954 8.201 -0.247 17934 3750 1 6 . 1 1 43 43 ALA N N 43 120.587 120.587 121.972 -1.385 17934 3751 1 6 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.186 -0.196 17934 3752 1 6 . 1 1 43 43 ALA C C 43 179.767 179.767 179.624 0.143 17934 3753 1 6 . 1 1 43 43 ALA CA C 43 55.320 55.320 54.990 0.329 17934 3754 1 6 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.257 0.973 17934 3755 1 6 . 1 1 43 43 ALA H H 43 7.842 7.842 8.275 -0.433 17934 3756 1 6 . 1 1 44 44 CYS N N 44 115.428 115.428 118.348 -2.920 17934 3757 1 6 . 1 1 44 44 CYS HA H 44 3.895 3.895 4.039 -0.144 17934 3758 1 6 . 1 1 44 44 CYS C C 44 176.076 176.076 176.456 -0.380 17934 3759 1 6 . 1 1 44 44 CYS CA C 44 64.695 64.695 62.355 2.340 17934 3760 1 6 . 1 1 44 44 CYS CB C 44 27.664 27.664 26.456 1.208 17934 3761 1 6 . 1 1 44 44 CYS H H 44 7.900 7.900 8.346 -0.446 17934 3762 1 6 . 1 1 45 45 ALA N N 45 120.487 120.487 122.759 -2.272 17934 3763 1 6 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.938 0.062 17934 3764 1 6 . 1 1 45 45 ALA C C 45 173.506 173.506 178.839 -5.333 17934 3765 1 6 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.247 0.073 17934 3766 1 6 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.183 -0.243 17934 3767 1 6 . 1 1 45 45 ALA H H 45 7.250 7.250 8.097 -0.847 17934 3768 1 6 . 1 1 46 46 LYS N N 46 119.267 119.267 119.219 0.048 17934 3769 1 6 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.894 0.053 17934 3770 1 6 . 1 1 46 46 LYS C C 46 179.561 179.561 178.604 0.957 17934 3771 1 6 . 1 1 46 46 LYS H H 46 8.102 8.102 8.108 -0.006 17934 3772 1 6 . 1 1 47 47 MET N N 47 118.009 118.009 118.304 -0.295 17934 3773 1 6 . 1 1 47 47 MET HA H 47 4.214 4.214 4.105 0.109 17934 3774 1 6 . 1 1 47 47 MET C C 47 179.526 179.526 178.053 1.473 17934 3775 1 6 . 1 1 47 47 MET CA C 47 57.195 57.195 58.599 -1.404 17934 3776 1 6 . 1 1 47 47 MET CB C 47 30.945 30.945 32.598 -1.653 17934 3777 1 6 . 1 1 47 47 MET H H 47 8.585 8.585 8.137 0.448 17934 3778 1 6 . 1 1 48 48 ARG N N 48 119.962 119.962 119.926 0.036 17934 3779 1 6 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.919 -0.063 17934 3780 1 6 . 1 1 48 48 ARG C C 48 178.875 178.875 177.832 1.043 17934 3781 1 6 . 1 1 48 48 ARG CA C 48 60.945 60.945 58.781 2.164 17934 3782 1 6 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.430 1.047 17934 3783 1 6 . 1 1 48 48 ARG H H 48 8.190 8.190 8.289 -0.099 17934 3784 1 6 . 1 1 49 49 ALA N N 49 120.640 120.640 119.768 0.872 17934 3785 1 6 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.118 -0.375 17934 3786 1 6 . 1 1 49 49 ALA C C 49 180.169 180.169 179.678 0.491 17934 3787 1 6 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.620 0.231 17934 3788 1 6 . 1 1 49 49 ALA CB C 49 17.821 17.821 18.691 -0.870 17934 3789 1 6 . 1 1 49 49 ALA H H 49 7.671 7.671 8.130 -0.459 17934 3790 1 6 . 1 1 50 50 ASN N N 50 116.063 116.063 118.711 -2.648 17934 3791 1 6 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.488 -0.014 17934 3792 1 6 . 1 1 50 50 ASN C C 50 177.084 177.084 177.521 -0.437 17934 3793 1 6 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.324 0.466 17934 3794 1 6 . 1 1 50 50 ASN CB C 50 38.914 38.914 37.968 0.946 17934 3795 1 6 . 1 1 50 50 ASN H H 50 7.893 7.893 8.563 -0.670 17934 3796 1 6 . 1 1 51 51 CYS N N 51 116.884 116.884 118.457 -1.573 17934 3797 1 6 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.017 0.289 17934 3798 1 6 . 1 1 51 51 CYS C C 51 175.002 175.002 176.102 -1.100 17934 3799 1 6 . 1 1 51 51 CYS CA C 51 61.414 61.414 61.770 -0.356 17934 3800 1 6 . 1 1 51 51 CYS CB C 51 27.664 27.664 26.346 1.319 17934 3801 1 6 . 1 1 51 51 CYS H H 51 7.770 7.770 8.309 -0.539 17934 3802 1 6 . 1 1 52 52 GLN N N 52 117.831 117.831 119.840 -2.009 17934 3803 1 6 . 1 1 52 52 GLN HA H 52 4.228 4.228 3.996 0.232 17934 3804 1 6 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.215 -1.489 17934 3805 1 6 . 1 1 52 52 GLN CB C 52 29.070 29.070 28.289 0.781 17934 3806 1 6 . 1 1 52 52 GLN H H 52 7.796 7.796 8.131 -0.335 17934 3807 1 6 . 1 1 53 53 LYS N N 53 118.841 118.841 119.331 -0.490 17934 3808 1 6 . 1 1 53 53 LYS CA C 53 57.195 57.195 58.316 -1.121 17934 3809 1 6 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.368 0.921 17934 3810 1 6 . 1 1 53 53 LYS H H 53 7.686 7.686 8.146 -0.460 17934 3811 1 6 . 1 1 55 55 THR HA H 55 4.304 4.304 4.170 0.134 17934 3812 1 6 . 1 1 55 55 THR CA C 55 63.757 63.757 65.057 -1.300 17934 3813 1 6 . 1 1 55 55 THR CB C 55 68.914 68.914 69.580 -0.666 17934 3814 1 6 . 1 1 56 56 GLU N N 56 120.861 120.861 121.546 -0.685 17934 3815 1 6 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.017 0.130 17934 3816 1 6 . 1 1 56 56 GLU C C 56 177.656 177.656 177.897 -0.241 17934 3817 1 6 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.958 -0.825 17934 3818 1 6 . 1 1 56 56 GLU CB C 56 30.008 30.008 28.247 1.760 17934 3819 1 6 . 1 1 56 56 GLU H H 56 8.311 8.311 8.665 -0.354 17934 3820 1 6 . 1 1 57 57 GLN N N 57 118.397 118.397 118.331 0.066 17934 3821 1 6 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.183 -0.041 17934 3822 1 6 . 1 1 57 57 GLN C C 57 177.275 177.275 176.649 0.626 17934 3823 1 6 . 1 1 57 57 GLN CA C 57 57.664 57.664 58.185 -0.521 17934 3824 1 6 . 1 1 57 57 GLN CB C 57 29.070 29.070 29.087 -0.017 17934 3825 1 6 . 1 1 57 57 GLN H H 57 7.899 7.899 7.815 0.084 17934 3826 1 6 . 1 1 58 58 MET N N 58 118.897 118.897 118.215 0.682 17934 3827 1 6 . 1 1 58 58 MET HA H 58 4.350 4.350 4.238 0.112 17934 3828 1 6 . 1 1 58 58 MET C C 58 177.172 177.172 178.419 -1.247 17934 3829 1 6 . 1 1 58 58 MET CA C 58 56.726 56.726 58.238 -1.512 17934 3830 1 6 . 1 1 58 58 MET CB C 58 32.196 32.196 33.158 -0.962 17934 3831 1 6 . 1 1 58 58 MET H H 58 8.036 8.036 7.570 0.466 17934 3832 1 6 . 1 1 59 59 LYS N N 59 119.779 119.779 118.213 1.566 17934 3833 1 6 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.025 0.206 17934 3834 1 6 . 1 1 59 59 LYS C C 59 176.676 176.676 176.888 -0.212 17934 3835 1 6 . 1 1 59 59 LYS CA C 59 57.195 57.195 58.141 -0.946 17934 3836 1 6 . 1 1 59 59 LYS CB C 59 32.820 32.820 32.349 0.471 17934 3837 1 6 . 1 1 59 59 LYS H H 59 7.901 7.901 8.147 -0.246 17934 3838 1 6 . 1 1 60 60 LYS N N 60 119.993 119.993 117.960 2.033 17934 3839 1 6 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.475 -0.140 17934 3840 1 6 . 1 1 60 60 LYS C C 60 176.336 176.336 174.164 2.172 17934 3841 1 6 . 1 1 60 60 LYS CA C 60 56.258 56.258 55.737 0.521 17934 3842 1 6 . 1 1 60 60 LYS CB C 60 32.820 32.820 34.497 -1.677 17934 3843 1 6 . 1 1 60 60 LYS H H 60 7.877 7.877 7.503 0.374 17934 3844 1 6 . 1 1 61 61 VAL N N 61 122.649 122.649 122.384 0.265 17934 3845 1 6 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.660 -0.280 17934 3846 1 6 . 1 1 61 61 VAL C C 61 174.210 174.210 173.937 0.273 17934 3847 1 6 . 1 1 61 61 VAL CA C 61 60.000 60.000 57.920 2.080 17934 3848 1 6 . 1 1 61 61 VAL CB C 61 32.350 32.350 33.967 -1.617 17934 3849 1 6 . 1 1 61 61 VAL H H 61 7.708 7.708 8.322 -0.614 17934 3850 1 6 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.674 -0.011 17934 3851 1 6 . 1 1 62 62 PRO C C 62 176.656 176.656 176.394 0.262 17934 3852 1 6 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.465 0.355 17934 3853 1 6 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.698 -0.815 17934 3854 1 6 . 1 1 63 63 THR N N 63 117.155 117.155 117.491 -0.336 17934 3855 1 6 . 1 1 63 63 THR HA H 63 4.830 4.830 4.712 0.118 17934 3856 1 6 . 1 1 63 63 THR C C 63 174.682 174.682 174.020 0.662 17934 3857 1 6 . 1 1 63 63 THR CA C 63 62.820 62.820 62.800 0.020 17934 3858 1 6 . 1 1 63 63 THR CB C 63 69.382 69.382 69.967 -0.585 17934 3859 1 6 . 1 1 63 63 THR H H 63 8.303 8.303 8.550 -0.247 17934 3860 1 6 . 1 1 64 64 ILE N N 64 121.004 121.004 120.462 0.542 17934 3861 1 6 . 1 1 64 64 ILE CA C 64 58.600 58.600 59.528 -0.928 17934 3862 1 6 . 1 1 64 64 ILE CB C 64 42.690 42.690 41.992 0.698 17934 3863 1 6 . 1 1 64 64 ILE H H 64 9.348 9.348 8.693 0.655 17934 3864 1 6 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.111 0.629 17934 3865 1 6 . 1 1 65 65 ILE C C 65 175.378 175.378 174.522 0.856 17934 3866 1 6 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.075 -0.994 17934 3867 1 6 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.749 1.001 17934 3868 1 6 . 1 1 66 66 LEU N N 66 110.343 110.343 129.915 -19.572 17934 3869 1 6 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.924 -0.074 17934 3870 1 6 . 1 1 66 66 LEU C C 66 174.982 174.982 175.738 -0.756 17934 3871 1 6 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.297 -0.387 17934 3872 1 6 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.766 1.464 17934 3873 1 6 . 1 1 66 66 LEU H H 66 9.610 9.610 9.272 0.338 17934 3874 1 6 . 1 1 67 67 SER N N 67 120.990 120.990 120.667 0.323 17934 3875 1 6 . 1 1 67 67 SER HA H 67 5.405 5.405 5.057 0.348 17934 3876 1 6 . 1 1 67 67 SER C C 67 174.405 174.405 173.007 1.398 17934 3877 1 6 . 1 1 67 67 SER CA C 67 57.195 57.195 57.139 0.056 17934 3878 1 6 . 1 1 67 67 SER CB C 67 64.695 64.695 64.011 0.684 17934 3879 1 6 . 1 1 67 67 SER H H 67 9.260 9.260 8.979 0.281 17934 3880 1 6 . 1 1 68 68 VAL N N 68 128.176 128.176 125.401 2.775 17934 3881 1 6 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.236 0.257 17934 3882 1 6 . 1 1 68 68 VAL C C 68 173.891 173.891 173.336 0.555 17934 3883 1 6 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.632 1.718 17934 3884 1 6 . 1 1 68 68 VAL CB C 68 33.750 33.750 33.421 0.329 17934 3885 1 6 . 1 1 68 68 VAL H H 68 9.225 9.225 8.991 0.234 17934 3886 1 6 . 1 1 69 69 SER N N 69 121.697 121.697 123.485 -1.788 17934 3887 1 6 . 1 1 69 69 SER HA H 69 4.837 4.837 4.835 0.002 17934 3888 1 6 . 1 1 69 69 SER C C 69 173.188 173.188 174.799 -1.611 17934 3889 1 6 . 1 1 69 69 SER CA C 69 57.195 57.195 56.388 0.807 17934 3890 1 6 . 1 1 69 69 SER CB C 69 67.976 67.976 65.840 2.136 17934 3891 1 6 . 1 1 69 69 SER H H 69 8.869 8.869 8.791 0.078 17934 3892 1 6 . 1 1 70 70 ALA N N 70 118.689 118.689 128.671 -9.982 17934 3893 1 6 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.202 -0.052 17934 3894 1 6 . 1 1 70 70 ALA C C 70 176.714 176.714 177.204 -0.490 17934 3895 1 6 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.166 -0.256 17934 3896 1 6 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.856 -0.256 17934 3897 1 6 . 1 1 70 70 ALA H H 70 8.810 8.810 8.787 0.023 17934 3898 1 6 . 1 1 71 71 LYS N N 71 112.633 112.633 115.725 -3.092 17934 3899 1 6 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.454 -0.179 17934 3900 1 6 . 1 1 71 71 LYS C C 71 177.033 177.033 176.166 0.867 17934 3901 1 6 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.531 1.664 17934 3902 1 6 . 1 1 71 71 LYS CB C 71 33.289 33.289 33.127 0.162 17934 3903 1 6 . 1 1 71 71 LYS H H 71 7.830 7.830 7.556 0.274 17934 3904 1 6 . 1 1 72 72 GLY N N 72 108.432 108.432 106.510 1.922 17934 3905 1 6 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.323 0.153 17934 3906 1 6 . 1 1 72 72 GLY H H 72 7.685 7.685 7.688 -0.003 17934 3907 1 6 . 1 1 73 73 VAL N N 73 120.414 120.414 117.365 3.049 17934 3908 1 6 . 1 1 73 73 VAL HA H 73 5.000 5.000 5.147 -0.147 17934 3909 1 6 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.539 0.931 17934 3910 1 6 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.354 0.276 17934 3911 1 6 . 1 1 73 73 VAL H H 73 8.620 8.620 7.964 0.656 17934 3912 1 6 . 1 1 74 74 LYS N N 74 125.257 125.257 124.841 0.416 17934 3913 1 6 . 1 1 74 74 LYS HA H 74 5.016 5.016 3.944 1.072 17934 3914 1 6 . 1 1 74 74 LYS CA C 74 54.383 54.383 54.517 -0.133 17934 3915 1 6 . 1 1 74 74 LYS CB C 74 36.570 36.570 35.845 0.725 17934 3916 1 6 . 1 1 74 74 LYS H H 74 8.783 8.783 8.186 0.597 17934 3917 1 6 . 1 1 75 75 PHE N N 75 119.414 119.414 118.291 1.123 17934 3918 1 6 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.608 0.092 17934 3919 1 6 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.419 -2.499 17934 3920 1 6 . 1 1 75 75 PHE CB C 75 40.610 40.610 42.549 -1.939 17934 3921 1 6 . 1 1 75 75 PHE H H 75 8.432 8.432 8.629 -0.197 17934 3922 1 6 . 1 1 76 76 ILE N N 76 121.430 121.430 119.765 1.665 17934 3923 1 6 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.515 0.325 17934 3924 1 6 . 1 1 76 76 ILE C C 76 175.249 175.249 173.718 1.531 17934 3925 1 6 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.808 -0.738 17934 3926 1 6 . 1 1 76 76 ILE CB C 76 41.220 41.220 42.187 -0.967 17934 3927 1 6 . 1 1 76 76 ILE H H 76 8.960 8.960 8.546 0.414 17934 3928 1 6 . 1 1 77 77 ASP N N 77 125.744 125.744 123.480 2.264 17934 3929 1 6 . 1 1 77 77 ASP HA H 77 4.563 4.563 4.888 -0.325 17934 3930 1 6 . 1 1 77 77 ASP C C 77 177.569 177.569 175.698 1.871 17934 3931 1 6 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.847 2.942 17934 3932 1 6 . 1 1 77 77 ASP CB C 77 43.601 43.601 42.705 0.897 17934 3933 1 6 . 1 1 77 77 ASP H H 77 8.750 8.750 8.529 0.221 17934 3934 1 6 . 1 1 78 78 ALA N N 78 128.632 128.632 129.227 -0.595 17934 3935 1 6 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.193 -0.223 17934 3936 1 6 . 1 1 78 78 ALA C C 78 178.052 178.052 178.274 -0.222 17934 3937 1 6 . 1 1 78 78 ALA CA C 78 54.830 54.830 53.813 1.017 17934 3938 1 6 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.759 0.034 17934 3939 1 6 . 1 1 78 78 ALA H H 78 8.700 8.700 8.812 -0.112 17934 3940 1 6 . 1 1 79 79 THR N N 79 113.087 113.087 114.296 -1.209 17934 3941 1 6 . 1 1 79 79 THR HA H 79 4.194 4.194 4.106 0.088 17934 3942 1 6 . 1 1 79 79 THR C C 79 175.587 175.587 176.151 -0.564 17934 3943 1 6 . 1 1 79 79 THR CA C 79 64.695 64.695 66.815 -2.120 17934 3944 1 6 . 1 1 79 79 THR CB C 79 69.382 69.382 69.044 0.338 17934 3945 1 6 . 1 1 79 79 THR H H 79 8.779 8.779 8.803 -0.024 17934 3946 1 6 . 1 1 80 80 ASN N N 80 118.434 118.434 117.365 1.069 17934 3947 1 6 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.841 -0.104 17934 3948 1 6 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.669 0.777 17934 3949 1 6 . 1 1 80 80 ASN CB C 80 39.383 39.383 39.022 0.361 17934 3950 1 6 . 1 1 80 80 ASN H H 80 8.584 8.584 8.674 -0.090 17934 3951 1 6 . 1 1 81 81 LYS N N 81 112.429 112.429 114.927 -2.498 17934 3952 1 6 . 1 1 81 81 LYS C C 81 174.909 174.909 175.810 -0.901 17934 3953 1 6 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.377 0.287 17934 3954 1 6 . 1 1 81 81 LYS CB C 81 28.602 28.602 30.098 -1.496 17934 3955 1 6 . 1 1 81 81 LYS H H 81 7.966 7.966 8.502 -0.536 17934 3956 1 6 . 1 1 82 82 ASN N N 82 116.806 116.806 116.373 0.433 17934 3957 1 6 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.620 -0.030 17934 3958 1 6 . 1 1 82 82 ASN C C 82 174.999 174.999 174.551 0.448 17934 3959 1 6 . 1 1 82 82 ASN CA C 82 52.976 52.976 52.517 0.459 17934 3960 1 6 . 1 1 82 82 ASN CB C 82 38.445 38.445 39.452 -1.007 17934 3961 1 6 . 1 1 82 82 ASN H H 82 8.455 8.455 8.065 0.390 17934 3962 1 6 . 1 1 83 83 ILE N N 83 122.447 122.447 116.343 6.104 17934 3963 1 6 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.446 -0.416 17934 3964 1 6 . 1 1 83 83 ILE C C 83 176.572 176.572 175.730 0.842 17934 3965 1 6 . 1 1 83 83 ILE CA C 83 62.350 62.350 59.832 2.518 17934 3966 1 6 . 1 1 83 83 ILE CB C 83 37.970 37.970 37.738 0.232 17934 3967 1 6 . 1 1 83 83 ILE H H 83 8.650 8.650 8.270 0.380 17934 3968 1 6 . 1 1 84 84 ILE N N 84 129.339 129.339 127.414 1.925 17934 3969 1 6 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.181 -0.261 17934 3970 1 6 . 1 1 84 84 ILE C C 84 175.873 175.873 176.205 -0.332 17934 3971 1 6 . 1 1 84 84 ILE CA C 84 62.810 62.810 60.887 1.923 17934 3972 1 6 . 1 1 84 84 ILE CB C 84 38.840 38.840 38.124 0.716 17934 3973 1 6 . 1 1 84 84 ILE H H 84 8.930 8.930 8.176 0.754 17934 3974 1 6 . 1 1 85 85 ALA N N 85 118.867 118.867 117.220 1.647 17934 3975 1 6 . 1 1 85 85 ALA C C 85 174.100 174.100 174.838 -0.738 17934 3976 1 6 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.054 -0.484 17934 3977 1 6 . 1 1 85 85 ALA H H 85 7.048 7.048 8.233 -1.185 17934 3978 1 6 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.965 0.189 17934 3979 1 6 . 1 1 87 87 HIS C C 87 174.986 174.986 173.302 1.684 17934 3980 1 6 . 1 1 87 87 HIS CB C 87 34.350 34.350 31.579 2.771 17934 3981 1 6 . 1 1 88 88 GLU N N 88 125.372 125.372 119.437 5.935 17934 3982 1 6 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.354 0.167 17934 3983 1 6 . 1 1 88 88 GLU C C 88 179.047 179.047 177.441 1.606 17934 3984 1 6 . 1 1 88 88 GLU CA C 88 56.726 56.726 56.772 -0.046 17934 3985 1 6 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.651 -0.175 17934 3986 1 6 . 1 1 88 88 GLU H H 88 9.106 9.106 8.778 0.328 17934 3987 1 6 . 1 1 89 89 ILE N N 89 124.132 124.132 123.553 0.579 17934 3988 1 6 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.864 0.155 17934 3989 1 6 . 1 1 89 89 ILE C C 89 176.095 176.095 177.806 -1.711 17934 3990 1 6 . 1 1 89 89 ILE CA C 89 62.351 62.351 64.912 -2.561 17934 3991 1 6 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.288 0.627 17934 3992 1 6 . 1 1 89 89 ILE H H 89 8.055 8.055 8.779 -0.724 17934 3993 1 6 . 1 1 90 90 ARG N N 90 116.949 116.949 115.928 1.021 17934 3994 1 6 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.601 -0.263 17934 3995 1 6 . 1 1 90 90 ARG C C 90 176.578 176.578 175.999 0.579 17934 3996 1 6 . 1 1 90 90 ARG CA C 90 57.664 57.664 58.042 -0.378 17934 3997 1 6 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.546 -0.476 17934 3998 1 6 . 1 1 90 90 ARG H H 90 8.045 8.045 8.600 -0.555 17934 3999 1 6 . 1 1 91 91 ASN N N 91 116.320 116.320 115.684 0.636 17934 4000 1 6 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.679 0.474 17934 4001 1 6 . 1 1 91 91 ASN C C 91 174.595 174.595 175.308 -0.713 17934 4002 1 6 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.058 -1.550 17934 4003 1 6 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.853 -0.001 17934 4004 1 6 . 1 1 91 91 ASN H H 91 8.067 8.067 7.753 0.314 17934 4005 1 6 . 1 1 92 92 ILE N N 92 122.441 122.441 121.583 0.858 17934 4006 1 6 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.567 1.506 17934 4007 1 6 . 1 1 92 92 ILE C C 92 175.229 175.229 175.881 -0.652 17934 4008 1 6 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.595 -0.715 17934 4009 1 6 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.418 2.432 17934 4010 1 6 . 1 1 92 92 ILE H H 92 7.483 7.483 7.652 -0.169 17934 4011 1 6 . 1 1 93 93 SER N N 93 120.329 120.329 122.621 -2.292 17934 4012 1 6 . 1 1 93 93 SER HA H 93 4.684 4.684 4.129 0.555 17934 4013 1 6 . 1 1 93 93 SER C C 93 180.744 180.744 174.376 6.368 17934 4014 1 6 . 1 1 93 93 SER CA C 93 57.664 57.664 61.118 -3.454 17934 4015 1 6 . 1 1 93 93 SER CB C 93 66.570 66.570 63.734 2.836 17934 4016 1 6 . 1 1 93 93 SER H H 93 9.545 9.545 8.295 1.250 17934 4017 1 6 . 1 1 94 94 CYS N N 94 110.900 110.900 114.617 -3.717 17934 4018 1 6 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.576 -0.764 17934 4019 1 6 . 1 1 94 94 CYS C C 94 173.973 173.973 173.096 0.877 17934 4020 1 6 . 1 1 94 94 CYS CA C 94 59.539 59.539 57.940 1.599 17934 4021 1 6 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.771 -4.513 17934 4022 1 6 . 1 1 94 94 CYS H H 94 8.858 8.858 7.760 1.098 17934 4023 1 6 . 1 1 95 95 ALA N N 95 121.379 121.379 122.720 -1.341 17934 4024 1 6 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.669 -0.239 17934 4025 1 6 . 1 1 95 95 ALA C C 95 178.098 178.098 175.302 2.796 17934 4026 1 6 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.599 1.051 17934 4027 1 6 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.409 -2.108 17934 4028 1 6 . 1 1 95 95 ALA H H 95 8.360 8.360 8.415 -0.055 17934 4029 1 6 . 1 1 96 96 ALA N N 96 122.576 122.576 123.738 -1.162 17934 4030 1 6 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.746 -0.066 17934 4031 1 6 . 1 1 96 96 ALA C C 96 175.716 175.716 174.813 0.903 17934 4032 1 6 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.505 0.935 17934 4033 1 6 . 1 1 96 96 ALA CB C 96 22.700 22.700 22.064 0.636 17934 4034 1 6 . 1 1 96 96 ALA H H 96 9.080 9.080 8.642 0.438 17934 4035 1 6 . 1 1 97 97 GLN N N 97 116.903 116.903 120.207 -3.304 17934 4036 1 6 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.595 0.335 17934 4037 1 6 . 1 1 97 97 GLN C C 97 175.270 175.270 174.221 1.049 17934 4038 1 6 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.957 0.894 17934 4039 1 6 . 1 1 97 97 GLN CB C 97 33.758 33.758 32.200 1.558 17934 4040 1 6 . 1 1 97 97 GLN H H 97 8.369 8.369 8.319 0.050 17934 4041 1 6 . 1 1 98 98 ASP N N 98 124.971 124.971 121.519 3.452 17934 4042 1 6 . 1 1 98 98 ASP C C 98 175.217 175.217 175.776 -0.559 17934 4043 1 6 . 1 1 98 98 ASP CA C 98 52.039 52.039 51.801 0.238 17934 4044 1 6 . 1 1 98 98 ASP CB C 98 42.195 42.195 41.911 0.284 17934 4045 1 6 . 1 1 98 98 ASP H H 98 8.395 8.395 8.425 -0.030 17934 4046 1 6 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.398 -0.164 17934 4047 1 6 . 1 1 99 99 PRO C C 99 178.433 178.433 177.413 1.020 17934 4048 1 6 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.840 -0.145 17934 4049 1 6 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.147 0.205 17934 4050 1 6 . 1 1 100 100 GLU N N 100 116.223 116.223 119.338 -3.115 17934 4051 1 6 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.132 0.088 17934 4052 1 6 . 1 1 100 100 GLU C C 100 176.678 176.678 175.932 0.746 17934 4053 1 6 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.185 -1.459 17934 4054 1 6 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.891 2.054 17934 4055 1 6 . 1 1 100 100 GLU H H 100 8.643 8.643 8.776 -0.133 17934 4056 1 6 . 1 1 101 101 ASP N N 101 119.053 119.053 118.837 0.216 17934 4057 1 6 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.894 -0.351 17934 4058 1 6 . 1 1 101 101 ASP C C 101 174.771 174.771 176.292 -1.521 17934 4059 1 6 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.289 0.625 17934 4060 1 6 . 1 1 101 101 ASP CB C 101 40.789 40.789 41.078 -0.289 17934 4061 1 6 . 1 1 101 101 ASP H H 101 7.597 7.597 8.085 -0.488 17934 4062 1 6 . 1 1 102 102 LEU N N 102 123.986 123.986 120.495 3.491 17934 4063 1 6 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.240 0.150 17934 4064 1 6 . 1 1 102 102 LEU C C 102 177.141 177.141 178.150 -1.009 17934 4065 1 6 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.474 0.186 17934 4066 1 6 . 1 1 102 102 LEU CB C 102 42.660 42.660 42.007 0.653 17934 4067 1 6 . 1 1 102 102 LEU H H 102 8.534 8.534 7.788 0.746 17934 4068 1 6 . 1 1 103 103 SER N N 103 112.339 112.339 112.234 0.105 17934 4069 1 6 . 1 1 103 103 SER HA H 103 4.290 4.290 4.281 0.009 17934 4070 1 6 . 1 1 103 103 SER C C 103 174.106 174.106 174.603 -0.497 17934 4071 1 6 . 1 1 103 103 SER CA C 103 60.945 60.945 60.697 0.248 17934 4072 1 6 . 1 1 103 103 SER CB C 103 63.757 63.757 63.518 0.239 17934 4073 1 6 . 1 1 103 103 SER H H 103 7.867 7.867 8.200 -0.333 17934 4074 1 6 . 1 1 104 104 THR N N 104 123.070 123.070 118.430 4.640 17934 4075 1 6 . 1 1 104 104 THR HA H 104 5.373 5.373 4.521 0.852 17934 4076 1 6 . 1 1 104 104 THR C C 104 180.693 180.693 173.029 7.664 17934 4077 1 6 . 1 1 104 104 THR CA C 104 63.289 63.289 63.424 -0.135 17934 4078 1 6 . 1 1 104 104 THR CB C 104 69.382 69.382 69.496 -0.114 17934 4079 1 6 . 1 1 104 104 THR H H 104 8.830 8.830 7.944 0.886 17934 4080 1 6 . 1 1 105 105 PHE N N 105 122.582 122.582 123.445 -0.863 17934 4081 1 6 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.963 0.507 17934 4082 1 6 . 1 1 105 105 PHE C C 105 179.211 179.211 172.251 6.960 17934 4083 1 6 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.433 -0.113 17934 4084 1 6 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.871 -0.081 17934 4085 1 6 . 1 1 105 105 PHE H H 105 9.170 9.170 8.651 0.519 17934 4086 1 6 . 1 1 106 106 ALA N N 106 119.567 119.567 124.692 -5.125 17934 4087 1 6 . 1 1 106 106 ALA C C 106 175.603 175.603 175.308 0.295 17934 4088 1 6 . 1 1 106 106 ALA H H 106 8.770 8.770 9.108 -0.338 17934 4089 1 6 . 1 1 107 107 TYR N N 107 109.933 109.933 119.858 -9.925 17934 4090 1 6 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.356 -0.436 17934 4091 1 6 . 1 1 107 107 TYR C C 107 180.426 180.426 173.144 7.282 17934 4092 1 6 . 1 1 107 107 TYR CA C 107 57.080 57.080 54.560 2.520 17934 4093 1 6 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.365 -0.576 17934 4094 1 6 . 1 1 107 107 TYR H H 107 7.950 7.950 8.777 -0.827 17934 4095 1 6 . 1 1 108 108 ILE N N 108 120.613 120.613 121.301 -0.688 17934 4096 1 6 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.575 0.795 17934 4097 1 6 . 1 1 108 108 ILE C C 108 176.212 176.212 176.023 0.189 17934 4098 1 6 . 1 1 108 108 ILE CA C 108 59.540 59.540 60.933 -1.393 17934 4099 1 6 . 1 1 108 108 ILE CB C 108 39.380 39.380 39.808 -0.428 17934 4100 1 6 . 1 1 108 108 ILE H H 108 8.869 8.869 8.239 0.630 17934 4101 1 6 . 1 1 109 109 THR N N 109 116.505 116.505 116.905 -0.400 17934 4102 1 6 . 1 1 109 109 THR HA H 109 5.669 5.669 4.566 1.103 17934 4103 1 6 . 1 1 109 109 THR C C 109 173.505 173.505 172.596 0.909 17934 4104 1 6 . 1 1 109 109 THR CA C 109 59.070 59.070 60.583 -1.513 17934 4105 1 6 . 1 1 109 109 THR H H 109 9.489 9.489 8.197 1.292 17934 4106 1 6 . 1 1 110 110 LYS N N 110 122.960 122.960 121.320 1.640 17934 4107 1 6 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.399 0.061 17934 4108 1 6 . 1 1 110 110 LYS C C 110 175.937 175.937 175.474 0.463 17934 4109 1 6 . 1 1 110 110 LYS CA C 110 55.789 55.789 56.224 -0.435 17934 4110 1 6 . 1 1 110 110 LYS CB C 110 34.227 34.227 32.965 1.262 17934 4111 1 6 . 1 1 110 110 LYS H H 110 7.831 7.831 8.290 -0.459 17934 4112 1 6 . 1 1 111 111 ASP N N 111 127.409 127.409 123.874 3.535 17934 4113 1 6 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.906 -0.125 17934 4114 1 6 . 1 1 111 111 ASP C C 111 176.396 176.396 177.236 -0.840 17934 4115 1 6 . 1 1 111 111 ASP CA C 111 53.914 53.914 52.416 1.498 17934 4116 1 6 . 1 1 111 111 ASP CB C 111 43.133 43.133 42.506 0.627 17934 4117 1 6 . 1 1 111 111 ASP H H 111 8.769 8.769 8.182 0.587 17934 4118 1 6 . 1 1 112 112 LEU N N 112 125.913 125.913 122.124 3.789 17934 4119 1 6 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.166 -0.016 17934 4120 1 6 . 1 1 112 112 LEU C C 112 178.553 178.553 177.550 1.003 17934 4121 1 6 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.025 0.165 17934 4122 1 6 . 1 1 112 112 LEU CB C 112 41.790 41.790 41.781 0.009 17934 4123 1 6 . 1 1 112 112 LEU H H 112 8.593 8.593 8.563 0.030 17934 4124 1 6 . 1 1 113 113 LYS N N 113 117.189 117.189 117.348 -0.159 17934 4125 1 6 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.225 0.037 17934 4126 1 6 . 1 1 113 113 LYS C C 113 177.180 177.180 176.106 1.074 17934 4127 1 6 . 1 1 113 113 LYS CA C 113 58.133 58.133 58.133 -0.000 17934 4128 1 6 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.894 -0.074 17934 4129 1 6 . 1 1 113 113 LYS H H 113 8.207 8.207 8.213 -0.006 17934 4130 1 6 . 1 1 114 114 SER N N 114 112.492 112.492 111.342 1.150 17934 4131 1 6 . 1 1 114 114 SER CA C 114 58.601 58.601 57.400 1.201 17934 4132 1 6 . 1 1 114 114 SER CB C 114 65.164 65.164 66.168 -1.004 17934 4133 1 6 . 1 1 114 114 SER H H 114 7.755 7.755 7.728 0.027 17934 4134 1 6 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.658 -0.269 17934 4135 1 6 . 1 1 115 115 ASN C C 115 174.203 174.203 174.946 -0.743 17934 4136 1 6 . 1 1 115 115 ASN CA C 115 54.383 54.383 53.499 0.884 17934 4137 1 6 . 1 1 115 115 ASN CB C 115 37.977 37.977 38.484 -0.507 17934 4138 1 6 . 1 1 116 116 HIS N N 116 116.822 116.822 118.891 -2.069 17934 4139 1 6 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.309 0.621 17934 4140 1 6 . 1 1 116 116 HIS C C 116 173.898 173.898 175.224 -1.326 17934 4141 1 6 . 1 1 116 116 HIS CA C 116 54.910 54.910 56.316 -1.405 17934 4142 1 6 . 1 1 116 116 HIS CB C 116 32.650 32.650 29.769 2.881 17934 4143 1 6 . 1 1 116 116 HIS H H 116 7.690 7.690 7.827 -0.137 17934 4144 1 6 . 1 1 117 117 HIS N N 117 118.253 118.253 123.688 -5.435 17934 4145 1 6 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.301 1.019 17934 4146 1 6 . 1 1 117 117 HIS C C 117 173.695 173.695 174.315 -0.620 17934 4147 1 6 . 1 1 117 117 HIS CA C 117 56.350 56.350 57.350 -1.000 17934 4148 1 6 . 1 1 117 117 HIS CB C 117 32.350 32.350 27.644 4.706 17934 4149 1 6 . 1 1 117 117 HIS H H 117 8.340 8.340 8.292 0.048 17934 4150 1 6 . 1 1 118 118 TYR N N 118 118.301 118.301 122.714 -4.413 17934 4151 1 6 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.659 0.351 17934 4152 1 6 . 1 1 118 118 TYR C C 118 173.530 173.530 175.167 -1.637 17934 4153 1 6 . 1 1 118 118 TYR CA C 118 56.730 56.730 58.856 -2.126 17934 4154 1 6 . 1 1 118 118 TYR CB C 118 43.240 43.240 41.339 1.901 17934 4155 1 6 . 1 1 118 118 TYR H H 118 9.080 9.080 8.189 0.891 17934 4156 1 6 . 1 1 119 119 CYS N N 119 121.015 121.015 121.647 -0.632 17934 4157 1 6 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.652 0.411 17934 4158 1 6 . 1 1 119 119 CYS C C 119 180.664 180.664 173.095 7.569 17934 4159 1 6 . 1 1 119 119 CYS CA C 119 56.726 56.726 56.668 0.058 17934 4160 1 6 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.949 0.590 17934 4161 1 6 . 1 1 119 119 CYS H H 119 9.120 9.120 8.873 0.247 17934 4162 1 6 . 1 1 120 120 HIS N N 120 110.134 110.134 128.418 -18.284 17934 4163 1 6 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.400 0.299 17934 4164 1 6 . 1 1 120 120 HIS C C 120 180.776 180.776 172.933 7.843 17934 4165 1 6 . 1 1 120 120 HIS CA C 120 55.320 55.320 55.846 -0.526 17934 4166 1 6 . 1 1 120 120 HIS CB C 120 32.352 32.352 30.491 1.861 17934 4167 1 6 . 1 1 120 120 HIS H H 120 8.482 8.482 8.681 -0.199 17934 4168 1 6 . 1 1 121 121 VAL N N 121 120.855 120.855 123.061 -2.206 17934 4169 1 6 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.060 0.290 17934 4170 1 6 . 1 1 121 121 VAL C C 121 173.419 173.419 172.724 0.695 17934 4171 1 6 . 1 1 121 121 VAL CA C 121 61.410 61.410 59.909 1.501 17934 4172 1 6 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.299 -0.019 17934 4173 1 6 . 1 1 121 121 VAL H H 121 7.929 7.929 8.418 -0.489 17934 4174 1 6 . 1 1 122 122 PHE N N 122 124.384 124.384 127.722 -3.338 17934 4175 1 6 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.254 0.166 17934 4176 1 6 . 1 1 122 122 PHE C C 122 174.876 174.876 174.490 0.386 17934 4177 1 6 . 1 1 122 122 PHE CA C 122 55.320 55.320 54.087 1.233 17934 4178 1 6 . 1 1 122 122 PHE CB C 122 44.540 44.540 42.861 1.679 17934 4179 1 6 . 1 1 122 122 PHE H H 122 8.910 8.910 8.851 0.059 17934 4180 1 6 . 1 1 123 123 THR N N 123 112.451 112.451 113.074 -0.623 17934 4181 1 6 . 1 1 123 123 THR HA H 123 5.147 5.147 4.457 0.690 17934 4182 1 6 . 1 1 123 123 THR C C 123 174.096 174.096 173.237 0.859 17934 4183 1 6 . 1 1 123 123 THR CA C 123 61.843 61.843 59.524 2.319 17934 4184 1 6 . 1 1 123 123 THR CB C 123 71.218 71.218 70.214 1.004 17934 4185 1 6 . 1 1 123 123 THR H H 123 8.668 8.668 8.717 -0.049 17934 4186 1 6 . 1 1 124 124 ALA N N 124 128.922 128.922 126.142 2.780 17934 4187 1 6 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.848 -0.128 17934 4188 1 6 . 1 1 124 124 ALA C C 124 177.168 177.168 176.659 0.509 17934 4189 1 6 . 1 1 124 124 ALA CA C 124 50.890 50.890 50.828 0.062 17934 4190 1 6 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.311 -0.211 17934 4191 1 6 . 1 1 124 124 ALA H H 124 9.180 9.180 8.162 1.018 17934 4192 1 6 . 1 1 125 125 PHE N N 125 115.427 115.427 118.279 -2.852 17934 4193 1 6 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.503 -0.213 17934 4194 1 6 . 1 1 125 125 PHE C C 125 174.703 174.703 175.513 -0.810 17934 4195 1 6 . 1 1 125 125 PHE CA C 125 60.470 60.470 58.808 1.662 17934 4196 1 6 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.546 -1.486 17934 4197 1 6 . 1 1 125 125 PHE H H 125 8.560 8.560 8.754 -0.194 17934 4198 1 6 . 1 1 126 126 ASP N N 126 115.745 115.745 119.013 -3.268 17934 4199 1 6 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.920 -0.077 17934 4200 1 6 . 1 1 126 126 ASP C C 126 176.532 176.532 176.124 0.408 17934 4201 1 6 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.297 0.148 17934 4202 1 6 . 1 1 126 126 ASP CB C 126 44.070 44.070 43.434 0.636 17934 4203 1 6 . 1 1 126 126 ASP H H 126 7.417 7.417 7.693 -0.276 17934 4204 1 6 . 1 1 127 127 VAL N N 127 121.923 121.923 125.166 -3.243 17934 4205 1 6 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.519 0.071 17934 4206 1 6 . 1 1 127 127 VAL C C 127 176.863 176.863 177.040 -0.177 17934 4207 1 6 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.963 -1.333 17934 4208 1 6 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.201 -0.371 17934 4209 1 6 . 1 1 127 127 VAL H H 127 8.508 8.508 8.783 -0.275 17934 4210 1 6 . 1 1 128 128 ASN N N 128 118.851 118.851 118.108 0.743 17934 4211 1 6 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.472 0.004 17934 4212 1 6 . 1 1 128 128 ASN C C 128 178.251 178.251 177.467 0.784 17934 4213 1 6 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.155 0.103 17934 4214 1 6 . 1 1 128 128 ASN CB C 128 37.977 37.977 37.888 0.089 17934 4215 1 6 . 1 1 128 128 ASN H H 128 8.207 8.207 8.446 -0.239 17934 4216 1 6 . 1 1 129 129 LEU N N 129 122.549 122.549 121.106 1.443 17934 4217 1 6 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.937 0.273 17934 4218 1 6 . 1 1 129 129 LEU C C 129 178.003 178.003 178.503 -0.500 17934 4219 1 6 . 1 1 129 129 LEU CA C 129 57.190 57.190 56.796 0.394 17934 4220 1 6 . 1 1 129 129 LEU CB C 129 41.790 41.790 40.435 1.355 17934 4221 1 6 . 1 1 129 129 LEU H H 129 8.223 8.223 8.030 0.193 17934 4222 1 6 . 1 1 130 130 ALA N N 130 120.036 120.036 122.127 -2.091 17934 4223 1 6 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.938 -0.628 17934 4224 1 6 . 1 1 130 130 ALA C C 130 178.172 178.172 179.192 -1.020 17934 4225 1 6 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.469 0.311 17934 4226 1 6 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.238 0.832 17934 4227 1 6 . 1 1 130 130 ALA H H 130 7.360 7.360 8.460 -1.101 17934 4228 1 6 . 1 1 131 131 ALA N N 131 116.989 116.989 119.730 -2.741 17934 4229 1 6 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.992 -0.282 17934 4230 1 6 . 1 1 131 131 ALA C C 131 180.163 180.163 180.030 0.133 17934 4231 1 6 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.576 1.204 17934 4232 1 6 . 1 1 131 131 ALA CB C 131 17.830 17.830 17.991 -0.161 17934 4233 1 6 . 1 1 131 131 ALA H H 131 7.360 7.360 8.209 -0.849 17934 4234 1 6 . 1 1 132 132 GLU N N 132 119.462 119.462 120.304 -0.842 17934 4235 1 6 . 1 1 132 132 GLU HA H 132 3.888 3.888 4.048 -0.160 17934 4236 1 6 . 1 1 132 132 GLU C C 132 179.243 179.243 178.768 0.475 17934 4237 1 6 . 1 1 132 132 GLU CA C 132 59.539 59.539 59.358 0.182 17934 4238 1 6 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.628 -0.089 17934 4239 1 6 . 1 1 132 132 GLU H H 132 7.673 7.673 8.176 -0.503 17934 4240 1 6 . 1 1 133 133 ILE N N 133 123.218 123.218 121.102 2.116 17934 4241 1 6 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.675 -0.895 17934 4242 1 6 . 1 1 133 133 ILE C C 133 177.421 177.421 178.233 -0.812 17934 4243 1 6 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.595 0.895 17934 4244 1 6 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.826 -1.176 17934 4245 1 6 . 1 1 133 133 ILE H H 133 8.154 8.154 8.451 -0.297 17934 4246 1 6 . 1 1 134 134 ILE N N 134 118.244 118.244 118.832 -0.588 17934 4247 1 6 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.590 -0.050 17934 4248 1 6 . 1 1 134 134 ILE C C 134 179.385 179.385 178.544 0.841 17934 4249 1 6 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.526 -1.246 17934 4250 1 6 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.673 -0.573 17934 4251 1 6 . 1 1 134 134 ILE H H 134 7.376 7.376 8.188 -0.812 17934 4252 1 6 . 1 1 135 135 LEU N N 135 123.061 123.061 121.998 1.063 17934 4253 1 6 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.916 0.274 17934 4254 1 6 . 1 1 135 135 LEU C C 135 179.858 179.858 178.512 1.346 17934 4255 1 6 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.633 -0.443 17934 4256 1 6 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.853 0.007 17934 4257 1 6 . 1 1 135 135 LEU H H 135 8.036 8.036 7.959 0.077 17934 4258 1 6 . 1 1 136 136 THR N N 136 119.647 119.647 115.277 4.370 17934 4259 1 6 . 1 1 136 136 THR HA H 136 3.725 3.725 3.945 -0.220 17934 4260 1 6 . 1 1 136 136 THR C C 136 176.088 176.088 176.579 -0.491 17934 4261 1 6 . 1 1 136 136 THR CA C 136 58.601 58.601 67.218 -8.617 17934 4262 1 6 . 1 1 136 136 THR CB C 136 67.976 67.976 69.075 -1.099 17934 4263 1 6 . 1 1 136 136 THR H H 136 8.508 8.508 8.242 0.266 17934 4264 1 6 . 1 1 137 137 LEU N N 137 123.182 123.182 121.482 1.700 17934 4265 1 6 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.937 -0.197 17934 4266 1 6 . 1 1 137 137 LEU C C 137 178.341 178.341 178.896 -0.555 17934 4267 1 6 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.432 -0.172 17934 4268 1 6 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.297 0.253 17934 4269 1 6 . 1 1 137 137 LEU H H 137 8.520 8.520 8.634 -0.114 17934 4270 1 6 . 1 1 138 138 GLY N N 138 105.266 105.266 105.245 0.021 17934 4271 1 6 . 1 1 138 138 GLY C C 138 176.973 176.973 175.776 1.197 17934 4272 1 6 . 1 1 138 138 GLY CA C 138 47.351 47.351 46.729 0.622 17934 4273 1 6 . 1 1 138 138 GLY H H 138 7.858 7.858 7.878 -0.020 17934 4274 1 6 . 1 1 139 139 GLN N N 139 123.485 123.485 122.239 1.246 17934 4275 1 6 . 1 1 139 139 GLN C C 139 177.891 177.891 178.367 -0.476 17934 4276 1 6 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.630 -0.029 17934 4277 1 6 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.567 -0.434 17934 4278 1 6 . 1 1 139 139 GLN H H 139 8.195 8.195 8.487 -0.292 17934 4279 1 6 . 1 1 140 140 ALA N N 140 122.754 122.754 121.694 1.060 17934 4280 1 6 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.236 -0.527 17934 4281 1 6 . 1 1 140 140 ALA C C 140 178.987 178.987 179.347 -0.360 17934 4282 1 6 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.716 1.064 17934 4283 1 6 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.233 -0.823 17934 4284 1 6 . 1 1 140 140 ALA H H 140 8.530 8.530 8.659 -0.130 17934 4285 1 6 . 1 1 141 141 PHE N N 141 116.275 116.275 120.970 -4.695 17934 4286 1 6 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.625 -0.535 17934 4287 1 6 . 1 1 141 141 PHE C C 141 178.129 178.129 177.516 0.613 17934 4288 1 6 . 1 1 141 141 PHE CA C 141 61.240 61.240 59.013 2.227 17934 4289 1 6 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.044 0.339 17934 4290 1 6 . 1 1 141 141 PHE H H 141 7.920 7.920 8.306 -0.386 17934 4291 1 6 . 1 1 142 142 GLU N N 142 119.967 119.967 119.510 0.457 17934 4292 1 6 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.552 0.675 17934 4293 1 6 . 1 1 142 142 GLU C C 142 179.250 179.250 178.619 0.631 17934 4294 1 6 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.592 0.947 17934 4295 1 6 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.467 0.072 17934 4296 1 6 . 1 1 142 142 GLU H H 142 7.713 7.713 8.290 -0.577 17934 4297 1 6 . 1 1 143 143 VAL N N 143 120.189 120.189 120.587 -0.398 17934 4298 1 6 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.696 -0.013 17934 4299 1 6 . 1 1 143 143 VAL C C 143 178.066 178.066 177.032 1.034 17934 4300 1 6 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.984 1.587 17934 4301 1 6 . 1 1 143 143 VAL CB C 143 31.883 31.883 31.401 0.482 17934 4302 1 6 . 1 1 143 143 VAL H H 143 8.608 8.608 7.833 0.775 17934 4303 1 6 . 1 1 144 144 ALA N N 144 121.753 121.753 121.802 -0.049 17934 4304 1 6 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.068 -0.068 17934 4305 1 6 . 1 1 144 144 ALA C C 144 180.776 180.776 178.833 1.943 17934 4306 1 6 . 1 1 144 144 ALA CA C 144 55.780 55.780 54.425 1.355 17934 4307 1 6 . 1 1 144 144 ALA CB C 144 18.770 18.770 18.828 -0.058 17934 4308 1 6 . 1 1 144 144 ALA H H 144 8.399 8.399 7.469 0.930 17934 4309 1 6 . 1 1 145 145 TYR N N 145 119.962 119.962 118.144 1.818 17934 4310 1 6 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.309 -0.119 17934 4311 1 6 . 1 1 145 145 TYR C C 145 177.645 177.645 175.451 2.194 17934 4312 1 6 . 1 1 145 145 TYR CA C 145 60.880 60.880 59.390 1.490 17934 4313 1 6 . 1 1 145 145 TYR CB C 145 37.980 37.980 38.681 -0.701 17934 4314 1 6 . 1 1 145 145 TYR H H 145 8.190 8.190 8.240 -0.050 17934 4315 1 7 . 1 1 13 13 LYS N N 13 120.778 120.778 123.068 -2.290 17934 4316 1 7 . 1 1 13 13 LYS C C 13 176.476 176.476 174.892 1.584 17934 4317 1 7 . 1 1 13 13 LYS CA C 13 58.601 58.601 55.687 2.914 17934 4318 1 7 . 1 1 13 13 LYS CB C 13 32.820 32.820 34.327 -1.507 17934 4319 1 7 . 1 1 13 13 LYS H H 13 7.984 7.984 7.930 0.054 17934 4320 1 7 . 1 1 15 15 ILE HA H 15 3.820 3.820 3.857 -0.037 17934 4321 1 7 . 1 1 15 15 ILE C C 15 176.376 176.376 176.863 -0.487 17934 4322 1 7 . 1 1 15 15 ILE CA C 15 63.570 63.570 62.889 0.681 17934 4323 1 7 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.782 1.598 17934 4324 1 7 . 1 1 16 16 ALA N N 16 121.364 121.364 119.940 1.424 17934 4325 1 7 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.404 0.034 17934 4326 1 7 . 1 1 16 16 ALA C C 16 177.494 177.494 177.567 -0.073 17934 4327 1 7 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.993 -0.017 17934 4328 1 7 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.146 1.187 17934 4329 1 7 . 1 1 16 16 ALA H H 16 8.081 8.081 7.850 0.231 17934 4330 1 7 . 1 1 17 17 GLN N N 17 118.109 118.109 116.640 1.469 17934 4331 1 7 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.460 0.113 17934 4332 1 7 . 1 1 17 17 GLN C C 17 173.632 173.632 174.788 -1.156 17934 4333 1 7 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.151 -0.300 17934 4334 1 7 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.605 -0.128 17934 4335 1 7 . 1 1 17 17 GLN H H 17 7.550 7.550 7.474 0.076 17934 4336 1 7 . 1 1 18 18 SER N N 18 112.384 112.384 115.083 -2.699 17934 4337 1 7 . 1 1 18 18 SER HA H 18 4.388 4.388 5.006 -0.618 17934 4338 1 7 . 1 1 18 18 SER C C 18 173.780 173.780 172.642 1.138 17934 4339 1 7 . 1 1 18 18 SER CA C 18 57.664 57.664 57.086 0.578 17934 4340 1 7 . 1 1 18 18 SER CB C 18 65.164 65.164 65.267 -0.103 17934 4341 1 7 . 1 1 18 18 SER H H 18 7.666 7.666 7.985 -0.319 17934 4342 1 7 . 1 1 19 19 CYS N N 19 120.116 120.116 123.813 -3.697 17934 4343 1 7 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.359 -0.029 17934 4344 1 7 . 1 1 19 19 CYS C C 19 180.387 180.387 173.706 6.681 17934 4345 1 7 . 1 1 19 19 CYS CA C 19 58.601 58.601 59.306 -0.704 17934 4346 1 7 . 1 1 19 19 CYS CB C 19 30.008 30.008 28.700 1.308 17934 4347 1 7 . 1 1 19 19 CYS H H 19 8.835 8.835 8.822 0.013 17934 4348 1 7 . 1 1 20 20 ASP N N 20 124.416 124.416 125.028 -0.612 17934 4349 1 7 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.562 -0.586 17934 4350 1 7 . 1 1 20 20 ASP CB C 20 42.195 42.195 43.558 -1.363 17934 4351 1 7 . 1 1 20 20 ASP H H 20 7.847 7.847 8.404 -0.557 17934 4352 1 7 . 1 1 21 21 TYR N N 21 121.296 121.296 122.114 -0.818 17934 4353 1 7 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.726 0.004 17934 4354 1 7 . 1 1 21 21 TYR C C 21 175.793 175.793 174.498 1.295 17934 4355 1 7 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.718 0.482 17934 4356 1 7 . 1 1 21 21 TYR CB C 21 43.240 43.240 43.479 -0.239 17934 4357 1 7 . 1 1 21 21 TYR H H 21 9.070 9.070 8.767 0.303 17934 4358 1 7 . 1 1 22 22 LYS N N 22 122.820 122.820 121.900 0.920 17934 4359 1 7 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.203 -0.011 17934 4360 1 7 . 1 1 22 22 LYS C C 22 175.793 175.793 175.452 0.341 17934 4361 1 7 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.480 0.778 17934 4362 1 7 . 1 1 22 22 LYS CB C 22 33.758 33.758 33.589 0.169 17934 4363 1 7 . 1 1 22 22 LYS H H 22 8.711 8.711 8.625 0.086 17934 4364 1 7 . 1 1 23 23 ALA N N 23 123.073 123.073 126.712 -3.639 17934 4365 1 7 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.953 -0.223 17934 4366 1 7 . 1 1 23 23 ALA C C 23 174.515 174.515 175.477 -0.962 17934 4367 1 7 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.909 0.661 17934 4368 1 7 . 1 1 23 23 ALA CB C 23 21.628 21.628 23.350 -1.722 17934 4369 1 7 . 1 1 23 23 ALA H H 23 8.727 8.727 8.788 -0.061 17934 4370 1 7 . 1 1 24 24 ALA N N 24 122.486 122.486 126.940 -4.454 17934 4371 1 7 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.775 0.406 17934 4372 1 7 . 1 1 24 24 ALA C C 24 176.835 176.835 176.430 0.405 17934 4373 1 7 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.472 0.098 17934 4374 1 7 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.064 0.056 17934 4375 1 7 . 1 1 24 24 ALA H H 24 8.675 8.675 8.897 -0.222 17934 4376 1 7 . 1 1 25 25 TYR N N 25 122.698 122.698 125.261 -2.563 17934 4377 1 7 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.384 0.626 17934 4378 1 7 . 1 1 25 25 TYR CA C 25 54.340 54.340 56.638 -2.297 17934 4379 1 7 . 1 1 25 25 TYR CB C 25 39.850 39.850 37.482 2.368 17934 4380 1 7 . 1 1 25 25 TYR H H 25 8.270 8.270 8.343 -0.073 17934 4381 1 7 . 1 1 26 26 LEU N N 26 127.997 127.997 129.159 -1.162 17934 4382 1 7 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.206 -0.286 17934 4383 1 7 . 1 1 26 26 LEU C C 26 175.983 175.983 176.923 -0.940 17934 4384 1 7 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.355 0.372 17934 4385 1 7 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.257 -2.187 17934 4386 1 7 . 1 1 26 26 LEU H H 26 8.700 8.700 8.498 0.202 17934 4387 1 7 . 1 1 27 27 GLY N N 27 102.901 102.901 102.041 0.860 17934 4388 1 7 . 1 1 27 27 GLY C C 27 176.219 176.219 171.855 4.364 17934 4389 1 7 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.018 -1.417 17934 4390 1 7 . 1 1 27 27 GLY H H 27 5.891 5.891 8.258 -2.367 17934 4391 1 7 . 1 1 28 28 SER N N 28 111.551 111.551 114.669 -3.118 17934 4392 1 7 . 1 1 28 28 SER HA H 28 5.785 5.785 5.445 0.340 17934 4393 1 7 . 1 1 28 28 SER CA C 28 56.258 56.258 57.392 -1.134 17934 4394 1 7 . 1 1 28 28 SER CB C 28 65.632 65.632 66.746 -1.114 17934 4395 1 7 . 1 1 28 28 SER H H 28 7.981 7.981 8.347 -0.366 17934 4396 1 7 . 1 1 29 29 MET N N 29 119.493 119.493 121.606 -2.113 17934 4397 1 7 . 1 1 29 29 MET HA H 29 4.725 4.725 4.575 0.150 17934 4398 1 7 . 1 1 29 29 MET C C 29 174.143 174.143 174.474 -0.331 17934 4399 1 7 . 1 1 29 29 MET CA C 29 54.036 54.036 54.370 -0.334 17934 4400 1 7 . 1 1 29 29 MET CB C 29 37.268 37.268 36.609 0.659 17934 4401 1 7 . 1 1 29 29 MET H H 29 8.704 8.704 8.800 -0.096 17934 4402 1 7 . 1 1 30 30 LEU N N 30 128.150 128.150 125.526 2.624 17934 4403 1 7 . 1 1 30 30 LEU HA H 30 3.785 3.785 4.384 -0.599 17934 4404 1 7 . 1 1 30 30 LEU C C 30 175.857 175.857 175.852 0.005 17934 4405 1 7 . 1 1 30 30 LEU CA C 30 56.250 56.250 55.041 1.209 17934 4406 1 7 . 1 1 30 30 LEU CB C 30 42.660 42.660 42.243 0.417 17934 4407 1 7 . 1 1 30 30 LEU H H 30 8.630 8.630 8.459 0.171 17934 4408 1 7 . 1 1 31 31 ILE N N 31 127.723 127.723 128.762 -1.039 17934 4409 1 7 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.349 -0.159 17934 4410 1 7 . 1 1 31 31 ILE C C 31 174.881 174.881 175.364 -0.483 17934 4411 1 7 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.174 -1.514 17934 4412 1 7 . 1 1 31 31 ILE CB C 31 37.110 37.110 36.477 0.633 17934 4413 1 7 . 1 1 31 31 ILE H H 31 8.560 8.560 8.778 -0.218 17934 4414 1 7 . 1 1 32 32 LYS HA H 32 4.055 4.055 4.334 -0.279 17934 4415 1 7 . 1 1 32 32 LYS C C 32 176.272 176.272 177.665 -1.393 17934 4416 1 7 . 1 1 32 32 LYS CA C 32 58.601 58.601 59.166 -0.565 17934 4417 1 7 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.709 0.111 17934 4418 1 7 . 1 1 33 33 GLU N N 33 118.638 118.638 120.798 -2.160 17934 4419 1 7 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.309 0.079 17934 4420 1 7 . 1 1 33 33 GLU C C 33 173.962 173.962 175.717 -1.755 17934 4421 1 7 . 1 1 33 33 GLU CA C 33 54.851 54.851 55.805 -0.954 17934 4422 1 7 . 1 1 33 33 GLU CB C 33 30.945 30.945 28.152 2.793 17934 4423 1 7 . 1 1 33 33 GLU H H 33 7.723 7.723 8.443 -0.720 17934 4424 1 7 . 1 1 34 34 LEU N N 34 126.535 126.535 120.254 6.281 17934 4425 1 7 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.598 -0.653 17934 4426 1 7 . 1 1 34 34 LEU C C 34 176.870 176.870 175.623 1.247 17934 4427 1 7 . 1 1 34 34 LEU CA C 34 54.850 54.850 53.912 0.938 17934 4428 1 7 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.784 -1.064 17934 4429 1 7 . 1 1 34 34 LEU H H 34 8.446 8.446 7.936 0.510 17934 4430 1 7 . 1 1 35 35 ARG N N 35 128.447 128.447 123.092 5.355 17934 4431 1 7 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.551 0.004 17934 4432 1 7 . 1 1 35 35 ARG C C 35 176.110 176.110 175.631 0.479 17934 4433 1 7 . 1 1 35 35 ARG CA C 35 54.851 54.851 55.322 -0.471 17934 4434 1 7 . 1 1 35 35 ARG CB C 35 30.477 30.477 31.454 -0.977 17934 4435 1 7 . 1 1 35 35 ARG H H 35 8.680 8.680 8.408 0.272 17934 4436 1 7 . 1 1 36 36 GLY N N 36 107.406 107.406 113.076 -5.670 17934 4437 1 7 . 1 1 36 36 GLY CA C 36 45.906 45.906 44.777 1.129 17934 4438 1 7 . 1 1 36 36 GLY H H 36 7.182 7.182 8.432 -1.250 17934 4439 1 7 . 1 1 37 37 THR HA H 37 4.060 4.060 4.081 -0.021 17934 4440 1 7 . 1 1 37 37 THR C C 37 176.634 176.634 175.926 0.708 17934 4441 1 7 . 1 1 37 37 THR CA C 37 65.632 65.632 63.244 2.388 17934 4442 1 7 . 1 1 37 37 THR CB C 37 68.445 68.445 68.870 -0.425 17934 4443 1 7 . 1 1 38 38 GLU N N 38 122.251 122.251 121.215 1.036 17934 4444 1 7 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.889 0.237 17934 4445 1 7 . 1 1 38 38 GLU C C 38 179.981 179.981 178.255 1.726 17934 4446 1 7 . 1 1 38 38 GLU CA C 38 60.008 60.008 60.217 -0.209 17934 4447 1 7 . 1 1 38 38 GLU CB C 38 29.539 29.539 29.318 0.221 17934 4448 1 7 . 1 1 38 38 GLU H H 38 8.450 8.450 8.928 -0.478 17934 4449 1 7 . 1 1 39 39 SER N N 39 115.966 115.966 112.919 3.047 17934 4450 1 7 . 1 1 39 39 SER C C 39 175.991 175.991 176.432 -0.441 17934 4451 1 7 . 1 1 39 39 SER CA C 39 62.820 62.820 61.841 0.979 17934 4452 1 7 . 1 1 39 39 SER H H 39 7.522 7.522 7.785 -0.263 17934 4453 1 7 . 1 1 40 40 THR HA H 40 4.049 4.049 3.904 0.145 17934 4454 1 7 . 1 1 40 40 THR C C 40 175.972 175.972 176.672 -0.700 17934 4455 1 7 . 1 1 40 40 THR CA C 40 66.101 66.101 65.213 0.887 17934 4456 1 7 . 1 1 40 40 THR CB C 40 67.976 67.976 68.357 -0.381 17934 4457 1 7 . 1 1 41 41 GLN N N 41 120.354 120.354 120.986 -0.632 17934 4458 1 7 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.070 -0.311 17934 4459 1 7 . 1 1 41 41 GLN C C 41 178.483 178.483 178.477 0.006 17934 4460 1 7 . 1 1 41 41 GLN CA C 41 60.476 60.476 59.867 0.609 17934 4461 1 7 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.259 -0.126 17934 4462 1 7 . 1 1 41 41 GLN H H 41 8.271 8.271 8.259 0.012 17934 4463 1 7 . 1 1 42 42 ASP N N 42 120.757 120.757 120.810 -0.053 17934 4464 1 7 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.471 -0.112 17934 4465 1 7 . 1 1 42 42 ASP C C 42 177.480 177.480 178.085 -0.605 17934 4466 1 7 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.023 0.641 17934 4467 1 7 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.901 1.294 17934 4468 1 7 . 1 1 42 42 ASP H H 42 7.954 7.954 8.156 -0.202 17934 4469 1 7 . 1 1 43 43 ALA N N 43 120.587 120.587 122.046 -1.459 17934 4470 1 7 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.162 -0.172 17934 4471 1 7 . 1 1 43 43 ALA C C 43 179.767 179.767 180.229 -0.462 17934 4472 1 7 . 1 1 43 43 ALA CA C 43 55.320 55.320 54.894 0.426 17934 4473 1 7 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.281 0.949 17934 4474 1 7 . 1 1 43 43 ALA H H 43 7.842 7.842 8.207 -0.365 17934 4475 1 7 . 1 1 44 44 CYS N N 44 115.428 115.428 117.955 -2.527 17934 4476 1 7 . 1 1 44 44 CYS HA H 44 3.895 3.895 3.974 -0.079 17934 4477 1 7 . 1 1 44 44 CYS C C 44 176.076 176.076 176.741 -0.665 17934 4478 1 7 . 1 1 44 44 CYS CA C 44 64.695 64.695 64.047 0.648 17934 4479 1 7 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.504 0.160 17934 4480 1 7 . 1 1 44 44 CYS H H 44 7.900 7.900 8.383 -0.483 17934 4481 1 7 . 1 1 45 45 ALA N N 45 120.487 120.487 122.035 -1.548 17934 4482 1 7 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.910 0.090 17934 4483 1 7 . 1 1 45 45 ALA C C 45 173.506 173.506 178.972 -5.466 17934 4484 1 7 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.464 -0.144 17934 4485 1 7 . 1 1 45 45 ALA CB C 45 17.940 17.940 17.987 -0.047 17934 4486 1 7 . 1 1 45 45 ALA H H 45 7.250 7.250 8.087 -0.837 17934 4487 1 7 . 1 1 46 46 LYS N N 46 119.267 119.267 119.235 0.032 17934 4488 1 7 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.948 -0.001 17934 4489 1 7 . 1 1 46 46 LYS C C 46 179.561 179.561 178.777 0.784 17934 4490 1 7 . 1 1 46 46 LYS H H 46 8.102 8.102 8.241 -0.139 17934 4491 1 7 . 1 1 47 47 MET N N 47 118.009 118.009 118.341 -0.332 17934 4492 1 7 . 1 1 47 47 MET HA H 47 4.214 4.214 4.100 0.114 17934 4493 1 7 . 1 1 47 47 MET C C 47 179.526 179.526 178.067 1.459 17934 4494 1 7 . 1 1 47 47 MET CA C 47 57.195 57.195 58.595 -1.400 17934 4495 1 7 . 1 1 47 47 MET CB C 47 30.945 30.945 32.506 -1.561 17934 4496 1 7 . 1 1 47 47 MET H H 47 8.585 8.585 7.796 0.789 17934 4497 1 7 . 1 1 48 48 ARG N N 48 119.962 119.962 119.860 0.102 17934 4498 1 7 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.940 -0.084 17934 4499 1 7 . 1 1 48 48 ARG C C 48 178.875 178.875 178.474 0.401 17934 4500 1 7 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.635 1.310 17934 4501 1 7 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.988 0.489 17934 4502 1 7 . 1 1 48 48 ARG H H 48 8.190 8.190 8.431 -0.241 17934 4503 1 7 . 1 1 49 49 ALA N N 49 120.640 120.640 120.198 0.442 17934 4504 1 7 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.163 -0.420 17934 4505 1 7 . 1 1 49 49 ALA C C 49 180.169 180.169 179.261 0.908 17934 4506 1 7 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.564 0.287 17934 4507 1 7 . 1 1 49 49 ALA CB C 49 17.821 17.821 18.252 -0.431 17934 4508 1 7 . 1 1 49 49 ALA H H 49 7.671 7.671 8.417 -0.746 17934 4509 1 7 . 1 1 50 50 ASN N N 50 116.063 116.063 116.890 -0.827 17934 4510 1 7 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.533 -0.059 17934 4511 1 7 . 1 1 50 50 ASN C C 50 177.084 177.084 177.335 -0.251 17934 4512 1 7 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.898 -0.109 17934 4513 1 7 . 1 1 50 50 ASN CB C 50 38.914 38.914 39.177 -0.263 17934 4514 1 7 . 1 1 50 50 ASN H H 50 7.893 7.893 8.133 -0.240 17934 4515 1 7 . 1 1 51 51 CYS N N 51 116.884 116.884 118.495 -1.611 17934 4516 1 7 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.396 -0.090 17934 4517 1 7 . 1 1 51 51 CYS C C 51 175.002 175.002 175.947 -0.945 17934 4518 1 7 . 1 1 51 51 CYS CA C 51 61.414 61.414 60.587 0.827 17934 4519 1 7 . 1 1 51 51 CYS CB C 51 27.664 27.664 28.367 -0.703 17934 4520 1 7 . 1 1 51 51 CYS H H 51 7.770 7.770 8.515 -0.745 17934 4521 1 7 . 1 1 52 52 GLN N N 52 117.831 117.831 121.675 -3.844 17934 4522 1 7 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.045 0.183 17934 4523 1 7 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.647 -1.921 17934 4524 1 7 . 1 1 52 52 GLN CB C 52 29.070 29.070 27.953 1.117 17934 4525 1 7 . 1 1 52 52 GLN H H 52 7.796 7.796 7.972 -0.176 17934 4526 1 7 . 1 1 53 53 LYS N N 53 118.841 118.841 116.667 2.174 17934 4527 1 7 . 1 1 53 53 LYS CA C 53 57.195 57.195 56.898 0.297 17934 4528 1 7 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.740 0.549 17934 4529 1 7 . 1 1 53 53 LYS H H 53 7.686 7.686 7.733 -0.047 17934 4530 1 7 . 1 1 55 55 THR HA H 55 4.304 4.304 3.896 0.408 17934 4531 1 7 . 1 1 55 55 THR CA C 55 63.757 63.757 66.127 -2.370 17934 4532 1 7 . 1 1 55 55 THR CB C 55 68.914 68.914 68.508 0.406 17934 4533 1 7 . 1 1 56 56 GLU N N 56 120.861 120.861 120.101 0.760 17934 4534 1 7 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.124 0.023 17934 4535 1 7 . 1 1 56 56 GLU C C 56 177.656 177.656 178.210 -0.554 17934 4536 1 7 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.530 -0.397 17934 4537 1 7 . 1 1 56 56 GLU CB C 56 30.008 30.008 29.670 0.338 17934 4538 1 7 . 1 1 56 56 GLU H H 56 8.311 8.311 7.598 0.713 17934 4539 1 7 . 1 1 57 57 GLN N N 57 118.397 118.397 119.160 -0.763 17934 4540 1 7 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.134 0.008 17934 4541 1 7 . 1 1 57 57 GLN C C 57 177.275 177.275 178.340 -1.065 17934 4542 1 7 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.857 -0.193 17934 4543 1 7 . 1 1 57 57 GLN CB C 57 29.070 29.070 29.130 -0.060 17934 4544 1 7 . 1 1 57 57 GLN H H 57 7.899 7.899 7.752 0.147 17934 4545 1 7 . 1 1 58 58 MET N N 58 118.897 118.897 115.732 3.165 17934 4546 1 7 . 1 1 58 58 MET HA H 58 4.350 4.350 4.349 0.001 17934 4547 1 7 . 1 1 58 58 MET C C 58 177.172 177.172 176.105 1.067 17934 4548 1 7 . 1 1 58 58 MET CA C 58 56.726 56.726 56.729 -0.003 17934 4549 1 7 . 1 1 58 58 MET CB C 58 32.196 32.196 32.819 -0.623 17934 4550 1 7 . 1 1 58 58 MET H H 58 8.036 8.036 8.003 0.033 17934 4551 1 7 . 1 1 59 59 LYS N N 59 119.779 119.779 119.466 0.313 17934 4552 1 7 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.116 0.115 17934 4553 1 7 . 1 1 59 59 LYS C C 59 176.676 176.676 175.678 0.998 17934 4554 1 7 . 1 1 59 59 LYS CA C 59 57.195 57.195 57.015 0.180 17934 4555 1 7 . 1 1 59 59 LYS CB C 59 32.820 32.820 30.282 2.538 17934 4556 1 7 . 1 1 59 59 LYS H H 59 7.901 7.901 7.555 0.346 17934 4557 1 7 . 1 1 60 60 LYS N N 60 119.993 119.993 118.564 1.429 17934 4558 1 7 . 1 1 60 60 LYS HA H 60 4.335 4.335 3.893 0.442 17934 4559 1 7 . 1 1 60 60 LYS C C 60 176.336 176.336 174.813 1.523 17934 4560 1 7 . 1 1 60 60 LYS CA C 60 56.258 56.258 56.950 -0.693 17934 4561 1 7 . 1 1 60 60 LYS CB C 60 32.820 32.820 32.858 -0.038 17934 4562 1 7 . 1 1 60 60 LYS H H 60 7.877 7.877 7.869 0.008 17934 4563 1 7 . 1 1 61 61 VAL N N 61 122.649 122.649 121.389 1.260 17934 4564 1 7 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.618 -0.238 17934 4565 1 7 . 1 1 61 61 VAL C C 61 174.210 174.210 173.950 0.260 17934 4566 1 7 . 1 1 61 61 VAL CA C 61 60.000 60.000 59.896 0.104 17934 4567 1 7 . 1 1 61 61 VAL CB C 61 32.350 32.350 32.707 -0.357 17934 4568 1 7 . 1 1 61 61 VAL H H 61 7.708 7.708 8.409 -0.701 17934 4569 1 7 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.722 -0.059 17934 4570 1 7 . 1 1 62 62 PRO C C 62 176.656 176.656 175.702 0.954 17934 4571 1 7 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.426 0.394 17934 4572 1 7 . 1 1 62 62 PRO CB C 62 31.883 31.883 33.547 -1.664 17934 4573 1 7 . 1 1 63 63 THR N N 63 117.155 117.155 115.399 1.756 17934 4574 1 7 . 1 1 63 63 THR HA H 63 4.830 4.830 4.682 0.148 17934 4575 1 7 . 1 1 63 63 THR C C 63 174.682 174.682 173.463 1.219 17934 4576 1 7 . 1 1 63 63 THR CA C 63 62.820 62.820 61.926 0.894 17934 4577 1 7 . 1 1 63 63 THR CB C 63 69.382 69.382 69.746 -0.364 17934 4578 1 7 . 1 1 63 63 THR H H 63 8.303 8.303 8.490 -0.187 17934 4579 1 7 . 1 1 64 64 ILE N N 64 121.004 121.004 125.774 -4.770 17934 4580 1 7 . 1 1 64 64 ILE CA C 64 58.600 58.600 58.190 0.410 17934 4581 1 7 . 1 1 64 64 ILE CB C 64 42.690 42.690 41.345 1.345 17934 4582 1 7 . 1 1 64 64 ILE H H 64 9.348 9.348 8.968 0.380 17934 4583 1 7 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.124 0.616 17934 4584 1 7 . 1 1 65 65 ILE C C 65 175.378 175.378 174.767 0.611 17934 4585 1 7 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.084 -1.004 17934 4586 1 7 . 1 1 65 65 ILE CB C 65 38.750 38.750 38.111 0.639 17934 4587 1 7 . 1 1 66 66 LEU N N 66 110.343 110.343 129.971 -19.628 17934 4588 1 7 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.895 -0.045 17934 4589 1 7 . 1 1 66 66 LEU C C 66 174.982 174.982 175.574 -0.592 17934 4590 1 7 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.461 -0.551 17934 4591 1 7 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.807 1.423 17934 4592 1 7 . 1 1 66 66 LEU H H 66 9.610 9.610 9.330 0.280 17934 4593 1 7 . 1 1 67 67 SER N N 67 120.990 120.990 120.180 0.810 17934 4594 1 7 . 1 1 67 67 SER HA H 67 5.405 5.405 4.890 0.515 17934 4595 1 7 . 1 1 67 67 SER C C 67 174.405 174.405 172.877 1.528 17934 4596 1 7 . 1 1 67 67 SER CA C 67 57.195 57.195 56.720 0.475 17934 4597 1 7 . 1 1 67 67 SER CB C 67 64.695 64.695 63.796 0.899 17934 4598 1 7 . 1 1 67 67 SER H H 67 9.260 9.260 8.874 0.386 17934 4599 1 7 . 1 1 68 68 VAL N N 68 128.176 128.176 125.701 2.475 17934 4600 1 7 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.305 0.188 17934 4601 1 7 . 1 1 68 68 VAL C C 68 173.891 173.891 173.298 0.593 17934 4602 1 7 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.305 2.045 17934 4603 1 7 . 1 1 68 68 VAL CB C 68 33.750 33.750 33.867 -0.117 17934 4604 1 7 . 1 1 68 68 VAL H H 68 9.225 9.225 8.754 0.471 17934 4605 1 7 . 1 1 69 69 SER N N 69 121.697 121.697 122.872 -1.175 17934 4606 1 7 . 1 1 69 69 SER HA H 69 4.837 4.837 5.047 -0.210 17934 4607 1 7 . 1 1 69 69 SER C C 69 173.188 173.188 174.678 -1.490 17934 4608 1 7 . 1 1 69 69 SER CA C 69 57.195 57.195 55.946 1.249 17934 4609 1 7 . 1 1 69 69 SER CB C 69 67.976 67.976 65.591 2.385 17934 4610 1 7 . 1 1 69 69 SER H H 69 8.869 8.869 8.858 0.011 17934 4611 1 7 . 1 1 70 70 ALA N N 70 118.689 118.689 128.363 -9.674 17934 4612 1 7 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.229 -0.079 17934 4613 1 7 . 1 1 70 70 ALA C C 70 176.714 176.714 176.953 -0.239 17934 4614 1 7 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.005 -0.095 17934 4615 1 7 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.953 -0.353 17934 4616 1 7 . 1 1 70 70 ALA H H 70 8.810 8.810 8.424 0.386 17934 4617 1 7 . 1 1 71 71 LYS N N 71 112.633 112.633 116.152 -3.519 17934 4618 1 7 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.457 -0.182 17934 4619 1 7 . 1 1 71 71 LYS C C 71 177.033 177.033 175.779 1.254 17934 4620 1 7 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.478 1.717 17934 4621 1 7 . 1 1 71 71 LYS CB C 71 33.289 33.289 33.001 0.288 17934 4622 1 7 . 1 1 71 71 LYS H H 71 7.830 7.830 8.100 -0.270 17934 4623 1 7 . 1 1 72 72 GLY N N 72 108.432 108.432 107.376 1.056 17934 4624 1 7 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.444 0.032 17934 4625 1 7 . 1 1 72 72 GLY H H 72 7.685 7.685 7.785 -0.100 17934 4626 1 7 . 1 1 73 73 VAL N N 73 120.414 120.414 121.002 -0.588 17934 4627 1 7 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.728 0.272 17934 4628 1 7 . 1 1 73 73 VAL CA C 73 60.470 60.470 60.890 -0.420 17934 4629 1 7 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.981 -0.351 17934 4630 1 7 . 1 1 73 73 VAL H H 73 8.620 8.620 8.246 0.374 17934 4631 1 7 . 1 1 74 74 LYS N N 74 125.257 125.257 125.453 -0.196 17934 4632 1 7 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.643 0.373 17934 4633 1 7 . 1 1 74 74 LYS CA C 74 54.383 54.383 54.444 -0.061 17934 4634 1 7 . 1 1 74 74 LYS CB C 74 36.570 36.570 35.898 0.672 17934 4635 1 7 . 1 1 74 74 LYS H H 74 8.783 8.783 8.800 -0.017 17934 4636 1 7 . 1 1 75 75 PHE N N 75 119.414 119.414 117.821 1.593 17934 4637 1 7 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.229 0.471 17934 4638 1 7 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.836 -2.916 17934 4639 1 7 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.935 -1.325 17934 4640 1 7 . 1 1 75 75 PHE H H 75 8.432 8.432 9.042 -0.610 17934 4641 1 7 . 1 1 76 76 ILE N N 76 121.430 121.430 120.832 0.598 17934 4642 1 7 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.584 0.256 17934 4643 1 7 . 1 1 76 76 ILE C C 76 175.249 175.249 174.233 1.016 17934 4644 1 7 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.587 -0.516 17934 4645 1 7 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.309 -0.089 17934 4646 1 7 . 1 1 76 76 ILE H H 76 8.960 8.960 8.393 0.567 17934 4647 1 7 . 1 1 77 77 ASP N N 77 125.744 125.744 123.425 2.319 17934 4648 1 7 . 1 1 77 77 ASP HA H 77 4.563 4.563 4.880 -0.317 17934 4649 1 7 . 1 1 77 77 ASP C C 77 177.569 177.569 175.678 1.891 17934 4650 1 7 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.796 2.993 17934 4651 1 7 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.160 0.441 17934 4652 1 7 . 1 1 77 77 ASP H H 77 8.750 8.750 8.315 0.435 17934 4653 1 7 . 1 1 78 78 ALA N N 78 128.632 128.632 128.583 0.049 17934 4654 1 7 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.331 -0.361 17934 4655 1 7 . 1 1 78 78 ALA C C 78 178.052 178.052 178.173 -0.121 17934 4656 1 7 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.031 0.799 17934 4657 1 7 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.561 0.231 17934 4658 1 7 . 1 1 78 78 ALA H H 78 8.700 8.700 8.773 -0.073 17934 4659 1 7 . 1 1 79 79 THR N N 79 113.087 113.087 113.721 -0.634 17934 4660 1 7 . 1 1 79 79 THR HA H 79 4.194 4.194 4.241 -0.047 17934 4661 1 7 . 1 1 79 79 THR C C 79 175.587 175.587 175.828 -0.241 17934 4662 1 7 . 1 1 79 79 THR CA C 79 64.695 64.695 64.876 -0.181 17934 4663 1 7 . 1 1 79 79 THR CB C 79 69.382 69.382 69.654 -0.272 17934 4664 1 7 . 1 1 79 79 THR H H 79 8.779 8.779 8.287 0.492 17934 4665 1 7 . 1 1 80 80 ASN N N 80 118.434 118.434 117.021 1.413 17934 4666 1 7 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.796 -0.059 17934 4667 1 7 . 1 1 80 80 ASN CA C 80 53.445 53.445 53.096 0.349 17934 4668 1 7 . 1 1 80 80 ASN CB C 80 39.383 39.383 39.656 -0.273 17934 4669 1 7 . 1 1 80 80 ASN H H 80 8.584 8.584 8.114 0.470 17934 4670 1 7 . 1 1 81 81 LYS N N 81 112.429 112.429 116.636 -4.207 17934 4671 1 7 . 1 1 81 81 LYS C C 81 174.909 174.909 175.151 -0.242 17934 4672 1 7 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.681 -0.017 17934 4673 1 7 . 1 1 81 81 LYS CB C 81 28.602 28.602 30.659 -2.057 17934 4674 1 7 . 1 1 81 81 LYS H H 81 7.966 7.966 8.313 -0.347 17934 4675 1 7 . 1 1 82 82 ASN N N 82 116.806 116.806 115.109 1.697 17934 4676 1 7 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.806 -0.216 17934 4677 1 7 . 1 1 82 82 ASN C C 82 174.999 174.999 174.068 0.931 17934 4678 1 7 . 1 1 82 82 ASN CA C 82 52.976 52.976 51.510 1.466 17934 4679 1 7 . 1 1 82 82 ASN CB C 82 38.445 38.445 40.628 -2.183 17934 4680 1 7 . 1 1 82 82 ASN H H 82 8.455 8.455 7.701 0.754 17934 4681 1 7 . 1 1 83 83 ILE N N 83 122.447 122.447 120.654 1.793 17934 4682 1 7 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.178 -0.148 17934 4683 1 7 . 1 1 83 83 ILE C C 83 176.572 176.572 176.088 0.484 17934 4684 1 7 . 1 1 83 83 ILE CA C 83 62.350 62.350 61.284 1.066 17934 4685 1 7 . 1 1 83 83 ILE CB C 83 37.970 37.970 37.199 0.771 17934 4686 1 7 . 1 1 83 83 ILE H H 83 8.650 8.650 8.513 0.137 17934 4687 1 7 . 1 1 84 84 ILE N N 84 129.339 129.339 126.520 2.819 17934 4688 1 7 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.151 -0.231 17934 4689 1 7 . 1 1 84 84 ILE C C 84 175.873 175.873 176.174 -0.301 17934 4690 1 7 . 1 1 84 84 ILE CA C 84 62.810 62.810 61.110 1.700 17934 4691 1 7 . 1 1 84 84 ILE CB C 84 38.840 38.840 37.737 1.103 17934 4692 1 7 . 1 1 84 84 ILE H H 84 8.930 8.930 8.127 0.803 17934 4693 1 7 . 1 1 85 85 ALA N N 85 118.867 118.867 119.552 -0.685 17934 4694 1 7 . 1 1 85 85 ALA C C 85 174.100 174.100 175.047 -0.947 17934 4695 1 7 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.409 -0.839 17934 4696 1 7 . 1 1 85 85 ALA H H 85 7.048 7.048 8.122 -1.074 17934 4697 1 7 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.822 0.332 17934 4698 1 7 . 1 1 87 87 HIS C C 87 174.986 174.986 173.773 1.213 17934 4699 1 7 . 1 1 87 87 HIS CB C 87 34.350 34.350 34.250 0.100 17934 4700 1 7 . 1 1 88 88 GLU N N 88 125.372 125.372 122.313 3.059 17934 4701 1 7 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.189 0.332 17934 4702 1 7 . 1 1 88 88 GLU C C 88 179.047 179.047 177.651 1.396 17934 4703 1 7 . 1 1 88 88 GLU CA C 88 56.726 56.726 56.822 -0.096 17934 4704 1 7 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.102 0.375 17934 4705 1 7 . 1 1 88 88 GLU H H 88 9.106 9.106 8.811 0.295 17934 4706 1 7 . 1 1 89 89 ILE N N 89 124.132 124.132 123.135 0.997 17934 4707 1 7 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.784 0.235 17934 4708 1 7 . 1 1 89 89 ILE C C 89 176.095 176.095 177.381 -1.286 17934 4709 1 7 . 1 1 89 89 ILE CA C 89 62.351 62.351 64.835 -2.484 17934 4710 1 7 . 1 1 89 89 ILE CB C 89 38.914 38.914 37.939 0.975 17934 4711 1 7 . 1 1 89 89 ILE H H 89 8.055 8.055 8.971 -0.916 17934 4712 1 7 . 1 1 90 90 ARG N N 90 116.949 116.949 115.571 1.378 17934 4713 1 7 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.275 0.063 17934 4714 1 7 . 1 1 90 90 ARG C C 90 176.578 176.578 177.028 -0.450 17934 4715 1 7 . 1 1 90 90 ARG CA C 90 57.664 57.664 58.102 -0.438 17934 4716 1 7 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.101 -0.031 17934 4717 1 7 . 1 1 90 90 ARG H H 90 8.045 8.045 8.517 -0.472 17934 4718 1 7 . 1 1 91 91 ASN N N 91 116.320 116.320 117.505 -1.185 17934 4719 1 7 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.515 0.638 17934 4720 1 7 . 1 1 91 91 ASN C C 91 174.595 174.595 175.823 -1.228 17934 4721 1 7 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.450 -1.942 17934 4722 1 7 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.691 0.161 17934 4723 1 7 . 1 1 91 91 ASN H H 91 8.067 8.067 7.855 0.212 17934 4724 1 7 . 1 1 92 92 ILE N N 92 122.441 122.441 122.544 -0.103 17934 4725 1 7 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.811 1.262 17934 4726 1 7 . 1 1 92 92 ILE C C 92 175.229 175.229 175.977 -0.748 17934 4727 1 7 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.323 -0.443 17934 4728 1 7 . 1 1 92 92 ILE CB C 92 39.850 39.850 36.254 3.596 17934 4729 1 7 . 1 1 92 92 ILE H H 92 7.483 7.483 7.753 -0.270 17934 4730 1 7 . 1 1 93 93 SER N N 93 120.329 120.329 122.936 -2.607 17934 4731 1 7 . 1 1 93 93 SER HA H 93 4.684 4.684 4.136 0.548 17934 4732 1 7 . 1 1 93 93 SER C C 93 180.744 180.744 174.048 6.696 17934 4733 1 7 . 1 1 93 93 SER CA C 93 57.664 57.664 60.431 -2.768 17934 4734 1 7 . 1 1 93 93 SER CB C 93 66.570 66.570 63.995 2.575 17934 4735 1 7 . 1 1 93 93 SER H H 93 9.545 9.545 8.499 1.046 17934 4736 1 7 . 1 1 94 94 CYS N N 94 110.900 110.900 115.955 -5.055 17934 4737 1 7 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.711 -0.899 17934 4738 1 7 . 1 1 94 94 CYS C C 94 173.973 173.973 172.580 1.393 17934 4739 1 7 . 1 1 94 94 CYS CA C 94 59.539 59.539 58.450 1.089 17934 4740 1 7 . 1 1 94 94 CYS CB C 94 26.258 26.258 29.718 -3.459 17934 4741 1 7 . 1 1 94 94 CYS H H 94 8.858 8.858 7.820 1.038 17934 4742 1 7 . 1 1 95 95 ALA N N 95 121.379 121.379 122.451 -1.072 17934 4743 1 7 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.574 -0.144 17934 4744 1 7 . 1 1 95 95 ALA C C 95 178.098 178.098 175.015 3.083 17934 4745 1 7 . 1 1 95 95 ALA CA C 95 52.650 52.650 52.081 0.569 17934 4746 1 7 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.610 -2.310 17934 4747 1 7 . 1 1 95 95 ALA H H 95 8.360 8.360 8.238 0.122 17934 4748 1 7 . 1 1 96 96 ALA N N 96 122.576 122.576 123.245 -0.669 17934 4749 1 7 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.749 -0.069 17934 4750 1 7 . 1 1 96 96 ALA C C 96 175.716 175.716 174.422 1.294 17934 4751 1 7 . 1 1 96 96 ALA CA C 96 52.440 52.440 52.007 0.433 17934 4752 1 7 . 1 1 96 96 ALA CB C 96 22.700 22.700 22.141 0.559 17934 4753 1 7 . 1 1 96 96 ALA H H 96 9.080 9.080 8.767 0.313 17934 4754 1 7 . 1 1 97 97 GLN N N 97 116.903 116.903 118.807 -1.904 17934 4755 1 7 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.608 0.322 17934 4756 1 7 . 1 1 97 97 GLN C C 97 175.270 175.270 174.138 1.132 17934 4757 1 7 . 1 1 97 97 GLN CA C 97 54.851 54.851 54.090 0.761 17934 4758 1 7 . 1 1 97 97 GLN CB C 97 33.758 33.758 32.218 1.540 17934 4759 1 7 . 1 1 97 97 GLN H H 97 8.369 8.369 8.262 0.107 17934 4760 1 7 . 1 1 98 98 ASP N N 98 124.971 124.971 121.777 3.194 17934 4761 1 7 . 1 1 98 98 ASP C C 98 175.217 175.217 176.205 -0.988 17934 4762 1 7 . 1 1 98 98 ASP CA C 98 52.039 52.039 51.957 0.082 17934 4763 1 7 . 1 1 98 98 ASP CB C 98 42.195 42.195 42.210 -0.015 17934 4764 1 7 . 1 1 98 98 ASP H H 98 8.395 8.395 8.272 0.123 17934 4765 1 7 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.391 -0.157 17934 4766 1 7 . 1 1 99 99 PRO C C 99 178.433 178.433 178.288 0.145 17934 4767 1 7 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.989 -0.294 17934 4768 1 7 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.050 0.302 17934 4769 1 7 . 1 1 100 100 GLU N N 100 116.223 116.223 118.541 -2.318 17934 4770 1 7 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.092 0.128 17934 4771 1 7 . 1 1 100 100 GLU C C 100 176.678 176.678 176.237 0.441 17934 4772 1 7 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.601 -1.875 17934 4773 1 7 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.946 1.999 17934 4774 1 7 . 1 1 100 100 GLU H H 100 8.643 8.643 8.650 -0.007 17934 4775 1 7 . 1 1 101 101 ASP N N 101 119.053 119.053 119.124 -0.071 17934 4776 1 7 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.828 -0.285 17934 4777 1 7 . 1 1 101 101 ASP C C 101 174.771 174.771 176.461 -1.690 17934 4778 1 7 . 1 1 101 101 ASP CA C 101 53.914 53.914 52.629 1.285 17934 4779 1 7 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.514 0.275 17934 4780 1 7 . 1 1 101 101 ASP H H 101 7.597 7.597 7.899 -0.302 17934 4781 1 7 . 1 1 102 102 LEU N N 102 123.986 123.986 121.491 2.495 17934 4782 1 7 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.343 0.047 17934 4783 1 7 . 1 1 102 102 LEU C C 102 177.141 177.141 177.341 -0.200 17934 4784 1 7 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.310 0.350 17934 4785 1 7 . 1 1 102 102 LEU CB C 102 42.660 42.660 42.150 0.510 17934 4786 1 7 . 1 1 102 102 LEU H H 102 8.534 8.534 7.555 0.979 17934 4787 1 7 . 1 1 103 103 SER N N 103 112.339 112.339 111.026 1.313 17934 4788 1 7 . 1 1 103 103 SER HA H 103 4.290 4.290 4.279 0.011 17934 4789 1 7 . 1 1 103 103 SER C C 103 174.106 174.106 174.753 -0.647 17934 4790 1 7 . 1 1 103 103 SER CA C 103 60.945 60.945 60.559 0.386 17934 4791 1 7 . 1 1 103 103 SER CB C 103 63.757 63.757 63.246 0.511 17934 4792 1 7 . 1 1 103 103 SER H H 103 7.867 7.867 8.193 -0.326 17934 4793 1 7 . 1 1 104 104 THR N N 104 123.070 123.070 120.470 2.600 17934 4794 1 7 . 1 1 104 104 THR HA H 104 5.373 5.373 4.744 0.629 17934 4795 1 7 . 1 1 104 104 THR C C 104 180.693 180.693 172.885 7.808 17934 4796 1 7 . 1 1 104 104 THR CA C 104 63.289 63.289 63.010 0.279 17934 4797 1 7 . 1 1 104 104 THR CB C 104 69.382 69.382 70.117 -0.735 17934 4798 1 7 . 1 1 104 104 THR H H 104 8.830 8.830 7.971 0.859 17934 4799 1 7 . 1 1 105 105 PHE N N 105 122.582 122.582 123.227 -0.645 17934 4800 1 7 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.963 0.507 17934 4801 1 7 . 1 1 105 105 PHE C C 105 179.211 179.211 172.499 6.712 17934 4802 1 7 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.229 0.091 17934 4803 1 7 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.276 0.514 17934 4804 1 7 . 1 1 105 105 PHE H H 105 9.170 9.170 8.409 0.761 17934 4805 1 7 . 1 1 106 106 ALA N N 106 119.567 119.567 124.142 -4.575 17934 4806 1 7 . 1 1 106 106 ALA C C 106 175.603 175.603 175.319 0.284 17934 4807 1 7 . 1 1 106 106 ALA H H 106 8.770 8.770 8.725 0.045 17934 4808 1 7 . 1 1 107 107 TYR N N 107 109.933 109.933 118.201 -8.268 17934 4809 1 7 . 1 1 107 107 TYR HA H 107 4.920 4.920 4.960 -0.040 17934 4810 1 7 . 1 1 107 107 TYR C C 107 180.426 180.426 172.736 7.690 17934 4811 1 7 . 1 1 107 107 TYR CA C 107 57.080 57.080 55.203 1.877 17934 4812 1 7 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.047 -0.258 17934 4813 1 7 . 1 1 107 107 TYR H H 107 7.950 7.950 8.954 -1.004 17934 4814 1 7 . 1 1 108 108 ILE N N 108 120.613 120.613 120.965 -0.352 17934 4815 1 7 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.592 0.778 17934 4816 1 7 . 1 1 108 108 ILE C C 108 176.212 176.212 176.158 0.054 17934 4817 1 7 . 1 1 108 108 ILE CA C 108 59.540 59.540 59.857 -0.317 17934 4818 1 7 . 1 1 108 108 ILE CB C 108 39.380 39.380 36.523 2.857 17934 4819 1 7 . 1 1 108 108 ILE H H 108 8.869 8.869 8.136 0.733 17934 4820 1 7 . 1 1 109 109 THR N N 109 116.505 116.505 122.799 -6.294 17934 4821 1 7 . 1 1 109 109 THR HA H 109 5.669 5.669 4.476 1.193 17934 4822 1 7 . 1 1 109 109 THR C C 109 173.505 173.505 173.357 0.148 17934 4823 1 7 . 1 1 109 109 THR CA C 109 59.070 59.070 61.147 -2.077 17934 4824 1 7 . 1 1 109 109 THR H H 109 9.489 9.489 8.270 1.219 17934 4825 1 7 . 1 1 110 110 LYS N N 110 122.960 122.960 122.323 0.637 17934 4826 1 7 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.115 0.345 17934 4827 1 7 . 1 1 110 110 LYS C C 110 175.937 175.937 175.928 0.009 17934 4828 1 7 . 1 1 110 110 LYS CA C 110 55.789 55.789 55.739 0.050 17934 4829 1 7 . 1 1 110 110 LYS CB C 110 34.227 34.227 33.007 1.220 17934 4830 1 7 . 1 1 110 110 LYS H H 110 7.831 7.831 8.785 -0.954 17934 4831 1 7 . 1 1 111 111 ASP N N 111 127.409 127.409 119.213 8.196 17934 4832 1 7 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.850 -0.069 17934 4833 1 7 . 1 1 111 111 ASP C C 111 176.396 176.396 176.672 -0.276 17934 4834 1 7 . 1 1 111 111 ASP CA C 111 53.914 53.914 52.124 1.790 17934 4835 1 7 . 1 1 111 111 ASP CB C 111 43.133 43.133 41.899 1.234 17934 4836 1 7 . 1 1 111 111 ASP H H 111 8.769 8.769 8.114 0.655 17934 4837 1 7 . 1 1 112 112 LEU N N 112 125.913 125.913 120.910 5.003 17934 4838 1 7 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.191 -0.041 17934 4839 1 7 . 1 1 112 112 LEU C C 112 178.553 178.553 177.898 0.655 17934 4840 1 7 . 1 1 112 112 LEU CA C 112 57.190 57.190 58.009 -0.819 17934 4841 1 7 . 1 1 112 112 LEU CB C 112 41.790 41.790 42.303 -0.513 17934 4842 1 7 . 1 1 112 112 LEU H H 112 8.593 8.593 8.934 -0.341 17934 4843 1 7 . 1 1 113 113 LYS N N 113 117.189 117.189 116.386 0.803 17934 4844 1 7 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.262 0.000 17934 4845 1 7 . 1 1 113 113 LYS C C 113 177.180 177.180 175.377 1.803 17934 4846 1 7 . 1 1 113 113 LYS CA C 113 58.133 58.133 56.219 1.914 17934 4847 1 7 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.642 0.177 17934 4848 1 7 . 1 1 113 113 LYS H H 113 8.207 8.207 7.950 0.257 17934 4849 1 7 . 1 1 114 114 SER N N 114 112.492 112.492 110.623 1.869 17934 4850 1 7 . 1 1 114 114 SER CA C 114 58.601 58.601 58.367 0.234 17934 4851 1 7 . 1 1 114 114 SER CB C 114 65.164 65.164 61.096 4.067 17934 4852 1 7 . 1 1 114 114 SER H H 114 7.755 7.755 7.588 0.167 17934 4853 1 7 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.549 -0.160 17934 4854 1 7 . 1 1 115 115 ASN C C 115 174.203 174.203 175.499 -1.296 17934 4855 1 7 . 1 1 115 115 ASN CA C 115 54.383 54.383 55.246 -0.863 17934 4856 1 7 . 1 1 115 115 ASN CB C 115 37.977 37.977 39.840 -1.863 17934 4857 1 7 . 1 1 116 116 HIS N N 116 116.822 116.822 113.790 3.032 17934 4858 1 7 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.567 0.363 17934 4859 1 7 . 1 1 116 116 HIS C C 116 173.898 173.898 173.311 0.587 17934 4860 1 7 . 1 1 116 116 HIS CA C 116 54.910 54.910 55.810 -0.900 17934 4861 1 7 . 1 1 116 116 HIS CB C 116 32.650 32.650 32.704 -0.054 17934 4862 1 7 . 1 1 116 116 HIS H H 116 7.690 7.690 7.314 0.376 17934 4863 1 7 . 1 1 117 117 HIS N N 117 118.253 118.253 119.255 -1.002 17934 4864 1 7 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.211 1.109 17934 4865 1 7 . 1 1 117 117 HIS C C 117 173.695 173.695 174.002 -0.307 17934 4866 1 7 . 1 1 117 117 HIS CA C 117 56.350 56.350 57.700 -1.350 17934 4867 1 7 . 1 1 117 117 HIS CB C 117 32.350 32.350 28.903 3.447 17934 4868 1 7 . 1 1 117 117 HIS H H 117 8.340 8.340 8.102 0.238 17934 4869 1 7 . 1 1 118 118 TYR N N 118 118.301 118.301 123.406 -5.105 17934 4870 1 7 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.615 0.395 17934 4871 1 7 . 1 1 118 118 TYR C C 118 173.530 173.530 175.011 -1.481 17934 4872 1 7 . 1 1 118 118 TYR CA C 118 56.730 56.730 56.022 0.709 17934 4873 1 7 . 1 1 118 118 TYR CB C 118 43.240 43.240 39.877 3.363 17934 4874 1 7 . 1 1 118 118 TYR H H 118 9.080 9.080 8.182 0.898 17934 4875 1 7 . 1 1 119 119 CYS N N 119 121.015 121.015 123.204 -2.189 17934 4876 1 7 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.404 0.659 17934 4877 1 7 . 1 1 119 119 CYS C C 119 180.664 180.664 173.777 6.887 17934 4878 1 7 . 1 1 119 119 CYS CA C 119 56.726 56.726 58.318 -1.592 17934 4879 1 7 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.329 1.210 17934 4880 1 7 . 1 1 119 119 CYS H H 119 9.120 9.120 8.951 0.169 17934 4881 1 7 . 1 1 120 120 HIS N N 120 110.134 110.134 126.028 -15.894 17934 4882 1 7 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.523 0.176 17934 4883 1 7 . 1 1 120 120 HIS C C 120 180.776 180.776 173.121 7.655 17934 4884 1 7 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.035 1.285 17934 4885 1 7 . 1 1 120 120 HIS CB C 120 32.352 32.352 31.017 1.335 17934 4886 1 7 . 1 1 120 120 HIS H H 120 8.482 8.482 8.680 -0.198 17934 4887 1 7 . 1 1 121 121 VAL N N 121 120.855 120.855 122.830 -1.975 17934 4888 1 7 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.378 -0.028 17934 4889 1 7 . 1 1 121 121 VAL C C 121 173.419 173.419 172.913 0.506 17934 4890 1 7 . 1 1 121 121 VAL CA C 121 61.410 61.410 59.711 1.699 17934 4891 1 7 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.904 -0.624 17934 4892 1 7 . 1 1 121 121 VAL H H 121 7.929 7.929 8.654 -0.725 17934 4893 1 7 . 1 1 122 122 PHE N N 122 124.384 124.384 127.447 -3.063 17934 4894 1 7 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.352 0.068 17934 4895 1 7 . 1 1 122 122 PHE C C 122 174.876 174.876 174.556 0.320 17934 4896 1 7 . 1 1 122 122 PHE CA C 122 55.320 55.320 54.256 1.064 17934 4897 1 7 . 1 1 122 122 PHE CB C 122 44.540 44.540 42.808 1.732 17934 4898 1 7 . 1 1 122 122 PHE H H 122 8.910 8.910 8.982 -0.072 17934 4899 1 7 . 1 1 123 123 THR N N 123 112.451 112.451 112.996 -0.545 17934 4900 1 7 . 1 1 123 123 THR HA H 123 5.147 5.147 4.574 0.573 17934 4901 1 7 . 1 1 123 123 THR C C 123 174.096 174.096 173.474 0.622 17934 4902 1 7 . 1 1 123 123 THR CA C 123 61.843 61.843 59.633 2.210 17934 4903 1 7 . 1 1 123 123 THR CB C 123 71.218 71.218 70.216 1.002 17934 4904 1 7 . 1 1 123 123 THR H H 123 8.668 8.668 8.908 -0.240 17934 4905 1 7 . 1 1 124 124 ALA N N 124 128.922 128.922 126.277 2.645 17934 4906 1 7 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.905 -0.185 17934 4907 1 7 . 1 1 124 124 ALA C C 124 177.168 177.168 176.607 0.561 17934 4908 1 7 . 1 1 124 124 ALA CA C 124 50.890 50.890 50.832 0.058 17934 4909 1 7 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.483 -0.383 17934 4910 1 7 . 1 1 124 124 ALA H H 124 9.180 9.180 8.140 1.040 17934 4911 1 7 . 1 1 125 125 PHE N N 125 115.427 115.427 119.294 -3.867 17934 4912 1 7 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.365 -0.075 17934 4913 1 7 . 1 1 125 125 PHE C C 125 174.703 174.703 175.606 -0.903 17934 4914 1 7 . 1 1 125 125 PHE CA C 125 60.470 60.470 59.518 0.952 17934 4915 1 7 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.286 -1.226 17934 4916 1 7 . 1 1 125 125 PHE H H 125 8.560 8.560 9.003 -0.443 17934 4917 1 7 . 1 1 126 126 ASP N N 126 115.745 115.745 118.469 -2.724 17934 4918 1 7 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.953 -0.110 17934 4919 1 7 . 1 1 126 126 ASP C C 126 176.532 176.532 176.089 0.443 17934 4920 1 7 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.544 -0.099 17934 4921 1 7 . 1 1 126 126 ASP CB C 126 44.070 44.070 44.365 -0.295 17934 4922 1 7 . 1 1 126 126 ASP H H 126 7.417 7.417 7.883 -0.466 17934 4923 1 7 . 1 1 127 127 VAL N N 127 121.923 121.923 124.588 -2.665 17934 4924 1 7 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.721 -0.131 17934 4925 1 7 . 1 1 127 127 VAL C C 127 176.863 176.863 176.973 -0.110 17934 4926 1 7 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.580 -0.950 17934 4927 1 7 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.302 -0.472 17934 4928 1 7 . 1 1 127 127 VAL H H 127 8.508 8.508 8.689 -0.181 17934 4929 1 7 . 1 1 128 128 ASN N N 128 118.851 118.851 118.301 0.550 17934 4930 1 7 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.425 0.051 17934 4931 1 7 . 1 1 128 128 ASN C C 128 178.251 178.251 177.403 0.848 17934 4932 1 7 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.515 -0.257 17934 4933 1 7 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.172 -0.195 17934 4934 1 7 . 1 1 128 128 ASN H H 128 8.207 8.207 8.501 -0.294 17934 4935 1 7 . 1 1 129 129 LEU N N 129 122.549 122.549 120.489 2.060 17934 4936 1 7 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.722 0.488 17934 4937 1 7 . 1 1 129 129 LEU C C 129 178.003 178.003 177.756 0.247 17934 4938 1 7 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.297 -0.107 17934 4939 1 7 . 1 1 129 129 LEU CB C 129 41.790 41.790 41.719 0.071 17934 4940 1 7 . 1 1 129 129 LEU H H 129 8.223 8.223 7.946 0.277 17934 4941 1 7 . 1 1 130 130 ALA N N 130 120.036 120.036 121.841 -1.805 17934 4942 1 7 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.772 -0.462 17934 4943 1 7 . 1 1 130 130 ALA C C 130 178.172 178.172 179.029 -0.857 17934 4944 1 7 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.348 0.432 17934 4945 1 7 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.211 0.859 17934 4946 1 7 . 1 1 130 130 ALA H H 130 7.360 7.360 8.205 -0.845 17934 4947 1 7 . 1 1 131 131 ALA N N 131 116.989 116.989 120.427 -3.438 17934 4948 1 7 . 1 1 131 131 ALA HA H 131 3.710 3.710 4.225 -0.515 17934 4949 1 7 . 1 1 131 131 ALA C C 131 180.163 180.163 179.817 0.346 17934 4950 1 7 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.596 1.184 17934 4951 1 7 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.324 -0.494 17934 4952 1 7 . 1 1 131 131 ALA H H 131 7.360 7.360 8.304 -0.944 17934 4953 1 7 . 1 1 132 132 GLU N N 132 119.462 119.462 119.642 -0.180 17934 4954 1 7 . 1 1 132 132 GLU HA H 132 3.888 3.888 4.054 -0.166 17934 4955 1 7 . 1 1 132 132 GLU C C 132 179.243 179.243 178.682 0.561 17934 4956 1 7 . 1 1 132 132 GLU CA C 132 59.539 59.539 58.725 0.814 17934 4957 1 7 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.197 0.342 17934 4958 1 7 . 1 1 132 132 GLU H H 132 7.673 7.673 7.819 -0.146 17934 4959 1 7 . 1 1 133 133 ILE N N 133 123.218 123.218 120.681 2.537 17934 4960 1 7 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.571 -0.791 17934 4961 1 7 . 1 1 133 133 ILE C C 133 177.421 177.421 178.122 -0.701 17934 4962 1 7 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.227 1.263 17934 4963 1 7 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.318 -0.668 17934 4964 1 7 . 1 1 133 133 ILE H H 133 8.154 8.154 8.024 0.130 17934 4965 1 7 . 1 1 134 134 ILE N N 134 118.244 118.244 119.927 -1.683 17934 4966 1 7 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.539 0.001 17934 4967 1 7 . 1 1 134 134 ILE C C 134 179.385 179.385 177.715 1.670 17934 4968 1 7 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.227 -0.947 17934 4969 1 7 . 1 1 134 134 ILE CB C 134 36.100 36.100 37.067 -0.967 17934 4970 1 7 . 1 1 134 134 ILE H H 134 7.376 7.376 8.269 -0.893 17934 4971 1 7 . 1 1 135 135 LEU N N 135 123.061 123.061 120.730 2.331 17934 4972 1 7 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.750 0.440 17934 4973 1 7 . 1 1 135 135 LEU C C 135 179.858 179.858 178.698 1.160 17934 4974 1 7 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.692 -0.502 17934 4975 1 7 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.822 0.038 17934 4976 1 7 . 1 1 135 135 LEU H H 135 8.036 8.036 8.375 -0.339 17934 4977 1 7 . 1 1 136 136 THR N N 136 119.647 119.647 114.301 5.346 17934 4978 1 7 . 1 1 136 136 THR HA H 136 3.725 3.725 3.919 -0.194 17934 4979 1 7 . 1 1 136 136 THR C C 136 176.088 176.088 176.737 -0.649 17934 4980 1 7 . 1 1 136 136 THR CA C 136 58.601 58.601 66.553 -7.952 17934 4981 1 7 . 1 1 136 136 THR CB C 136 67.976 67.976 68.938 -0.962 17934 4982 1 7 . 1 1 136 136 THR H H 136 8.508 8.508 8.173 0.335 17934 4983 1 7 . 1 1 137 137 LEU N N 137 123.182 123.182 121.410 1.772 17934 4984 1 7 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.782 -0.042 17934 4985 1 7 . 1 1 137 137 LEU C C 137 178.341 178.341 178.928 -0.587 17934 4986 1 7 . 1 1 137 137 LEU CA C 137 58.260 58.260 57.962 0.298 17934 4987 1 7 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.584 -0.034 17934 4988 1 7 . 1 1 137 137 LEU H H 137 8.520 8.520 8.232 0.288 17934 4989 1 7 . 1 1 138 138 GLY N N 138 105.266 105.266 105.470 -0.204 17934 4990 1 7 . 1 1 138 138 GLY C C 138 176.973 176.973 176.063 0.910 17934 4991 1 7 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.145 0.206 17934 4992 1 7 . 1 1 138 138 GLY H H 138 7.858 7.858 8.350 -0.492 17934 4993 1 7 . 1 1 139 139 GLN N N 139 123.485 123.485 122.228 1.257 17934 4994 1 7 . 1 1 139 139 GLN C C 139 177.891 177.891 178.414 -0.523 17934 4995 1 7 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.887 -0.286 17934 4996 1 7 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.418 -0.285 17934 4997 1 7 . 1 1 139 139 GLN H H 139 8.195 8.195 8.521 -0.326 17934 4998 1 7 . 1 1 140 140 ALA N N 140 122.754 122.754 120.984 1.770 17934 4999 1 7 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.151 -0.442 17934 5000 1 7 . 1 1 140 140 ALA C C 140 178.987 178.987 179.049 -0.062 17934 5001 1 7 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.690 1.090 17934 5002 1 7 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.414 -1.004 17934 5003 1 7 . 1 1 140 140 ALA H H 140 8.530 8.530 8.531 -0.001 17934 5004 1 7 . 1 1 141 141 PHE N N 141 116.275 116.275 119.258 -2.983 17934 5005 1 7 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.301 -0.211 17934 5006 1 7 . 1 1 141 141 PHE C C 141 178.129 178.129 176.720 1.409 17934 5007 1 7 . 1 1 141 141 PHE CA C 141 61.240 61.240 59.124 2.116 17934 5008 1 7 . 1 1 141 141 PHE CB C 141 39.383 39.383 38.859 0.524 17934 5009 1 7 . 1 1 141 141 PHE H H 141 7.920 7.920 8.056 -0.136 17934 5010 1 7 . 1 1 142 142 GLU N N 142 119.967 119.967 119.522 0.445 17934 5011 1 7 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.654 0.573 17934 5012 1 7 . 1 1 142 142 GLU C C 142 179.250 179.250 177.259 1.991 17934 5013 1 7 . 1 1 142 142 GLU CA C 142 59.539 59.539 57.897 1.642 17934 5014 1 7 . 1 1 142 142 GLU CB C 142 29.539 29.539 30.264 -0.725 17934 5015 1 7 . 1 1 142 142 GLU H H 142 7.713 7.713 8.123 -0.410 17934 5016 1 7 . 1 1 143 143 VAL N N 143 120.189 120.189 118.907 1.282 17934 5017 1 7 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.685 -0.002 17934 5018 1 7 . 1 1 143 143 VAL C C 143 178.066 178.066 175.243 2.823 17934 5019 1 7 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.971 1.599 17934 5020 1 7 . 1 1 143 143 VAL CB C 143 31.883 31.883 32.254 -0.371 17934 5021 1 7 . 1 1 143 143 VAL H H 143 8.608 8.608 7.479 1.129 17934 5022 1 7 . 1 1 144 144 ALA N N 144 121.753 121.753 119.753 2.000 17934 5023 1 7 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.534 -0.534 17934 5024 1 7 . 1 1 144 144 ALA C C 144 180.776 180.776 175.417 5.359 17934 5025 1 7 . 1 1 144 144 ALA CA C 144 55.780 55.780 51.128 4.652 17934 5026 1 7 . 1 1 144 144 ALA CB C 144 18.770 18.770 20.387 -1.617 17934 5027 1 7 . 1 1 144 144 ALA H H 144 8.399 8.399 7.161 1.238 17934 5028 1 7 . 1 1 145 145 TYR N N 145 119.962 119.962 120.475 -0.513 17934 5029 1 7 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.623 -0.433 17934 5030 1 7 . 1 1 145 145 TYR C C 145 177.645 177.645 176.072 1.573 17934 5031 1 7 . 1 1 145 145 TYR CA C 145 60.880 60.880 57.053 3.826 17934 5032 1 7 . 1 1 145 145 TYR CB C 145 37.980 37.980 41.072 -3.092 17934 5033 1 7 . 1 1 145 145 TYR H H 145 8.190 8.190 8.562 -0.372 17934 5034 1 8 . 1 1 13 13 LYS N N 13 120.778 120.778 123.575 -2.797 17934 5035 1 8 . 1 1 13 13 LYS C C 13 176.476 176.476 174.576 1.900 17934 5036 1 8 . 1 1 13 13 LYS CA C 13 58.601 58.601 54.389 4.212 17934 5037 1 8 . 1 1 13 13 LYS CB C 13 32.820 32.820 34.223 -1.403 17934 5038 1 8 . 1 1 13 13 LYS H H 13 7.984 7.984 8.419 -0.435 17934 5039 1 8 . 1 1 15 15 ILE HA H 15 3.820 3.820 3.803 0.017 17934 5040 1 8 . 1 1 15 15 ILE C C 15 176.376 176.376 176.210 0.166 17934 5041 1 8 . 1 1 15 15 ILE CA C 15 63.570 63.570 63.886 -0.316 17934 5042 1 8 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.701 1.679 17934 5043 1 8 . 1 1 16 16 ALA N N 16 121.364 121.364 120.759 0.605 17934 5044 1 8 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.399 0.039 17934 5045 1 8 . 1 1 16 16 ALA C C 16 177.494 177.494 177.715 -0.221 17934 5046 1 8 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.904 0.072 17934 5047 1 8 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.971 0.362 17934 5048 1 8 . 1 1 16 16 ALA H H 16 8.081 8.081 7.559 0.522 17934 5049 1 8 . 1 1 17 17 GLN N N 17 118.109 118.109 117.485 0.624 17934 5050 1 8 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.285 0.288 17934 5051 1 8 . 1 1 17 17 GLN C C 17 173.632 173.632 176.165 -2.533 17934 5052 1 8 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.556 -0.705 17934 5053 1 8 . 1 1 17 17 GLN CB C 17 30.477 30.477 29.044 1.433 17934 5054 1 8 . 1 1 17 17 GLN H H 17 7.550 7.550 8.240 -0.690 17934 5055 1 8 . 1 1 18 18 SER N N 18 112.384 112.384 116.279 -3.895 17934 5056 1 8 . 1 1 18 18 SER HA H 18 4.388 4.388 4.374 0.014 17934 5057 1 8 . 1 1 18 18 SER C C 18 173.780 173.780 173.869 -0.089 17934 5058 1 8 . 1 1 18 18 SER CA C 18 57.664 57.664 58.156 -0.492 17934 5059 1 8 . 1 1 18 18 SER CB C 18 65.164 65.164 64.119 1.045 17934 5060 1 8 . 1 1 18 18 SER H H 18 7.666 7.666 8.027 -0.361 17934 5061 1 8 . 1 1 19 19 CYS N N 19 120.116 120.116 118.811 1.305 17934 5062 1 8 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.518 -0.188 17934 5063 1 8 . 1 1 19 19 CYS C C 19 180.387 180.387 172.387 8.000 17934 5064 1 8 . 1 1 19 19 CYS CA C 19 58.601 58.601 57.925 0.676 17934 5065 1 8 . 1 1 19 19 CYS CB C 19 30.008 30.008 30.355 -0.347 17934 5066 1 8 . 1 1 19 19 CYS H H 19 8.835 8.835 8.472 0.363 17934 5067 1 8 . 1 1 20 20 ASP N N 20 124.416 124.416 122.191 2.225 17934 5068 1 8 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.553 -0.577 17934 5069 1 8 . 1 1 20 20 ASP CB C 20 42.195 42.195 44.603 -2.408 17934 5070 1 8 . 1 1 20 20 ASP H H 20 7.847 7.847 7.922 -0.075 17934 5071 1 8 . 1 1 21 21 TYR N N 21 121.296 121.296 119.968 1.328 17934 5072 1 8 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.864 -0.135 17934 5073 1 8 . 1 1 21 21 TYR C C 21 175.793 175.793 173.965 1.828 17934 5074 1 8 . 1 1 21 21 TYR CA C 21 57.200 57.200 55.500 1.700 17934 5075 1 8 . 1 1 21 21 TYR CB C 21 43.240 43.240 41.187 2.053 17934 5076 1 8 . 1 1 21 21 TYR H H 21 9.070 9.070 8.861 0.209 17934 5077 1 8 . 1 1 22 22 LYS N N 22 122.820 122.820 120.546 2.274 17934 5078 1 8 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.382 -0.190 17934 5079 1 8 . 1 1 22 22 LYS C C 22 175.793 175.793 175.463 0.330 17934 5080 1 8 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.183 1.075 17934 5081 1 8 . 1 1 22 22 LYS CB C 22 33.758 33.758 34.497 -0.739 17934 5082 1 8 . 1 1 22 22 LYS H H 22 8.711 8.711 8.433 0.278 17934 5083 1 8 . 1 1 23 23 ALA N N 23 123.073 123.073 123.838 -0.765 17934 5084 1 8 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.207 0.523 17934 5085 1 8 . 1 1 23 23 ALA C C 23 174.515 174.515 175.233 -0.718 17934 5086 1 8 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.490 1.080 17934 5087 1 8 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.999 -1.371 17934 5088 1 8 . 1 1 23 23 ALA H H 23 8.727 8.727 8.613 0.114 17934 5089 1 8 . 1 1 24 24 ALA N N 24 122.486 122.486 124.553 -2.067 17934 5090 1 8 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.476 0.705 17934 5091 1 8 . 1 1 24 24 ALA C C 24 176.835 176.835 176.098 0.737 17934 5092 1 8 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.332 0.238 17934 5093 1 8 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.013 0.107 17934 5094 1 8 . 1 1 24 24 ALA H H 24 8.675 8.675 8.865 -0.190 17934 5095 1 8 . 1 1 25 25 TYR N N 25 122.698 122.698 125.624 -2.926 17934 5096 1 8 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.267 0.743 17934 5097 1 8 . 1 1 25 25 TYR CA C 25 54.340 54.340 57.958 -3.618 17934 5098 1 8 . 1 1 25 25 TYR CB C 25 39.850 39.850 38.069 1.781 17934 5099 1 8 . 1 1 25 25 TYR H H 25 8.270 8.270 8.524 -0.254 17934 5100 1 8 . 1 1 26 26 LEU N N 26 127.997 127.997 129.059 -1.062 17934 5101 1 8 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.247 -0.327 17934 5102 1 8 . 1 1 26 26 LEU C C 26 175.983 175.983 176.835 -0.852 17934 5103 1 8 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.371 0.355 17934 5104 1 8 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.126 -2.056 17934 5105 1 8 . 1 1 26 26 LEU H H 26 8.700 8.700 8.237 0.463 17934 5106 1 8 . 1 1 27 27 GLY N N 27 102.901 102.901 101.874 1.027 17934 5107 1 8 . 1 1 27 27 GLY C C 27 176.219 176.219 171.335 4.884 17934 5108 1 8 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.107 -1.506 17934 5109 1 8 . 1 1 27 27 GLY H H 27 5.891 5.891 8.040 -2.149 17934 5110 1 8 . 1 1 28 28 SER N N 28 111.551 111.551 114.775 -3.224 17934 5111 1 8 . 1 1 28 28 SER HA H 28 5.785 5.785 5.110 0.675 17934 5112 1 8 . 1 1 28 28 SER CA C 28 56.258 56.258 57.612 -1.355 17934 5113 1 8 . 1 1 28 28 SER CB C 28 65.632 65.632 65.692 -0.060 17934 5114 1 8 . 1 1 28 28 SER H H 28 7.981 7.981 8.404 -0.423 17934 5115 1 8 . 1 1 29 29 MET N N 29 119.493 119.493 123.734 -4.241 17934 5116 1 8 . 1 1 29 29 MET HA H 29 4.725 4.725 4.710 0.015 17934 5117 1 8 . 1 1 29 29 MET C C 29 174.143 174.143 174.764 -0.621 17934 5118 1 8 . 1 1 29 29 MET CA C 29 54.036 54.036 54.087 -0.050 17934 5119 1 8 . 1 1 29 29 MET CB C 29 37.268 37.268 36.729 0.539 17934 5120 1 8 . 1 1 29 29 MET H H 29 8.704 8.704 8.709 -0.005 17934 5121 1 8 . 1 1 30 30 LEU N N 30 128.150 128.150 126.599 1.551 17934 5122 1 8 . 1 1 30 30 LEU HA H 30 3.785 3.785 4.045 -0.260 17934 5123 1 8 . 1 1 30 30 LEU C C 30 175.857 175.857 175.102 0.755 17934 5124 1 8 . 1 1 30 30 LEU CA C 30 56.250 56.250 54.753 1.497 17934 5125 1 8 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.388 1.272 17934 5126 1 8 . 1 1 30 30 LEU H H 30 8.630 8.630 8.472 0.158 17934 5127 1 8 . 1 1 31 31 ILE N N 31 127.723 127.723 126.310 1.413 17934 5128 1 8 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.194 -0.004 17934 5129 1 8 . 1 1 31 31 ILE C C 31 174.881 174.881 173.853 1.028 17934 5130 1 8 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.290 -1.630 17934 5131 1 8 . 1 1 31 31 ILE CB C 31 37.110 37.110 39.448 -2.338 17934 5132 1 8 . 1 1 31 31 ILE H H 31 8.560 8.560 8.263 0.297 17934 5133 1 8 . 1 1 32 32 LYS HA H 32 4.055 4.055 4.424 -0.369 17934 5134 1 8 . 1 1 32 32 LYS C C 32 176.272 176.272 175.727 0.545 17934 5135 1 8 . 1 1 32 32 LYS CA C 32 58.601 58.601 55.587 3.014 17934 5136 1 8 . 1 1 32 32 LYS CB C 32 32.820 32.820 33.932 -1.112 17934 5137 1 8 . 1 1 33 33 GLU N N 33 118.638 118.638 121.414 -2.776 17934 5138 1 8 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.032 0.356 17934 5139 1 8 . 1 1 33 33 GLU C C 33 173.962 173.962 175.110 -1.148 17934 5140 1 8 . 1 1 33 33 GLU CA C 33 54.851 54.851 57.087 -2.236 17934 5141 1 8 . 1 1 33 33 GLU CB C 33 30.945 30.945 28.830 2.115 17934 5142 1 8 . 1 1 33 33 GLU H H 33 7.723 7.723 8.911 -1.188 17934 5143 1 8 . 1 1 34 34 LEU N N 34 126.535 126.535 117.611 8.924 17934 5144 1 8 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.639 -0.694 17934 5145 1 8 . 1 1 34 34 LEU C C 34 176.870 176.870 175.502 1.368 17934 5146 1 8 . 1 1 34 34 LEU CA C 34 54.850 54.850 53.877 0.973 17934 5147 1 8 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.447 -0.726 17934 5148 1 8 . 1 1 34 34 LEU H H 34 8.446 8.446 8.036 0.410 17934 5149 1 8 . 1 1 35 35 ARG N N 35 128.447 128.447 123.602 4.845 17934 5150 1 8 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.571 -0.016 17934 5151 1 8 . 1 1 35 35 ARG C C 35 176.110 176.110 175.000 1.110 17934 5152 1 8 . 1 1 35 35 ARG CA C 35 54.851 54.851 55.725 -0.874 17934 5153 1 8 . 1 1 35 35 ARG CB C 35 30.477 30.477 30.414 0.063 17934 5154 1 8 . 1 1 35 35 ARG H H 35 8.680 8.680 8.448 0.232 17934 5155 1 8 . 1 1 36 36 GLY N N 36 107.406 107.406 113.546 -6.140 17934 5156 1 8 . 1 1 36 36 GLY CA C 36 45.906 45.906 45.544 0.362 17934 5157 1 8 . 1 1 36 36 GLY H H 36 7.182 7.182 7.988 -0.806 17934 5158 1 8 . 1 1 37 37 THR HA H 37 4.060 4.060 4.168 -0.108 17934 5159 1 8 . 1 1 37 37 THR C C 37 176.634 176.634 175.666 0.968 17934 5160 1 8 . 1 1 37 37 THR CA C 37 65.632 65.632 63.524 2.108 17934 5161 1 8 . 1 1 37 37 THR CB C 37 68.445 68.445 68.833 -0.388 17934 5162 1 8 . 1 1 38 38 GLU N N 38 122.251 122.251 121.849 0.402 17934 5163 1 8 . 1 1 38 38 GLU HA H 38 4.126 4.126 4.053 0.073 17934 5164 1 8 . 1 1 38 38 GLU C C 38 179.981 179.981 179.003 0.978 17934 5165 1 8 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.977 0.031 17934 5166 1 8 . 1 1 38 38 GLU CB C 38 29.539 29.539 29.001 0.538 17934 5167 1 8 . 1 1 38 38 GLU H H 38 8.450 8.450 8.746 -0.296 17934 5168 1 8 . 1 1 39 39 SER N N 39 115.966 115.966 114.063 1.903 17934 5169 1 8 . 1 1 39 39 SER C C 39 175.991 175.991 176.739 -0.748 17934 5170 1 8 . 1 1 39 39 SER CA C 39 62.820 62.820 61.727 1.093 17934 5171 1 8 . 1 1 39 39 SER H H 39 7.522 7.522 8.177 -0.655 17934 5172 1 8 . 1 1 40 40 THR HA H 40 4.049 4.049 3.788 0.261 17934 5173 1 8 . 1 1 40 40 THR C C 40 175.972 175.972 176.578 -0.606 17934 5174 1 8 . 1 1 40 40 THR CA C 40 66.101 66.101 66.745 -0.644 17934 5175 1 8 . 1 1 40 40 THR CB C 40 67.976 67.976 68.737 -0.761 17934 5176 1 8 . 1 1 41 41 GLN N N 41 120.354 120.354 118.879 1.475 17934 5177 1 8 . 1 1 41 41 GLN HA H 41 3.759 3.759 3.948 -0.189 17934 5178 1 8 . 1 1 41 41 GLN C C 41 178.483 178.483 177.764 0.719 17934 5179 1 8 . 1 1 41 41 GLN CA C 41 60.476 60.476 59.042 1.434 17934 5180 1 8 . 1 1 41 41 GLN CB C 41 28.133 28.133 27.593 0.540 17934 5181 1 8 . 1 1 41 41 GLN H H 41 8.271 8.271 8.679 -0.408 17934 5182 1 8 . 1 1 42 42 ASP N N 42 120.757 120.757 121.016 -0.259 17934 5183 1 8 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.336 0.023 17934 5184 1 8 . 1 1 42 42 ASP C C 42 177.480 177.480 177.973 -0.493 17934 5185 1 8 . 1 1 42 42 ASP CA C 42 57.664 57.664 56.953 0.712 17934 5186 1 8 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.483 1.712 17934 5187 1 8 . 1 1 42 42 ASP H H 42 7.954 7.954 8.141 -0.187 17934 5188 1 8 . 1 1 43 43 ALA N N 43 120.587 120.587 121.720 -1.133 17934 5189 1 8 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.163 -0.173 17934 5190 1 8 . 1 1 43 43 ALA C C 43 179.767 179.767 179.872 -0.105 17934 5191 1 8 . 1 1 43 43 ALA CA C 43 55.320 55.320 54.791 0.529 17934 5192 1 8 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.121 1.109 17934 5193 1 8 . 1 1 43 43 ALA H H 43 7.842 7.842 8.157 -0.315 17934 5194 1 8 . 1 1 44 44 CYS N N 44 115.428 115.428 118.572 -3.144 17934 5195 1 8 . 1 1 44 44 CYS HA H 44 3.895 3.895 3.969 -0.074 17934 5196 1 8 . 1 1 44 44 CYS C C 44 176.076 176.076 176.616 -0.540 17934 5197 1 8 . 1 1 44 44 CYS CA C 44 64.695 64.695 63.374 1.321 17934 5198 1 8 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.201 0.463 17934 5199 1 8 . 1 1 44 44 CYS H H 44 7.900 7.900 8.094 -0.194 17934 5200 1 8 . 1 1 45 45 ALA N N 45 120.487 120.487 122.578 -2.091 17934 5201 1 8 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.990 0.010 17934 5202 1 8 . 1 1 45 45 ALA C C 45 173.506 173.506 179.274 -5.768 17934 5203 1 8 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.455 -0.135 17934 5204 1 8 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.436 -0.496 17934 5205 1 8 . 1 1 45 45 ALA H H 45 7.250 7.250 8.619 -1.369 17934 5206 1 8 . 1 1 46 46 LYS N N 46 119.267 119.267 118.463 0.804 17934 5207 1 8 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.913 0.034 17934 5208 1 8 . 1 1 46 46 LYS C C 46 179.561 179.561 178.875 0.686 17934 5209 1 8 . 1 1 46 46 LYS H H 46 8.102 8.102 8.214 -0.112 17934 5210 1 8 . 1 1 47 47 MET N N 47 118.009 118.009 119.022 -1.013 17934 5211 1 8 . 1 1 47 47 MET HA H 47 4.214 4.214 4.111 0.103 17934 5212 1 8 . 1 1 47 47 MET C C 47 179.526 179.526 177.819 1.707 17934 5213 1 8 . 1 1 47 47 MET CA C 47 57.195 57.195 58.741 -1.546 17934 5214 1 8 . 1 1 47 47 MET CB C 47 30.945 30.945 32.655 -1.710 17934 5215 1 8 . 1 1 47 47 MET H H 47 8.585 8.585 8.028 0.557 17934 5216 1 8 . 1 1 48 48 ARG N N 48 119.962 119.962 119.512 0.450 17934 5217 1 8 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.909 -0.053 17934 5218 1 8 . 1 1 48 48 ARG C C 48 178.875 178.875 178.167 0.708 17934 5219 1 8 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.379 1.566 17934 5220 1 8 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.811 0.666 17934 5221 1 8 . 1 1 48 48 ARG H H 48 8.190 8.190 8.438 -0.248 17934 5222 1 8 . 1 1 49 49 ALA N N 49 120.640 120.640 120.499 0.141 17934 5223 1 8 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.176 -0.433 17934 5224 1 8 . 1 1 49 49 ALA C C 49 180.169 180.169 178.983 1.186 17934 5225 1 8 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.484 0.367 17934 5226 1 8 . 1 1 49 49 ALA CB C 49 17.821 17.821 18.892 -1.071 17934 5227 1 8 . 1 1 49 49 ALA H H 49 7.671 7.671 8.190 -0.519 17934 5228 1 8 . 1 1 50 50 ASN N N 50 116.063 116.063 117.360 -1.297 17934 5229 1 8 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.450 0.024 17934 5230 1 8 . 1 1 50 50 ASN C C 50 177.084 177.084 176.340 0.744 17934 5231 1 8 . 1 1 50 50 ASN CA C 50 55.789 55.789 56.005 -0.216 17934 5232 1 8 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.859 0.055 17934 5233 1 8 . 1 1 50 50 ASN H H 50 7.893 7.893 8.090 -0.197 17934 5234 1 8 . 1 1 51 51 CYS N N 51 116.884 116.884 116.889 -0.005 17934 5235 1 8 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.307 -0.001 17934 5236 1 8 . 1 1 51 51 CYS C C 51 175.002 175.002 177.017 -2.015 17934 5237 1 8 . 1 1 51 51 CYS CA C 51 61.414 61.414 60.194 1.220 17934 5238 1 8 . 1 1 51 51 CYS CB C 51 27.664 27.664 28.567 -0.903 17934 5239 1 8 . 1 1 51 51 CYS H H 51 7.770 7.770 8.388 -0.618 17934 5240 1 8 . 1 1 52 52 GLN N N 52 117.831 117.831 119.727 -1.896 17934 5241 1 8 . 1 1 52 52 GLN HA H 52 4.228 4.228 3.976 0.252 17934 5242 1 8 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.353 -1.627 17934 5243 1 8 . 1 1 52 52 GLN CB C 52 29.070 29.070 28.411 0.659 17934 5244 1 8 . 1 1 52 52 GLN H H 52 7.796 7.796 7.674 0.122 17934 5245 1 8 . 1 1 53 53 LYS N N 53 118.841 118.841 118.361 0.480 17934 5246 1 8 . 1 1 53 53 LYS CA C 53 57.195 57.195 57.778 -0.583 17934 5247 1 8 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.902 0.387 17934 5248 1 8 . 1 1 53 53 LYS H H 53 7.686 7.686 7.635 0.051 17934 5249 1 8 . 1 1 55 55 THR HA H 55 4.304 4.304 4.205 0.099 17934 5250 1 8 . 1 1 55 55 THR CA C 55 63.757 63.757 63.873 -0.116 17934 5251 1 8 . 1 1 55 55 THR CB C 55 68.914 68.914 68.847 0.067 17934 5252 1 8 . 1 1 56 56 GLU N N 56 120.861 120.861 120.508 0.353 17934 5253 1 8 . 1 1 56 56 GLU HA H 56 4.147 4.147 3.974 0.173 17934 5254 1 8 . 1 1 56 56 GLU C C 56 177.656 177.656 178.370 -0.714 17934 5255 1 8 . 1 1 56 56 GLU CA C 56 58.133 58.133 59.644 -1.511 17934 5256 1 8 . 1 1 56 56 GLU CB C 56 30.008 30.008 29.252 0.756 17934 5257 1 8 . 1 1 56 56 GLU H H 56 8.311 8.311 8.569 -0.258 17934 5258 1 8 . 1 1 57 57 GLN N N 57 118.397 118.397 115.204 3.193 17934 5259 1 8 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.261 -0.119 17934 5260 1 8 . 1 1 57 57 GLN C C 57 177.275 177.275 177.044 0.231 17934 5261 1 8 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.015 0.649 17934 5262 1 8 . 1 1 57 57 GLN CB C 57 29.070 29.070 28.909 0.161 17934 5263 1 8 . 1 1 57 57 GLN H H 57 7.899 7.899 8.026 -0.127 17934 5264 1 8 . 1 1 58 58 MET N N 58 118.897 118.897 118.086 0.811 17934 5265 1 8 . 1 1 58 58 MET HA H 58 4.350 4.350 4.221 0.129 17934 5266 1 8 . 1 1 58 58 MET C C 58 177.172 177.172 177.532 -0.360 17934 5267 1 8 . 1 1 58 58 MET CA C 58 56.726 56.726 57.275 -0.549 17934 5268 1 8 . 1 1 58 58 MET CB C 58 32.196 32.196 32.589 -0.393 17934 5269 1 8 . 1 1 58 58 MET H H 58 8.036 8.036 7.598 0.438 17934 5270 1 8 . 1 1 59 59 LYS N N 59 119.779 119.779 117.518 2.261 17934 5271 1 8 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.052 0.179 17934 5272 1 8 . 1 1 59 59 LYS C C 59 176.676 176.676 177.271 -0.595 17934 5273 1 8 . 1 1 59 59 LYS CA C 59 57.195 57.195 58.233 -1.038 17934 5274 1 8 . 1 1 59 59 LYS CB C 59 32.820 32.820 32.354 0.466 17934 5275 1 8 . 1 1 59 59 LYS H H 59 7.901 7.901 8.065 -0.164 17934 5276 1 8 . 1 1 60 60 LYS N N 60 119.993 119.993 119.850 0.143 17934 5277 1 8 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.371 -0.036 17934 5278 1 8 . 1 1 60 60 LYS C C 60 176.336 176.336 174.824 1.512 17934 5279 1 8 . 1 1 60 60 LYS CA C 60 56.258 56.258 55.741 0.517 17934 5280 1 8 . 1 1 60 60 LYS CB C 60 32.820 32.820 33.986 -1.166 17934 5281 1 8 . 1 1 60 60 LYS H H 60 7.877 7.877 7.607 0.270 17934 5282 1 8 . 1 1 61 61 VAL N N 61 122.649 122.649 123.456 -0.807 17934 5283 1 8 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.603 -0.223 17934 5284 1 8 . 1 1 61 61 VAL C C 61 174.210 174.210 174.166 0.044 17934 5285 1 8 . 1 1 61 61 VAL CA C 61 60.000 60.000 57.937 2.063 17934 5286 1 8 . 1 1 61 61 VAL CB C 61 32.350 32.350 32.852 -0.502 17934 5287 1 8 . 1 1 61 61 VAL H H 61 7.708 7.708 8.261 -0.553 17934 5288 1 8 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.652 0.011 17934 5289 1 8 . 1 1 62 62 PRO C C 62 176.656 176.656 176.164 0.492 17934 5290 1 8 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.683 0.137 17934 5291 1 8 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.216 -0.333 17934 5292 1 8 . 1 1 63 63 THR N N 63 117.155 117.155 120.824 -3.669 17934 5293 1 8 . 1 1 63 63 THR HA H 63 4.830 4.830 4.838 -0.008 17934 5294 1 8 . 1 1 63 63 THR C C 63 174.682 174.682 173.743 0.939 17934 5295 1 8 . 1 1 63 63 THR CA C 63 62.820 62.820 63.187 -0.367 17934 5296 1 8 . 1 1 63 63 THR CB C 63 69.382 69.382 70.315 -0.933 17934 5297 1 8 . 1 1 63 63 THR H H 63 8.303 8.303 8.516 -0.213 17934 5298 1 8 . 1 1 64 64 ILE N N 64 121.004 121.004 120.156 0.848 17934 5299 1 8 . 1 1 64 64 ILE CA C 64 58.600 58.600 58.748 -0.148 17934 5300 1 8 . 1 1 64 64 ILE CB C 64 42.690 42.690 42.099 0.591 17934 5301 1 8 . 1 1 64 64 ILE H H 64 9.348 9.348 8.760 0.588 17934 5302 1 8 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.135 0.605 17934 5303 1 8 . 1 1 65 65 ILE C C 65 175.378 175.378 174.602 0.776 17934 5304 1 8 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.032 -0.952 17934 5305 1 8 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.868 0.882 17934 5306 1 8 . 1 1 66 66 LEU N N 66 110.343 110.343 129.701 -19.358 17934 5307 1 8 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.994 -0.144 17934 5308 1 8 . 1 1 66 66 LEU C C 66 174.982 174.982 175.661 -0.679 17934 5309 1 8 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.321 -0.411 17934 5310 1 8 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.734 1.496 17934 5311 1 8 . 1 1 66 66 LEU H H 66 9.610 9.610 9.271 0.339 17934 5312 1 8 . 1 1 67 67 SER N N 67 120.990 120.990 119.314 1.676 17934 5313 1 8 . 1 1 67 67 SER HA H 67 5.405 5.405 4.765 0.640 17934 5314 1 8 . 1 1 67 67 SER C C 67 174.405 174.405 172.882 1.523 17934 5315 1 8 . 1 1 67 67 SER CA C 67 57.195 57.195 57.076 0.119 17934 5316 1 8 . 1 1 67 67 SER CB C 67 64.695 64.695 64.769 -0.074 17934 5317 1 8 . 1 1 67 67 SER H H 67 9.260 9.260 8.817 0.443 17934 5318 1 8 . 1 1 68 68 VAL N N 68 128.176 128.176 125.782 2.394 17934 5319 1 8 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.437 0.056 17934 5320 1 8 . 1 1 68 68 VAL C C 68 173.891 173.891 173.239 0.652 17934 5321 1 8 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.527 1.823 17934 5322 1 8 . 1 1 68 68 VAL CB C 68 33.750 33.750 34.247 -0.497 17934 5323 1 8 . 1 1 68 68 VAL H H 68 9.225 9.225 8.647 0.578 17934 5324 1 8 . 1 1 69 69 SER N N 69 121.697 121.697 124.431 -2.734 17934 5325 1 8 . 1 1 69 69 SER HA H 69 4.837 4.837 4.959 -0.122 17934 5326 1 8 . 1 1 69 69 SER C C 69 173.188 173.188 174.997 -1.809 17934 5327 1 8 . 1 1 69 69 SER CA C 69 57.195 57.195 56.120 1.075 17934 5328 1 8 . 1 1 69 69 SER CB C 69 67.976 67.976 65.916 2.060 17934 5329 1 8 . 1 1 69 69 SER H H 69 8.869 8.869 8.572 0.297 17934 5330 1 8 . 1 1 70 70 ALA N N 70 118.689 118.689 124.229 -5.540 17934 5331 1 8 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.233 -0.083 17934 5332 1 8 . 1 1 70 70 ALA C C 70 176.714 176.714 177.462 -0.748 17934 5333 1 8 . 1 1 70 70 ALA CA C 70 53.910 53.910 53.773 0.137 17934 5334 1 8 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.329 0.271 17934 5335 1 8 . 1 1 70 70 ALA H H 70 8.810 8.810 8.664 0.146 17934 5336 1 8 . 1 1 71 71 LYS N N 71 112.633 112.633 117.400 -4.767 17934 5337 1 8 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.366 -0.091 17934 5338 1 8 . 1 1 71 71 LYS C C 71 177.033 177.033 175.951 1.082 17934 5339 1 8 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.001 2.194 17934 5340 1 8 . 1 1 71 71 LYS CB C 71 33.289 33.289 33.139 0.151 17934 5341 1 8 . 1 1 71 71 LYS H H 71 7.830 7.830 7.652 0.178 17934 5342 1 8 . 1 1 72 72 GLY N N 72 108.432 108.432 106.878 1.554 17934 5343 1 8 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.134 0.342 17934 5344 1 8 . 1 1 72 72 GLY H H 72 7.685 7.685 7.553 0.132 17934 5345 1 8 . 1 1 73 73 VAL N N 73 120.414 120.414 117.532 2.882 17934 5346 1 8 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.866 0.134 17934 5347 1 8 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.103 1.367 17934 5348 1 8 . 1 1 73 73 VAL CB C 73 35.630 35.630 34.297 1.333 17934 5349 1 8 . 1 1 73 73 VAL H H 73 8.620 8.620 8.070 0.550 17934 5350 1 8 . 1 1 74 74 LYS N N 74 125.257 125.257 124.463 0.794 17934 5351 1 8 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.092 0.924 17934 5352 1 8 . 1 1 74 74 LYS CA C 74 54.383 54.383 53.987 0.396 17934 5353 1 8 . 1 1 74 74 LYS CB C 74 36.570 36.570 36.041 0.529 17934 5354 1 8 . 1 1 74 74 LYS H H 74 8.783 8.783 7.978 0.805 17934 5355 1 8 . 1 1 75 75 PHE N N 75 119.414 119.414 118.067 1.347 17934 5356 1 8 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.397 0.303 17934 5357 1 8 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.564 -2.644 17934 5358 1 8 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.834 -1.224 17934 5359 1 8 . 1 1 75 75 PHE H H 75 8.432 8.432 8.926 -0.494 17934 5360 1 8 . 1 1 76 76 ILE N N 76 121.430 121.430 120.421 1.009 17934 5361 1 8 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.566 0.274 17934 5362 1 8 . 1 1 76 76 ILE C C 76 175.249 175.249 174.242 1.007 17934 5363 1 8 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.623 -0.553 17934 5364 1 8 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.688 -0.468 17934 5365 1 8 . 1 1 76 76 ILE H H 76 8.960 8.960 8.412 0.548 17934 5366 1 8 . 1 1 77 77 ASP N N 77 125.744 125.744 123.565 2.179 17934 5367 1 8 . 1 1 77 77 ASP HA H 77 4.563 4.563 4.884 -0.321 17934 5368 1 8 . 1 1 77 77 ASP C C 77 177.569 177.569 175.731 1.838 17934 5369 1 8 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.868 2.921 17934 5370 1 8 . 1 1 77 77 ASP CB C 77 43.601 43.601 42.845 0.756 17934 5371 1 8 . 1 1 77 77 ASP H H 77 8.750 8.750 8.230 0.520 17934 5372 1 8 . 1 1 78 78 ALA N N 78 128.632 128.632 128.395 0.237 17934 5373 1 8 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.307 -0.337 17934 5374 1 8 . 1 1 78 78 ALA C C 78 178.052 178.052 178.065 -0.013 17934 5375 1 8 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.092 0.739 17934 5376 1 8 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.465 0.328 17934 5377 1 8 . 1 1 78 78 ALA H H 78 8.700 8.700 8.834 -0.134 17934 5378 1 8 . 1 1 79 79 THR N N 79 113.087 113.087 114.518 -1.431 17934 5379 1 8 . 1 1 79 79 THR HA H 79 4.194 4.194 4.276 -0.082 17934 5380 1 8 . 1 1 79 79 THR C C 79 175.587 175.587 175.768 -0.181 17934 5381 1 8 . 1 1 79 79 THR CA C 79 64.695 64.695 64.845 -0.150 17934 5382 1 8 . 1 1 79 79 THR CB C 79 69.382 69.382 69.317 0.065 17934 5383 1 8 . 1 1 79 79 THR H H 79 8.779 8.779 8.526 0.253 17934 5384 1 8 . 1 1 80 80 ASN N N 80 118.434 118.434 116.116 2.318 17934 5385 1 8 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.834 -0.097 17934 5386 1 8 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.904 0.541 17934 5387 1 8 . 1 1 80 80 ASN CB C 80 39.383 39.383 39.969 -0.586 17934 5388 1 8 . 1 1 80 80 ASN H H 80 8.584 8.584 8.402 0.182 17934 5389 1 8 . 1 1 81 81 LYS N N 81 112.429 112.429 114.241 -1.812 17934 5390 1 8 . 1 1 81 81 LYS C C 81 174.909 174.909 175.452 -0.543 17934 5391 1 8 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.567 0.097 17934 5392 1 8 . 1 1 81 81 LYS CB C 81 28.602 28.602 29.774 -1.172 17934 5393 1 8 . 1 1 81 81 LYS H H 81 7.966 7.966 8.521 -0.555 17934 5394 1 8 . 1 1 82 82 ASN N N 82 116.806 116.806 116.336 0.470 17934 5395 1 8 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.762 -0.172 17934 5396 1 8 . 1 1 82 82 ASN C C 82 174.999 174.999 174.163 0.836 17934 5397 1 8 . 1 1 82 82 ASN CA C 82 52.976 52.976 52.250 0.726 17934 5398 1 8 . 1 1 82 82 ASN CB C 82 38.445 38.445 39.459 -1.014 17934 5399 1 8 . 1 1 82 82 ASN H H 82 8.455 8.455 8.021 0.434 17934 5400 1 8 . 1 1 83 83 ILE N N 83 122.447 122.447 117.605 4.842 17934 5401 1 8 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.351 -0.321 17934 5402 1 8 . 1 1 83 83 ILE C C 83 176.572 176.572 175.310 1.262 17934 5403 1 8 . 1 1 83 83 ILE CA C 83 62.350 62.350 61.784 0.566 17934 5404 1 8 . 1 1 83 83 ILE CB C 83 37.970 37.970 38.382 -0.412 17934 5405 1 8 . 1 1 83 83 ILE H H 83 8.650 8.650 8.311 0.339 17934 5406 1 8 . 1 1 84 84 ILE N N 84 129.339 129.339 128.945 0.394 17934 5407 1 8 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.424 -0.504 17934 5408 1 8 . 1 1 84 84 ILE C C 84 175.873 175.873 176.982 -1.109 17934 5409 1 8 . 1 1 84 84 ILE CA C 84 62.810 62.810 61.012 1.798 17934 5410 1 8 . 1 1 84 84 ILE CB C 84 38.840 38.840 38.257 0.583 17934 5411 1 8 . 1 1 84 84 ILE H H 84 8.930 8.930 8.462 0.468 17934 5412 1 8 . 1 1 85 85 ALA N N 85 118.867 118.867 119.941 -1.074 17934 5413 1 8 . 1 1 85 85 ALA C C 85 174.100 174.100 174.856 -0.756 17934 5414 1 8 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.486 -0.916 17934 5415 1 8 . 1 1 85 85 ALA H H 85 7.048 7.048 8.346 -1.298 17934 5416 1 8 . 1 1 87 87 HIS HA H 87 5.154 5.154 5.088 0.066 17934 5417 1 8 . 1 1 87 87 HIS C C 87 174.986 174.986 173.799 1.187 17934 5418 1 8 . 1 1 87 87 HIS CB C 87 34.350 34.350 32.057 2.293 17934 5419 1 8 . 1 1 88 88 GLU N N 88 125.372 125.372 122.152 3.220 17934 5420 1 8 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.358 0.163 17934 5421 1 8 . 1 1 88 88 GLU C C 88 179.047 179.047 177.864 1.183 17934 5422 1 8 . 1 1 88 88 GLU CA C 88 56.726 56.726 56.561 0.165 17934 5423 1 8 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.385 0.092 17934 5424 1 8 . 1 1 88 88 GLU H H 88 9.106 9.106 8.833 0.273 17934 5425 1 8 . 1 1 89 89 ILE N N 89 124.132 124.132 124.361 -0.229 17934 5426 1 8 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.877 0.142 17934 5427 1 8 . 1 1 89 89 ILE C C 89 176.095 176.095 177.435 -1.340 17934 5428 1 8 . 1 1 89 89 ILE CA C 89 62.351 62.351 66.003 -3.652 17934 5429 1 8 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.324 0.591 17934 5430 1 8 . 1 1 89 89 ILE H H 89 8.055 8.055 8.934 -0.879 17934 5431 1 8 . 1 1 90 90 ARG N N 90 116.949 116.949 116.601 0.348 17934 5432 1 8 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.185 0.153 17934 5433 1 8 . 1 1 90 90 ARG C C 90 176.578 176.578 176.408 0.170 17934 5434 1 8 . 1 1 90 90 ARG CA C 90 57.664 57.664 58.252 -0.588 17934 5435 1 8 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.328 -0.258 17934 5436 1 8 . 1 1 90 90 ARG H H 90 8.045 8.045 8.484 -0.439 17934 5437 1 8 . 1 1 91 91 ASN N N 91 116.320 116.320 116.687 -0.367 17934 5438 1 8 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.784 0.369 17934 5439 1 8 . 1 1 91 91 ASN C C 91 174.595 174.595 175.366 -0.771 17934 5440 1 8 . 1 1 91 91 ASN CA C 91 52.508 52.508 53.883 -1.375 17934 5441 1 8 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.554 0.298 17934 5442 1 8 . 1 1 91 91 ASN H H 91 8.067 8.067 8.027 0.040 17934 5443 1 8 . 1 1 92 92 ILE N N 92 122.441 122.441 120.653 1.788 17934 5444 1 8 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.734 1.339 17934 5445 1 8 . 1 1 92 92 ILE C C 92 175.229 175.229 176.136 -0.907 17934 5446 1 8 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.901 -1.021 17934 5447 1 8 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.868 1.982 17934 5448 1 8 . 1 1 92 92 ILE H H 92 7.483 7.483 7.848 -0.365 17934 5449 1 8 . 1 1 93 93 SER N N 93 120.329 120.329 124.552 -4.223 17934 5450 1 8 . 1 1 93 93 SER HA H 93 4.684 4.684 4.239 0.445 17934 5451 1 8 . 1 1 93 93 SER C C 93 180.744 180.744 173.970 6.774 17934 5452 1 8 . 1 1 93 93 SER CA C 93 57.664 57.664 60.462 -2.798 17934 5453 1 8 . 1 1 93 93 SER CB C 93 66.570 66.570 64.474 2.096 17934 5454 1 8 . 1 1 93 93 SER H H 93 9.545 9.545 8.356 1.189 17934 5455 1 8 . 1 1 94 94 CYS N N 94 110.900 110.900 115.247 -4.347 17934 5456 1 8 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.436 -0.624 17934 5457 1 8 . 1 1 94 94 CYS C C 94 173.973 173.973 172.448 1.525 17934 5458 1 8 . 1 1 94 94 CYS CA C 94 59.539 59.539 58.330 1.209 17934 5459 1 8 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.143 -3.885 17934 5460 1 8 . 1 1 94 94 CYS H H 94 8.858 8.858 8.074 0.784 17934 5461 1 8 . 1 1 95 95 ALA N N 95 121.379 121.379 122.204 -0.825 17934 5462 1 8 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.591 -0.161 17934 5463 1 8 . 1 1 95 95 ALA C C 95 178.098 178.098 174.924 3.174 17934 5464 1 8 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.493 1.157 17934 5465 1 8 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.860 -2.560 17934 5466 1 8 . 1 1 95 95 ALA H H 95 8.360 8.360 8.157 0.203 17934 5467 1 8 . 1 1 96 96 ALA N N 96 122.576 122.576 121.342 1.234 17934 5468 1 8 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.738 -0.058 17934 5469 1 8 . 1 1 96 96 ALA C C 96 175.716 175.716 174.453 1.263 17934 5470 1 8 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.975 0.465 17934 5471 1 8 . 1 1 96 96 ALA CB C 96 22.700 22.700 22.072 0.628 17934 5472 1 8 . 1 1 96 96 ALA H H 96 9.080 9.080 8.758 0.322 17934 5473 1 8 . 1 1 97 97 GLN N N 97 116.903 116.903 120.165 -3.262 17934 5474 1 8 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.666 0.264 17934 5475 1 8 . 1 1 97 97 GLN C C 97 175.270 175.270 174.331 0.939 17934 5476 1 8 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.527 1.324 17934 5477 1 8 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.640 2.119 17934 5478 1 8 . 1 1 97 97 GLN H H 97 8.369 8.369 8.451 -0.082 17934 5479 1 8 . 1 1 98 98 ASP N N 98 124.971 124.971 121.082 3.889 17934 5480 1 8 . 1 1 98 98 ASP C C 98 175.217 175.217 175.843 -0.626 17934 5481 1 8 . 1 1 98 98 ASP CA C 98 52.039 52.039 51.724 0.315 17934 5482 1 8 . 1 1 98 98 ASP CB C 98 42.195 42.195 41.532 0.663 17934 5483 1 8 . 1 1 98 98 ASP H H 98 8.395 8.395 8.347 0.048 17934 5484 1 8 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.408 -0.174 17934 5485 1 8 . 1 1 99 99 PRO C C 99 178.433 178.433 177.214 1.219 17934 5486 1 8 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.674 0.021 17934 5487 1 8 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.143 0.209 17934 5488 1 8 . 1 1 100 100 GLU N N 100 116.223 116.223 119.210 -2.987 17934 5489 1 8 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.134 0.086 17934 5490 1 8 . 1 1 100 100 GLU C C 100 176.678 176.678 175.757 0.921 17934 5491 1 8 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.202 -1.476 17934 5492 1 8 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.852 2.093 17934 5493 1 8 . 1 1 100 100 GLU H H 100 8.643 8.643 8.727 -0.084 17934 5494 1 8 . 1 1 101 101 ASP N N 101 119.053 119.053 118.641 0.412 17934 5495 1 8 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.938 -0.395 17934 5496 1 8 . 1 1 101 101 ASP C C 101 174.771 174.771 176.263 -1.492 17934 5497 1 8 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.261 0.653 17934 5498 1 8 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.490 0.299 17934 5499 1 8 . 1 1 101 101 ASP H H 101 7.597 7.597 8.126 -0.529 17934 5500 1 8 . 1 1 102 102 LEU N N 102 123.986 123.986 119.879 4.107 17934 5501 1 8 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.186 0.204 17934 5502 1 8 . 1 1 102 102 LEU C C 102 177.141 177.141 177.987 -0.846 17934 5503 1 8 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.819 -0.159 17934 5504 1 8 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.827 0.833 17934 5505 1 8 . 1 1 102 102 LEU H H 102 8.534 8.534 7.762 0.772 17934 5506 1 8 . 1 1 103 103 SER N N 103 112.339 112.339 110.757 1.582 17934 5507 1 8 . 1 1 103 103 SER HA H 103 4.290 4.290 4.336 -0.046 17934 5508 1 8 . 1 1 103 103 SER C C 103 174.106 174.106 174.966 -0.860 17934 5509 1 8 . 1 1 103 103 SER CA C 103 60.945 60.945 60.762 0.183 17934 5510 1 8 . 1 1 103 103 SER CB C 103 63.757 63.757 63.411 0.346 17934 5511 1 8 . 1 1 103 103 SER H H 103 7.867 7.867 8.120 -0.253 17934 5512 1 8 . 1 1 104 104 THR N N 104 123.070 123.070 117.956 5.114 17934 5513 1 8 . 1 1 104 104 THR HA H 104 5.373 5.373 4.510 0.863 17934 5514 1 8 . 1 1 104 104 THR C C 104 180.693 180.693 172.715 7.978 17934 5515 1 8 . 1 1 104 104 THR CA C 104 63.289 63.289 62.981 0.308 17934 5516 1 8 . 1 1 104 104 THR CB C 104 69.382 69.382 70.345 -0.963 17934 5517 1 8 . 1 1 104 104 THR H H 104 8.830 8.830 7.923 0.907 17934 5518 1 8 . 1 1 105 105 PHE N N 105 122.582 122.582 123.393 -0.811 17934 5519 1 8 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.851 0.619 17934 5520 1 8 . 1 1 105 105 PHE C C 105 179.211 179.211 172.042 7.169 17934 5521 1 8 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.861 -0.541 17934 5522 1 8 . 1 1 105 105 PHE CB C 105 41.790 41.790 42.124 -0.334 17934 5523 1 8 . 1 1 105 105 PHE H H 105 9.170 9.170 8.680 0.490 17934 5524 1 8 . 1 1 106 106 ALA N N 106 119.567 119.567 121.547 -1.980 17934 5525 1 8 . 1 1 106 106 ALA C C 106 175.603 175.603 174.971 0.632 17934 5526 1 8 . 1 1 106 106 ALA H H 106 8.770 8.770 9.127 -0.357 17934 5527 1 8 . 1 1 107 107 TYR N N 107 109.933 109.933 117.436 -7.503 17934 5528 1 8 . 1 1 107 107 TYR HA H 107 4.920 4.920 4.923 -0.003 17934 5529 1 8 . 1 1 107 107 TYR C C 107 180.426 180.426 172.460 7.966 17934 5530 1 8 . 1 1 107 107 TYR CA C 107 57.080 57.080 55.609 1.471 17934 5531 1 8 . 1 1 107 107 TYR CB C 107 40.789 40.789 40.744 0.045 17934 5532 1 8 . 1 1 107 107 TYR H H 107 7.950 7.950 8.740 -0.790 17934 5533 1 8 . 1 1 108 108 ILE N N 108 120.613 120.613 119.297 1.316 17934 5534 1 8 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.683 0.687 17934 5535 1 8 . 1 1 108 108 ILE C C 108 176.212 176.212 175.528 0.684 17934 5536 1 8 . 1 1 108 108 ILE CA C 108 59.540 59.540 59.877 -0.337 17934 5537 1 8 . 1 1 108 108 ILE CB C 108 39.380 39.380 40.922 -1.542 17934 5538 1 8 . 1 1 108 108 ILE H H 108 8.869 8.869 8.516 0.353 17934 5539 1 8 . 1 1 109 109 THR N N 109 116.505 116.505 114.654 1.851 17934 5540 1 8 . 1 1 109 109 THR HA H 109 5.669 5.669 4.737 0.932 17934 5541 1 8 . 1 1 109 109 THR C C 109 173.505 173.505 173.129 0.376 17934 5542 1 8 . 1 1 109 109 THR CA C 109 59.070 59.070 60.163 -1.093 17934 5543 1 8 . 1 1 109 109 THR H H 109 9.489 9.489 8.083 1.406 17934 5544 1 8 . 1 1 110 110 LYS N N 110 122.960 122.960 120.425 2.535 17934 5545 1 8 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.478 -0.018 17934 5546 1 8 . 1 1 110 110 LYS C C 110 175.937 175.937 176.176 -0.239 17934 5547 1 8 . 1 1 110 110 LYS CA C 110 55.789 55.789 56.541 -0.752 17934 5548 1 8 . 1 1 110 110 LYS CB C 110 34.227 34.227 33.520 0.707 17934 5549 1 8 . 1 1 110 110 LYS H H 110 7.831 7.831 8.399 -0.568 17934 5550 1 8 . 1 1 111 111 ASP N N 111 127.409 127.409 120.947 6.462 17934 5551 1 8 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.741 0.040 17934 5552 1 8 . 1 1 111 111 ASP C C 111 176.396 176.396 177.144 -0.748 17934 5553 1 8 . 1 1 111 111 ASP CA C 111 53.914 53.914 52.914 1.000 17934 5554 1 8 . 1 1 111 111 ASP CB C 111 43.133 43.133 42.332 0.801 17934 5555 1 8 . 1 1 111 111 ASP H H 111 8.769 8.769 8.664 0.105 17934 5556 1 8 . 1 1 112 112 LEU N N 112 125.913 125.913 121.955 3.958 17934 5557 1 8 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.089 0.061 17934 5558 1 8 . 1 1 112 112 LEU C C 112 178.553 178.553 177.889 0.664 17934 5559 1 8 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.267 -0.076 17934 5560 1 8 . 1 1 112 112 LEU CB C 112 41.790 41.790 42.172 -0.382 17934 5561 1 8 . 1 1 112 112 LEU H H 112 8.593 8.593 8.474 0.119 17934 5562 1 8 . 1 1 113 113 LYS N N 113 117.189 117.189 118.763 -1.574 17934 5563 1 8 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.250 0.012 17934 5564 1 8 . 1 1 113 113 LYS C C 113 177.180 177.180 176.438 0.742 17934 5565 1 8 . 1 1 113 113 LYS CA C 113 58.133 58.133 56.135 1.998 17934 5566 1 8 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.712 0.107 17934 5567 1 8 . 1 1 113 113 LYS H H 113 8.207 8.207 7.984 0.223 17934 5568 1 8 . 1 1 114 114 SER N N 114 112.492 112.492 111.913 0.579 17934 5569 1 8 . 1 1 114 114 SER CA C 114 58.601 58.601 58.829 -0.228 17934 5570 1 8 . 1 1 114 114 SER CB C 114 65.164 65.164 61.585 3.579 17934 5571 1 8 . 1 1 114 114 SER H H 114 7.755 7.755 8.432 -0.677 17934 5572 1 8 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.937 -0.548 17934 5573 1 8 . 1 1 115 115 ASN C C 115 174.203 174.203 174.230 -0.027 17934 5574 1 8 . 1 1 115 115 ASN CA C 115 54.383 54.383 53.427 0.956 17934 5575 1 8 . 1 1 115 115 ASN CB C 115 37.977 37.977 39.799 -1.822 17934 5576 1 8 . 1 1 116 116 HIS N N 116 116.822 116.822 116.777 0.045 17934 5577 1 8 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.687 0.243 17934 5578 1 8 . 1 1 116 116 HIS C C 116 173.898 173.898 173.485 0.413 17934 5579 1 8 . 1 1 116 116 HIS CA C 116 54.910 54.910 56.291 -1.381 17934 5580 1 8 . 1 1 116 116 HIS CB C 116 32.650 32.650 31.664 0.986 17934 5581 1 8 . 1 1 116 116 HIS H H 116 7.690 7.690 7.730 -0.040 17934 5582 1 8 . 1 1 117 117 HIS N N 117 118.253 118.253 121.578 -3.325 17934 5583 1 8 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.840 0.480 17934 5584 1 8 . 1 1 117 117 HIS C C 117 173.695 173.695 173.299 0.396 17934 5585 1 8 . 1 1 117 117 HIS CA C 117 56.350 56.350 54.569 1.781 17934 5586 1 8 . 1 1 117 117 HIS CB C 117 32.350 32.350 30.697 1.653 17934 5587 1 8 . 1 1 117 117 HIS H H 117 8.340 8.340 8.598 -0.258 17934 5588 1 8 . 1 1 118 118 TYR N N 118 118.301 118.301 125.274 -6.973 17934 5589 1 8 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.502 0.508 17934 5590 1 8 . 1 1 118 118 TYR C C 118 173.530 173.530 174.247 -0.717 17934 5591 1 8 . 1 1 118 118 TYR CA C 118 56.730 56.730 57.361 -0.631 17934 5592 1 8 . 1 1 118 118 TYR CB C 118 43.240 43.240 40.158 3.082 17934 5593 1 8 . 1 1 118 118 TYR H H 118 9.080 9.080 8.647 0.433 17934 5594 1 8 . 1 1 119 119 CYS N N 119 121.015 121.015 123.104 -2.089 17934 5595 1 8 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.492 0.571 17934 5596 1 8 . 1 1 119 119 CYS C C 119 180.664 180.664 173.218 7.446 17934 5597 1 8 . 1 1 119 119 CYS CA C 119 56.726 56.726 56.628 0.098 17934 5598 1 8 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.896 0.643 17934 5599 1 8 . 1 1 119 119 CYS H H 119 9.120 9.120 8.884 0.236 17934 5600 1 8 . 1 1 120 120 HIS N N 120 110.134 110.134 128.643 -18.509 17934 5601 1 8 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.478 0.221 17934 5602 1 8 . 1 1 120 120 HIS C C 120 180.776 180.776 173.058 7.718 17934 5603 1 8 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.321 0.999 17934 5604 1 8 . 1 1 120 120 HIS CB C 120 32.352 32.352 31.926 0.426 17934 5605 1 8 . 1 1 120 120 HIS H H 120 8.482 8.482 8.630 -0.148 17934 5606 1 8 . 1 1 121 121 VAL N N 121 120.855 120.855 124.561 -3.706 17934 5607 1 8 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.101 0.249 17934 5608 1 8 . 1 1 121 121 VAL C C 121 173.419 173.419 172.769 0.650 17934 5609 1 8 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.322 1.088 17934 5610 1 8 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.478 -0.198 17934 5611 1 8 . 1 1 121 121 VAL H H 121 7.929 7.929 8.552 -0.623 17934 5612 1 8 . 1 1 122 122 PHE N N 122 124.384 124.384 127.333 -2.949 17934 5613 1 8 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.244 0.176 17934 5614 1 8 . 1 1 122 122 PHE C C 122 174.876 174.876 174.399 0.477 17934 5615 1 8 . 1 1 122 122 PHE CA C 122 55.320 55.320 54.318 1.002 17934 5616 1 8 . 1 1 122 122 PHE CB C 122 44.540 44.540 43.130 1.409 17934 5617 1 8 . 1 1 122 122 PHE H H 122 8.910 8.910 8.766 0.144 17934 5618 1 8 . 1 1 123 123 THR N N 123 112.451 112.451 112.084 0.367 17934 5619 1 8 . 1 1 123 123 THR HA H 123 5.147 5.147 4.822 0.325 17934 5620 1 8 . 1 1 123 123 THR C C 123 174.096 174.096 172.917 1.179 17934 5621 1 8 . 1 1 123 123 THR CA C 123 61.843 61.843 59.770 2.073 17934 5622 1 8 . 1 1 123 123 THR CB C 123 71.218 71.218 71.386 -0.168 17934 5623 1 8 . 1 1 123 123 THR H H 123 8.668 8.668 8.968 -0.300 17934 5624 1 8 . 1 1 124 124 ALA N N 124 128.922 128.922 125.756 3.166 17934 5625 1 8 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.357 0.363 17934 5626 1 8 . 1 1 124 124 ALA C C 124 177.168 177.168 176.953 0.215 17934 5627 1 8 . 1 1 124 124 ALA CA C 124 50.890 50.890 50.697 0.193 17934 5628 1 8 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.242 -0.142 17934 5629 1 8 . 1 1 124 124 ALA H H 124 9.180 9.180 8.410 0.770 17934 5630 1 8 . 1 1 125 125 PHE N N 125 115.427 115.427 117.657 -2.230 17934 5631 1 8 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.494 -0.204 17934 5632 1 8 . 1 1 125 125 PHE C C 125 174.703 174.703 175.965 -1.262 17934 5633 1 8 . 1 1 125 125 PHE CA C 125 60.470 60.470 57.879 2.591 17934 5634 1 8 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.087 -1.027 17934 5635 1 8 . 1 1 125 125 PHE H H 125 8.560 8.560 8.241 0.319 17934 5636 1 8 . 1 1 126 126 ASP N N 126 115.745 115.745 119.372 -3.627 17934 5637 1 8 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.886 -0.043 17934 5638 1 8 . 1 1 126 126 ASP C C 126 176.532 176.532 176.130 0.402 17934 5639 1 8 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.112 0.333 17934 5640 1 8 . 1 1 126 126 ASP CB C 126 44.070 44.070 44.240 -0.170 17934 5641 1 8 . 1 1 126 126 ASP H H 126 7.417 7.417 7.620 -0.203 17934 5642 1 8 . 1 1 127 127 VAL N N 127 121.923 121.923 125.033 -3.110 17934 5643 1 8 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.768 -0.178 17934 5644 1 8 . 1 1 127 127 VAL C C 127 176.863 176.863 177.186 -0.323 17934 5645 1 8 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.614 -0.984 17934 5646 1 8 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.158 -0.328 17934 5647 1 8 . 1 1 127 127 VAL H H 127 8.508 8.508 8.736 -0.228 17934 5648 1 8 . 1 1 128 128 ASN N N 128 118.851 118.851 117.291 1.560 17934 5649 1 8 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.346 0.130 17934 5650 1 8 . 1 1 128 128 ASN C C 128 178.251 178.251 177.528 0.723 17934 5651 1 8 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.403 -0.145 17934 5652 1 8 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.227 -0.250 17934 5653 1 8 . 1 1 128 128 ASN H H 128 8.207 8.207 8.194 0.013 17934 5654 1 8 . 1 1 129 129 LEU N N 129 122.549 122.549 121.304 1.245 17934 5655 1 8 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.953 0.257 17934 5656 1 8 . 1 1 129 129 LEU C C 129 178.003 178.003 178.415 -0.412 17934 5657 1 8 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.534 -0.344 17934 5658 1 8 . 1 1 129 129 LEU CB C 129 41.790 41.790 40.663 1.127 17934 5659 1 8 . 1 1 129 129 LEU H H 129 8.223 8.223 7.593 0.630 17934 5660 1 8 . 1 1 130 130 ALA N N 130 120.036 120.036 121.918 -1.882 17934 5661 1 8 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.798 -0.488 17934 5662 1 8 . 1 1 130 130 ALA C C 130 178.172 178.172 179.180 -1.008 17934 5663 1 8 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.303 0.477 17934 5664 1 8 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.185 0.885 17934 5665 1 8 . 1 1 130 130 ALA H H 130 7.360 7.360 8.218 -0.858 17934 5666 1 8 . 1 1 131 131 ALA N N 131 116.989 116.989 119.442 -2.453 17934 5667 1 8 . 1 1 131 131 ALA HA H 131 3.710 3.710 4.035 -0.325 17934 5668 1 8 . 1 1 131 131 ALA C C 131 180.163 180.163 179.757 0.406 17934 5669 1 8 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.589 1.191 17934 5670 1 8 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.141 -0.311 17934 5671 1 8 . 1 1 131 131 ALA H H 131 7.360 7.360 8.239 -0.879 17934 5672 1 8 . 1 1 132 132 GLU N N 132 119.462 119.462 118.574 0.888 17934 5673 1 8 . 1 1 132 132 GLU HA H 132 3.888 3.888 4.078 -0.190 17934 5674 1 8 . 1 1 132 132 GLU C C 132 179.243 179.243 178.672 0.571 17934 5675 1 8 . 1 1 132 132 GLU CA C 132 59.539 59.539 58.896 0.643 17934 5676 1 8 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.815 -0.276 17934 5677 1 8 . 1 1 132 132 GLU H H 132 7.673 7.673 8.154 -0.481 17934 5678 1 8 . 1 1 133 133 ILE N N 133 123.218 123.218 120.386 2.832 17934 5679 1 8 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.535 -0.755 17934 5680 1 8 . 1 1 133 133 ILE C C 133 177.421 177.421 178.151 -0.730 17934 5681 1 8 . 1 1 133 133 ILE CA C 133 66.490 66.490 64.455 2.035 17934 5682 1 8 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.545 -0.895 17934 5683 1 8 . 1 1 133 133 ILE H H 133 8.154 8.154 8.000 0.154 17934 5684 1 8 . 1 1 134 134 ILE N N 134 118.244 118.244 119.727 -1.483 17934 5685 1 8 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.427 0.113 17934 5686 1 8 . 1 1 134 134 ILE C C 134 179.385 179.385 177.796 1.589 17934 5687 1 8 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.385 -1.105 17934 5688 1 8 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.901 -0.801 17934 5689 1 8 . 1 1 134 134 ILE H H 134 7.376 7.376 8.114 -0.738 17934 5690 1 8 . 1 1 135 135 LEU N N 135 123.061 123.061 121.234 1.827 17934 5691 1 8 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.887 0.303 17934 5692 1 8 . 1 1 135 135 LEU C C 135 179.858 179.858 178.709 1.149 17934 5693 1 8 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.580 -0.390 17934 5694 1 8 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.929 -0.069 17934 5695 1 8 . 1 1 135 135 LEU H H 135 8.036 8.036 8.383 -0.347 17934 5696 1 8 . 1 1 136 136 THR N N 136 119.647 119.647 115.723 3.924 17934 5697 1 8 . 1 1 136 136 THR HA H 136 3.725 3.725 4.028 -0.303 17934 5698 1 8 . 1 1 136 136 THR C C 136 176.088 176.088 176.885 -0.797 17934 5699 1 8 . 1 1 136 136 THR CA C 136 58.601 58.601 66.705 -8.104 17934 5700 1 8 . 1 1 136 136 THR CB C 136 67.976 67.976 68.814 -0.838 17934 5701 1 8 . 1 1 136 136 THR H H 136 8.508 8.508 8.286 0.222 17934 5702 1 8 . 1 1 137 137 LEU N N 137 123.182 123.182 121.519 1.663 17934 5703 1 8 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.866 -0.126 17934 5704 1 8 . 1 1 137 137 LEU C C 137 178.341 178.341 178.951 -0.610 17934 5705 1 8 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.114 0.146 17934 5706 1 8 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.506 0.044 17934 5707 1 8 . 1 1 137 137 LEU H H 137 8.520 8.520 8.400 0.120 17934 5708 1 8 . 1 1 138 138 GLY N N 138 105.266 105.266 105.382 -0.116 17934 5709 1 8 . 1 1 138 138 GLY C C 138 176.973 176.973 175.780 1.193 17934 5710 1 8 . 1 1 138 138 GLY CA C 138 47.351 47.351 46.800 0.551 17934 5711 1 8 . 1 1 138 138 GLY H H 138 7.858 7.858 8.174 -0.316 17934 5712 1 8 . 1 1 139 139 GLN N N 139 123.485 123.485 123.267 0.218 17934 5713 1 8 . 1 1 139 139 GLN C C 139 177.891 177.891 178.493 -0.602 17934 5714 1 8 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.725 -0.124 17934 5715 1 8 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.647 -0.514 17934 5716 1 8 . 1 1 139 139 GLN H H 139 8.195 8.195 8.543 -0.348 17934 5717 1 8 . 1 1 140 140 ALA N N 140 122.754 122.754 122.056 0.698 17934 5718 1 8 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.136 -0.427 17934 5719 1 8 . 1 1 140 140 ALA C C 140 178.987 178.987 179.306 -0.319 17934 5720 1 8 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.754 1.026 17934 5721 1 8 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.247 -0.837 17934 5722 1 8 . 1 1 140 140 ALA H H 140 8.530 8.530 8.335 0.195 17934 5723 1 8 . 1 1 141 141 PHE N N 141 116.275 116.275 118.867 -2.592 17934 5724 1 8 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.355 -0.265 17934 5725 1 8 . 1 1 141 141 PHE C C 141 178.129 178.129 176.929 1.200 17934 5726 1 8 . 1 1 141 141 PHE CA C 141 61.240 61.240 60.581 0.659 17934 5727 1 8 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.707 -0.324 17934 5728 1 8 . 1 1 141 141 PHE H H 141 7.920 7.920 8.179 -0.259 17934 5729 1 8 . 1 1 142 142 GLU N N 142 119.967 119.967 120.192 -0.225 17934 5730 1 8 . 1 1 142 142 GLU HA H 142 4.227 4.227 4.023 0.204 17934 5731 1 8 . 1 1 142 142 GLU C C 142 179.250 179.250 177.326 1.924 17934 5732 1 8 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.119 1.420 17934 5733 1 8 . 1 1 142 142 GLU CB C 142 29.539 29.539 30.146 -0.608 17934 5734 1 8 . 1 1 142 142 GLU H H 142 7.713 7.713 8.475 -0.762 17934 5735 1 8 . 1 1 143 143 VAL N N 143 120.189 120.189 120.378 -0.189 17934 5736 1 8 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.648 0.035 17934 5737 1 8 . 1 1 143 143 VAL C C 143 178.066 178.066 175.502 2.564 17934 5738 1 8 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.662 1.908 17934 5739 1 8 . 1 1 143 143 VAL CB C 143 31.883 31.883 31.882 0.001 17934 5740 1 8 . 1 1 143 143 VAL H H 143 8.608 8.608 7.465 1.143 17934 5741 1 8 . 1 1 144 144 ALA N N 144 121.753 121.753 121.600 0.153 17934 5742 1 8 . 1 1 144 144 ALA HA H 144 4.000 4.000 3.891 0.109 17934 5743 1 8 . 1 1 144 144 ALA C C 144 180.776 180.776 176.912 3.864 17934 5744 1 8 . 1 1 144 144 ALA CA C 144 55.780 55.780 52.434 3.346 17934 5745 1 8 . 1 1 144 144 ALA CB C 144 18.770 18.770 18.860 -0.090 17934 5746 1 8 . 1 1 144 144 ALA H H 144 8.399 8.399 7.215 1.184 17934 5747 1 8 . 1 1 145 145 TYR N N 145 119.962 119.962 120.124 -0.162 17934 5748 1 8 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.398 -0.208 17934 5749 1 8 . 1 1 145 145 TYR C C 145 177.645 177.645 176.471 1.174 17934 5750 1 8 . 1 1 145 145 TYR CA C 145 60.880 60.880 58.366 2.514 17934 5751 1 8 . 1 1 145 145 TYR CB C 145 37.980 37.980 38.848 -0.868 17934 5752 1 8 . 1 1 145 145 TYR H H 145 8.190 8.190 7.948 0.242 17934 5753 1 9 . 1 1 13 13 LYS N N 13 120.778 120.778 123.672 -2.894 17934 5754 1 9 . 1 1 13 13 LYS C C 13 176.476 176.476 176.360 0.116 17934 5755 1 9 . 1 1 13 13 LYS CA C 13 58.601 58.601 56.319 2.282 17934 5756 1 9 . 1 1 13 13 LYS CB C 13 32.820 32.820 33.078 -0.258 17934 5757 1 9 . 1 1 13 13 LYS H H 13 7.984 7.984 8.323 -0.339 17934 5758 1 9 . 1 1 15 15 ILE HA H 15 3.820 3.820 3.979 -0.159 17934 5759 1 9 . 1 1 15 15 ILE C C 15 176.376 176.376 175.631 0.745 17934 5760 1 9 . 1 1 15 15 ILE CA C 15 63.570 63.570 62.369 1.201 17934 5761 1 9 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.652 1.728 17934 5762 1 9 . 1 1 16 16 ALA N N 16 121.364 121.364 120.375 0.989 17934 5763 1 9 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.500 -0.062 17934 5764 1 9 . 1 1 16 16 ALA C C 16 177.494 177.494 177.456 0.038 17934 5765 1 9 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.551 0.425 17934 5766 1 9 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.541 0.792 17934 5767 1 9 . 1 1 16 16 ALA H H 16 8.081 8.081 7.840 0.241 17934 5768 1 9 . 1 1 17 17 GLN N N 17 118.109 118.109 116.450 1.659 17934 5769 1 9 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.483 0.090 17934 5770 1 9 . 1 1 17 17 GLN C C 17 173.632 173.632 174.469 -0.837 17934 5771 1 9 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.260 -0.409 17934 5772 1 9 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.559 -0.082 17934 5773 1 9 . 1 1 17 17 GLN H H 17 7.550 7.550 8.166 -0.616 17934 5774 1 9 . 1 1 18 18 SER N N 18 112.384 112.384 113.118 -0.734 17934 5775 1 9 . 1 1 18 18 SER HA H 18 4.388 4.388 4.862 -0.474 17934 5776 1 9 . 1 1 18 18 SER C C 18 173.780 173.780 172.260 1.520 17934 5777 1 9 . 1 1 18 18 SER CA C 18 57.664 57.664 57.665 -0.001 17934 5778 1 9 . 1 1 18 18 SER CB C 18 65.164 65.164 65.350 -0.186 17934 5779 1 9 . 1 1 18 18 SER H H 18 7.666 7.666 7.984 -0.318 17934 5780 1 9 . 1 1 19 19 CYS N N 19 120.116 120.116 121.469 -1.353 17934 5781 1 9 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.552 -0.222 17934 5782 1 9 . 1 1 19 19 CYS C C 19 180.387 180.387 173.503 6.884 17934 5783 1 9 . 1 1 19 19 CYS CA C 19 58.601 58.601 58.025 0.576 17934 5784 1 9 . 1 1 19 19 CYS CB C 19 30.008 30.008 29.399 0.609 17934 5785 1 9 . 1 1 19 19 CYS H H 19 8.835 8.835 8.619 0.216 17934 5786 1 9 . 1 1 20 20 ASP N N 20 124.416 124.416 124.486 -0.070 17934 5787 1 9 . 1 1 20 20 ASP CA C 20 52.976 52.976 52.277 0.699 17934 5788 1 9 . 1 1 20 20 ASP CB C 20 42.195 42.195 44.385 -2.190 17934 5789 1 9 . 1 1 20 20 ASP H H 20 7.847 7.847 8.231 -0.384 17934 5790 1 9 . 1 1 21 21 TYR N N 21 121.296 121.296 120.935 0.361 17934 5791 1 9 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.713 0.017 17934 5792 1 9 . 1 1 21 21 TYR C C 21 175.793 175.793 174.227 1.566 17934 5793 1 9 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.736 0.464 17934 5794 1 9 . 1 1 21 21 TYR CB C 21 43.240 43.240 42.788 0.452 17934 5795 1 9 . 1 1 21 21 TYR H H 21 9.070 9.070 8.704 0.366 17934 5796 1 9 . 1 1 22 22 LYS N N 22 122.820 122.820 120.790 2.030 17934 5797 1 9 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.031 0.161 17934 5798 1 9 . 1 1 22 22 LYS C C 22 175.793 175.793 174.863 0.930 17934 5799 1 9 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.479 0.779 17934 5800 1 9 . 1 1 22 22 LYS CB C 22 33.758 33.758 33.271 0.487 17934 5801 1 9 . 1 1 22 22 LYS H H 22 8.711 8.711 8.588 0.123 17934 5802 1 9 . 1 1 23 23 ALA N N 23 123.073 123.073 127.044 -3.971 17934 5803 1 9 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.493 0.237 17934 5804 1 9 . 1 1 23 23 ALA C C 23 174.515 174.515 175.758 -1.243 17934 5805 1 9 . 1 1 23 23 ALA CA C 23 51.570 51.570 49.831 1.739 17934 5806 1 9 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.118 -0.490 17934 5807 1 9 . 1 1 23 23 ALA H H 23 8.727 8.727 8.573 0.154 17934 5808 1 9 . 1 1 24 24 ALA N N 24 122.486 122.486 126.972 -4.486 17934 5809 1 9 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.981 0.200 17934 5810 1 9 . 1 1 24 24 ALA C C 24 176.835 176.835 176.553 0.282 17934 5811 1 9 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.156 0.414 17934 5812 1 9 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.136 -0.016 17934 5813 1 9 . 1 1 24 24 ALA H H 24 8.675 8.675 8.787 -0.112 17934 5814 1 9 . 1 1 25 25 TYR N N 25 122.698 122.698 125.560 -2.862 17934 5815 1 9 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.378 0.632 17934 5816 1 9 . 1 1 25 25 TYR CA C 25 54.340 54.340 58.080 -3.740 17934 5817 1 9 . 1 1 25 25 TYR CB C 25 39.850 39.850 37.780 2.070 17934 5818 1 9 . 1 1 25 25 TYR H H 25 8.270 8.270 8.387 -0.117 17934 5819 1 9 . 1 1 26 26 LEU N N 26 127.997 127.997 127.734 0.263 17934 5820 1 9 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.265 -0.345 17934 5821 1 9 . 1 1 26 26 LEU C C 26 175.983 175.983 176.975 -0.992 17934 5822 1 9 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.340 0.386 17934 5823 1 9 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.178 -2.108 17934 5824 1 9 . 1 1 26 26 LEU H H 26 8.700 8.700 8.332 0.368 17934 5825 1 9 . 1 1 27 27 GLY N N 27 102.901 102.901 102.299 0.602 17934 5826 1 9 . 1 1 27 27 GLY C C 27 176.219 176.219 171.527 4.692 17934 5827 1 9 . 1 1 27 27 GLY CA C 27 43.601 43.601 44.986 -1.385 17934 5828 1 9 . 1 1 27 27 GLY H H 27 5.891 5.891 8.174 -2.283 17934 5829 1 9 . 1 1 28 28 SER N N 28 111.551 111.551 116.010 -4.459 17934 5830 1 9 . 1 1 28 28 SER HA H 28 5.785 5.785 5.443 0.342 17934 5831 1 9 . 1 1 28 28 SER CA C 28 56.258 56.258 56.993 -0.735 17934 5832 1 9 . 1 1 28 28 SER CB C 28 65.632 65.632 64.985 0.647 17934 5833 1 9 . 1 1 28 28 SER H H 28 7.981 7.981 8.408 -0.427 17934 5834 1 9 . 1 1 29 29 MET N N 29 119.493 119.493 125.427 -5.934 17934 5835 1 9 . 1 1 29 29 MET HA H 29 4.725 4.725 4.645 0.080 17934 5836 1 9 . 1 1 29 29 MET C C 29 174.143 174.143 174.651 -0.508 17934 5837 1 9 . 1 1 29 29 MET CA C 29 54.036 54.036 52.277 1.759 17934 5838 1 9 . 1 1 29 29 MET CB C 29 37.268 37.268 34.831 2.437 17934 5839 1 9 . 1 1 29 29 MET H H 29 8.704 8.704 8.619 0.085 17934 5840 1 9 . 1 1 30 30 LEU N N 30 128.150 128.150 126.253 1.897 17934 5841 1 9 . 1 1 30 30 LEU HA H 30 3.785 3.785 4.133 -0.348 17934 5842 1 9 . 1 1 30 30 LEU C C 30 175.857 175.857 175.502 0.355 17934 5843 1 9 . 1 1 30 30 LEU CA C 30 56.250 56.250 54.906 1.344 17934 5844 1 9 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.750 0.910 17934 5845 1 9 . 1 1 30 30 LEU H H 30 8.630 8.630 8.442 0.188 17934 5846 1 9 . 1 1 31 31 ILE N N 31 127.723 127.723 127.611 0.112 17934 5847 1 9 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.313 -0.123 17934 5848 1 9 . 1 1 31 31 ILE C C 31 174.881 174.881 175.089 -0.208 17934 5849 1 9 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.151 -1.491 17934 5850 1 9 . 1 1 31 31 ILE CB C 31 37.110 37.110 37.191 -0.081 17934 5851 1 9 . 1 1 31 31 ILE H H 31 8.560 8.560 8.780 -0.220 17934 5852 1 9 . 1 1 32 32 LYS HA H 32 4.055 4.055 4.494 -0.439 17934 5853 1 9 . 1 1 32 32 LYS C C 32 176.272 176.272 176.426 -0.154 17934 5854 1 9 . 1 1 32 32 LYS CA C 32 58.601 58.601 56.476 2.125 17934 5855 1 9 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.795 0.025 17934 5856 1 9 . 1 1 33 33 GLU N N 33 118.638 118.638 115.389 3.249 17934 5857 1 9 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.012 0.376 17934 5858 1 9 . 1 1 33 33 GLU C C 33 173.962 173.962 175.528 -1.566 17934 5859 1 9 . 1 1 33 33 GLU CA C 33 54.851 54.851 57.292 -2.442 17934 5860 1 9 . 1 1 33 33 GLU CB C 33 30.945 30.945 27.885 3.060 17934 5861 1 9 . 1 1 33 33 GLU H H 33 7.723 7.723 9.045 -1.322 17934 5862 1 9 . 1 1 34 34 LEU N N 34 126.535 126.535 117.715 8.820 17934 5863 1 9 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.317 -0.372 17934 5864 1 9 . 1 1 34 34 LEU C C 34 176.870 176.870 176.302 0.568 17934 5865 1 9 . 1 1 34 34 LEU CA C 34 54.850 54.850 55.970 -1.120 17934 5866 1 9 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.389 -0.668 17934 5867 1 9 . 1 1 34 34 LEU H H 34 8.446 8.446 7.427 1.019 17934 5868 1 9 . 1 1 35 35 ARG N N 35 128.447 128.447 124.368 4.079 17934 5869 1 9 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.499 0.056 17934 5870 1 9 . 1 1 35 35 ARG C C 35 176.110 176.110 175.474 0.636 17934 5871 1 9 . 1 1 35 35 ARG CA C 35 54.851 54.851 55.239 -0.388 17934 5872 1 9 . 1 1 35 35 ARG CB C 35 30.477 30.477 31.618 -1.141 17934 5873 1 9 . 1 1 35 35 ARG H H 35 8.680 8.680 8.602 0.078 17934 5874 1 9 . 1 1 36 36 GLY N N 36 107.406 107.406 114.432 -7.026 17934 5875 1 9 . 1 1 36 36 GLY CA C 36 45.906 45.906 44.564 1.342 17934 5876 1 9 . 1 1 36 36 GLY H H 36 7.182 7.182 8.332 -1.150 17934 5877 1 9 . 1 1 37 37 THR HA H 37 4.060 4.060 4.068 -0.008 17934 5878 1 9 . 1 1 37 37 THR C C 37 176.634 176.634 175.519 1.115 17934 5879 1 9 . 1 1 37 37 THR CA C 37 65.632 65.632 63.715 1.917 17934 5880 1 9 . 1 1 37 37 THR CB C 37 68.445 68.445 69.011 -0.566 17934 5881 1 9 . 1 1 38 38 GLU N N 38 122.251 122.251 121.853 0.398 17934 5882 1 9 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.917 0.209 17934 5883 1 9 . 1 1 38 38 GLU C C 38 179.981 179.981 178.133 1.848 17934 5884 1 9 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.754 0.254 17934 5885 1 9 . 1 1 38 38 GLU CB C 38 29.539 29.539 28.906 0.633 17934 5886 1 9 . 1 1 38 38 GLU H H 38 8.450 8.450 8.584 -0.134 17934 5887 1 9 . 1 1 39 39 SER N N 39 115.966 115.966 113.498 2.468 17934 5888 1 9 . 1 1 39 39 SER C C 39 175.991 175.991 176.389 -0.398 17934 5889 1 9 . 1 1 39 39 SER CA C 39 62.820 62.820 61.922 0.897 17934 5890 1 9 . 1 1 39 39 SER H H 39 7.522 7.522 7.699 -0.177 17934 5891 1 9 . 1 1 40 40 THR HA H 40 4.049 4.049 4.024 0.025 17934 5892 1 9 . 1 1 40 40 THR C C 40 175.972 175.972 177.295 -1.323 17934 5893 1 9 . 1 1 40 40 THR CA C 40 66.101 66.101 65.393 0.708 17934 5894 1 9 . 1 1 40 40 THR CB C 40 67.976 67.976 68.229 -0.253 17934 5895 1 9 . 1 1 41 41 GLN N N 41 120.354 120.354 119.104 1.250 17934 5896 1 9 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.191 -0.432 17934 5897 1 9 . 1 1 41 41 GLN C C 41 178.483 178.483 178.169 0.314 17934 5898 1 9 . 1 1 41 41 GLN CA C 41 60.476 60.476 59.010 1.466 17934 5899 1 9 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.299 -0.166 17934 5900 1 9 . 1 1 41 41 GLN H H 41 8.271 8.271 8.210 0.061 17934 5901 1 9 . 1 1 42 42 ASP N N 42 120.757 120.757 121.827 -1.070 17934 5902 1 9 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.404 -0.045 17934 5903 1 9 . 1 1 42 42 ASP C C 42 177.480 177.480 177.698 -0.218 17934 5904 1 9 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.120 0.544 17934 5905 1 9 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.690 1.505 17934 5906 1 9 . 1 1 42 42 ASP H H 42 7.954 7.954 7.873 0.081 17934 5907 1 9 . 1 1 43 43 ALA N N 43 120.587 120.587 122.246 -1.659 17934 5908 1 9 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.196 -0.206 17934 5909 1 9 . 1 1 43 43 ALA C C 43 179.767 179.767 179.577 0.190 17934 5910 1 9 . 1 1 43 43 ALA CA C 43 55.320 55.320 55.166 0.154 17934 5911 1 9 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.369 0.861 17934 5912 1 9 . 1 1 43 43 ALA H H 43 7.842 7.842 8.308 -0.466 17934 5913 1 9 . 1 1 44 44 CYS N N 44 115.428 115.428 117.746 -2.318 17934 5914 1 9 . 1 1 44 44 CYS HA H 44 3.895 3.895 4.030 -0.135 17934 5915 1 9 . 1 1 44 44 CYS C C 44 176.076 176.076 176.471 -0.395 17934 5916 1 9 . 1 1 44 44 CYS CA C 44 64.695 64.695 62.864 1.831 17934 5917 1 9 . 1 1 44 44 CYS CB C 44 27.664 27.664 26.849 0.814 17934 5918 1 9 . 1 1 44 44 CYS H H 44 7.900 7.900 8.396 -0.496 17934 5919 1 9 . 1 1 45 45 ALA N N 45 120.487 120.487 122.529 -2.042 17934 5920 1 9 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.949 0.051 17934 5921 1 9 . 1 1 45 45 ALA C C 45 173.506 173.506 178.939 -5.433 17934 5922 1 9 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.322 -0.002 17934 5923 1 9 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.122 -0.182 17934 5924 1 9 . 1 1 45 45 ALA H H 45 7.250 7.250 8.192 -0.942 17934 5925 1 9 . 1 1 46 46 LYS N N 46 119.267 119.267 119.685 -0.418 17934 5926 1 9 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.926 0.021 17934 5927 1 9 . 1 1 46 46 LYS C C 46 179.561 179.561 178.958 0.603 17934 5928 1 9 . 1 1 46 46 LYS H H 46 8.102 8.102 8.153 -0.051 17934 5929 1 9 . 1 1 47 47 MET N N 47 118.009 118.009 118.255 -0.246 17934 5930 1 9 . 1 1 47 47 MET HA H 47 4.214 4.214 4.097 0.117 17934 5931 1 9 . 1 1 47 47 MET C C 47 179.526 179.526 178.099 1.427 17934 5932 1 9 . 1 1 47 47 MET CA C 47 57.195 57.195 58.819 -1.623 17934 5933 1 9 . 1 1 47 47 MET CB C 47 30.945 30.945 32.610 -1.665 17934 5934 1 9 . 1 1 47 47 MET H H 47 8.585 8.585 8.361 0.224 17934 5935 1 9 . 1 1 48 48 ARG N N 48 119.962 119.962 120.452 -0.490 17934 5936 1 9 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.967 -0.111 17934 5937 1 9 . 1 1 48 48 ARG C C 48 178.875 178.875 177.351 1.524 17934 5938 1 9 . 1 1 48 48 ARG CA C 48 60.945 60.945 58.549 2.396 17934 5939 1 9 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.530 0.947 17934 5940 1 9 . 1 1 48 48 ARG H H 48 8.190 8.190 8.226 -0.036 17934 5941 1 9 . 1 1 49 49 ALA N N 49 120.640 120.640 117.849 2.791 17934 5942 1 9 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.296 -0.553 17934 5943 1 9 . 1 1 49 49 ALA C C 49 180.169 180.169 180.379 -0.210 17934 5944 1 9 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.019 0.832 17934 5945 1 9 . 1 1 49 49 ALA CB C 49 17.821 17.821 19.009 -1.188 17934 5946 1 9 . 1 1 49 49 ALA H H 49 7.671 7.671 8.230 -0.559 17934 5947 1 9 . 1 1 50 50 ASN N N 50 116.063 116.063 118.861 -2.798 17934 5948 1 9 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.514 -0.040 17934 5949 1 9 . 1 1 50 50 ASN C C 50 177.084 177.084 177.335 -0.251 17934 5950 1 9 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.642 0.146 17934 5951 1 9 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.291 0.623 17934 5952 1 9 . 1 1 50 50 ASN H H 50 7.893 7.893 8.428 -0.535 17934 5953 1 9 . 1 1 51 51 CYS N N 51 116.884 116.884 117.915 -1.031 17934 5954 1 9 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.391 -0.085 17934 5955 1 9 . 1 1 51 51 CYS C C 51 175.002 175.002 175.142 -0.140 17934 5956 1 9 . 1 1 51 51 CYS CA C 51 61.414 61.414 58.831 2.583 17934 5957 1 9 . 1 1 51 51 CYS CB C 51 27.664 27.664 27.153 0.511 17934 5958 1 9 . 1 1 51 51 CYS H H 51 7.770 7.770 8.394 -0.624 17934 5959 1 9 . 1 1 52 52 GLN N N 52 117.831 117.831 120.819 -2.988 17934 5960 1 9 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.128 0.100 17934 5961 1 9 . 1 1 52 52 GLN CA C 52 56.726 56.726 57.335 -0.609 17934 5962 1 9 . 1 1 52 52 GLN CB C 52 29.070 29.070 27.533 1.537 17934 5963 1 9 . 1 1 52 52 GLN H H 52 7.796 7.796 8.280 -0.484 17934 5964 1 9 . 1 1 53 53 LYS N N 53 118.841 118.841 120.604 -1.763 17934 5965 1 9 . 1 1 53 53 LYS CA C 53 57.195 57.195 57.526 -0.331 17934 5966 1 9 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.624 0.665 17934 5967 1 9 . 1 1 53 53 LYS H H 53 7.686 7.686 7.668 0.018 17934 5968 1 9 . 1 1 55 55 THR HA H 55 4.304 4.304 4.235 0.069 17934 5969 1 9 . 1 1 55 55 THR CA C 55 63.757 63.757 63.893 -0.136 17934 5970 1 9 . 1 1 55 55 THR CB C 55 68.914 68.914 68.894 0.020 17934 5971 1 9 . 1 1 56 56 GLU N N 56 120.861 120.861 118.759 2.102 17934 5972 1 9 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.117 0.029 17934 5973 1 9 . 1 1 56 56 GLU C C 56 177.656 177.656 178.898 -1.242 17934 5974 1 9 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.220 -0.087 17934 5975 1 9 . 1 1 56 56 GLU CB C 56 30.008 30.008 28.960 1.048 17934 5976 1 9 . 1 1 56 56 GLU H H 56 8.311 8.311 8.467 -0.156 17934 5977 1 9 . 1 1 57 57 GLN N N 57 118.397 118.397 119.082 -0.685 17934 5978 1 9 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.115 0.027 17934 5979 1 9 . 1 1 57 57 GLN C C 57 177.275 177.275 178.473 -1.198 17934 5980 1 9 . 1 1 57 57 GLN CA C 57 57.664 57.664 58.062 -0.398 17934 5981 1 9 . 1 1 57 57 GLN CB C 57 29.070 29.070 28.224 0.846 17934 5982 1 9 . 1 1 57 57 GLN H H 57 7.899 7.899 7.876 0.023 17934 5983 1 9 . 1 1 58 58 MET N N 58 118.897 118.897 118.161 0.736 17934 5984 1 9 . 1 1 58 58 MET HA H 58 4.350 4.350 4.322 0.028 17934 5985 1 9 . 1 1 58 58 MET C C 58 177.172 177.172 176.836 0.336 17934 5986 1 9 . 1 1 58 58 MET CA C 58 56.726 56.726 57.896 -1.170 17934 5987 1 9 . 1 1 58 58 MET CB C 58 32.196 32.196 32.608 -0.412 17934 5988 1 9 . 1 1 58 58 MET H H 58 8.036 8.036 7.329 0.707 17934 5989 1 9 . 1 1 59 59 LYS N N 59 119.779 119.779 115.130 4.649 17934 5990 1 9 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.496 -0.265 17934 5991 1 9 . 1 1 59 59 LYS C C 59 176.676 176.676 176.901 -0.225 17934 5992 1 9 . 1 1 59 59 LYS CA C 59 57.195 57.195 54.925 2.270 17934 5993 1 9 . 1 1 59 59 LYS CB C 59 32.820 32.820 32.218 0.602 17934 5994 1 9 . 1 1 59 59 LYS H H 59 7.901 7.901 7.704 0.197 17934 5995 1 9 . 1 1 60 60 LYS N N 60 119.993 119.993 118.471 1.522 17934 5996 1 9 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.199 0.136 17934 5997 1 9 . 1 1 60 60 LYS C C 60 176.336 176.336 177.274 -0.938 17934 5998 1 9 . 1 1 60 60 LYS CA C 60 56.258 56.258 56.530 -0.272 17934 5999 1 9 . 1 1 60 60 LYS CB C 60 32.820 32.820 33.086 -0.266 17934 6000 1 9 . 1 1 60 60 LYS H H 60 7.877 7.877 7.627 0.250 17934 6001 1 9 . 1 1 61 61 VAL N N 61 122.649 122.649 119.450 3.199 17934 6002 1 9 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.042 0.338 17934 6003 1 9 . 1 1 61 61 VAL C C 61 174.210 174.210 174.795 -0.585 17934 6004 1 9 . 1 1 61 61 VAL CA C 61 60.000 60.000 60.078 -0.078 17934 6005 1 9 . 1 1 61 61 VAL CB C 61 32.350 32.350 30.215 2.135 17934 6006 1 9 . 1 1 61 61 VAL H H 61 7.708 7.708 7.538 0.170 17934 6007 1 9 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.667 -0.004 17934 6008 1 9 . 1 1 62 62 PRO C C 62 176.656 176.656 175.942 0.714 17934 6009 1 9 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.239 0.581 17934 6010 1 9 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.548 -0.665 17934 6011 1 9 . 1 1 63 63 THR N N 63 117.155 117.155 114.247 2.908 17934 6012 1 9 . 1 1 63 63 THR HA H 63 4.830 4.830 4.656 0.174 17934 6013 1 9 . 1 1 63 63 THR C C 63 174.682 174.682 173.240 1.442 17934 6014 1 9 . 1 1 63 63 THR CA C 63 62.820 62.820 62.545 0.275 17934 6015 1 9 . 1 1 63 63 THR CB C 63 69.382 69.382 70.219 -0.837 17934 6016 1 9 . 1 1 63 63 THR H H 63 8.303 8.303 8.267 0.036 17934 6017 1 9 . 1 1 64 64 ILE N N 64 121.004 121.004 126.838 -5.834 17934 6018 1 9 . 1 1 64 64 ILE CA C 64 58.600 58.600 57.935 0.664 17934 6019 1 9 . 1 1 64 64 ILE CB C 64 42.690 42.690 41.336 1.354 17934 6020 1 9 . 1 1 64 64 ILE H H 64 9.348 9.348 8.953 0.395 17934 6021 1 9 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.634 0.106 17934 6022 1 9 . 1 1 65 65 ILE C C 65 175.378 175.378 174.954 0.424 17934 6023 1 9 . 1 1 65 65 ILE CA C 65 60.080 60.080 60.549 -0.469 17934 6024 1 9 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.912 0.838 17934 6025 1 9 . 1 1 66 66 LEU N N 66 110.343 110.343 130.372 -20.029 17934 6026 1 9 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.719 0.131 17934 6027 1 9 . 1 1 66 66 LEU C C 66 174.982 174.982 175.785 -0.803 17934 6028 1 9 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.591 -0.681 17934 6029 1 9 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.940 1.290 17934 6030 1 9 . 1 1 66 66 LEU H H 66 9.610 9.610 9.231 0.379 17934 6031 1 9 . 1 1 67 67 SER N N 67 120.990 120.990 120.351 0.639 17934 6032 1 9 . 1 1 67 67 SER HA H 67 5.405 5.405 5.103 0.302 17934 6033 1 9 . 1 1 67 67 SER C C 67 174.405 174.405 173.291 1.114 17934 6034 1 9 . 1 1 67 67 SER CA C 67 57.195 57.195 56.801 0.394 17934 6035 1 9 . 1 1 67 67 SER CB C 67 64.695 64.695 63.873 0.821 17934 6036 1 9 . 1 1 67 67 SER H H 67 9.260 9.260 9.060 0.200 17934 6037 1 9 . 1 1 68 68 VAL N N 68 128.176 128.176 127.373 0.803 17934 6038 1 9 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.326 0.167 17934 6039 1 9 . 1 1 68 68 VAL C C 68 173.891 173.891 173.728 0.163 17934 6040 1 9 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.868 1.482 17934 6041 1 9 . 1 1 68 68 VAL CB C 68 33.750 33.750 32.560 1.190 17934 6042 1 9 . 1 1 68 68 VAL H H 68 9.225 9.225 8.895 0.330 17934 6043 1 9 . 1 1 69 69 SER N N 69 121.697 121.697 124.025 -2.328 17934 6044 1 9 . 1 1 69 69 SER HA H 69 4.837 4.837 4.945 -0.108 17934 6045 1 9 . 1 1 69 69 SER C C 69 173.188 173.188 174.771 -1.583 17934 6046 1 9 . 1 1 69 69 SER CA C 69 57.195 57.195 56.283 0.912 17934 6047 1 9 . 1 1 69 69 SER CB C 69 67.976 67.976 66.001 1.975 17934 6048 1 9 . 1 1 69 69 SER H H 69 8.869 8.869 8.231 0.638 17934 6049 1 9 . 1 1 70 70 ALA N N 70 118.689 118.689 126.913 -8.224 17934 6050 1 9 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.208 -0.058 17934 6051 1 9 . 1 1 70 70 ALA C C 70 176.714 176.714 177.840 -1.126 17934 6052 1 9 . 1 1 70 70 ALA CA C 70 53.910 53.910 53.833 0.077 17934 6053 1 9 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.465 0.135 17934 6054 1 9 . 1 1 70 70 ALA H H 70 8.810 8.810 9.009 -0.199 17934 6055 1 9 . 1 1 71 71 LYS N N 71 112.633 112.633 116.022 -3.389 17934 6056 1 9 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.472 -0.197 17934 6057 1 9 . 1 1 71 71 LYS C C 71 177.033 177.033 176.376 0.657 17934 6058 1 9 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.397 1.798 17934 6059 1 9 . 1 1 71 71 LYS CB C 71 33.289 33.289 33.071 0.218 17934 6060 1 9 . 1 1 71 71 LYS H H 71 7.830 7.830 7.671 0.159 17934 6061 1 9 . 1 1 72 72 GLY N N 72 108.432 108.432 106.636 1.796 17934 6062 1 9 . 1 1 72 72 GLY CA C 72 45.476 45.476 44.971 0.505 17934 6063 1 9 . 1 1 72 72 GLY H H 72 7.685 7.685 7.782 -0.097 17934 6064 1 9 . 1 1 73 73 VAL N N 73 120.414 120.414 121.656 -1.242 17934 6065 1 9 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.961 0.039 17934 6066 1 9 . 1 1 73 73 VAL CA C 73 60.470 60.470 60.220 0.250 17934 6067 1 9 . 1 1 73 73 VAL CB C 73 35.630 35.630 34.866 0.764 17934 6068 1 9 . 1 1 73 73 VAL H H 73 8.620 8.620 8.472 0.148 17934 6069 1 9 . 1 1 74 74 LYS N N 74 125.257 125.257 125.556 -0.299 17934 6070 1 9 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.255 0.761 17934 6071 1 9 . 1 1 74 74 LYS CA C 74 54.383 54.383 54.289 0.094 17934 6072 1 9 . 1 1 74 74 LYS CB C 74 36.570 36.570 35.693 0.877 17934 6073 1 9 . 1 1 74 74 LYS H H 74 8.783 8.783 8.505 0.278 17934 6074 1 9 . 1 1 75 75 PHE N N 75 119.414 119.414 119.000 0.414 17934 6075 1 9 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.515 0.185 17934 6076 1 9 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.225 -2.305 17934 6077 1 9 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.144 -0.534 17934 6078 1 9 . 1 1 75 75 PHE H H 75 8.432 8.432 8.723 -0.291 17934 6079 1 9 . 1 1 76 76 ILE N N 76 121.430 121.430 121.702 -0.272 17934 6080 1 9 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.595 0.245 17934 6081 1 9 . 1 1 76 76 ILE C C 76 175.249 175.249 174.565 0.684 17934 6082 1 9 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.893 -0.823 17934 6083 1 9 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.215 0.005 17934 6084 1 9 . 1 1 76 76 ILE H H 76 8.960 8.960 8.465 0.495 17934 6085 1 9 . 1 1 77 77 ASP N N 77 125.744 125.744 123.815 1.929 17934 6086 1 9 . 1 1 77 77 ASP HA H 77 4.563 4.563 5.055 -0.492 17934 6087 1 9 . 1 1 77 77 ASP C C 77 177.569 177.569 175.940 1.629 17934 6088 1 9 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.951 2.838 17934 6089 1 9 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.104 0.497 17934 6090 1 9 . 1 1 77 77 ASP H H 77 8.750 8.750 8.806 -0.056 17934 6091 1 9 . 1 1 78 78 ALA N N 78 128.632 128.632 127.960 0.672 17934 6092 1 9 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.303 -0.333 17934 6093 1 9 . 1 1 78 78 ALA C C 78 178.052 178.052 177.827 0.225 17934 6094 1 9 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.190 0.640 17934 6095 1 9 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.895 -0.102 17934 6096 1 9 . 1 1 78 78 ALA H H 78 8.700 8.700 8.826 -0.126 17934 6097 1 9 . 1 1 79 79 THR N N 79 113.087 113.087 112.363 0.724 17934 6098 1 9 . 1 1 79 79 THR HA H 79 4.194 4.194 4.172 0.022 17934 6099 1 9 . 1 1 79 79 THR C C 79 175.587 175.587 175.555 0.032 17934 6100 1 9 . 1 1 79 79 THR CA C 79 64.695 64.695 64.530 0.165 17934 6101 1 9 . 1 1 79 79 THR CB C 79 69.382 69.382 69.144 0.238 17934 6102 1 9 . 1 1 79 79 THR H H 79 8.779 8.779 8.247 0.532 17934 6103 1 9 . 1 1 80 80 ASN N N 80 118.434 118.434 116.759 1.675 17934 6104 1 9 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.788 -0.051 17934 6105 1 9 . 1 1 80 80 ASN CA C 80 53.445 53.445 53.079 0.366 17934 6106 1 9 . 1 1 80 80 ASN CB C 80 39.383 39.383 38.565 0.818 17934 6107 1 9 . 1 1 80 80 ASN H H 80 8.584 8.584 7.921 0.663 17934 6108 1 9 . 1 1 81 81 LYS N N 81 112.429 112.429 116.096 -3.667 17934 6109 1 9 . 1 1 81 81 LYS C C 81 174.909 174.909 175.245 -0.336 17934 6110 1 9 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.549 0.115 17934 6111 1 9 . 1 1 81 81 LYS CB C 81 28.602 28.602 30.883 -2.281 17934 6112 1 9 . 1 1 81 81 LYS H H 81 7.966 7.966 8.360 -0.394 17934 6113 1 9 . 1 1 82 82 ASN N N 82 116.806 116.806 116.584 0.222 17934 6114 1 9 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.934 -0.344 17934 6115 1 9 . 1 1 82 82 ASN C C 82 174.999 174.999 173.914 1.085 17934 6116 1 9 . 1 1 82 82 ASN CA C 82 52.976 52.976 51.816 1.160 17934 6117 1 9 . 1 1 82 82 ASN CB C 82 38.445 38.445 39.720 -1.275 17934 6118 1 9 . 1 1 82 82 ASN H H 82 8.455 8.455 8.013 0.442 17934 6119 1 9 . 1 1 83 83 ILE N N 83 122.447 122.447 119.045 3.402 17934 6120 1 9 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.439 -0.409 17934 6121 1 9 . 1 1 83 83 ILE C C 83 176.572 176.572 175.513 1.059 17934 6122 1 9 . 1 1 83 83 ILE CA C 83 62.350 62.350 60.349 2.001 17934 6123 1 9 . 1 1 83 83 ILE CB C 83 37.970 37.970 38.169 -0.199 17934 6124 1 9 . 1 1 83 83 ILE H H 83 8.650 8.650 8.443 0.207 17934 6125 1 9 . 1 1 84 84 ILE N N 84 129.339 129.339 125.551 3.788 17934 6126 1 9 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.310 -0.390 17934 6127 1 9 . 1 1 84 84 ILE C C 84 175.873 175.873 176.094 -0.221 17934 6128 1 9 . 1 1 84 84 ILE CA C 84 62.810 62.810 60.724 2.087 17934 6129 1 9 . 1 1 84 84 ILE CB C 84 38.840 38.840 37.762 1.078 17934 6130 1 9 . 1 1 84 84 ILE H H 84 8.930 8.930 9.029 -0.099 17934 6131 1 9 . 1 1 85 85 ALA N N 85 118.867 118.867 119.271 -0.404 17934 6132 1 9 . 1 1 85 85 ALA C C 85 174.100 174.100 175.233 -1.133 17934 6133 1 9 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.232 -0.662 17934 6134 1 9 . 1 1 85 85 ALA H H 85 7.048 7.048 8.091 -1.043 17934 6135 1 9 . 1 1 87 87 HIS HA H 87 5.154 5.154 5.081 0.073 17934 6136 1 9 . 1 1 87 87 HIS C C 87 174.986 174.986 174.174 0.812 17934 6137 1 9 . 1 1 87 87 HIS CB C 87 34.350 34.350 31.974 2.376 17934 6138 1 9 . 1 1 88 88 GLU N N 88 125.372 125.372 121.184 4.188 17934 6139 1 9 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.379 0.142 17934 6140 1 9 . 1 1 88 88 GLU C C 88 179.047 179.047 178.064 0.983 17934 6141 1 9 . 1 1 88 88 GLU CA C 88 56.726 56.726 56.903 -0.177 17934 6142 1 9 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.159 0.318 17934 6143 1 9 . 1 1 88 88 GLU H H 88 9.106 9.106 8.880 0.226 17934 6144 1 9 . 1 1 89 89 ILE N N 89 124.132 124.132 123.481 0.651 17934 6145 1 9 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.876 0.143 17934 6146 1 9 . 1 1 89 89 ILE C C 89 176.095 176.095 177.567 -1.472 17934 6147 1 9 . 1 1 89 89 ILE CA C 89 62.351 62.351 65.482 -3.131 17934 6148 1 9 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.144 0.770 17934 6149 1 9 . 1 1 89 89 ILE H H 89 8.055 8.055 8.893 -0.838 17934 6150 1 9 . 1 1 90 90 ARG N N 90 116.949 116.949 116.357 0.592 17934 6151 1 9 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.168 0.170 17934 6152 1 9 . 1 1 90 90 ARG C C 90 176.578 176.578 176.549 0.029 17934 6153 1 9 . 1 1 90 90 ARG CA C 90 57.664 57.664 58.202 -0.538 17934 6154 1 9 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.156 -0.086 17934 6155 1 9 . 1 1 90 90 ARG H H 90 8.045 8.045 8.373 -0.328 17934 6156 1 9 . 1 1 91 91 ASN N N 91 116.320 116.320 117.216 -0.896 17934 6157 1 9 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.710 0.443 17934 6158 1 9 . 1 1 91 91 ASN C C 91 174.595 174.595 175.709 -1.114 17934 6159 1 9 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.118 -1.610 17934 6160 1 9 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.670 0.182 17934 6161 1 9 . 1 1 91 91 ASN H H 91 8.067 8.067 8.045 0.022 17934 6162 1 9 . 1 1 92 92 ILE N N 92 122.441 122.441 122.103 0.338 17934 6163 1 9 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.718 1.355 17934 6164 1 9 . 1 1 92 92 ILE C C 92 175.229 175.229 175.997 -0.768 17934 6165 1 9 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.718 -0.838 17934 6166 1 9 . 1 1 92 92 ILE CB C 92 39.850 39.850 36.955 2.895 17934 6167 1 9 . 1 1 92 92 ILE H H 92 7.483 7.483 7.918 -0.435 17934 6168 1 9 . 1 1 93 93 SER N N 93 120.329 120.329 123.247 -2.918 17934 6169 1 9 . 1 1 93 93 SER HA H 93 4.684 4.684 4.063 0.621 17934 6170 1 9 . 1 1 93 93 SER C C 93 180.744 180.744 174.481 6.263 17934 6171 1 9 . 1 1 93 93 SER CA C 93 57.664 57.664 61.259 -3.595 17934 6172 1 9 . 1 1 93 93 SER CB C 93 66.570 66.570 63.768 2.802 17934 6173 1 9 . 1 1 93 93 SER H H 93 9.545 9.545 8.329 1.216 17934 6174 1 9 . 1 1 94 94 CYS N N 94 110.900 110.900 114.228 -3.328 17934 6175 1 9 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.361 -0.549 17934 6176 1 9 . 1 1 94 94 CYS C C 94 173.973 173.973 172.701 1.272 17934 6177 1 9 . 1 1 94 94 CYS CA C 94 59.539 59.539 58.163 1.376 17934 6178 1 9 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.570 -4.312 17934 6179 1 9 . 1 1 94 94 CYS H H 94 8.858 8.858 7.902 0.956 17934 6180 1 9 . 1 1 95 95 ALA N N 95 121.379 121.379 122.881 -1.502 17934 6181 1 9 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.610 -0.180 17934 6182 1 9 . 1 1 95 95 ALA C C 95 178.098 178.098 175.178 2.920 17934 6183 1 9 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.565 1.085 17934 6184 1 9 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.502 -2.202 17934 6185 1 9 . 1 1 95 95 ALA H H 95 8.360 8.360 8.268 0.092 17934 6186 1 9 . 1 1 96 96 ALA N N 96 122.576 122.576 121.892 0.684 17934 6187 1 9 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.642 0.038 17934 6188 1 9 . 1 1 96 96 ALA C C 96 175.716 175.716 174.777 0.939 17934 6189 1 9 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.630 0.810 17934 6190 1 9 . 1 1 96 96 ALA CB C 96 22.700 22.700 21.912 0.788 17934 6191 1 9 . 1 1 96 96 ALA H H 96 9.080 9.080 8.645 0.435 17934 6192 1 9 . 1 1 97 97 GLN N N 97 116.903 116.903 120.108 -3.205 17934 6193 1 9 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.746 0.184 17934 6194 1 9 . 1 1 97 97 GLN C C 97 175.270 175.270 174.303 0.967 17934 6195 1 9 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.280 1.571 17934 6196 1 9 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.418 2.340 17934 6197 1 9 . 1 1 97 97 GLN H H 97 8.369 8.369 8.243 0.126 17934 6198 1 9 . 1 1 98 98 ASP N N 98 124.971 124.971 121.375 3.596 17934 6199 1 9 . 1 1 98 98 ASP C C 98 175.217 175.217 176.222 -1.005 17934 6200 1 9 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.198 -0.159 17934 6201 1 9 . 1 1 98 98 ASP CB C 98 42.195 42.195 41.507 0.688 17934 6202 1 9 . 1 1 98 98 ASP H H 98 8.395 8.395 8.276 0.119 17934 6203 1 9 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.374 -0.140 17934 6204 1 9 . 1 1 99 99 PRO C C 99 178.433 178.433 177.506 0.927 17934 6205 1 9 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.720 -0.025 17934 6206 1 9 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.155 0.197 17934 6207 1 9 . 1 1 100 100 GLU N N 100 116.223 116.223 118.591 -2.368 17934 6208 1 9 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.131 0.089 17934 6209 1 9 . 1 1 100 100 GLU C C 100 176.678 176.678 175.852 0.826 17934 6210 1 9 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.530 -1.804 17934 6211 1 9 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.832 2.113 17934 6212 1 9 . 1 1 100 100 GLU H H 100 8.643 8.643 8.669 -0.026 17934 6213 1 9 . 1 1 101 101 ASP N N 101 119.053 119.053 118.833 0.220 17934 6214 1 9 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.887 -0.344 17934 6215 1 9 . 1 1 101 101 ASP C C 101 174.771 174.771 176.329 -1.558 17934 6216 1 9 . 1 1 101 101 ASP CA C 101 53.914 53.914 52.905 1.009 17934 6217 1 9 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.661 0.128 17934 6218 1 9 . 1 1 101 101 ASP H H 101 7.597 7.597 8.130 -0.533 17934 6219 1 9 . 1 1 102 102 LEU N N 102 123.986 123.986 120.771 3.215 17934 6220 1 9 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.235 0.155 17934 6221 1 9 . 1 1 102 102 LEU C C 102 177.141 177.141 177.974 -0.833 17934 6222 1 9 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.247 0.413 17934 6223 1 9 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.823 0.837 17934 6224 1 9 . 1 1 102 102 LEU H H 102 8.534 8.534 7.692 0.842 17934 6225 1 9 . 1 1 103 103 SER N N 103 112.339 112.339 113.035 -0.696 17934 6226 1 9 . 1 1 103 103 SER HA H 103 4.290 4.290 4.369 -0.079 17934 6227 1 9 . 1 1 103 103 SER C C 103 174.106 174.106 174.637 -0.531 17934 6228 1 9 . 1 1 103 103 SER CA C 103 60.945 60.945 60.665 0.280 17934 6229 1 9 . 1 1 103 103 SER CB C 103 63.757 63.757 63.441 0.316 17934 6230 1 9 . 1 1 103 103 SER H H 103 7.867 7.867 8.253 -0.386 17934 6231 1 9 . 1 1 104 104 THR N N 104 123.070 123.070 115.777 7.293 17934 6232 1 9 . 1 1 104 104 THR HA H 104 5.373 5.373 4.643 0.730 17934 6233 1 9 . 1 1 104 104 THR C C 104 180.693 180.693 172.844 7.849 17934 6234 1 9 . 1 1 104 104 THR CA C 104 63.289 63.289 62.794 0.495 17934 6235 1 9 . 1 1 104 104 THR CB C 104 69.382 69.382 71.367 -1.985 17934 6236 1 9 . 1 1 104 104 THR H H 104 8.830 8.830 7.902 0.928 17934 6237 1 9 . 1 1 105 105 PHE N N 105 122.582 122.582 120.141 2.441 17934 6238 1 9 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.919 0.551 17934 6239 1 9 . 1 1 105 105 PHE C C 105 179.211 179.211 172.170 7.041 17934 6240 1 9 . 1 1 105 105 PHE CA C 105 55.320 55.320 56.003 -0.683 17934 6241 1 9 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.965 -0.175 17934 6242 1 9 . 1 1 105 105 PHE H H 105 9.170 9.170 8.692 0.478 17934 6243 1 9 . 1 1 106 106 ALA N N 106 119.567 119.567 122.340 -2.773 17934 6244 1 9 . 1 1 106 106 ALA C C 106 175.603 175.603 175.239 0.364 17934 6245 1 9 . 1 1 106 106 ALA H H 106 8.770 8.770 9.006 -0.236 17934 6246 1 9 . 1 1 107 107 TYR N N 107 109.933 109.933 118.392 -8.459 17934 6247 1 9 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.268 -0.348 17934 6248 1 9 . 1 1 107 107 TYR C C 107 180.426 180.426 173.096 7.330 17934 6249 1 9 . 1 1 107 107 TYR CA C 107 57.080 57.080 54.619 2.461 17934 6250 1 9 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.325 -0.535 17934 6251 1 9 . 1 1 107 107 TYR H H 107 7.950 7.950 8.947 -0.997 17934 6252 1 9 . 1 1 108 108 ILE N N 108 120.613 120.613 121.973 -1.360 17934 6253 1 9 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.679 0.691 17934 6254 1 9 . 1 1 108 108 ILE C C 108 176.212 176.212 175.840 0.372 17934 6255 1 9 . 1 1 108 108 ILE CA C 108 59.540 59.540 60.969 -1.429 17934 6256 1 9 . 1 1 108 108 ILE CB C 108 39.380 39.380 39.722 -0.342 17934 6257 1 9 . 1 1 108 108 ILE H H 108 8.869 8.869 8.344 0.525 17934 6258 1 9 . 1 1 109 109 THR N N 109 116.505 116.505 119.611 -3.106 17934 6259 1 9 . 1 1 109 109 THR HA H 109 5.669 5.669 4.715 0.954 17934 6260 1 9 . 1 1 109 109 THR C C 109 173.505 173.505 172.971 0.534 17934 6261 1 9 . 1 1 109 109 THR CA C 109 59.070 59.070 59.815 -0.745 17934 6262 1 9 . 1 1 109 109 THR H H 109 9.489 9.489 8.206 1.283 17934 6263 1 9 . 1 1 110 110 LYS N N 110 122.960 122.960 120.513 2.447 17934 6264 1 9 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.355 0.105 17934 6265 1 9 . 1 1 110 110 LYS C C 110 175.937 175.937 175.485 0.452 17934 6266 1 9 . 1 1 110 110 LYS CA C 110 55.789 55.789 56.022 -0.233 17934 6267 1 9 . 1 1 110 110 LYS CB C 110 34.227 34.227 33.063 1.164 17934 6268 1 9 . 1 1 110 110 LYS H H 110 7.831 7.831 8.158 -0.327 17934 6269 1 9 . 1 1 111 111 ASP N N 111 127.409 127.409 121.081 6.328 17934 6270 1 9 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.749 0.032 17934 6271 1 9 . 1 1 111 111 ASP C C 111 176.396 176.396 176.471 -0.075 17934 6272 1 9 . 1 1 111 111 ASP CA C 111 53.914 53.914 53.328 0.586 17934 6273 1 9 . 1 1 111 111 ASP CB C 111 43.133 43.133 41.935 1.198 17934 6274 1 9 . 1 1 111 111 ASP H H 111 8.769 8.769 8.269 0.500 17934 6275 1 9 . 1 1 112 112 LEU N N 112 125.913 125.913 123.419 2.494 17934 6276 1 9 . 1 1 112 112 LEU HA H 112 4.150 4.150 3.971 0.179 17934 6277 1 9 . 1 1 112 112 LEU C C 112 178.553 178.553 177.473 1.080 17934 6278 1 9 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.902 -0.712 17934 6279 1 9 . 1 1 112 112 LEU CB C 112 41.790 41.790 42.346 -0.556 17934 6280 1 9 . 1 1 112 112 LEU H H 112 8.593 8.593 8.620 -0.027 17934 6281 1 9 . 1 1 113 113 LYS N N 113 117.189 117.189 116.468 0.721 17934 6282 1 9 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.343 -0.081 17934 6283 1 9 . 1 1 113 113 LYS C C 113 177.180 177.180 176.384 0.796 17934 6284 1 9 . 1 1 113 113 LYS CA C 113 58.133 58.133 56.059 2.074 17934 6285 1 9 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.542 0.278 17934 6286 1 9 . 1 1 113 113 LYS H H 113 8.207 8.207 8.025 0.182 17934 6287 1 9 . 1 1 114 114 SER N N 114 112.492 112.492 109.515 2.977 17934 6288 1 9 . 1 1 114 114 SER CA C 114 58.601 58.601 58.481 0.120 17934 6289 1 9 . 1 1 114 114 SER CB C 114 65.164 65.164 62.232 2.932 17934 6290 1 9 . 1 1 114 114 SER H H 114 7.755 7.755 7.876 -0.121 17934 6291 1 9 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.515 -0.126 17934 6292 1 9 . 1 1 115 115 ASN C C 115 174.203 174.203 175.432 -1.229 17934 6293 1 9 . 1 1 115 115 ASN CA C 115 54.383 54.383 54.691 -0.307 17934 6294 1 9 . 1 1 115 115 ASN CB C 115 37.977 37.977 39.318 -1.341 17934 6295 1 9 . 1 1 116 116 HIS N N 116 116.822 116.822 115.361 1.461 17934 6296 1 9 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.547 0.383 17934 6297 1 9 . 1 1 116 116 HIS C C 116 173.898 173.898 173.140 0.758 17934 6298 1 9 . 1 1 116 116 HIS CA C 116 54.910 54.910 55.382 -0.472 17934 6299 1 9 . 1 1 116 116 HIS CB C 116 32.650 32.650 32.046 0.604 17934 6300 1 9 . 1 1 116 116 HIS H H 116 7.690 7.690 7.610 0.080 17934 6301 1 9 . 1 1 117 117 HIS N N 117 118.253 118.253 119.983 -1.730 17934 6302 1 9 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.448 0.872 17934 6303 1 9 . 1 1 117 117 HIS C C 117 173.695 173.695 174.971 -1.276 17934 6304 1 9 . 1 1 117 117 HIS CA C 117 56.350 56.350 56.675 -0.325 17934 6305 1 9 . 1 1 117 117 HIS CB C 117 32.350 32.350 27.756 4.595 17934 6306 1 9 . 1 1 117 117 HIS H H 117 8.340 8.340 7.957 0.383 17934 6307 1 9 . 1 1 118 118 TYR N N 118 118.301 118.301 123.929 -5.628 17934 6308 1 9 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.456 0.554 17934 6309 1 9 . 1 1 118 118 TYR C C 118 173.530 173.530 174.292 -0.762 17934 6310 1 9 . 1 1 118 118 TYR CA C 118 56.730 56.730 56.618 0.112 17934 6311 1 9 . 1 1 118 118 TYR CB C 118 43.240 43.240 40.477 2.763 17934 6312 1 9 . 1 1 118 118 TYR H H 118 9.080 9.080 8.304 0.776 17934 6313 1 9 . 1 1 119 119 CYS N N 119 121.015 121.015 123.382 -2.367 17934 6314 1 9 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.369 0.694 17934 6315 1 9 . 1 1 119 119 CYS C C 119 180.664 180.664 173.142 7.522 17934 6316 1 9 . 1 1 119 119 CYS CA C 119 56.726 56.726 56.565 0.161 17934 6317 1 9 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.455 1.084 17934 6318 1 9 . 1 1 119 119 CYS H H 119 9.120 9.120 8.756 0.364 17934 6319 1 9 . 1 1 120 120 HIS N N 120 110.134 110.134 128.572 -18.438 17934 6320 1 9 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.457 0.242 17934 6321 1 9 . 1 1 120 120 HIS C C 120 180.776 180.776 173.383 7.393 17934 6322 1 9 . 1 1 120 120 HIS CA C 120 55.320 55.320 55.062 0.258 17934 6323 1 9 . 1 1 120 120 HIS CB C 120 32.352 32.352 30.047 2.305 17934 6324 1 9 . 1 1 120 120 HIS H H 120 8.482 8.482 8.520 -0.038 17934 6325 1 9 . 1 1 121 121 VAL N N 121 120.855 120.855 122.711 -1.856 17934 6326 1 9 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.306 0.044 17934 6327 1 9 . 1 1 121 121 VAL C C 121 173.419 173.419 173.000 0.419 17934 6328 1 9 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.103 1.307 17934 6329 1 9 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.475 -0.195 17934 6330 1 9 . 1 1 121 121 VAL H H 121 7.929 7.929 8.605 -0.676 17934 6331 1 9 . 1 1 122 122 PHE N N 122 124.384 124.384 127.993 -3.609 17934 6332 1 9 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.350 0.070 17934 6333 1 9 . 1 1 122 122 PHE C C 122 174.876 174.876 174.662 0.214 17934 6334 1 9 . 1 1 122 122 PHE CA C 122 55.320 55.320 54.517 0.803 17934 6335 1 9 . 1 1 122 122 PHE CB C 122 44.540 44.540 43.045 1.495 17934 6336 1 9 . 1 1 122 122 PHE H H 122 8.910 8.910 9.049 -0.139 17934 6337 1 9 . 1 1 123 123 THR N N 123 112.451 112.451 113.468 -1.017 17934 6338 1 9 . 1 1 123 123 THR HA H 123 5.147 5.147 4.823 0.324 17934 6339 1 9 . 1 1 123 123 THR C C 123 174.096 174.096 173.369 0.727 17934 6340 1 9 . 1 1 123 123 THR CA C 123 61.843 61.843 59.455 2.388 17934 6341 1 9 . 1 1 123 123 THR CB C 123 71.218 71.218 70.604 0.614 17934 6342 1 9 . 1 1 123 123 THR H H 123 8.668 8.668 9.013 -0.345 17934 6343 1 9 . 1 1 124 124 ALA N N 124 128.922 128.922 125.619 3.303 17934 6344 1 9 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.441 0.279 17934 6345 1 9 . 1 1 124 124 ALA C C 124 177.168 177.168 176.716 0.452 17934 6346 1 9 . 1 1 124 124 ALA CA C 124 50.890 50.890 50.528 0.362 17934 6347 1 9 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.474 -0.374 17934 6348 1 9 . 1 1 124 124 ALA H H 124 9.180 9.180 8.512 0.668 17934 6349 1 9 . 1 1 125 125 PHE N N 125 115.427 115.427 117.800 -2.373 17934 6350 1 9 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.583 -0.293 17934 6351 1 9 . 1 1 125 125 PHE C C 125 174.703 174.703 175.874 -1.171 17934 6352 1 9 . 1 1 125 125 PHE CA C 125 60.470 60.470 57.250 3.220 17934 6353 1 9 . 1 1 125 125 PHE CB C 125 38.060 38.060 38.904 -0.844 17934 6354 1 9 . 1 1 125 125 PHE H H 125 8.560 8.560 8.705 -0.145 17934 6355 1 9 . 1 1 126 126 ASP N N 126 115.745 115.745 119.545 -3.800 17934 6356 1 9 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.938 -0.095 17934 6357 1 9 . 1 1 126 126 ASP C C 126 176.532 176.532 176.052 0.480 17934 6358 1 9 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.305 0.140 17934 6359 1 9 . 1 1 126 126 ASP CB C 126 44.070 44.070 44.940 -0.870 17934 6360 1 9 . 1 1 126 126 ASP H H 126 7.417 7.417 7.579 -0.162 17934 6361 1 9 . 1 1 127 127 VAL N N 127 121.923 121.923 124.013 -2.090 17934 6362 1 9 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.756 -0.166 17934 6363 1 9 . 1 1 127 127 VAL C C 127 176.863 176.863 177.304 -0.441 17934 6364 1 9 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.729 -1.099 17934 6365 1 9 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.230 -0.400 17934 6366 1 9 . 1 1 127 127 VAL H H 127 8.508 8.508 8.614 -0.106 17934 6367 1 9 . 1 1 128 128 ASN N N 128 118.851 118.851 118.520 0.331 17934 6368 1 9 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.463 0.013 17934 6369 1 9 . 1 1 128 128 ASN C C 128 178.251 178.251 177.581 0.670 17934 6370 1 9 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.160 0.098 17934 6371 1 9 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.023 -0.045 17934 6372 1 9 . 1 1 128 128 ASN H H 128 8.207 8.207 8.470 -0.263 17934 6373 1 9 . 1 1 129 129 LEU N N 129 122.549 122.549 119.938 2.611 17934 6374 1 9 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.915 0.295 17934 6375 1 9 . 1 1 129 129 LEU C C 129 178.003 178.003 177.908 0.095 17934 6376 1 9 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.927 -0.737 17934 6377 1 9 . 1 1 129 129 LEU CB C 129 41.790 41.790 41.141 0.649 17934 6378 1 9 . 1 1 129 129 LEU H H 129 8.223 8.223 8.078 0.145 17934 6379 1 9 . 1 1 130 130 ALA N N 130 120.036 120.036 122.061 -2.025 17934 6380 1 9 . 1 1 130 130 ALA HA H 130 3.310 3.310 4.042 -0.732 17934 6381 1 9 . 1 1 130 130 ALA C C 130 178.172 178.172 179.187 -1.015 17934 6382 1 9 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.287 0.493 17934 6383 1 9 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.260 0.810 17934 6384 1 9 . 1 1 130 130 ALA H H 130 7.360 7.360 8.028 -0.668 17934 6385 1 9 . 1 1 131 131 ALA N N 131 116.989 116.989 119.613 -2.624 17934 6386 1 9 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.836 -0.126 17934 6387 1 9 . 1 1 131 131 ALA C C 131 180.163 180.163 179.594 0.569 17934 6388 1 9 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.796 0.984 17934 6389 1 9 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.014 -0.184 17934 6390 1 9 . 1 1 131 131 ALA H H 131 7.360 7.360 8.202 -0.842 17934 6391 1 9 . 1 1 132 132 GLU N N 132 119.462 119.462 119.897 -0.435 17934 6392 1 9 . 1 1 132 132 GLU HA H 132 3.888 3.888 3.984 -0.096 17934 6393 1 9 . 1 1 132 132 GLU C C 132 179.243 179.243 178.643 0.600 17934 6394 1 9 . 1 1 132 132 GLU CA C 132 59.539 59.539 59.295 0.244 17934 6395 1 9 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.339 0.200 17934 6396 1 9 . 1 1 132 132 GLU H H 132 7.673 7.673 7.938 -0.265 17934 6397 1 9 . 1 1 133 133 ILE N N 133 123.218 123.218 120.494 2.724 17934 6398 1 9 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.411 -0.631 17934 6399 1 9 . 1 1 133 133 ILE C C 133 177.421 177.421 177.948 -0.527 17934 6400 1 9 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.308 1.182 17934 6401 1 9 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.519 -0.869 17934 6402 1 9 . 1 1 133 133 ILE H H 133 8.154 8.154 7.830 0.324 17934 6403 1 9 . 1 1 134 134 ILE N N 134 118.244 118.244 119.912 -1.668 17934 6404 1 9 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.282 0.258 17934 6405 1 9 . 1 1 134 134 ILE C C 134 179.385 179.385 177.671 1.714 17934 6406 1 9 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.335 -1.055 17934 6407 1 9 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.782 -0.682 17934 6408 1 9 . 1 1 134 134 ILE H H 134 7.376 7.376 7.700 -0.324 17934 6409 1 9 . 1 1 135 135 LEU N N 135 123.061 123.061 120.990 2.071 17934 6410 1 9 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.764 0.426 17934 6411 1 9 . 1 1 135 135 LEU C C 135 179.858 179.858 178.757 1.101 17934 6412 1 9 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.698 -0.508 17934 6413 1 9 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.852 0.008 17934 6414 1 9 . 1 1 135 135 LEU H H 135 8.036 8.036 8.359 -0.323 17934 6415 1 9 . 1 1 136 136 THR N N 136 119.647 119.647 115.733 3.914 17934 6416 1 9 . 1 1 136 136 THR HA H 136 3.725 3.725 3.874 -0.149 17934 6417 1 9 . 1 1 136 136 THR C C 136 176.088 176.088 176.339 -0.251 17934 6418 1 9 . 1 1 136 136 THR CA C 136 58.601 58.601 66.729 -8.128 17934 6419 1 9 . 1 1 136 136 THR CB C 136 67.976 67.976 68.811 -0.835 17934 6420 1 9 . 1 1 136 136 THR H H 136 8.508 8.508 8.309 0.199 17934 6421 1 9 . 1 1 137 137 LEU N N 137 123.182 123.182 121.960 1.222 17934 6422 1 9 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.709 0.031 17934 6423 1 9 . 1 1 137 137 LEU C C 137 178.341 178.341 179.094 -0.753 17934 6424 1 9 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.011 0.249 17934 6425 1 9 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.398 0.152 17934 6426 1 9 . 1 1 137 137 LEU H H 137 8.520 8.520 8.312 0.208 17934 6427 1 9 . 1 1 138 138 GLY N N 138 105.266 105.266 105.181 0.085 17934 6428 1 9 . 1 1 138 138 GLY C C 138 176.973 176.973 175.909 1.064 17934 6429 1 9 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.140 0.211 17934 6430 1 9 . 1 1 138 138 GLY H H 138 7.858 7.858 8.153 -0.295 17934 6431 1 9 . 1 1 139 139 GLN N N 139 123.485 123.485 123.300 0.185 17934 6432 1 9 . 1 1 139 139 GLN C C 139 177.891 177.891 178.418 -0.527 17934 6433 1 9 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.773 -0.172 17934 6434 1 9 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.412 -0.279 17934 6435 1 9 . 1 1 139 139 GLN H H 139 8.195 8.195 8.424 -0.229 17934 6436 1 9 . 1 1 140 140 ALA N N 140 122.754 122.754 122.353 0.401 17934 6437 1 9 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.082 -0.373 17934 6438 1 9 . 1 1 140 140 ALA C C 140 178.987 178.987 179.337 -0.350 17934 6439 1 9 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.787 0.993 17934 6440 1 9 . 1 1 140 140 ALA CB C 140 17.410 17.410 17.978 -0.568 17934 6441 1 9 . 1 1 140 140 ALA H H 140 8.530 8.530 8.279 0.251 17934 6442 1 9 . 1 1 141 141 PHE N N 141 116.275 116.275 118.971 -2.696 17934 6443 1 9 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.271 -0.181 17934 6444 1 9 . 1 1 141 141 PHE C C 141 178.129 178.129 177.724 0.405 17934 6445 1 9 . 1 1 141 141 PHE CA C 141 61.240 61.240 61.010 0.230 17934 6446 1 9 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.284 0.099 17934 6447 1 9 . 1 1 141 141 PHE H H 141 7.920 7.920 8.124 -0.204 17934 6448 1 9 . 1 1 142 142 GLU N N 142 119.967 119.967 118.606 1.361 17934 6449 1 9 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.980 0.247 17934 6450 1 9 . 1 1 142 142 GLU C C 142 179.250 179.250 177.672 1.578 17934 6451 1 9 . 1 1 142 142 GLU CA C 142 59.539 59.539 57.791 1.748 17934 6452 1 9 . 1 1 142 142 GLU CB C 142 29.539 29.539 30.072 -0.533 17934 6453 1 9 . 1 1 142 142 GLU H H 142 7.713 7.713 8.301 -0.588 17934 6454 1 9 . 1 1 143 143 VAL N N 143 120.189 120.189 119.083 1.106 17934 6455 1 9 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.545 0.138 17934 6456 1 9 . 1 1 143 143 VAL C C 143 178.066 178.066 175.907 2.159 17934 6457 1 9 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.397 2.173 17934 6458 1 9 . 1 1 143 143 VAL CB C 143 31.883 31.883 32.039 -0.156 17934 6459 1 9 . 1 1 143 143 VAL H H 143 8.608 8.608 7.380 1.228 17934 6460 1 9 . 1 1 144 144 ALA N N 144 121.753 121.753 120.342 1.411 17934 6461 1 9 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.035 -0.035 17934 6462 1 9 . 1 1 144 144 ALA C C 144 180.776 180.776 176.093 4.683 17934 6463 1 9 . 1 1 144 144 ALA CA C 144 55.780 55.780 52.688 3.092 17934 6464 1 9 . 1 1 144 144 ALA CB C 144 18.770 18.770 19.173 -0.403 17934 6465 1 9 . 1 1 144 144 ALA H H 144 8.399 8.399 7.228 1.171 17934 6466 1 9 . 1 1 145 145 TYR N N 145 119.962 119.962 120.969 -1.007 17934 6467 1 9 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.519 -0.329 17934 6468 1 9 . 1 1 145 145 TYR C C 145 177.645 177.645 176.098 1.547 17934 6469 1 9 . 1 1 145 145 TYR CA C 145 60.880 60.880 57.857 3.023 17934 6470 1 9 . 1 1 145 145 TYR CB C 145 37.980 37.980 39.854 -1.874 17934 6471 1 9 . 1 1 145 145 TYR H H 145 8.190 8.190 8.422 -0.232 17934 6472 1 10 . 1 1 13 13 LYS N N 13 120.778 120.778 123.688 -2.910 17934 6473 1 10 . 1 1 13 13 LYS C C 13 176.476 176.476 175.533 0.943 17934 6474 1 10 . 1 1 13 13 LYS CA C 13 58.601 58.601 57.044 1.557 17934 6475 1 10 . 1 1 13 13 LYS CB C 13 32.820 32.820 33.255 -0.435 17934 6476 1 10 . 1 1 13 13 LYS H H 13 7.984 7.984 8.622 -0.638 17934 6477 1 10 . 1 1 15 15 ILE HA H 15 3.820 3.820 3.890 -0.070 17934 6478 1 10 . 1 1 15 15 ILE C C 15 176.376 176.376 175.319 1.057 17934 6479 1 10 . 1 1 15 15 ILE CA C 15 63.570 63.570 63.148 0.422 17934 6480 1 10 . 1 1 15 15 ILE CB C 15 39.380 39.380 38.002 1.378 17934 6481 1 10 . 1 1 16 16 ALA N N 16 121.364 121.364 119.555 1.809 17934 6482 1 10 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.465 -0.027 17934 6483 1 10 . 1 1 16 16 ALA C C 16 177.494 177.494 177.376 0.118 17934 6484 1 10 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.660 0.316 17934 6485 1 10 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.313 1.020 17934 6486 1 10 . 1 1 16 16 ALA H H 16 8.081 8.081 7.826 0.255 17934 6487 1 10 . 1 1 17 17 GLN N N 17 118.109 118.109 116.876 1.233 17934 6488 1 10 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.593 -0.020 17934 6489 1 10 . 1 1 17 17 GLN C C 17 173.632 173.632 174.904 -1.272 17934 6490 1 10 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.248 -0.397 17934 6491 1 10 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.041 0.436 17934 6492 1 10 . 1 1 17 17 GLN H H 17 7.550 7.550 7.550 0.000 17934 6493 1 10 . 1 1 18 18 SER N N 18 112.384 112.384 113.577 -1.193 17934 6494 1 10 . 1 1 18 18 SER HA H 18 4.388 4.388 4.721 -0.333 17934 6495 1 10 . 1 1 18 18 SER C C 18 173.780 173.780 173.008 0.772 17934 6496 1 10 . 1 1 18 18 SER CA C 18 57.664 57.664 57.350 0.314 17934 6497 1 10 . 1 1 18 18 SER CB C 18 65.164 65.164 65.691 -0.527 17934 6498 1 10 . 1 1 18 18 SER H H 18 7.666 7.666 7.966 -0.300 17934 6499 1 10 . 1 1 19 19 CYS N N 19 120.116 120.116 122.293 -2.177 17934 6500 1 10 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.613 -0.283 17934 6501 1 10 . 1 1 19 19 CYS C C 19 180.387 180.387 172.871 7.516 17934 6502 1 10 . 1 1 19 19 CYS CA C 19 58.601 58.601 57.893 0.708 17934 6503 1 10 . 1 1 19 19 CYS CB C 19 30.008 30.008 30.062 -0.054 17934 6504 1 10 . 1 1 19 19 CYS H H 19 8.835 8.835 8.781 0.054 17934 6505 1 10 . 1 1 20 20 ASP N N 20 124.416 124.416 127.861 -3.445 17934 6506 1 10 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.368 -0.392 17934 6507 1 10 . 1 1 20 20 ASP CB C 20 42.195 42.195 44.354 -2.159 17934 6508 1 10 . 1 1 20 20 ASP H H 20 7.847 7.847 7.988 -0.141 17934 6509 1 10 . 1 1 21 21 TYR N N 21 121.296 121.296 120.224 1.072 17934 6510 1 10 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.678 0.052 17934 6511 1 10 . 1 1 21 21 TYR C C 21 175.793 175.793 174.304 1.489 17934 6512 1 10 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.843 0.358 17934 6513 1 10 . 1 1 21 21 TYR CB C 21 43.240 43.240 43.652 -0.412 17934 6514 1 10 . 1 1 21 21 TYR H H 21 9.070 9.070 8.717 0.353 17934 6515 1 10 . 1 1 22 22 LYS N N 22 122.820 122.820 121.149 1.671 17934 6516 1 10 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.398 -0.206 17934 6517 1 10 . 1 1 22 22 LYS C C 22 175.793 175.793 175.263 0.530 17934 6518 1 10 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.304 0.954 17934 6519 1 10 . 1 1 22 22 LYS CB C 22 33.758 33.758 33.816 -0.058 17934 6520 1 10 . 1 1 22 22 LYS H H 22 8.711 8.711 8.581 0.130 17934 6521 1 10 . 1 1 23 23 ALA N N 23 123.073 123.073 126.585 -3.512 17934 6522 1 10 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.970 -0.240 17934 6523 1 10 . 1 1 23 23 ALA C C 23 174.515 174.515 175.666 -1.151 17934 6524 1 10 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.373 1.197 17934 6525 1 10 . 1 1 23 23 ALA CB C 23 21.628 21.628 23.120 -1.492 17934 6526 1 10 . 1 1 23 23 ALA H H 23 8.727 8.727 8.809 -0.082 17934 6527 1 10 . 1 1 24 24 ALA N N 24 122.486 122.486 125.801 -3.315 17934 6528 1 10 . 1 1 24 24 ALA HA H 24 5.181 5.181 5.152 0.029 17934 6529 1 10 . 1 1 24 24 ALA C C 24 176.835 176.835 176.693 0.142 17934 6530 1 10 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.035 0.535 17934 6531 1 10 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.192 -0.072 17934 6532 1 10 . 1 1 24 24 ALA H H 24 8.675 8.675 9.075 -0.400 17934 6533 1 10 . 1 1 25 25 TYR N N 25 122.698 122.698 126.594 -3.896 17934 6534 1 10 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.477 0.533 17934 6535 1 10 . 1 1 25 25 TYR CA C 25 54.340 54.340 58.388 -4.048 17934 6536 1 10 . 1 1 25 25 TYR CB C 25 39.850 39.850 37.930 1.920 17934 6537 1 10 . 1 1 25 25 TYR H H 25 8.270 8.270 8.588 -0.318 17934 6538 1 10 . 1 1 26 26 LEU N N 26 127.997 127.997 127.020 0.977 17934 6539 1 10 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.056 -0.136 17934 6540 1 10 . 1 1 26 26 LEU C C 26 175.983 175.983 176.049 -0.066 17934 6541 1 10 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.611 0.115 17934 6542 1 10 . 1 1 26 26 LEU CB C 26 41.070 41.070 42.960 -1.890 17934 6543 1 10 . 1 1 26 26 LEU H H 26 8.700 8.700 7.755 0.945 17934 6544 1 10 . 1 1 27 27 GLY N N 27 102.901 102.901 100.193 2.708 17934 6545 1 10 . 1 1 27 27 GLY C C 27 176.219 176.219 171.114 5.105 17934 6546 1 10 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.087 -1.486 17934 6547 1 10 . 1 1 27 27 GLY H H 27 5.891 5.891 7.550 -1.659 17934 6548 1 10 . 1 1 28 28 SER N N 28 111.551 111.551 114.110 -2.559 17934 6549 1 10 . 1 1 28 28 SER HA H 28 5.785 5.785 4.990 0.795 17934 6550 1 10 . 1 1 28 28 SER CA C 28 56.258 56.258 57.607 -1.349 17934 6551 1 10 . 1 1 28 28 SER CB C 28 65.632 65.632 66.065 -0.433 17934 6552 1 10 . 1 1 28 28 SER H H 28 7.981 7.981 8.260 -0.279 17934 6553 1 10 . 1 1 29 29 MET N N 29 119.493 119.493 122.251 -2.758 17934 6554 1 10 . 1 1 29 29 MET HA H 29 4.725 4.725 4.579 0.146 17934 6555 1 10 . 1 1 29 29 MET C C 29 174.143 174.143 174.634 -0.491 17934 6556 1 10 . 1 1 29 29 MET CA C 29 54.036 54.036 53.923 0.113 17934 6557 1 10 . 1 1 29 29 MET CB C 29 37.268 37.268 36.961 0.308 17934 6558 1 10 . 1 1 29 29 MET H H 29 8.704 8.704 8.782 -0.078 17934 6559 1 10 . 1 1 30 30 LEU N N 30 128.150 128.150 124.564 3.586 17934 6560 1 10 . 1 1 30 30 LEU HA H 30 3.785 3.785 3.739 0.046 17934 6561 1 10 . 1 1 30 30 LEU C C 30 175.857 175.857 175.068 0.789 17934 6562 1 10 . 1 1 30 30 LEU CA C 30 56.250 56.250 55.074 1.176 17934 6563 1 10 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.625 1.035 17934 6564 1 10 . 1 1 30 30 LEU H H 30 8.630 8.630 8.323 0.307 17934 6565 1 10 . 1 1 31 31 ILE N N 31 127.723 127.723 127.194 0.529 17934 6566 1 10 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.400 -0.210 17934 6567 1 10 . 1 1 31 31 ILE C C 31 174.881 174.881 175.725 -0.844 17934 6568 1 10 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.090 -1.429 17934 6569 1 10 . 1 1 31 31 ILE CB C 31 37.110 37.110 36.141 0.969 17934 6570 1 10 . 1 1 31 31 ILE H H 31 8.560 8.560 8.650 -0.090 17934 6571 1 10 . 1 1 32 32 LYS HA H 32 4.055 4.055 3.922 0.133 17934 6572 1 10 . 1 1 32 32 LYS C C 32 176.272 176.272 176.840 -0.568 17934 6573 1 10 . 1 1 32 32 LYS CA C 32 58.601 58.601 58.619 -0.018 17934 6574 1 10 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.293 0.527 17934 6575 1 10 . 1 1 33 33 GLU N N 33 118.638 118.638 120.574 -1.936 17934 6576 1 10 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.280 0.108 17934 6577 1 10 . 1 1 33 33 GLU C C 33 173.962 173.962 174.987 -1.025 17934 6578 1 10 . 1 1 33 33 GLU CA C 33 54.851 54.851 55.888 -1.037 17934 6579 1 10 . 1 1 33 33 GLU CB C 33 30.945 30.945 28.832 2.113 17934 6580 1 10 . 1 1 33 33 GLU H H 33 7.723 7.723 8.109 -0.386 17934 6581 1 10 . 1 1 34 34 LEU N N 34 126.535 126.535 125.162 1.373 17934 6582 1 10 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.390 -0.445 17934 6583 1 10 . 1 1 34 34 LEU C C 34 176.870 176.870 176.566 0.304 17934 6584 1 10 . 1 1 34 34 LEU CA C 34 54.850 54.850 54.782 0.068 17934 6585 1 10 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.204 -0.484 17934 6586 1 10 . 1 1 34 34 LEU H H 34 8.446 8.446 7.990 0.456 17934 6587 1 10 . 1 1 35 35 ARG N N 35 128.447 128.447 124.910 3.537 17934 6588 1 10 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.625 -0.070 17934 6589 1 10 . 1 1 35 35 ARG C C 35 176.110 176.110 176.001 0.109 17934 6590 1 10 . 1 1 35 35 ARG CA C 35 54.851 54.851 54.814 0.037 17934 6591 1 10 . 1 1 35 35 ARG CB C 35 30.477 30.477 30.685 -0.208 17934 6592 1 10 . 1 1 35 35 ARG H H 35 8.680 8.680 8.525 0.155 17934 6593 1 10 . 1 1 36 36 GLY N N 36 107.406 107.406 112.582 -5.176 17934 6594 1 10 . 1 1 36 36 GLY CA C 36 45.906 45.906 45.866 0.040 17934 6595 1 10 . 1 1 36 36 GLY H H 36 7.182 7.182 8.748 -1.566 17934 6596 1 10 . 1 1 37 37 THR HA H 37 4.060 4.060 4.167 -0.107 17934 6597 1 10 . 1 1 37 37 THR C C 37 176.634 176.634 176.830 -0.196 17934 6598 1 10 . 1 1 37 37 THR CA C 37 65.632 65.632 64.776 0.856 17934 6599 1 10 . 1 1 37 37 THR CB C 37 68.445 68.445 68.805 -0.360 17934 6600 1 10 . 1 1 38 38 GLU N N 38 122.251 122.251 122.742 -0.491 17934 6601 1 10 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.947 0.179 17934 6602 1 10 . 1 1 38 38 GLU C C 38 179.981 179.981 178.699 1.282 17934 6603 1 10 . 1 1 38 38 GLU CA C 38 60.008 60.008 60.128 -0.120 17934 6604 1 10 . 1 1 38 38 GLU CB C 38 29.539 29.539 29.022 0.517 17934 6605 1 10 . 1 1 38 38 GLU H H 38 8.450 8.450 8.450 -0.000 17934 6606 1 10 . 1 1 39 39 SER N N 39 115.966 115.966 113.455 2.511 17934 6607 1 10 . 1 1 39 39 SER C C 39 175.991 175.991 176.543 -0.552 17934 6608 1 10 . 1 1 39 39 SER CA C 39 62.820 62.820 62.142 0.679 17934 6609 1 10 . 1 1 39 39 SER H H 39 7.522 7.522 7.859 -0.337 17934 6610 1 10 . 1 1 40 40 THR HA H 40 4.049 4.049 4.001 0.048 17934 6611 1 10 . 1 1 40 40 THR C C 40 175.972 175.972 177.501 -1.529 17934 6612 1 10 . 1 1 40 40 THR CA C 40 66.101 66.101 65.176 0.925 17934 6613 1 10 . 1 1 40 40 THR CB C 40 67.976 67.976 68.296 -0.320 17934 6614 1 10 . 1 1 41 41 GLN N N 41 120.354 120.354 118.210 2.144 17934 6615 1 10 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.201 -0.442 17934 6616 1 10 . 1 1 41 41 GLN C C 41 178.483 178.483 178.295 0.188 17934 6617 1 10 . 1 1 41 41 GLN CA C 41 60.476 60.476 58.625 1.851 17934 6618 1 10 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.102 0.031 17934 6619 1 10 . 1 1 41 41 GLN H H 41 8.271 8.271 8.608 -0.337 17934 6620 1 10 . 1 1 42 42 ASP N N 42 120.757 120.757 122.109 -1.352 17934 6621 1 10 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.460 -0.101 17934 6622 1 10 . 1 1 42 42 ASP C C 42 177.480 177.480 177.861 -0.381 17934 6623 1 10 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.054 0.610 17934 6624 1 10 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.680 1.515 17934 6625 1 10 . 1 1 42 42 ASP H H 42 7.954 7.954 8.120 -0.166 17934 6626 1 10 . 1 1 43 43 ALA N N 43 120.587 120.587 122.245 -1.658 17934 6627 1 10 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.158 -0.168 17934 6628 1 10 . 1 1 43 43 ALA C C 43 179.767 179.767 179.610 0.157 17934 6629 1 10 . 1 1 43 43 ALA CA C 43 55.320 55.320 55.219 0.101 17934 6630 1 10 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.337 0.893 17934 6631 1 10 . 1 1 43 43 ALA H H 43 7.842 7.842 8.312 -0.470 17934 6632 1 10 . 1 1 44 44 CYS N N 44 115.428 115.428 117.937 -2.509 17934 6633 1 10 . 1 1 44 44 CYS HA H 44 3.895 3.895 4.026 -0.131 17934 6634 1 10 . 1 1 44 44 CYS C C 44 176.076 176.076 176.470 -0.394 17934 6635 1 10 . 1 1 44 44 CYS CA C 44 64.695 64.695 62.410 2.285 17934 6636 1 10 . 1 1 44 44 CYS CB C 44 27.664 27.664 26.458 1.206 17934 6637 1 10 . 1 1 44 44 CYS H H 44 7.900 7.900 8.428 -0.528 17934 6638 1 10 . 1 1 45 45 ALA N N 45 120.487 120.487 122.727 -2.240 17934 6639 1 10 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.931 0.069 17934 6640 1 10 . 1 1 45 45 ALA C C 45 173.506 173.506 178.862 -5.356 17934 6641 1 10 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.298 0.022 17934 6642 1 10 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.105 -0.164 17934 6643 1 10 . 1 1 45 45 ALA H H 45 7.250 7.250 8.132 -0.882 17934 6644 1 10 . 1 1 46 46 LYS N N 46 119.267 119.267 119.509 -0.242 17934 6645 1 10 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.923 0.024 17934 6646 1 10 . 1 1 46 46 LYS C C 46 179.561 179.561 178.726 0.835 17934 6647 1 10 . 1 1 46 46 LYS H H 46 8.102 8.102 8.158 -0.056 17934 6648 1 10 . 1 1 47 47 MET N N 47 118.009 118.009 118.044 -0.035 17934 6649 1 10 . 1 1 47 47 MET HA H 47 4.214 4.214 4.058 0.156 17934 6650 1 10 . 1 1 47 47 MET C C 47 179.526 179.526 178.366 1.160 17934 6651 1 10 . 1 1 47 47 MET CA C 47 57.195 57.195 58.770 -1.575 17934 6652 1 10 . 1 1 47 47 MET CB C 47 30.945 30.945 32.652 -1.707 17934 6653 1 10 . 1 1 47 47 MET H H 47 8.585 8.585 8.229 0.356 17934 6654 1 10 . 1 1 48 48 ARG N N 48 119.962 119.962 119.690 0.272 17934 6655 1 10 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.979 -0.123 17934 6656 1 10 . 1 1 48 48 ARG C C 48 178.875 178.875 178.390 0.485 17934 6657 1 10 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.473 1.472 17934 6658 1 10 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.974 0.503 17934 6659 1 10 . 1 1 48 48 ARG H H 48 8.190 8.190 8.407 -0.217 17934 6660 1 10 . 1 1 49 49 ALA N N 49 120.640 120.640 122.588 -1.948 17934 6661 1 10 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.332 -0.589 17934 6662 1 10 . 1 1 49 49 ALA C C 49 180.169 180.169 179.393 0.776 17934 6663 1 10 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.814 0.037 17934 6664 1 10 . 1 1 49 49 ALA CB C 49 17.821 17.821 18.506 -0.685 17934 6665 1 10 . 1 1 49 49 ALA H H 49 7.671 7.671 8.518 -0.847 17934 6666 1 10 . 1 1 50 50 ASN N N 50 116.063 116.063 116.874 -0.811 17934 6667 1 10 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.445 0.029 17934 6668 1 10 . 1 1 50 50 ASN C C 50 177.084 177.084 177.639 -0.555 17934 6669 1 10 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.817 -0.028 17934 6670 1 10 . 1 1 50 50 ASN CB C 50 38.914 38.914 37.982 0.932 17934 6671 1 10 . 1 1 50 50 ASN H H 50 7.893 7.893 8.288 -0.395 17934 6672 1 10 . 1 1 51 51 CYS N N 51 116.884 116.884 118.432 -1.548 17934 6673 1 10 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.377 -0.071 17934 6674 1 10 . 1 1 51 51 CYS C C 51 175.002 175.002 176.719 -1.717 17934 6675 1 10 . 1 1 51 51 CYS CA C 51 61.414 61.414 59.756 1.658 17934 6676 1 10 . 1 1 51 51 CYS CB C 51 27.664 27.664 27.874 -0.210 17934 6677 1 10 . 1 1 51 51 CYS H H 51 7.770 7.770 8.087 -0.317 17934 6678 1 10 . 1 1 52 52 GLN N N 52 117.831 117.831 119.992 -2.161 17934 6679 1 10 . 1 1 52 52 GLN HA H 52 4.228 4.228 3.982 0.246 17934 6680 1 10 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.623 -1.897 17934 6681 1 10 . 1 1 52 52 GLN CB C 52 29.070 29.070 28.624 0.446 17934 6682 1 10 . 1 1 52 52 GLN H H 52 7.796 7.796 8.180 -0.384 17934 6683 1 10 . 1 1 53 53 LYS N N 53 118.841 118.841 118.819 0.022 17934 6684 1 10 . 1 1 53 53 LYS CA C 53 57.195 57.195 58.331 -1.136 17934 6685 1 10 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.919 0.370 17934 6686 1 10 . 1 1 53 53 LYS H H 53 7.686 7.686 8.064 -0.378 17934 6687 1 10 . 1 1 55 55 THR HA H 55 4.304 4.304 4.172 0.132 17934 6688 1 10 . 1 1 55 55 THR CA C 55 63.757 63.757 64.190 -0.433 17934 6689 1 10 . 1 1 55 55 THR CB C 55 68.914 68.914 69.538 -0.624 17934 6690 1 10 . 1 1 56 56 GLU N N 56 120.861 120.861 122.469 -1.608 17934 6691 1 10 . 1 1 56 56 GLU HA H 56 4.147 4.147 3.975 0.172 17934 6692 1 10 . 1 1 56 56 GLU C C 56 177.656 177.656 178.731 -1.075 17934 6693 1 10 . 1 1 56 56 GLU CA C 56 58.133 58.133 59.404 -1.271 17934 6694 1 10 . 1 1 56 56 GLU CB C 56 30.008 30.008 27.897 2.111 17934 6695 1 10 . 1 1 56 56 GLU H H 56 8.311 8.311 8.537 -0.227 17934 6696 1 10 . 1 1 57 57 GLN N N 57 118.397 118.397 118.072 0.325 17934 6697 1 10 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.043 0.099 17934 6698 1 10 . 1 1 57 57 GLN C C 57 177.275 177.275 177.291 -0.016 17934 6699 1 10 . 1 1 57 57 GLN CA C 57 57.664 57.664 58.434 -0.770 17934 6700 1 10 . 1 1 57 57 GLN CB C 57 29.070 29.070 27.779 1.291 17934 6701 1 10 . 1 1 57 57 GLN H H 57 7.899 7.899 8.310 -0.411 17934 6702 1 10 . 1 1 58 58 MET N N 58 118.897 118.897 116.155 2.742 17934 6703 1 10 . 1 1 58 58 MET HA H 58 4.350 4.350 4.455 -0.105 17934 6704 1 10 . 1 1 58 58 MET C C 58 177.172 177.172 175.871 1.301 17934 6705 1 10 . 1 1 58 58 MET CA C 58 56.726 56.726 56.580 0.146 17934 6706 1 10 . 1 1 58 58 MET CB C 58 32.196 32.196 33.869 -1.673 17934 6707 1 10 . 1 1 58 58 MET H H 58 8.036 8.036 7.576 0.460 17934 6708 1 10 . 1 1 59 59 LYS N N 59 119.779 119.779 117.071 2.708 17934 6709 1 10 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.491 -0.260 17934 6710 1 10 . 1 1 59 59 LYS C C 59 176.676 176.676 174.195 2.481 17934 6711 1 10 . 1 1 59 59 LYS CA C 59 57.195 57.195 55.732 1.463 17934 6712 1 10 . 1 1 59 59 LYS CB C 59 32.820 32.820 34.198 -1.378 17934 6713 1 10 . 1 1 59 59 LYS H H 59 7.901 7.901 8.482 -0.581 17934 6714 1 10 . 1 1 60 60 LYS N N 60 119.993 119.993 119.841 0.152 17934 6715 1 10 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.574 -0.239 17934 6716 1 10 . 1 1 60 60 LYS C C 60 176.336 176.336 176.203 0.133 17934 6717 1 10 . 1 1 60 60 LYS CA C 60 56.258 56.258 55.162 1.096 17934 6718 1 10 . 1 1 60 60 LYS CB C 60 32.820 32.820 32.125 0.695 17934 6719 1 10 . 1 1 60 60 LYS H H 60 7.877 7.877 8.243 -0.366 17934 6720 1 10 . 1 1 61 61 VAL N N 61 122.649 122.649 121.137 1.512 17934 6721 1 10 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.206 0.174 17934 6722 1 10 . 1 1 61 61 VAL C C 61 174.210 174.210 175.576 -1.366 17934 6723 1 10 . 1 1 61 61 VAL CA C 61 60.000 60.000 61.215 -1.215 17934 6724 1 10 . 1 1 61 61 VAL CB C 61 32.350 32.350 31.035 1.315 17934 6725 1 10 . 1 1 61 61 VAL H H 61 7.708 7.708 8.349 -0.641 17934 6726 1 10 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.691 -0.028 17934 6727 1 10 . 1 1 62 62 PRO C C 62 176.656 176.656 176.209 0.447 17934 6728 1 10 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.246 0.574 17934 6729 1 10 . 1 1 62 62 PRO CB C 62 31.883 31.883 33.425 -1.542 17934 6730 1 10 . 1 1 63 63 THR N N 63 117.155 117.155 113.871 3.284 17934 6731 1 10 . 1 1 63 63 THR HA H 63 4.830 4.830 4.829 0.001 17934 6732 1 10 . 1 1 63 63 THR C C 63 174.682 174.682 173.240 1.442 17934 6733 1 10 . 1 1 63 63 THR CA C 63 62.820 62.820 62.271 0.549 17934 6734 1 10 . 1 1 63 63 THR CB C 63 69.382 69.382 70.548 -1.166 17934 6735 1 10 . 1 1 63 63 THR H H 63 8.303 8.303 8.167 0.136 17934 6736 1 10 . 1 1 64 64 ILE N N 64 121.004 121.004 124.735 -3.731 17934 6737 1 10 . 1 1 64 64 ILE CA C 64 58.600 58.600 58.416 0.184 17934 6738 1 10 . 1 1 64 64 ILE CB C 64 42.690 42.690 42.095 0.595 17934 6739 1 10 . 1 1 64 64 ILE H H 64 9.348 9.348 9.073 0.275 17934 6740 1 10 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.114 0.626 17934 6741 1 10 . 1 1 65 65 ILE C C 65 175.378 175.378 174.636 0.742 17934 6742 1 10 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.042 -0.962 17934 6743 1 10 . 1 1 65 65 ILE CB C 65 38.750 38.750 38.055 0.695 17934 6744 1 10 . 1 1 66 66 LEU N N 66 110.343 110.343 129.924 -19.581 17934 6745 1 10 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.726 0.124 17934 6746 1 10 . 1 1 66 66 LEU C C 66 174.982 174.982 175.525 -0.543 17934 6747 1 10 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.279 -0.368 17934 6748 1 10 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.157 2.073 17934 6749 1 10 . 1 1 66 66 LEU H H 66 9.610 9.610 9.244 0.366 17934 6750 1 10 . 1 1 67 67 SER N N 67 120.990 120.990 120.111 0.879 17934 6751 1 10 . 1 1 67 67 SER HA H 67 5.405 5.405 5.107 0.298 17934 6752 1 10 . 1 1 67 67 SER C C 67 174.405 174.405 172.811 1.594 17934 6753 1 10 . 1 1 67 67 SER CA C 67 57.195 57.195 56.962 0.233 17934 6754 1 10 . 1 1 67 67 SER CB C 67 64.695 64.695 64.024 0.671 17934 6755 1 10 . 1 1 67 67 SER H H 67 9.260 9.260 8.764 0.496 17934 6756 1 10 . 1 1 68 68 VAL N N 68 128.176 128.176 126.044 2.132 17934 6757 1 10 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.263 0.230 17934 6758 1 10 . 1 1 68 68 VAL C C 68 173.891 173.891 173.272 0.619 17934 6759 1 10 . 1 1 68 68 VAL CA C 68 62.350 62.350 59.756 2.594 17934 6760 1 10 . 1 1 68 68 VAL CB C 68 33.750 33.750 33.516 0.234 17934 6761 1 10 . 1 1 68 68 VAL H H 68 9.225 9.225 8.890 0.335 17934 6762 1 10 . 1 1 69 69 SER N N 69 121.697 121.697 123.272 -1.575 17934 6763 1 10 . 1 1 69 69 SER HA H 69 4.837 4.837 4.900 -0.063 17934 6764 1 10 . 1 1 69 69 SER C C 69 173.188 173.188 174.525 -1.337 17934 6765 1 10 . 1 1 69 69 SER CA C 69 57.195 57.195 56.221 0.973 17934 6766 1 10 . 1 1 69 69 SER CB C 69 67.976 67.976 66.623 1.353 17934 6767 1 10 . 1 1 69 69 SER H H 69 8.869 8.869 8.865 0.004 17934 6768 1 10 . 1 1 70 70 ALA N N 70 118.689 118.689 124.790 -6.101 17934 6769 1 10 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.116 0.034 17934 6770 1 10 . 1 1 70 70 ALA C C 70 176.714 176.714 177.243 -0.529 17934 6771 1 10 . 1 1 70 70 ALA CA C 70 53.910 53.910 53.977 -0.067 17934 6772 1 10 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.831 -0.231 17934 6773 1 10 . 1 1 70 70 ALA H H 70 8.810 8.810 8.850 -0.040 17934 6774 1 10 . 1 1 71 71 LYS N N 71 112.633 112.633 115.191 -2.558 17934 6775 1 10 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.425 -0.150 17934 6776 1 10 . 1 1 71 71 LYS C C 71 177.033 177.033 175.747 1.286 17934 6777 1 10 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.123 2.072 17934 6778 1 10 . 1 1 71 71 LYS CB C 71 33.289 33.289 31.434 1.855 17934 6779 1 10 . 1 1 71 71 LYS H H 71 7.830 7.830 8.101 -0.271 17934 6780 1 10 . 1 1 72 72 GLY N N 72 108.432 108.432 105.848 2.584 17934 6781 1 10 . 1 1 72 72 GLY CA C 72 45.476 45.476 44.881 0.595 17934 6782 1 10 . 1 1 72 72 GLY H H 72 7.685 7.685 7.720 -0.035 17934 6783 1 10 . 1 1 73 73 VAL N N 73 120.414 120.414 121.425 -1.011 17934 6784 1 10 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.753 0.247 17934 6785 1 10 . 1 1 73 73 VAL CA C 73 60.470 60.470 60.986 -0.516 17934 6786 1 10 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.452 0.178 17934 6787 1 10 . 1 1 73 73 VAL H H 73 8.620 8.620 8.426 0.194 17934 6788 1 10 . 1 1 74 74 LYS N N 74 125.257 125.257 125.186 0.071 17934 6789 1 10 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.611 0.405 17934 6790 1 10 . 1 1 74 74 LYS CA C 74 54.383 54.383 54.369 0.014 17934 6791 1 10 . 1 1 74 74 LYS CB C 74 36.570 36.570 35.898 0.672 17934 6792 1 10 . 1 1 74 74 LYS H H 74 8.783 8.783 8.756 0.027 17934 6793 1 10 . 1 1 75 75 PHE N N 75 119.414 119.414 117.906 1.508 17934 6794 1 10 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.192 0.508 17934 6795 1 10 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.579 -2.659 17934 6796 1 10 . 1 1 75 75 PHE CB C 75 40.610 40.610 42.004 -1.393 17934 6797 1 10 . 1 1 75 75 PHE H H 75 8.432 8.432 9.145 -0.713 17934 6798 1 10 . 1 1 76 76 ILE N N 76 121.430 121.430 120.922 0.508 17934 6799 1 10 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.574 0.266 17934 6800 1 10 . 1 1 76 76 ILE C C 76 175.249 175.249 174.210 1.039 17934 6801 1 10 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.825 -0.755 17934 6802 1 10 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.725 -0.505 17934 6803 1 10 . 1 1 76 76 ILE H H 76 8.960 8.960 8.759 0.201 17934 6804 1 10 . 1 1 77 77 ASP N N 77 125.744 125.744 123.201 2.543 17934 6805 1 10 . 1 1 77 77 ASP HA H 77 4.563 4.563 5.040 -0.477 17934 6806 1 10 . 1 1 77 77 ASP C C 77 177.569 177.569 176.031 1.538 17934 6807 1 10 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.141 3.648 17934 6808 1 10 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.142 0.459 17934 6809 1 10 . 1 1 77 77 ASP H H 77 8.750 8.750 8.162 0.588 17934 6810 1 10 . 1 1 78 78 ALA N N 78 128.632 128.632 127.971 0.661 17934 6811 1 10 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.366 -0.396 17934 6812 1 10 . 1 1 78 78 ALA C C 78 178.052 178.052 178.094 -0.042 17934 6813 1 10 . 1 1 78 78 ALA CA C 78 54.830 54.830 53.985 0.845 17934 6814 1 10 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.473 0.320 17934 6815 1 10 . 1 1 78 78 ALA H H 78 8.700 8.700 8.829 -0.129 17934 6816 1 10 . 1 1 79 79 THR N N 79 113.087 113.087 114.125 -1.038 17934 6817 1 10 . 1 1 79 79 THR HA H 79 4.194 4.194 4.265 -0.071 17934 6818 1 10 . 1 1 79 79 THR C C 79 175.587 175.587 175.959 -0.372 17934 6819 1 10 . 1 1 79 79 THR CA C 79 64.695 64.695 65.747 -1.052 17934 6820 1 10 . 1 1 79 79 THR CB C 79 69.382 69.382 69.521 -0.139 17934 6821 1 10 . 1 1 79 79 THR H H 79 8.779 8.779 8.705 0.074 17934 6822 1 10 . 1 1 80 80 ASN N N 80 118.434 118.434 116.381 2.053 17934 6823 1 10 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.981 -0.244 17934 6824 1 10 . 1 1 80 80 ASN CA C 80 53.445 53.445 53.233 0.213 17934 6825 1 10 . 1 1 80 80 ASN CB C 80 39.383 39.383 39.378 0.005 17934 6826 1 10 . 1 1 80 80 ASN H H 80 8.584 8.584 8.305 0.279 17934 6827 1 10 . 1 1 81 81 LYS N N 81 112.429 112.429 114.981 -2.552 17934 6828 1 10 . 1 1 81 81 LYS C C 81 174.909 174.909 175.342 -0.433 17934 6829 1 10 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.916 -0.252 17934 6830 1 10 . 1 1 81 81 LYS CB C 81 28.602 28.602 29.510 -0.908 17934 6831 1 10 . 1 1 81 81 LYS H H 81 7.966 7.966 8.436 -0.470 17934 6832 1 10 . 1 1 82 82 ASN N N 82 116.806 116.806 116.607 0.199 17934 6833 1 10 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.761 -0.171 17934 6834 1 10 . 1 1 82 82 ASN C C 82 174.999 174.999 173.907 1.092 17934 6835 1 10 . 1 1 82 82 ASN CA C 82 52.976 52.976 52.053 0.923 17934 6836 1 10 . 1 1 82 82 ASN CB C 82 38.445 38.445 41.037 -2.592 17934 6837 1 10 . 1 1 82 82 ASN H H 82 8.455 8.455 7.973 0.482 17934 6838 1 10 . 1 1 83 83 ILE N N 83 122.447 122.447 118.390 4.057 17934 6839 1 10 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.521 -0.491 17934 6840 1 10 . 1 1 83 83 ILE C C 83 176.572 176.572 175.240 1.332 17934 6841 1 10 . 1 1 83 83 ILE CA C 83 62.350 62.350 60.102 2.248 17934 6842 1 10 . 1 1 83 83 ILE CB C 83 37.970 37.970 37.355 0.616 17934 6843 1 10 . 1 1 83 83 ILE H H 83 8.650 8.650 8.445 0.205 17934 6844 1 10 . 1 1 84 84 ILE N N 84 129.339 129.339 124.272 5.067 17934 6845 1 10 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.321 -0.401 17934 6846 1 10 . 1 1 84 84 ILE C C 84 175.873 175.873 176.386 -0.513 17934 6847 1 10 . 1 1 84 84 ILE CA C 84 62.810 62.810 61.434 1.376 17934 6848 1 10 . 1 1 84 84 ILE CB C 84 38.840 38.840 38.420 0.419 17934 6849 1 10 . 1 1 84 84 ILE H H 84 8.930 8.930 8.313 0.617 17934 6850 1 10 . 1 1 85 85 ALA N N 85 118.867 118.867 119.134 -0.267 17934 6851 1 10 . 1 1 85 85 ALA C C 85 174.100 174.100 174.907 -0.807 17934 6852 1 10 . 1 1 85 85 ALA CA C 85 51.570 51.570 51.941 -0.371 17934 6853 1 10 . 1 1 85 85 ALA H H 85 7.048 7.048 8.200 -1.152 17934 6854 1 10 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.802 0.352 17934 6855 1 10 . 1 1 87 87 HIS C C 87 174.986 174.986 174.284 0.702 17934 6856 1 10 . 1 1 87 87 HIS CB C 87 34.350 34.350 33.066 1.284 17934 6857 1 10 . 1 1 88 88 GLU N N 88 125.372 125.372 121.103 4.269 17934 6858 1 10 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.273 0.248 17934 6859 1 10 . 1 1 88 88 GLU C C 88 179.047 179.047 178.245 0.802 17934 6860 1 10 . 1 1 88 88 GLU CA C 88 56.726 56.726 57.139 -0.413 17934 6861 1 10 . 1 1 88 88 GLU CB C 88 30.477 30.477 29.694 0.783 17934 6862 1 10 . 1 1 88 88 GLU H H 88 9.106 9.106 9.007 0.099 17934 6863 1 10 . 1 1 89 89 ILE N N 89 124.132 124.132 123.386 0.746 17934 6864 1 10 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.776 0.243 17934 6865 1 10 . 1 1 89 89 ILE C C 89 176.095 176.095 177.515 -1.420 17934 6866 1 10 . 1 1 89 89 ILE CA C 89 62.351 62.351 64.750 -2.399 17934 6867 1 10 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.215 0.699 17934 6868 1 10 . 1 1 89 89 ILE H H 89 8.055 8.055 8.849 -0.794 17934 6869 1 10 . 1 1 90 90 ARG N N 90 116.949 116.949 115.446 1.503 17934 6870 1 10 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.341 -0.003 17934 6871 1 10 . 1 1 90 90 ARG C C 90 176.578 176.578 176.182 0.396 17934 6872 1 10 . 1 1 90 90 ARG CA C 90 57.664 57.664 57.896 -0.232 17934 6873 1 10 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.258 -0.188 17934 6874 1 10 . 1 1 90 90 ARG H H 90 8.045 8.045 8.466 -0.421 17934 6875 1 10 . 1 1 91 91 ASN N N 91 116.320 116.320 116.794 -0.474 17934 6876 1 10 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.854 0.299 17934 6877 1 10 . 1 1 91 91 ASN C C 91 174.595 174.595 175.195 -0.600 17934 6878 1 10 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.076 -1.568 17934 6879 1 10 . 1 1 91 91 ASN CB C 91 39.852 39.852 40.077 -0.225 17934 6880 1 10 . 1 1 91 91 ASN H H 91 8.067 8.067 7.942 0.125 17934 6881 1 10 . 1 1 92 92 ILE N N 92 122.441 122.441 121.787 0.654 17934 6882 1 10 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.807 1.266 17934 6883 1 10 . 1 1 92 92 ILE C C 92 175.229 175.229 175.969 -0.740 17934 6884 1 10 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.827 -0.946 17934 6885 1 10 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.382 2.468 17934 6886 1 10 . 1 1 92 92 ILE H H 92 7.483 7.483 7.727 -0.244 17934 6887 1 10 . 1 1 93 93 SER N N 93 120.329 120.329 123.591 -3.262 17934 6888 1 10 . 1 1 93 93 SER HA H 93 4.684 4.684 4.129 0.555 17934 6889 1 10 . 1 1 93 93 SER C C 93 180.744 180.744 174.228 6.516 17934 6890 1 10 . 1 1 93 93 SER CA C 93 57.664 57.664 60.878 -3.214 17934 6891 1 10 . 1 1 93 93 SER CB C 93 66.570 66.570 63.668 2.902 17934 6892 1 10 . 1 1 93 93 SER H H 93 9.545 9.545 8.360 1.185 17934 6893 1 10 . 1 1 94 94 CYS N N 94 110.900 110.900 114.651 -3.751 17934 6894 1 10 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.370 -0.558 17934 6895 1 10 . 1 1 94 94 CYS C C 94 173.973 173.973 172.758 1.215 17934 6896 1 10 . 1 1 94 94 CYS CA C 94 59.539 59.539 59.100 0.439 17934 6897 1 10 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.481 -4.223 17934 6898 1 10 . 1 1 94 94 CYS H H 94 8.858 8.858 7.715 1.143 17934 6899 1 10 . 1 1 95 95 ALA N N 95 121.379 121.379 122.961 -1.582 17934 6900 1 10 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.713 -0.283 17934 6901 1 10 . 1 1 95 95 ALA C C 95 178.098 178.098 175.131 2.967 17934 6902 1 10 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.825 0.826 17934 6903 1 10 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.614 -2.314 17934 6904 1 10 . 1 1 95 95 ALA H H 95 8.360 8.360 8.350 0.010 17934 6905 1 10 . 1 1 96 96 ALA N N 96 122.576 122.576 122.999 -0.423 17934 6906 1 10 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.795 -0.115 17934 6907 1 10 . 1 1 96 96 ALA C C 96 175.716 175.716 174.551 1.165 17934 6908 1 10 . 1 1 96 96 ALA CA C 96 52.440 52.440 52.063 0.376 17934 6909 1 10 . 1 1 96 96 ALA CB C 96 22.700 22.700 22.121 0.579 17934 6910 1 10 . 1 1 96 96 ALA H H 96 9.080 9.080 8.967 0.113 17934 6911 1 10 . 1 1 97 97 GLN N N 97 116.903 116.903 119.271 -2.368 17934 6912 1 10 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.725 0.205 17934 6913 1 10 . 1 1 97 97 GLN C C 97 175.270 175.270 174.321 0.949 17934 6914 1 10 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.693 1.158 17934 6915 1 10 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.711 2.047 17934 6916 1 10 . 1 1 97 97 GLN H H 97 8.369 8.369 8.402 -0.033 17934 6917 1 10 . 1 1 98 98 ASP N N 98 124.971 124.971 121.105 3.866 17934 6918 1 10 . 1 1 98 98 ASP C C 98 175.217 175.217 176.317 -1.100 17934 6919 1 10 . 1 1 98 98 ASP CA C 98 52.039 52.039 51.874 0.165 17934 6920 1 10 . 1 1 98 98 ASP CB C 98 42.195 42.195 41.565 0.631 17934 6921 1 10 . 1 1 98 98 ASP H H 98 8.395 8.395 8.380 0.015 17934 6922 1 10 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.398 -0.164 17934 6923 1 10 . 1 1 99 99 PRO C C 99 178.433 178.433 177.887 0.546 17934 6924 1 10 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.834 -0.139 17934 6925 1 10 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.153 0.199 17934 6926 1 10 . 1 1 100 100 GLU N N 100 116.223 116.223 118.619 -2.396 17934 6927 1 10 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.122 0.098 17934 6928 1 10 . 1 1 100 100 GLU C C 100 176.678 176.678 175.999 0.679 17934 6929 1 10 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.357 -1.631 17934 6930 1 10 . 1 1 100 100 GLU CB C 100 30.945 30.945 29.025 1.920 17934 6931 1 10 . 1 1 100 100 GLU H H 100 8.643 8.643 8.787 -0.144 17934 6932 1 10 . 1 1 101 101 ASP N N 101 119.053 119.053 118.345 0.708 17934 6933 1 10 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.890 -0.347 17934 6934 1 10 . 1 1 101 101 ASP C C 101 174.771 174.771 176.363 -1.592 17934 6935 1 10 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.023 0.892 17934 6936 1 10 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.014 0.775 17934 6937 1 10 . 1 1 101 101 ASP H H 101 7.597 7.597 8.095 -0.498 17934 6938 1 10 . 1 1 102 102 LEU N N 102 123.986 123.986 121.443 2.543 17934 6939 1 10 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.218 0.172 17934 6940 1 10 . 1 1 102 102 LEU C C 102 177.141 177.141 178.193 -1.052 17934 6941 1 10 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.788 -0.129 17934 6942 1 10 . 1 1 102 102 LEU CB C 102 42.660 42.660 42.036 0.624 17934 6943 1 10 . 1 1 102 102 LEU H H 102 8.534 8.534 7.787 0.747 17934 6944 1 10 . 1 1 103 103 SER N N 103 112.339 112.339 112.040 0.299 17934 6945 1 10 . 1 1 103 103 SER HA H 103 4.290 4.290 4.248 0.042 17934 6946 1 10 . 1 1 103 103 SER C C 103 174.106 174.106 174.446 -0.340 17934 6947 1 10 . 1 1 103 103 SER CA C 103 60.945 60.945 60.352 0.593 17934 6948 1 10 . 1 1 103 103 SER CB C 103 63.757 63.757 63.496 0.261 17934 6949 1 10 . 1 1 103 103 SER H H 103 7.867 7.867 8.325 -0.458 17934 6950 1 10 . 1 1 104 104 THR N N 104 123.070 123.070 118.312 4.758 17934 6951 1 10 . 1 1 104 104 THR HA H 104 5.373 5.373 4.510 0.863 17934 6952 1 10 . 1 1 104 104 THR C C 104 180.693 180.693 172.766 7.927 17934 6953 1 10 . 1 1 104 104 THR CA C 104 63.289 63.289 63.259 0.030 17934 6954 1 10 . 1 1 104 104 THR CB C 104 69.382 69.382 70.006 -0.624 17934 6955 1 10 . 1 1 104 104 THR H H 104 8.830 8.830 7.867 0.963 17934 6956 1 10 . 1 1 105 105 PHE N N 105 122.582 122.582 123.340 -0.758 17934 6957 1 10 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.931 0.539 17934 6958 1 10 . 1 1 105 105 PHE C C 105 179.211 179.211 172.136 7.075 17934 6959 1 10 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.705 -0.384 17934 6960 1 10 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.495 0.296 17934 6961 1 10 . 1 1 105 105 PHE H H 105 9.170 9.170 8.696 0.474 17934 6962 1 10 . 1 1 106 106 ALA N N 106 119.567 119.567 123.083 -3.516 17934 6963 1 10 . 1 1 106 106 ALA C C 106 175.603 175.603 175.142 0.461 17934 6964 1 10 . 1 1 106 106 ALA H H 106 8.770 8.770 8.967 -0.197 17934 6965 1 10 . 1 1 107 107 TYR N N 107 109.933 109.933 117.930 -7.997 17934 6966 1 10 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.007 -0.087 17934 6967 1 10 . 1 1 107 107 TYR C C 107 180.426 180.426 172.622 7.804 17934 6968 1 10 . 1 1 107 107 TYR CA C 107 57.080 57.080 56.298 0.782 17934 6969 1 10 . 1 1 107 107 TYR CB C 107 40.789 40.789 40.983 -0.194 17934 6970 1 10 . 1 1 107 107 TYR H H 107 7.950 7.950 9.153 -1.203 17934 6971 1 10 . 1 1 108 108 ILE N N 108 120.613 120.613 117.410 3.203 17934 6972 1 10 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.824 0.546 17934 6973 1 10 . 1 1 108 108 ILE C C 108 176.212 176.212 175.475 0.737 17934 6974 1 10 . 1 1 108 108 ILE CA C 108 59.540 59.540 58.676 0.864 17934 6975 1 10 . 1 1 108 108 ILE CB C 108 39.380 39.380 39.759 -0.379 17934 6976 1 10 . 1 1 108 108 ILE H H 108 8.869 8.869 8.774 0.095 17934 6977 1 10 . 1 1 109 109 THR N N 109 116.505 116.505 113.704 2.801 17934 6978 1 10 . 1 1 109 109 THR HA H 109 5.669 5.669 4.695 0.974 17934 6979 1 10 . 1 1 109 109 THR C C 109 173.505 173.505 172.993 0.512 17934 6980 1 10 . 1 1 109 109 THR CA C 109 59.070 59.070 60.272 -1.202 17934 6981 1 10 . 1 1 109 109 THR H H 109 9.489 9.489 7.876 1.613 17934 6982 1 10 . 1 1 110 110 LYS N N 110 122.960 122.960 122.983 -0.023 17934 6983 1 10 . 1 1 110 110 LYS HA H 110 4.460 4.460 3.970 0.490 17934 6984 1 10 . 1 1 110 110 LYS C C 110 175.937 175.937 174.961 0.976 17934 6985 1 10 . 1 1 110 110 LYS CA C 110 55.789 55.789 56.674 -0.885 17934 6986 1 10 . 1 1 110 110 LYS CB C 110 34.227 34.227 32.510 1.717 17934 6987 1 10 . 1 1 110 110 LYS H H 110 7.831 7.831 8.184 -0.353 17934 6988 1 10 . 1 1 111 111 ASP N N 111 127.409 127.409 120.885 6.524 17934 6989 1 10 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.692 0.089 17934 6990 1 10 . 1 1 111 111 ASP C C 111 176.396 176.396 177.159 -0.763 17934 6991 1 10 . 1 1 111 111 ASP CA C 111 53.914 53.914 54.036 -0.122 17934 6992 1 10 . 1 1 111 111 ASP CB C 111 43.133 43.133 41.370 1.763 17934 6993 1 10 . 1 1 111 111 ASP H H 111 8.769 8.769 8.216 0.553 17934 6994 1 10 . 1 1 112 112 LEU N N 112 125.913 125.913 120.545 5.368 17934 6995 1 10 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.486 -0.336 17934 6996 1 10 . 1 1 112 112 LEU C C 112 178.553 178.553 177.524 1.029 17934 6997 1 10 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.813 -0.623 17934 6998 1 10 . 1 1 112 112 LEU CB C 112 41.790 41.790 42.078 -0.288 17934 6999 1 10 . 1 1 112 112 LEU H H 112 8.593 8.593 8.651 -0.058 17934 7000 1 10 . 1 1 113 113 LYS N N 113 117.189 117.189 115.357 1.832 17934 7001 1 10 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.284 -0.022 17934 7002 1 10 . 1 1 113 113 LYS C C 113 177.180 177.180 175.914 1.266 17934 7003 1 10 . 1 1 113 113 LYS CA C 113 58.133 58.133 55.818 2.315 17934 7004 1 10 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.577 0.243 17934 7005 1 10 . 1 1 113 113 LYS H H 113 8.207 8.207 7.780 0.427 17934 7006 1 10 . 1 1 114 114 SER N N 114 112.492 112.492 113.554 -1.062 17934 7007 1 10 . 1 1 114 114 SER CA C 114 58.601 58.601 58.724 -0.123 17934 7008 1 10 . 1 1 114 114 SER CB C 114 65.164 65.164 61.786 3.378 17934 7009 1 10 . 1 1 114 114 SER H H 114 7.755 7.755 7.889 -0.134 17934 7010 1 10 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.696 -0.307 17934 7011 1 10 . 1 1 115 115 ASN C C 115 174.203 174.203 174.742 -0.539 17934 7012 1 10 . 1 1 115 115 ASN CA C 115 54.383 54.383 54.019 0.364 17934 7013 1 10 . 1 1 115 115 ASN CB C 115 37.977 37.977 38.934 -0.957 17934 7014 1 10 . 1 1 116 116 HIS N N 116 116.822 116.822 115.148 1.674 17934 7015 1 10 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.779 0.151 17934 7016 1 10 . 1 1 116 116 HIS C C 116 173.898 173.898 173.134 0.764 17934 7017 1 10 . 1 1 116 116 HIS CA C 116 54.910 54.910 55.668 -0.758 17934 7018 1 10 . 1 1 116 116 HIS CB C 116 32.650 32.650 32.924 -0.274 17934 7019 1 10 . 1 1 116 116 HIS H H 116 7.690 7.690 7.585 0.105 17934 7020 1 10 . 1 1 117 117 HIS N N 117 118.253 118.253 120.679 -2.426 17934 7021 1 10 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.508 0.812 17934 7022 1 10 . 1 1 117 117 HIS C C 117 173.695 173.695 174.514 -0.819 17934 7023 1 10 . 1 1 117 117 HIS CA C 117 56.350 56.350 56.951 -0.601 17934 7024 1 10 . 1 1 117 117 HIS CB C 117 32.350 32.350 28.936 3.414 17934 7025 1 10 . 1 1 117 117 HIS H H 117 8.340 8.340 9.017 -0.677 17934 7026 1 10 . 1 1 118 118 TYR N N 118 118.301 118.301 124.112 -5.811 17934 7027 1 10 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.604 0.406 17934 7028 1 10 . 1 1 118 118 TYR C C 118 173.530 173.530 174.373 -0.843 17934 7029 1 10 . 1 1 118 118 TYR CA C 118 56.730 56.730 56.617 0.113 17934 7030 1 10 . 1 1 118 118 TYR CB C 118 43.240 43.240 40.435 2.805 17934 7031 1 10 . 1 1 118 118 TYR H H 118 9.080 9.080 8.453 0.627 17934 7032 1 10 . 1 1 119 119 CYS N N 119 121.015 121.015 122.694 -1.679 17934 7033 1 10 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.558 0.505 17934 7034 1 10 . 1 1 119 119 CYS C C 119 180.664 180.664 173.182 7.482 17934 7035 1 10 . 1 1 119 119 CYS CA C 119 56.726 56.726 56.871 -0.145 17934 7036 1 10 . 1 1 119 119 CYS CB C 119 29.539 29.539 29.385 0.154 17934 7037 1 10 . 1 1 119 119 CYS H H 119 9.120 9.120 8.932 0.188 17934 7038 1 10 . 1 1 120 120 HIS N N 120 110.134 110.134 128.476 -18.342 17934 7039 1 10 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.763 -0.064 17934 7040 1 10 . 1 1 120 120 HIS C C 120 180.776 180.776 173.197 7.579 17934 7041 1 10 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.480 0.840 17934 7042 1 10 . 1 1 120 120 HIS CB C 120 32.352 32.352 33.079 -0.727 17934 7043 1 10 . 1 1 120 120 HIS H H 120 8.482 8.482 8.926 -0.444 17934 7044 1 10 . 1 1 121 121 VAL N N 121 120.855 120.855 125.888 -5.033 17934 7045 1 10 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.355 -0.005 17934 7046 1 10 . 1 1 121 121 VAL C C 121 173.419 173.419 172.817 0.602 17934 7047 1 10 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.794 0.616 17934 7048 1 10 . 1 1 121 121 VAL CB C 121 33.280 33.280 34.073 -0.793 17934 7049 1 10 . 1 1 121 121 VAL H H 121 7.929 7.929 8.867 -0.938 17934 7050 1 10 . 1 1 122 122 PHE N N 122 124.384 124.384 128.256 -3.872 17934 7051 1 10 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.164 0.256 17934 7052 1 10 . 1 1 122 122 PHE C C 122 174.876 174.876 174.530 0.346 17934 7053 1 10 . 1 1 122 122 PHE CA C 122 55.320 55.320 55.878 -0.558 17934 7054 1 10 . 1 1 122 122 PHE CB C 122 44.540 44.540 43.497 1.043 17934 7055 1 10 . 1 1 122 122 PHE H H 122 8.910 8.910 9.067 -0.157 17934 7056 1 10 . 1 1 123 123 THR N N 123 112.451 112.451 113.360 -0.909 17934 7057 1 10 . 1 1 123 123 THR HA H 123 5.147 5.147 4.556 0.591 17934 7058 1 10 . 1 1 123 123 THR C C 123 174.096 174.096 173.348 0.748 17934 7059 1 10 . 1 1 123 123 THR CA C 123 61.843 61.843 59.926 1.917 17934 7060 1 10 . 1 1 123 123 THR CB C 123 71.218 71.218 70.462 0.756 17934 7061 1 10 . 1 1 123 123 THR H H 123 8.668 8.668 9.024 -0.356 17934 7062 1 10 . 1 1 124 124 ALA N N 124 128.922 128.922 125.155 3.767 17934 7063 1 10 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.817 -0.098 17934 7064 1 10 . 1 1 124 124 ALA C C 124 177.168 177.168 176.318 0.850 17934 7065 1 10 . 1 1 124 124 ALA CA C 124 50.890 50.890 49.892 0.998 17934 7066 1 10 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.465 -0.365 17934 7067 1 10 . 1 1 124 124 ALA H H 124 9.180 9.180 8.667 0.513 17934 7068 1 10 . 1 1 125 125 PHE N N 125 115.427 115.427 117.723 -2.296 17934 7069 1 10 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.442 -0.152 17934 7070 1 10 . 1 1 125 125 PHE C C 125 174.703 174.703 175.241 -0.538 17934 7071 1 10 . 1 1 125 125 PHE CA C 125 60.470 60.470 59.421 1.049 17934 7072 1 10 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.710 -1.650 17934 7073 1 10 . 1 1 125 125 PHE H H 125 8.560 8.560 9.303 -0.743 17934 7074 1 10 . 1 1 126 126 ASP N N 126 115.745 115.745 118.582 -2.837 17934 7075 1 10 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.935 -0.092 17934 7076 1 10 . 1 1 126 126 ASP C C 126 176.532 176.532 176.118 0.414 17934 7077 1 10 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.124 0.321 17934 7078 1 10 . 1 1 126 126 ASP CB C 126 44.070 44.070 43.522 0.548 17934 7079 1 10 . 1 1 126 126 ASP H H 126 7.417 7.417 7.750 -0.333 17934 7080 1 10 . 1 1 127 127 VAL N N 127 121.923 121.923 123.728 -1.805 17934 7081 1 10 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.628 -0.038 17934 7082 1 10 . 1 1 127 127 VAL C C 127 176.863 176.863 177.338 -0.475 17934 7083 1 10 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.899 -1.269 17934 7084 1 10 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.049 -0.219 17934 7085 1 10 . 1 1 127 127 VAL H H 127 8.508 8.508 8.637 -0.129 17934 7086 1 10 . 1 1 128 128 ASN N N 128 118.851 118.851 117.925 0.926 17934 7087 1 10 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.370 0.106 17934 7088 1 10 . 1 1 128 128 ASN C C 128 178.251 178.251 177.274 0.977 17934 7089 1 10 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.401 -0.143 17934 7090 1 10 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.030 -0.053 17934 7091 1 10 . 1 1 128 128 ASN H H 128 8.207 8.207 8.477 -0.270 17934 7092 1 10 . 1 1 129 129 LEU N N 129 122.549 122.549 119.498 3.051 17934 7093 1 10 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.652 0.558 17934 7094 1 10 . 1 1 129 129 LEU C C 129 178.003 178.003 177.679 0.324 17934 7095 1 10 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.419 -0.229 17934 7096 1 10 . 1 1 129 129 LEU CB C 129 41.790 41.790 41.423 0.367 17934 7097 1 10 . 1 1 129 129 LEU H H 129 8.223 8.223 7.932 0.291 17934 7098 1 10 . 1 1 130 130 ALA N N 130 120.036 120.036 121.529 -1.493 17934 7099 1 10 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.873 -0.563 17934 7100 1 10 . 1 1 130 130 ALA C C 130 178.172 178.172 179.126 -0.954 17934 7101 1 10 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.342 0.438 17934 7102 1 10 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.076 0.994 17934 7103 1 10 . 1 1 130 130 ALA H H 130 7.360 7.360 8.146 -0.786 17934 7104 1 10 . 1 1 131 131 ALA N N 131 116.989 116.989 119.751 -2.762 17934 7105 1 10 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.850 -0.140 17934 7106 1 10 . 1 1 131 131 ALA C C 131 180.163 180.163 179.665 0.498 17934 7107 1 10 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.962 0.818 17934 7108 1 10 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.086 -0.256 17934 7109 1 10 . 1 1 131 131 ALA H H 131 7.360 7.360 8.164 -0.804 17934 7110 1 10 . 1 1 132 132 GLU N N 132 119.462 119.462 119.386 0.076 17934 7111 1 10 . 1 1 132 132 GLU HA H 132 3.888 3.888 3.977 -0.089 17934 7112 1 10 . 1 1 132 132 GLU C C 132 179.243 179.243 178.859 0.384 17934 7113 1 10 . 1 1 132 132 GLU CA C 132 59.539 59.539 58.980 0.559 17934 7114 1 10 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.085 0.454 17934 7115 1 10 . 1 1 132 132 GLU H H 132 7.673 7.673 8.075 -0.402 17934 7116 1 10 . 1 1 133 133 ILE N N 133 123.218 123.218 120.981 2.237 17934 7117 1 10 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.570 -0.790 17934 7118 1 10 . 1 1 133 133 ILE C C 133 177.421 177.421 178.027 -0.606 17934 7119 1 10 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.340 1.150 17934 7120 1 10 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.912 -1.262 17934 7121 1 10 . 1 1 133 133 ILE H H 133 8.154 8.154 8.051 0.103 17934 7122 1 10 . 1 1 134 134 ILE N N 134 118.244 118.244 118.835 -0.591 17934 7123 1 10 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.447 0.093 17934 7124 1 10 . 1 1 134 134 ILE C C 134 179.385 179.385 178.161 1.224 17934 7125 1 10 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.627 -1.347 17934 7126 1 10 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.591 -0.491 17934 7127 1 10 . 1 1 134 134 ILE H H 134 7.376 7.376 7.724 -0.348 17934 7128 1 10 . 1 1 135 135 LEU N N 135 123.061 123.061 120.225 2.836 17934 7129 1 10 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.895 0.295 17934 7130 1 10 . 1 1 135 135 LEU C C 135 179.858 179.858 179.057 0.801 17934 7131 1 10 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.952 -0.762 17934 7132 1 10 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.193 0.667 17934 7133 1 10 . 1 1 135 135 LEU H H 135 8.036 8.036 8.281 -0.245 17934 7134 1 10 . 1 1 136 136 THR N N 136 119.647 119.647 115.631 4.016 17934 7135 1 10 . 1 1 136 136 THR HA H 136 3.725 3.725 3.962 -0.237 17934 7136 1 10 . 1 1 136 136 THR C C 136 176.088 176.088 176.426 -0.338 17934 7137 1 10 . 1 1 136 136 THR CA C 136 58.601 58.601 67.079 -8.478 17934 7138 1 10 . 1 1 136 136 THR CB C 136 67.976 67.976 68.971 -0.995 17934 7139 1 10 . 1 1 136 136 THR H H 136 8.508 8.508 8.140 0.368 17934 7140 1 10 . 1 1 137 137 LEU N N 137 123.182 123.182 121.898 1.284 17934 7141 1 10 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.801 -0.061 17934 7142 1 10 . 1 1 137 137 LEU C C 137 178.341 178.341 178.467 -0.126 17934 7143 1 10 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.169 0.091 17934 7144 1 10 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.569 -0.019 17934 7145 1 10 . 1 1 137 137 LEU H H 137 8.520 8.520 8.564 -0.044 17934 7146 1 10 . 1 1 138 138 GLY N N 138 105.266 105.266 105.003 0.263 17934 7147 1 10 . 1 1 138 138 GLY C C 138 176.973 176.973 175.719 1.254 17934 7148 1 10 . 1 1 138 138 GLY CA C 138 47.351 47.351 46.988 0.363 17934 7149 1 10 . 1 1 138 138 GLY H H 138 7.858 7.858 7.892 -0.034 17934 7150 1 10 . 1 1 139 139 GLN N N 139 123.485 123.485 122.546 0.939 17934 7151 1 10 . 1 1 139 139 GLN C C 139 177.891 177.891 178.412 -0.521 17934 7152 1 10 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.290 0.311 17934 7153 1 10 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.190 -0.057 17934 7154 1 10 . 1 1 139 139 GLN H H 139 8.195 8.195 8.069 0.126 17934 7155 1 10 . 1 1 140 140 ALA N N 140 122.754 122.754 121.379 1.375 17934 7156 1 10 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.145 -0.436 17934 7157 1 10 . 1 1 140 140 ALA C C 140 178.987 178.987 179.223 -0.236 17934 7158 1 10 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.539 1.241 17934 7159 1 10 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.167 -0.757 17934 7160 1 10 . 1 1 140 140 ALA H H 140 8.530 8.530 8.557 -0.027 17934 7161 1 10 . 1 1 141 141 PHE N N 141 116.275 116.275 120.170 -3.895 17934 7162 1 10 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.499 -0.409 17934 7163 1 10 . 1 1 141 141 PHE C C 141 178.129 178.129 176.575 1.554 17934 7164 1 10 . 1 1 141 141 PHE CA C 141 61.240 61.240 58.822 2.417 17934 7165 1 10 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.089 0.294 17934 7166 1 10 . 1 1 141 141 PHE H H 141 7.920 7.920 8.006 -0.086 17934 7167 1 10 . 1 1 142 142 GLU N N 142 119.967 119.967 117.677 2.290 17934 7168 1 10 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.255 0.972 17934 7169 1 10 . 1 1 142 142 GLU C C 142 179.250 179.250 178.215 1.035 17934 7170 1 10 . 1 1 142 142 GLU CA C 142 59.539 59.539 57.200 2.339 17934 7171 1 10 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.989 -0.450 17934 7172 1 10 . 1 1 142 142 GLU H H 142 7.713 7.713 8.023 -0.310 17934 7173 1 10 . 1 1 143 143 VAL N N 143 120.189 120.189 118.551 1.638 17934 7174 1 10 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.632 0.051 17934 7175 1 10 . 1 1 143 143 VAL C C 143 178.066 178.066 175.190 2.876 17934 7176 1 10 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.400 2.170 17934 7177 1 10 . 1 1 143 143 VAL CB C 143 31.883 31.883 31.733 0.150 17934 7178 1 10 . 1 1 143 143 VAL H H 143 8.608 8.608 7.517 1.091 17934 7179 1 10 . 1 1 144 144 ALA N N 144 121.753 121.753 118.224 3.529 17934 7180 1 10 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.294 -0.294 17934 7181 1 10 . 1 1 144 144 ALA C C 144 180.776 180.776 175.495 5.281 17934 7182 1 10 . 1 1 144 144 ALA CA C 144 55.780 55.780 51.398 4.381 17934 7183 1 10 . 1 1 144 144 ALA CB C 144 18.770 18.770 20.897 -2.127 17934 7184 1 10 . 1 1 144 144 ALA H H 144 8.399 8.399 6.893 1.506 17934 7185 1 10 . 1 1 145 145 TYR N N 145 119.962 119.962 121.668 -1.706 17934 7186 1 10 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.538 -0.348 17934 7187 1 10 . 1 1 145 145 TYR C C 145 177.645 177.645 176.171 1.474 17934 7188 1 10 . 1 1 145 145 TYR CA C 145 60.880 60.880 58.556 2.324 17934 7189 1 10 . 1 1 145 145 TYR CB C 145 37.980 37.980 39.429 -1.449 17934 7190 1 10 . 1 1 145 145 TYR H H 145 8.190 8.190 8.428 -0.238 17934 7191 1 11 . 1 1 13 13 LYS N N 13 120.778 120.778 120.827 -0.049 17934 7192 1 11 . 1 1 13 13 LYS C C 13 176.476 176.476 174.690 1.786 17934 7193 1 11 . 1 1 13 13 LYS CA C 13 58.601 58.601 55.560 3.041 17934 7194 1 11 . 1 1 13 13 LYS CB C 13 32.820 32.820 33.072 -0.251 17934 7195 1 11 . 1 1 13 13 LYS H H 13 7.984 7.984 8.425 -0.441 17934 7196 1 11 . 1 1 15 15 ILE HA H 15 3.820 3.820 4.115 -0.295 17934 7197 1 11 . 1 1 15 15 ILE C C 15 176.376 176.376 176.536 -0.160 17934 7198 1 11 . 1 1 15 15 ILE CA C 15 63.570 63.570 63.127 0.443 17934 7199 1 11 . 1 1 15 15 ILE CB C 15 39.380 39.380 38.105 1.275 17934 7200 1 11 . 1 1 16 16 ALA N N 16 121.364 121.364 120.843 0.521 17934 7201 1 11 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.576 -0.138 17934 7202 1 11 . 1 1 16 16 ALA C C 16 177.494 177.494 177.821 -0.327 17934 7203 1 11 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.840 0.136 17934 7204 1 11 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.408 0.925 17934 7205 1 11 . 1 1 16 16 ALA H H 16 8.081 8.081 7.784 0.297 17934 7206 1 11 . 1 1 17 17 GLN N N 17 118.109 118.109 116.652 1.457 17934 7207 1 11 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.520 0.053 17934 7208 1 11 . 1 1 17 17 GLN C C 17 173.632 173.632 174.469 -0.837 17934 7209 1 11 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.332 -0.481 17934 7210 1 11 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.466 0.011 17934 7211 1 11 . 1 1 17 17 GLN H H 17 7.550 7.550 8.131 -0.581 17934 7212 1 11 . 1 1 18 18 SER N N 18 112.384 112.384 113.134 -0.750 17934 7213 1 11 . 1 1 18 18 SER HA H 18 4.388 4.388 4.734 -0.346 17934 7214 1 11 . 1 1 18 18 SER C C 18 173.780 173.780 172.204 1.576 17934 7215 1 11 . 1 1 18 18 SER CA C 18 57.664 57.664 58.068 -0.404 17934 7216 1 11 . 1 1 18 18 SER CB C 18 65.164 65.164 65.109 0.055 17934 7217 1 11 . 1 1 18 18 SER H H 18 7.666 7.666 8.127 -0.461 17934 7218 1 11 . 1 1 19 19 CYS N N 19 120.116 120.116 122.643 -2.527 17934 7219 1 11 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.434 -0.104 17934 7220 1 11 . 1 1 19 19 CYS C C 19 180.387 180.387 173.184 7.203 17934 7221 1 11 . 1 1 19 19 CYS CA C 19 58.601 58.601 58.708 -0.107 17934 7222 1 11 . 1 1 19 19 CYS CB C 19 30.008 30.008 29.071 0.937 17934 7223 1 11 . 1 1 19 19 CYS H H 19 8.835 8.835 8.737 0.098 17934 7224 1 11 . 1 1 20 20 ASP N N 20 124.416 124.416 123.609 0.807 17934 7225 1 11 . 1 1 20 20 ASP CA C 20 52.976 52.976 52.944 0.032 17934 7226 1 11 . 1 1 20 20 ASP CB C 20 42.195 42.195 44.946 -2.751 17934 7227 1 11 . 1 1 20 20 ASP H H 20 7.847 7.847 7.933 -0.086 17934 7228 1 11 . 1 1 21 21 TYR N N 21 121.296 121.296 119.282 2.014 17934 7229 1 11 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.705 0.025 17934 7230 1 11 . 1 1 21 21 TYR C C 21 175.793 175.793 174.290 1.503 17934 7231 1 11 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.383 0.817 17934 7232 1 11 . 1 1 21 21 TYR CB C 21 43.240 43.240 42.951 0.289 17934 7233 1 11 . 1 1 21 21 TYR H H 21 9.070 9.070 8.696 0.374 17934 7234 1 11 . 1 1 22 22 LYS N N 22 122.820 122.820 120.808 2.012 17934 7235 1 11 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.372 -0.180 17934 7236 1 11 . 1 1 22 22 LYS C C 22 175.793 175.793 175.441 0.352 17934 7237 1 11 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.382 0.876 17934 7238 1 11 . 1 1 22 22 LYS CB C 22 33.758 33.758 33.376 0.382 17934 7239 1 11 . 1 1 22 22 LYS H H 22 8.711 8.711 8.523 0.188 17934 7240 1 11 . 1 1 23 23 ALA N N 23 123.073 123.073 126.280 -3.207 17934 7241 1 11 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.810 -0.080 17934 7242 1 11 . 1 1 23 23 ALA C C 23 174.515 174.515 175.354 -0.839 17934 7243 1 11 . 1 1 23 23 ALA CA C 23 51.570 51.570 49.999 1.571 17934 7244 1 11 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.941 -1.313 17934 7245 1 11 . 1 1 23 23 ALA H H 23 8.727 8.727 8.740 -0.013 17934 7246 1 11 . 1 1 24 24 ALA N N 24 122.486 122.486 122.055 0.431 17934 7247 1 11 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.879 0.302 17934 7248 1 11 . 1 1 24 24 ALA C C 24 176.835 176.835 175.958 0.877 17934 7249 1 11 . 1 1 24 24 ALA CA C 24 51.570 51.570 50.469 1.101 17934 7250 1 11 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.804 -0.684 17934 7251 1 11 . 1 1 24 24 ALA H H 24 8.675 8.675 9.015 -0.340 17934 7252 1 11 . 1 1 25 25 TYR N N 25 122.698 122.698 125.658 -2.960 17934 7253 1 11 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.594 0.416 17934 7254 1 11 . 1 1 25 25 TYR CA C 25 54.340 54.340 59.067 -4.727 17934 7255 1 11 . 1 1 25 25 TYR CB C 25 39.850 39.850 38.497 1.353 17934 7256 1 11 . 1 1 25 25 TYR H H 25 8.270 8.270 8.501 -0.231 17934 7257 1 11 . 1 1 26 26 LEU N N 26 127.997 127.997 130.034 -2.037 17934 7258 1 11 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.331 -0.411 17934 7259 1 11 . 1 1 26 26 LEU C C 26 175.983 175.983 176.758 -0.775 17934 7260 1 11 . 1 1 26 26 LEU CA C 26 56.726 56.726 55.776 0.951 17934 7261 1 11 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.267 -2.197 17934 7262 1 11 . 1 1 26 26 LEU H H 26 8.700 8.700 8.101 0.599 17934 7263 1 11 . 1 1 27 27 GLY N N 27 102.901 102.901 102.221 0.680 17934 7264 1 11 . 1 1 27 27 GLY C C 27 176.219 176.219 171.669 4.550 17934 7265 1 11 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.289 -1.688 17934 7266 1 11 . 1 1 27 27 GLY H H 27 5.891 5.891 7.898 -2.007 17934 7267 1 11 . 1 1 28 28 SER N N 28 111.551 111.551 115.297 -3.746 17934 7268 1 11 . 1 1 28 28 SER HA H 28 5.785 5.785 5.364 0.420 17934 7269 1 11 . 1 1 28 28 SER CA C 28 56.258 56.258 57.790 -1.532 17934 7270 1 11 . 1 1 28 28 SER CB C 28 65.632 65.632 66.229 -0.597 17934 7271 1 11 . 1 1 28 28 SER H H 28 7.981 7.981 8.436 -0.455 17934 7272 1 11 . 1 1 29 29 MET N N 29 119.493 119.493 123.514 -4.021 17934 7273 1 11 . 1 1 29 29 MET HA H 29 4.725 4.725 4.698 0.027 17934 7274 1 11 . 1 1 29 29 MET C C 29 174.143 174.143 174.561 -0.418 17934 7275 1 11 . 1 1 29 29 MET CA C 29 54.036 54.036 54.246 -0.210 17934 7276 1 11 . 1 1 29 29 MET CB C 29 37.268 37.268 36.352 0.916 17934 7277 1 11 . 1 1 29 29 MET H H 29 8.704 8.704 8.875 -0.171 17934 7278 1 11 . 1 1 30 30 LEU N N 30 128.150 128.150 125.941 2.209 17934 7279 1 11 . 1 1 30 30 LEU HA H 30 3.785 3.785 3.782 0.003 17934 7280 1 11 . 1 1 30 30 LEU C C 30 175.857 175.857 175.379 0.478 17934 7281 1 11 . 1 1 30 30 LEU CA C 30 56.250 56.250 54.770 1.480 17934 7282 1 11 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.608 1.052 17934 7283 1 11 . 1 1 30 30 LEU H H 30 8.630 8.630 8.504 0.126 17934 7284 1 11 . 1 1 31 31 ILE N N 31 127.723 127.723 127.447 0.276 17934 7285 1 11 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.245 -0.055 17934 7286 1 11 . 1 1 31 31 ILE C C 31 174.881 174.881 175.483 -0.602 17934 7287 1 11 . 1 1 31 31 ILE CA C 31 57.660 57.660 58.905 -1.245 17934 7288 1 11 . 1 1 31 31 ILE CB C 31 37.110 37.110 35.696 1.414 17934 7289 1 11 . 1 1 31 31 ILE H H 31 8.560 8.560 8.427 0.133 17934 7290 1 11 . 1 1 32 32 LYS HA H 32 4.055 4.055 4.065 -0.010 17934 7291 1 11 . 1 1 32 32 LYS C C 32 176.272 176.272 176.879 -0.607 17934 7292 1 11 . 1 1 32 32 LYS CA C 32 58.601 58.601 58.846 -0.245 17934 7293 1 11 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.936 -0.116 17934 7294 1 11 . 1 1 33 33 GLU N N 33 118.638 118.638 120.056 -1.418 17934 7295 1 11 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.150 0.238 17934 7296 1 11 . 1 1 33 33 GLU C C 33 173.962 173.962 175.584 -1.622 17934 7297 1 11 . 1 1 33 33 GLU CA C 33 54.851 54.851 55.829 -0.978 17934 7298 1 11 . 1 1 33 33 GLU CB C 33 30.945 30.945 28.958 1.987 17934 7299 1 11 . 1 1 33 33 GLU H H 33 7.723 7.723 8.202 -0.479 17934 7300 1 11 . 1 1 34 34 LEU N N 34 126.535 126.535 124.981 1.554 17934 7301 1 11 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.190 -0.245 17934 7302 1 11 . 1 1 34 34 LEU C C 34 176.870 176.870 177.209 -0.339 17934 7303 1 11 . 1 1 34 34 LEU CA C 34 54.850 54.850 55.090 -0.240 17934 7304 1 11 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.053 -0.333 17934 7305 1 11 . 1 1 34 34 LEU H H 34 8.446 8.446 8.225 0.221 17934 7306 1 11 . 1 1 35 35 ARG N N 35 128.447 128.447 123.758 4.689 17934 7307 1 11 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.480 0.075 17934 7308 1 11 . 1 1 35 35 ARG C C 35 176.110 176.110 176.095 0.015 17934 7309 1 11 . 1 1 35 35 ARG CA C 35 54.851 54.851 54.773 0.078 17934 7310 1 11 . 1 1 35 35 ARG CB C 35 30.477 30.477 30.623 -0.146 17934 7311 1 11 . 1 1 35 35 ARG H H 35 8.680 8.680 8.611 0.069 17934 7312 1 11 . 1 1 36 36 GLY N N 36 107.406 107.406 113.749 -6.343 17934 7313 1 11 . 1 1 36 36 GLY CA C 36 45.906 45.906 45.479 0.427 17934 7314 1 11 . 1 1 36 36 GLY H H 36 7.182 7.182 8.432 -1.250 17934 7315 1 11 . 1 1 37 37 THR HA H 37 4.060 4.060 4.019 0.041 17934 7316 1 11 . 1 1 37 37 THR C C 37 176.634 176.634 175.569 1.065 17934 7317 1 11 . 1 1 37 37 THR CA C 37 65.632 65.632 63.301 2.331 17934 7318 1 11 . 1 1 37 37 THR CB C 37 68.445 68.445 68.406 0.039 17934 7319 1 11 . 1 1 38 38 GLU N N 38 122.251 122.251 122.322 -0.071 17934 7320 1 11 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.892 0.234 17934 7321 1 11 . 1 1 38 38 GLU C C 38 179.981 179.981 178.308 1.673 17934 7322 1 11 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.628 0.380 17934 7323 1 11 . 1 1 38 38 GLU CB C 38 29.539 29.539 29.331 0.208 17934 7324 1 11 . 1 1 38 38 GLU H H 38 8.450 8.450 8.649 -0.199 17934 7325 1 11 . 1 1 39 39 SER N N 39 115.966 115.966 114.240 1.726 17934 7326 1 11 . 1 1 39 39 SER C C 39 175.991 175.991 176.545 -0.554 17934 7327 1 11 . 1 1 39 39 SER CA C 39 62.820 62.820 61.440 1.380 17934 7328 1 11 . 1 1 39 39 SER H H 39 7.522 7.522 7.759 -0.237 17934 7329 1 11 . 1 1 40 40 THR HA H 40 4.049 4.049 3.968 0.081 17934 7330 1 11 . 1 1 40 40 THR C C 40 175.972 175.972 176.580 -0.608 17934 7331 1 11 . 1 1 40 40 THR CA C 40 66.101 66.101 65.460 0.641 17934 7332 1 11 . 1 1 40 40 THR CB C 40 67.976 67.976 68.550 -0.574 17934 7333 1 11 . 1 1 41 41 GLN N N 41 120.354 120.354 121.200 -0.846 17934 7334 1 11 . 1 1 41 41 GLN HA H 41 3.759 3.759 3.984 -0.225 17934 7335 1 11 . 1 1 41 41 GLN C C 41 178.483 178.483 177.932 0.551 17934 7336 1 11 . 1 1 41 41 GLN CA C 41 60.476 60.476 59.189 1.287 17934 7337 1 11 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.430 -0.297 17934 7338 1 11 . 1 1 41 41 GLN H H 41 8.271 8.271 8.506 -0.235 17934 7339 1 11 . 1 1 42 42 ASP N N 42 120.757 120.757 120.456 0.301 17934 7340 1 11 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.430 -0.071 17934 7341 1 11 . 1 1 42 42 ASP C C 42 177.480 177.480 178.096 -0.616 17934 7342 1 11 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.435 0.229 17934 7343 1 11 . 1 1 42 42 ASP CB C 42 42.195 42.195 41.133 1.062 17934 7344 1 11 . 1 1 42 42 ASP H H 42 7.954 7.954 8.097 -0.143 17934 7345 1 11 . 1 1 43 43 ALA N N 43 120.587 120.587 122.319 -1.732 17934 7346 1 11 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.148 -0.158 17934 7347 1 11 . 1 1 43 43 ALA C C 43 179.767 179.767 179.915 -0.148 17934 7348 1 11 . 1 1 43 43 ALA CA C 43 55.320 55.320 54.982 0.338 17934 7349 1 11 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.233 0.997 17934 7350 1 11 . 1 1 43 43 ALA H H 43 7.842 7.842 8.252 -0.410 17934 7351 1 11 . 1 1 44 44 CYS N N 44 115.428 115.428 118.111 -2.683 17934 7352 1 11 . 1 1 44 44 CYS HA H 44 3.895 3.895 3.970 -0.075 17934 7353 1 11 . 1 1 44 44 CYS C C 44 176.076 176.076 176.357 -0.281 17934 7354 1 11 . 1 1 44 44 CYS CA C 44 64.695 64.695 64.365 0.330 17934 7355 1 11 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.325 0.339 17934 7356 1 11 . 1 1 44 44 CYS H H 44 7.900 7.900 8.403 -0.503 17934 7357 1 11 . 1 1 45 45 ALA N N 45 120.487 120.487 122.178 -1.691 17934 7358 1 11 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.969 0.031 17934 7359 1 11 . 1 1 45 45 ALA C C 45 173.506 173.506 179.013 -5.507 17934 7360 1 11 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.438 -0.118 17934 7361 1 11 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.161 -0.221 17934 7362 1 11 . 1 1 45 45 ALA H H 45 7.250 7.250 8.117 -0.867 17934 7363 1 11 . 1 1 46 46 LYS N N 46 119.267 119.267 119.216 0.051 17934 7364 1 11 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.947 -0.000 17934 7365 1 11 . 1 1 46 46 LYS C C 46 179.561 179.561 178.759 0.802 17934 7366 1 11 . 1 1 46 46 LYS H H 46 8.102 8.102 8.138 -0.036 17934 7367 1 11 . 1 1 47 47 MET N N 47 118.009 118.009 118.449 -0.440 17934 7368 1 11 . 1 1 47 47 MET HA H 47 4.214 4.214 4.121 0.093 17934 7369 1 11 . 1 1 47 47 MET C C 47 179.526 179.526 178.032 1.494 17934 7370 1 11 . 1 1 47 47 MET CA C 47 57.195 57.195 59.207 -2.012 17934 7371 1 11 . 1 1 47 47 MET CB C 47 30.945 30.945 32.854 -1.909 17934 7372 1 11 . 1 1 47 47 MET H H 47 8.585 8.585 7.870 0.715 17934 7373 1 11 . 1 1 48 48 ARG N N 48 119.962 119.962 119.125 0.837 17934 7374 1 11 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.871 -0.015 17934 7375 1 11 . 1 1 48 48 ARG C C 48 178.875 178.875 177.736 1.139 17934 7376 1 11 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.287 1.658 17934 7377 1 11 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.906 0.571 17934 7378 1 11 . 1 1 48 48 ARG H H 48 8.190 8.190 8.549 -0.359 17934 7379 1 11 . 1 1 49 49 ALA N N 49 120.640 120.640 119.874 0.766 17934 7380 1 11 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.152 -0.409 17934 7381 1 11 . 1 1 49 49 ALA C C 49 180.169 180.169 179.517 0.652 17934 7382 1 11 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.173 0.678 17934 7383 1 11 . 1 1 49 49 ALA CB C 49 17.821 17.821 19.118 -1.297 17934 7384 1 11 . 1 1 49 49 ALA H H 49 7.671 7.671 8.264 -0.593 17934 7385 1 11 . 1 1 50 50 ASN N N 50 116.063 116.063 118.862 -2.799 17934 7386 1 11 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.492 -0.017 17934 7387 1 11 . 1 1 50 50 ASN C C 50 177.084 177.084 177.195 -0.111 17934 7388 1 11 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.311 0.478 17934 7389 1 11 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.035 0.879 17934 7390 1 11 . 1 1 50 50 ASN H H 50 7.893 7.893 8.404 -0.511 17934 7391 1 11 . 1 1 51 51 CYS N N 51 116.884 116.884 118.609 -1.725 17934 7392 1 11 . 1 1 51 51 CYS HA H 51 4.306 4.306 3.982 0.324 17934 7393 1 11 . 1 1 51 51 CYS C C 51 175.002 175.002 176.539 -1.537 17934 7394 1 11 . 1 1 51 51 CYS CA C 51 61.414 61.414 62.505 -1.091 17934 7395 1 11 . 1 1 51 51 CYS CB C 51 27.664 27.664 26.487 1.177 17934 7396 1 11 . 1 1 51 51 CYS H H 51 7.770 7.770 8.532 -0.762 17934 7397 1 11 . 1 1 52 52 GLN N N 52 117.831 117.831 119.455 -1.624 17934 7398 1 11 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.071 0.157 17934 7399 1 11 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.680 -1.954 17934 7400 1 11 . 1 1 52 52 GLN CB C 52 29.070 29.070 28.582 0.488 17934 7401 1 11 . 1 1 52 52 GLN H H 52 7.796 7.796 8.295 -0.499 17934 7402 1 11 . 1 1 53 53 LYS N N 53 118.841 118.841 119.009 -0.168 17934 7403 1 11 . 1 1 53 53 LYS CA C 53 57.195 57.195 57.940 -0.744 17934 7404 1 11 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.601 0.688 17934 7405 1 11 . 1 1 53 53 LYS H H 53 7.686 7.686 7.874 -0.188 17934 7406 1 11 . 1 1 55 55 THR HA H 55 4.304 4.304 3.943 0.361 17934 7407 1 11 . 1 1 55 55 THR CA C 55 63.757 63.757 66.587 -2.830 17934 7408 1 11 . 1 1 55 55 THR CB C 55 68.914 68.914 68.854 0.060 17934 7409 1 11 . 1 1 56 56 GLU N N 56 120.861 120.861 120.455 0.406 17934 7410 1 11 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.029 0.118 17934 7411 1 11 . 1 1 56 56 GLU C C 56 177.656 177.656 178.966 -1.310 17934 7412 1 11 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.983 -0.850 17934 7413 1 11 . 1 1 56 56 GLU CB C 56 30.008 30.008 28.571 1.437 17934 7414 1 11 . 1 1 56 56 GLU H H 56 8.311 8.311 8.610 -0.299 17934 7415 1 11 . 1 1 57 57 GLN N N 57 118.397 118.397 118.454 -0.057 17934 7416 1 11 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.244 -0.102 17934 7417 1 11 . 1 1 57 57 GLN C C 57 177.275 177.275 178.046 -0.771 17934 7418 1 11 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.355 0.309 17934 7419 1 11 . 1 1 57 57 GLN CB C 57 29.070 29.070 29.177 -0.107 17934 7420 1 11 . 1 1 57 57 GLN H H 57 7.899 7.899 7.795 0.104 17934 7421 1 11 . 1 1 58 58 MET N N 58 118.897 118.897 119.893 -0.996 17934 7422 1 11 . 1 1 58 58 MET HA H 58 4.350 4.350 4.088 0.262 17934 7423 1 11 . 1 1 58 58 MET C C 58 177.172 177.172 177.774 -0.602 17934 7424 1 11 . 1 1 58 58 MET CA C 58 56.726 56.726 58.499 -1.773 17934 7425 1 11 . 1 1 58 58 MET CB C 58 32.196 32.196 32.489 -0.293 17934 7426 1 11 . 1 1 58 58 MET H H 58 8.036 8.036 8.352 -0.316 17934 7427 1 11 . 1 1 59 59 LYS N N 59 119.779 119.779 118.302 1.477 17934 7428 1 11 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.050 0.181 17934 7429 1 11 . 1 1 59 59 LYS C C 59 176.676 176.676 177.198 -0.522 17934 7430 1 11 . 1 1 59 59 LYS CA C 59 57.195 57.195 58.172 -0.977 17934 7431 1 11 . 1 1 59 59 LYS CB C 59 32.820 32.820 32.443 0.377 17934 7432 1 11 . 1 1 59 59 LYS H H 59 7.901 7.901 7.840 0.061 17934 7433 1 11 . 1 1 60 60 LYS N N 60 119.993 119.993 118.373 1.620 17934 7434 1 11 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.531 -0.196 17934 7435 1 11 . 1 1 60 60 LYS C C 60 176.336 176.336 174.568 1.768 17934 7436 1 11 . 1 1 60 60 LYS CA C 60 56.258 56.258 55.593 0.665 17934 7437 1 11 . 1 1 60 60 LYS CB C 60 32.820 32.820 34.529 -1.709 17934 7438 1 11 . 1 1 60 60 LYS H H 60 7.877 7.877 7.877 0.000 17934 7439 1 11 . 1 1 61 61 VAL N N 61 122.649 122.649 120.506 2.143 17934 7440 1 11 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.584 -0.204 17934 7441 1 11 . 1 1 61 61 VAL C C 61 174.210 174.210 174.395 -0.185 17934 7442 1 11 . 1 1 61 61 VAL CA C 61 60.000 60.000 58.823 1.177 17934 7443 1 11 . 1 1 61 61 VAL CB C 61 32.350 32.350 33.300 -0.950 17934 7444 1 11 . 1 1 61 61 VAL H H 61 7.708 7.708 8.186 -0.478 17934 7445 1 11 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.693 -0.030 17934 7446 1 11 . 1 1 62 62 PRO C C 62 176.656 176.656 176.528 0.128 17934 7447 1 11 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.669 0.151 17934 7448 1 11 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.469 -0.586 17934 7449 1 11 . 1 1 63 63 THR N N 63 117.155 117.155 116.743 0.412 17934 7450 1 11 . 1 1 63 63 THR HA H 63 4.830 4.830 4.874 -0.044 17934 7451 1 11 . 1 1 63 63 THR C C 63 174.682 174.682 173.674 1.008 17934 7452 1 11 . 1 1 63 63 THR CA C 63 62.820 62.820 62.807 0.013 17934 7453 1 11 . 1 1 63 63 THR CB C 63 69.382 69.382 70.174 -0.792 17934 7454 1 11 . 1 1 63 63 THR H H 63 8.303 8.303 8.313 -0.010 17934 7455 1 11 . 1 1 64 64 ILE N N 64 121.004 121.004 119.551 1.453 17934 7456 1 11 . 1 1 64 64 ILE CA C 64 58.600 58.600 59.311 -0.711 17934 7457 1 11 . 1 1 64 64 ILE CB C 64 42.690 42.690 42.428 0.262 17934 7458 1 11 . 1 1 64 64 ILE H H 64 9.348 9.348 8.812 0.536 17934 7459 1 11 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.474 0.266 17934 7460 1 11 . 1 1 65 65 ILE C C 65 175.378 175.378 174.571 0.807 17934 7461 1 11 . 1 1 65 65 ILE CA C 65 60.080 60.080 60.412 -0.332 17934 7462 1 11 . 1 1 65 65 ILE CB C 65 38.750 38.750 38.019 0.731 17934 7463 1 11 . 1 1 66 66 LEU N N 66 110.343 110.343 129.408 -19.065 17934 7464 1 11 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.890 -0.040 17934 7465 1 11 . 1 1 66 66 LEU C C 66 174.982 174.982 175.244 -0.262 17934 7466 1 11 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.429 -0.519 17934 7467 1 11 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.950 1.280 17934 7468 1 11 . 1 1 66 66 LEU H H 66 9.610 9.610 9.290 0.320 17934 7469 1 11 . 1 1 67 67 SER N N 67 120.990 120.990 119.836 1.154 17934 7470 1 11 . 1 1 67 67 SER HA H 67 5.405 5.405 5.199 0.206 17934 7471 1 11 . 1 1 67 67 SER C C 67 174.405 174.405 172.734 1.671 17934 7472 1 11 . 1 1 67 67 SER CA C 67 57.195 57.195 56.724 0.471 17934 7473 1 11 . 1 1 67 67 SER CB C 67 64.695 64.695 65.315 -0.620 17934 7474 1 11 . 1 1 67 67 SER H H 67 9.260 9.260 8.581 0.679 17934 7475 1 11 . 1 1 68 68 VAL N N 68 128.176 128.176 125.852 2.324 17934 7476 1 11 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.384 0.109 17934 7477 1 11 . 1 1 68 68 VAL C C 68 173.891 173.891 172.989 0.902 17934 7478 1 11 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.309 2.041 17934 7479 1 11 . 1 1 68 68 VAL CB C 68 33.750 33.750 34.521 -0.771 17934 7480 1 11 . 1 1 68 68 VAL H H 68 9.225 9.225 9.274 -0.049 17934 7481 1 11 . 1 1 69 69 SER N N 69 121.697 121.697 123.969 -2.272 17934 7482 1 11 . 1 1 69 69 SER HA H 69 4.837 4.837 4.928 -0.091 17934 7483 1 11 . 1 1 69 69 SER C C 69 173.188 173.188 174.582 -1.394 17934 7484 1 11 . 1 1 69 69 SER CA C 69 57.195 57.195 56.391 0.804 17934 7485 1 11 . 1 1 69 69 SER CB C 69 67.976 67.976 65.801 2.175 17934 7486 1 11 . 1 1 69 69 SER H H 69 8.869 8.869 8.968 -0.099 17934 7487 1 11 . 1 1 70 70 ALA N N 70 118.689 118.689 124.893 -6.204 17934 7488 1 11 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.181 -0.031 17934 7489 1 11 . 1 1 70 70 ALA C C 70 176.714 176.714 177.602 -0.888 17934 7490 1 11 . 1 1 70 70 ALA CA C 70 53.910 53.910 53.974 -0.064 17934 7491 1 11 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.912 -0.312 17934 7492 1 11 . 1 1 70 70 ALA H H 70 8.810 8.810 8.969 -0.159 17934 7493 1 11 . 1 1 71 71 LYS N N 71 112.633 112.633 116.026 -3.393 17934 7494 1 11 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.446 -0.171 17934 7495 1 11 . 1 1 71 71 LYS C C 71 177.033 177.033 175.737 1.296 17934 7496 1 11 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.264 1.931 17934 7497 1 11 . 1 1 71 71 LYS CB C 71 33.289 33.289 31.965 1.324 17934 7498 1 11 . 1 1 71 71 LYS H H 71 7.830 7.830 8.033 -0.203 17934 7499 1 11 . 1 1 72 72 GLY N N 72 108.432 108.432 105.707 2.725 17934 7500 1 11 . 1 1 72 72 GLY CA C 72 45.476 45.476 44.686 0.790 17934 7501 1 11 . 1 1 72 72 GLY H H 72 7.685 7.685 7.585 0.100 17934 7502 1 11 . 1 1 73 73 VAL N N 73 120.414 120.414 115.317 5.097 17934 7503 1 11 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.598 0.402 17934 7504 1 11 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.564 0.906 17934 7505 1 11 . 1 1 73 73 VAL CB C 73 35.630 35.630 34.091 1.539 17934 7506 1 11 . 1 1 73 73 VAL H H 73 8.620 8.620 8.483 0.137 17934 7507 1 11 . 1 1 74 74 LYS N N 74 125.257 125.257 126.667 -1.410 17934 7508 1 11 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.453 0.563 17934 7509 1 11 . 1 1 74 74 LYS CA C 74 54.383 54.383 54.729 -0.346 17934 7510 1 11 . 1 1 74 74 LYS CB C 74 36.570 36.570 36.261 0.309 17934 7511 1 11 . 1 1 74 74 LYS H H 74 8.783 8.783 7.847 0.936 17934 7512 1 11 . 1 1 75 75 PHE N N 75 119.414 119.414 118.653 0.761 17934 7513 1 11 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.332 0.368 17934 7514 1 11 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.758 -2.837 17934 7515 1 11 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.696 -1.086 17934 7516 1 11 . 1 1 75 75 PHE H H 75 8.432 8.432 9.000 -0.568 17934 7517 1 11 . 1 1 76 76 ILE N N 76 121.430 121.430 121.479 -0.049 17934 7518 1 11 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.726 0.114 17934 7519 1 11 . 1 1 76 76 ILE C C 76 175.249 175.249 174.613 0.636 17934 7520 1 11 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.699 -0.629 17934 7521 1 11 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.409 -0.189 17934 7522 1 11 . 1 1 76 76 ILE H H 76 8.960 8.960 8.491 0.469 17934 7523 1 11 . 1 1 77 77 ASP N N 77 125.744 125.744 124.317 1.427 17934 7524 1 11 . 1 1 77 77 ASP HA H 77 4.563 4.563 5.013 -0.450 17934 7525 1 11 . 1 1 77 77 ASP C C 77 177.569 177.569 175.736 1.833 17934 7526 1 11 . 1 1 77 77 ASP CA C 77 55.789 55.789 53.544 2.245 17934 7527 1 11 . 1 1 77 77 ASP CB C 77 43.601 43.601 42.622 0.979 17934 7528 1 11 . 1 1 77 77 ASP H H 77 8.750 8.750 8.790 -0.040 17934 7529 1 11 . 1 1 78 78 ALA N N 78 128.632 128.632 127.098 1.534 17934 7530 1 11 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.285 -0.315 17934 7531 1 11 . 1 1 78 78 ALA C C 78 178.052 178.052 177.982 0.070 17934 7532 1 11 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.047 0.783 17934 7533 1 11 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.567 0.226 17934 7534 1 11 . 1 1 78 78 ALA H H 78 8.700 8.700 8.709 -0.009 17934 7535 1 11 . 1 1 79 79 THR N N 79 113.087 113.087 114.612 -1.525 17934 7536 1 11 . 1 1 79 79 THR HA H 79 4.194 4.194 4.221 -0.027 17934 7537 1 11 . 1 1 79 79 THR C C 79 175.587 175.587 175.025 0.562 17934 7538 1 11 . 1 1 79 79 THR CA C 79 64.695 64.695 64.679 0.016 17934 7539 1 11 . 1 1 79 79 THR CB C 79 69.382 69.382 69.067 0.315 17934 7540 1 11 . 1 1 79 79 THR H H 79 8.779 8.779 8.247 0.532 17934 7541 1 11 . 1 1 80 80 ASN N N 80 118.434 118.434 116.686 1.748 17934 7542 1 11 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.860 -0.123 17934 7543 1 11 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.681 0.764 17934 7544 1 11 . 1 1 80 80 ASN CB C 80 39.383 39.383 38.468 0.916 17934 7545 1 11 . 1 1 80 80 ASN H H 80 8.584 8.584 7.963 0.621 17934 7546 1 11 . 1 1 81 81 LYS N N 81 112.429 112.429 116.441 -4.012 17934 7547 1 11 . 1 1 81 81 LYS C C 81 174.909 174.909 175.561 -0.652 17934 7548 1 11 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.634 0.030 17934 7549 1 11 . 1 1 81 81 LYS CB C 81 28.602 28.602 29.604 -1.002 17934 7550 1 11 . 1 1 81 81 LYS H H 81 7.966 7.966 8.355 -0.389 17934 7551 1 11 . 1 1 82 82 ASN N N 82 116.806 116.806 116.034 0.772 17934 7552 1 11 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.705 -0.115 17934 7553 1 11 . 1 1 82 82 ASN C C 82 174.999 174.999 173.975 1.024 17934 7554 1 11 . 1 1 82 82 ASN CA C 82 52.976 52.976 52.219 0.757 17934 7555 1 11 . 1 1 82 82 ASN CB C 82 38.445 38.445 40.852 -2.407 17934 7556 1 11 . 1 1 82 82 ASN H H 82 8.455 8.455 7.546 0.909 17934 7557 1 11 . 1 1 83 83 ILE N N 83 122.447 122.447 120.981 1.466 17934 7558 1 11 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.215 -0.185 17934 7559 1 11 . 1 1 83 83 ILE C C 83 176.572 176.572 175.594 0.978 17934 7560 1 11 . 1 1 83 83 ILE CA C 83 62.350 62.350 61.799 0.551 17934 7561 1 11 . 1 1 83 83 ILE CB C 83 37.970 37.970 39.376 -1.406 17934 7562 1 11 . 1 1 83 83 ILE H H 83 8.650 8.650 8.443 0.207 17934 7563 1 11 . 1 1 84 84 ILE N N 84 129.339 129.339 130.578 -1.239 17934 7564 1 11 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.237 -0.317 17934 7565 1 11 . 1 1 84 84 ILE C C 84 175.873 175.873 175.741 0.132 17934 7566 1 11 . 1 1 84 84 ILE CA C 84 62.810 62.810 60.377 2.433 17934 7567 1 11 . 1 1 84 84 ILE CB C 84 38.840 38.840 39.346 -0.506 17934 7568 1 11 . 1 1 84 84 ILE H H 84 8.930 8.930 8.860 0.070 17934 7569 1 11 . 1 1 85 85 ALA N N 85 118.867 118.867 119.868 -1.001 17934 7570 1 11 . 1 1 85 85 ALA C C 85 174.100 174.100 175.200 -1.100 17934 7571 1 11 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.215 -0.645 17934 7572 1 11 . 1 1 85 85 ALA H H 85 7.048 7.048 8.117 -1.069 17934 7573 1 11 . 1 1 87 87 HIS HA H 87 5.154 5.154 5.039 0.115 17934 7574 1 11 . 1 1 87 87 HIS C C 87 174.986 174.986 173.399 1.587 17934 7575 1 11 . 1 1 87 87 HIS CB C 87 34.350 34.350 32.381 1.969 17934 7576 1 11 . 1 1 88 88 GLU N N 88 125.372 125.372 120.953 4.419 17934 7577 1 11 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.495 0.026 17934 7578 1 11 . 1 1 88 88 GLU C C 88 179.047 179.047 178.162 0.885 17934 7579 1 11 . 1 1 88 88 GLU CA C 88 56.726 56.726 55.604 1.122 17934 7580 1 11 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.662 -0.185 17934 7581 1 11 . 1 1 88 88 GLU H H 88 9.106 9.106 8.879 0.227 17934 7582 1 11 . 1 1 89 89 ILE N N 89 124.132 124.132 122.897 1.235 17934 7583 1 11 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.954 0.065 17934 7584 1 11 . 1 1 89 89 ILE C C 89 176.095 176.095 177.094 -0.999 17934 7585 1 11 . 1 1 89 89 ILE CA C 89 62.351 62.351 65.989 -3.638 17934 7586 1 11 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.349 0.565 17934 7587 1 11 . 1 1 89 89 ILE H H 89 8.055 8.055 8.924 -0.869 17934 7588 1 11 . 1 1 90 90 ARG N N 90 116.949 116.949 114.931 2.018 17934 7589 1 11 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.196 0.142 17934 7590 1 11 . 1 1 90 90 ARG C C 90 176.578 176.578 176.386 0.192 17934 7591 1 11 . 1 1 90 90 ARG CA C 90 57.664 57.664 57.635 0.029 17934 7592 1 11 . 1 1 90 90 ARG CB C 90 29.070 29.070 28.797 0.273 17934 7593 1 11 . 1 1 90 90 ARG H H 90 8.045 8.045 8.643 -0.598 17934 7594 1 11 . 1 1 91 91 ASN N N 91 116.320 116.320 116.586 -0.266 17934 7595 1 11 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.831 0.322 17934 7596 1 11 . 1 1 91 91 ASN C C 91 174.595 174.595 175.169 -0.574 17934 7597 1 11 . 1 1 91 91 ASN CA C 91 52.508 52.508 53.792 -1.284 17934 7598 1 11 . 1 1 91 91 ASN CB C 91 39.852 39.852 40.466 -0.614 17934 7599 1 11 . 1 1 91 91 ASN H H 91 8.067 8.067 8.164 -0.097 17934 7600 1 11 . 1 1 92 92 ILE N N 92 122.441 122.441 121.926 0.515 17934 7601 1 11 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.807 1.266 17934 7602 1 11 . 1 1 92 92 ILE C C 92 175.229 175.229 175.760 -0.531 17934 7603 1 11 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.922 -1.042 17934 7604 1 11 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.402 2.448 17934 7605 1 11 . 1 1 92 92 ILE H H 92 7.483 7.483 7.964 -0.481 17934 7606 1 11 . 1 1 93 93 SER N N 93 120.329 120.329 123.266 -2.937 17934 7607 1 11 . 1 1 93 93 SER HA H 93 4.684 4.684 4.140 0.544 17934 7608 1 11 . 1 1 93 93 SER C C 93 180.744 180.744 174.608 6.136 17934 7609 1 11 . 1 1 93 93 SER CA C 93 57.664 57.664 61.889 -4.225 17934 7610 1 11 . 1 1 93 93 SER CB C 93 66.570 66.570 63.839 2.731 17934 7611 1 11 . 1 1 93 93 SER H H 93 9.545 9.545 8.363 1.182 17934 7612 1 11 . 1 1 94 94 CYS N N 94 110.900 110.900 113.591 -2.691 17934 7613 1 11 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.436 -0.624 17934 7614 1 11 . 1 1 94 94 CYS C C 94 173.973 173.973 172.716 1.257 17934 7615 1 11 . 1 1 94 94 CYS CA C 94 59.539 59.539 58.010 1.529 17934 7616 1 11 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.590 -4.332 17934 7617 1 11 . 1 1 94 94 CYS H H 94 8.858 8.858 7.965 0.893 17934 7618 1 11 . 1 1 95 95 ALA N N 95 121.379 121.379 122.126 -0.747 17934 7619 1 11 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.566 -0.136 17934 7620 1 11 . 1 1 95 95 ALA C C 95 178.098 178.098 175.085 3.013 17934 7621 1 11 . 1 1 95 95 ALA CA C 95 52.650 52.650 52.057 0.593 17934 7622 1 11 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.591 -2.291 17934 7623 1 11 . 1 1 95 95 ALA H H 95 8.360 8.360 8.333 0.027 17934 7624 1 11 . 1 1 96 96 ALA N N 96 122.576 122.576 119.466 3.110 17934 7625 1 11 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.625 0.055 17934 7626 1 11 . 1 1 96 96 ALA C C 96 175.716 175.716 174.393 1.323 17934 7627 1 11 . 1 1 96 96 ALA CA C 96 52.440 52.440 52.310 0.130 17934 7628 1 11 . 1 1 96 96 ALA CB C 96 22.700 22.700 21.477 1.223 17934 7629 1 11 . 1 1 96 96 ALA H H 96 9.080 9.080 8.973 0.107 17934 7630 1 11 . 1 1 97 97 GLN N N 97 116.903 116.903 119.760 -2.857 17934 7631 1 11 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.698 0.232 17934 7632 1 11 . 1 1 97 97 GLN C C 97 175.270 175.270 173.768 1.502 17934 7633 1 11 . 1 1 97 97 GLN CA C 97 54.851 54.851 54.006 0.845 17934 7634 1 11 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.420 2.338 17934 7635 1 11 . 1 1 97 97 GLN H H 97 8.369 8.369 8.300 0.069 17934 7636 1 11 . 1 1 98 98 ASP N N 98 124.971 124.971 121.179 3.792 17934 7637 1 11 . 1 1 98 98 ASP C C 98 175.217 175.217 175.801 -0.584 17934 7638 1 11 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.615 -0.576 17934 7639 1 11 . 1 1 98 98 ASP CB C 98 42.195 42.195 42.575 -0.380 17934 7640 1 11 . 1 1 98 98 ASP H H 98 8.395 8.395 8.437 -0.042 17934 7641 1 11 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.352 -0.118 17934 7642 1 11 . 1 1 99 99 PRO C C 99 178.433 178.433 177.442 0.991 17934 7643 1 11 . 1 1 99 99 PRO CA C 99 64.695 64.695 65.099 -0.404 17934 7644 1 11 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.040 0.312 17934 7645 1 11 . 1 1 100 100 GLU N N 100 116.223 116.223 118.922 -2.699 17934 7646 1 11 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.129 0.091 17934 7647 1 11 . 1 1 100 100 GLU C C 100 176.678 176.678 175.853 0.825 17934 7648 1 11 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.077 -1.351 17934 7649 1 11 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.538 2.407 17934 7650 1 11 . 1 1 100 100 GLU H H 100 8.643 8.643 8.761 -0.118 17934 7651 1 11 . 1 1 101 101 ASP N N 101 119.053 119.053 119.131 -0.078 17934 7652 1 11 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.792 -0.249 17934 7653 1 11 . 1 1 101 101 ASP C C 101 174.771 174.771 176.509 -1.738 17934 7654 1 11 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.127 0.787 17934 7655 1 11 . 1 1 101 101 ASP CB C 101 40.789 40.789 41.142 -0.353 17934 7656 1 11 . 1 1 101 101 ASP H H 101 7.597 7.597 8.171 -0.574 17934 7657 1 11 . 1 1 102 102 LEU N N 102 123.986 123.986 120.660 3.326 17934 7658 1 11 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.180 0.210 17934 7659 1 11 . 1 1 102 102 LEU C C 102 177.141 177.141 178.479 -1.338 17934 7660 1 11 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.408 0.252 17934 7661 1 11 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.801 0.859 17934 7662 1 11 . 1 1 102 102 LEU H H 102 8.534 8.534 7.599 0.935 17934 7663 1 11 . 1 1 103 103 SER N N 103 112.339 112.339 112.464 -0.125 17934 7664 1 11 . 1 1 103 103 SER HA H 103 4.290 4.290 4.366 -0.076 17934 7665 1 11 . 1 1 103 103 SER C C 103 174.106 174.106 175.340 -1.234 17934 7666 1 11 . 1 1 103 103 SER CA C 103 60.945 60.945 60.901 0.044 17934 7667 1 11 . 1 1 103 103 SER CB C 103 63.757 63.757 63.327 0.430 17934 7668 1 11 . 1 1 103 103 SER H H 103 7.867 7.867 8.247 -0.380 17934 7669 1 11 . 1 1 104 104 THR N N 104 123.070 123.070 118.677 4.393 17934 7670 1 11 . 1 1 104 104 THR HA H 104 5.373 5.373 4.848 0.525 17934 7671 1 11 . 1 1 104 104 THR C C 104 180.693 180.693 173.566 7.127 17934 7672 1 11 . 1 1 104 104 THR CA C 104 63.289 63.289 64.442 -1.153 17934 7673 1 11 . 1 1 104 104 THR CB C 104 69.382 69.382 69.426 -0.044 17934 7674 1 11 . 1 1 104 104 THR H H 104 8.830 8.830 8.256 0.574 17934 7675 1 11 . 1 1 105 105 PHE N N 105 122.582 122.582 122.299 0.283 17934 7676 1 11 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.852 0.618 17934 7677 1 11 . 1 1 105 105 PHE C C 105 179.211 179.211 172.115 7.096 17934 7678 1 11 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.942 -0.622 17934 7679 1 11 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.223 0.567 17934 7680 1 11 . 1 1 105 105 PHE H H 105 9.170 9.170 9.234 -0.064 17934 7681 1 11 . 1 1 106 106 ALA N N 106 119.567 119.567 120.741 -1.174 17934 7682 1 11 . 1 1 106 106 ALA C C 106 175.603 175.603 174.703 0.900 17934 7683 1 11 . 1 1 106 106 ALA H H 106 8.770 8.770 8.891 -0.121 17934 7684 1 11 . 1 1 107 107 TYR N N 107 109.933 109.933 114.245 -4.312 17934 7685 1 11 . 1 1 107 107 TYR HA H 107 4.920 4.920 4.729 0.191 17934 7686 1 11 . 1 1 107 107 TYR C C 107 180.426 180.426 172.261 8.165 17934 7687 1 11 . 1 1 107 107 TYR CA C 107 57.080 57.080 56.666 0.414 17934 7688 1 11 . 1 1 107 107 TYR CB C 107 40.789 40.789 40.102 0.687 17934 7689 1 11 . 1 1 107 107 TYR H H 107 7.950 7.950 8.562 -0.612 17934 7690 1 11 . 1 1 108 108 ILE N N 108 120.613 120.613 118.686 1.927 17934 7691 1 11 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.829 0.541 17934 7692 1 11 . 1 1 108 108 ILE C C 108 176.212 176.212 175.529 0.683 17934 7693 1 11 . 1 1 108 108 ILE CA C 108 59.540 59.540 58.908 0.632 17934 7694 1 11 . 1 1 108 108 ILE CB C 108 39.380 39.380 38.872 0.508 17934 7695 1 11 . 1 1 108 108 ILE H H 108 8.869 8.869 8.226 0.643 17934 7696 1 11 . 1 1 109 109 THR N N 109 116.505 116.505 114.602 1.903 17934 7697 1 11 . 1 1 109 109 THR HA H 109 5.669 5.669 4.496 1.173 17934 7698 1 11 . 1 1 109 109 THR C C 109 173.505 173.505 173.102 0.403 17934 7699 1 11 . 1 1 109 109 THR CA C 109 59.070 59.070 60.425 -1.355 17934 7700 1 11 . 1 1 109 109 THR H H 109 9.489 9.489 7.754 1.735 17934 7701 1 11 . 1 1 110 110 LYS N N 110 122.960 122.960 119.973 2.987 17934 7702 1 11 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.487 -0.027 17934 7703 1 11 . 1 1 110 110 LYS C C 110 175.937 175.937 175.402 0.535 17934 7704 1 11 . 1 1 110 110 LYS CA C 110 55.789 55.789 56.309 -0.520 17934 7705 1 11 . 1 1 110 110 LYS CB C 110 34.227 34.227 34.097 0.130 17934 7706 1 11 . 1 1 110 110 LYS H H 110 7.831 7.831 8.318 -0.486 17934 7707 1 11 . 1 1 111 111 ASP N N 111 127.409 127.409 119.346 8.063 17934 7708 1 11 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.956 -0.175 17934 7709 1 11 . 1 1 111 111 ASP C C 111 176.396 176.396 177.361 -0.965 17934 7710 1 11 . 1 1 111 111 ASP CA C 111 53.914 53.914 53.597 0.317 17934 7711 1 11 . 1 1 111 111 ASP CB C 111 43.133 43.133 43.866 -0.733 17934 7712 1 11 . 1 1 111 111 ASP H H 111 8.769 8.769 8.004 0.765 17934 7713 1 11 . 1 1 112 112 LEU N N 112 125.913 125.913 120.231 5.682 17934 7714 1 11 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.066 0.084 17934 7715 1 11 . 1 1 112 112 LEU C C 112 178.553 178.553 177.235 1.318 17934 7716 1 11 . 1 1 112 112 LEU CA C 112 57.190 57.190 56.970 0.220 17934 7717 1 11 . 1 1 112 112 LEU CB C 112 41.790 41.790 41.767 0.023 17934 7718 1 11 . 1 1 112 112 LEU H H 112 8.593 8.593 8.436 0.157 17934 7719 1 11 . 1 1 113 113 LYS N N 113 117.189 117.189 116.262 0.927 17934 7720 1 11 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.199 0.063 17934 7721 1 11 . 1 1 113 113 LYS C C 113 177.180 177.180 175.989 1.191 17934 7722 1 11 . 1 1 113 113 LYS CA C 113 58.133 58.133 56.670 1.463 17934 7723 1 11 . 1 1 113 113 LYS CB C 113 32.820 32.820 31.884 0.936 17934 7724 1 11 . 1 1 113 113 LYS H H 113 8.207 8.207 8.089 0.118 17934 7725 1 11 . 1 1 114 114 SER N N 114 112.492 112.492 115.720 -3.228 17934 7726 1 11 . 1 1 114 114 SER CA C 114 58.601 58.601 57.706 0.895 17934 7727 1 11 . 1 1 114 114 SER CB C 114 65.164 65.164 64.999 0.165 17934 7728 1 11 . 1 1 114 114 SER H H 114 7.755 7.755 7.714 0.041 17934 7729 1 11 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.662 -0.273 17934 7730 1 11 . 1 1 115 115 ASN C C 115 174.203 174.203 175.245 -1.042 17934 7731 1 11 . 1 1 115 115 ASN CA C 115 54.383 54.383 53.644 0.739 17934 7732 1 11 . 1 1 115 115 ASN CB C 115 37.977 37.977 38.400 -0.423 17934 7733 1 11 . 1 1 116 116 HIS N N 116 116.822 116.822 118.538 -1.716 17934 7734 1 11 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.640 0.290 17934 7735 1 11 . 1 1 116 116 HIS C C 116 173.898 173.898 174.555 -0.657 17934 7736 1 11 . 1 1 116 116 HIS CA C 116 54.910 54.910 54.701 0.209 17934 7737 1 11 . 1 1 116 116 HIS CB C 116 32.650 32.650 31.341 1.309 17934 7738 1 11 . 1 1 116 116 HIS H H 116 7.690 7.690 7.949 -0.259 17934 7739 1 11 . 1 1 117 117 HIS N N 117 118.253 118.253 119.975 -1.722 17934 7740 1 11 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.445 0.875 17934 7741 1 11 . 1 1 117 117 HIS C C 117 173.695 173.695 174.396 -0.701 17934 7742 1 11 . 1 1 117 117 HIS CA C 117 56.350 56.350 56.372 -0.022 17934 7743 1 11 . 1 1 117 117 HIS CB C 117 32.350 32.350 27.517 4.833 17934 7744 1 11 . 1 1 117 117 HIS H H 117 8.340 8.340 8.216 0.124 17934 7745 1 11 . 1 1 118 118 TYR N N 118 118.301 118.301 123.330 -5.029 17934 7746 1 11 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.551 0.459 17934 7747 1 11 . 1 1 118 118 TYR C C 118 173.530 173.530 174.326 -0.796 17934 7748 1 11 . 1 1 118 118 TYR CA C 118 56.730 56.730 58.154 -1.424 17934 7749 1 11 . 1 1 118 118 TYR CB C 118 43.240 43.240 40.398 2.842 17934 7750 1 11 . 1 1 118 118 TYR H H 118 9.080 9.080 8.338 0.742 17934 7751 1 11 . 1 1 119 119 CYS N N 119 121.015 121.015 124.348 -3.333 17934 7752 1 11 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.706 0.357 17934 7753 1 11 . 1 1 119 119 CYS C C 119 180.664 180.664 173.552 7.112 17934 7754 1 11 . 1 1 119 119 CYS CA C 119 56.726 56.726 57.315 -0.589 17934 7755 1 11 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.771 0.768 17934 7756 1 11 . 1 1 119 119 CYS H H 119 9.120 9.120 8.665 0.455 17934 7757 1 11 . 1 1 120 120 HIS N N 120 110.134 110.134 129.514 -19.380 17934 7758 1 11 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.585 0.114 17934 7759 1 11 . 1 1 120 120 HIS C C 120 180.776 180.776 172.768 8.008 17934 7760 1 11 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.310 1.010 17934 7761 1 11 . 1 1 120 120 HIS CB C 120 32.352 32.352 31.857 0.495 17934 7762 1 11 . 1 1 120 120 HIS H H 120 8.482 8.482 8.610 -0.128 17934 7763 1 11 . 1 1 121 121 VAL N N 121 120.855 120.855 126.363 -5.508 17934 7764 1 11 . 1 1 121 121 VAL HA H 121 4.350 4.350 3.913 0.437 17934 7765 1 11 . 1 1 121 121 VAL C C 121 173.419 173.419 172.575 0.844 17934 7766 1 11 . 1 1 121 121 VAL CA C 121 61.410 61.410 59.152 2.258 17934 7767 1 11 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.677 -0.397 17934 7768 1 11 . 1 1 121 121 VAL H H 121 7.929 7.929 8.280 -0.351 17934 7769 1 11 . 1 1 122 122 PHE N N 122 124.384 124.384 124.385 -0.001 17934 7770 1 11 . 1 1 122 122 PHE HA H 122 5.420 5.420 4.934 0.486 17934 7771 1 11 . 1 1 122 122 PHE C C 122 174.876 174.876 172.745 2.131 17934 7772 1 11 . 1 1 122 122 PHE CA C 122 55.320 55.320 53.919 1.401 17934 7773 1 11 . 1 1 122 122 PHE CB C 122 44.540 44.540 40.473 4.067 17934 7774 1 11 . 1 1 122 122 PHE H H 122 8.910 8.910 8.570 0.340 17934 7775 1 11 . 1 1 123 123 THR N N 123 112.451 112.451 111.194 1.257 17934 7776 1 11 . 1 1 123 123 THR HA H 123 5.147 5.147 4.797 0.350 17934 7777 1 11 . 1 1 123 123 THR C C 123 174.096 174.096 173.809 0.287 17934 7778 1 11 . 1 1 123 123 THR CA C 123 61.843 61.843 59.675 2.168 17934 7779 1 11 . 1 1 123 123 THR CB C 123 71.218 71.218 70.455 0.763 17934 7780 1 11 . 1 1 123 123 THR H H 123 8.668 8.668 8.685 -0.017 17934 7781 1 11 . 1 1 124 124 ALA N N 124 128.922 128.922 125.556 3.366 17934 7782 1 11 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.848 -0.128 17934 7783 1 11 . 1 1 124 124 ALA C C 124 177.168 177.168 177.267 -0.099 17934 7784 1 11 . 1 1 124 124 ALA CA C 124 50.890 50.890 50.349 0.541 17934 7785 1 11 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.024 0.076 17934 7786 1 11 . 1 1 124 124 ALA H H 124 9.180 9.180 8.343 0.837 17934 7787 1 11 . 1 1 125 125 PHE N N 125 115.427 115.427 118.932 -3.505 17934 7788 1 11 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.458 -0.168 17934 7789 1 11 . 1 1 125 125 PHE C C 125 174.703 174.703 175.237 -0.534 17934 7790 1 11 . 1 1 125 125 PHE CA C 125 60.470 60.470 59.584 0.886 17934 7791 1 11 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.478 -1.418 17934 7792 1 11 . 1 1 125 125 PHE H H 125 8.560 8.560 9.327 -0.767 17934 7793 1 11 . 1 1 126 126 ASP N N 126 115.745 115.745 118.114 -2.369 17934 7794 1 11 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.807 0.036 17934 7795 1 11 . 1 1 126 126 ASP C C 126 176.532 176.532 176.091 0.441 17934 7796 1 11 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.059 0.386 17934 7797 1 11 . 1 1 126 126 ASP CB C 126 44.070 44.070 43.844 0.226 17934 7798 1 11 . 1 1 126 126 ASP H H 126 7.417 7.417 7.556 -0.139 17934 7799 1 11 . 1 1 127 127 VAL N N 127 121.923 121.923 123.697 -1.774 17934 7800 1 11 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.750 -0.160 17934 7801 1 11 . 1 1 127 127 VAL C C 127 176.863 176.863 177.609 -0.746 17934 7802 1 11 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.824 -1.194 17934 7803 1 11 . 1 1 127 127 VAL CB C 127 31.830 31.830 31.999 -0.169 17934 7804 1 11 . 1 1 127 127 VAL H H 127 8.508 8.508 8.453 0.055 17934 7805 1 11 . 1 1 128 128 ASN N N 128 118.851 118.851 118.401 0.450 17934 7806 1 11 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.440 0.036 17934 7807 1 11 . 1 1 128 128 ASN C C 128 178.251 178.251 177.652 0.599 17934 7808 1 11 . 1 1 128 128 ASN CA C 128 56.258 56.258 55.840 0.417 17934 7809 1 11 . 1 1 128 128 ASN CB C 128 37.977 37.977 37.965 0.013 17934 7810 1 11 . 1 1 128 128 ASN H H 128 8.207 8.207 8.430 -0.223 17934 7811 1 11 . 1 1 129 129 LEU N N 129 122.549 122.549 120.025 2.524 17934 7812 1 11 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.959 0.251 17934 7813 1 11 . 1 1 129 129 LEU C C 129 178.003 178.003 178.390 -0.387 17934 7814 1 11 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.766 -0.576 17934 7815 1 11 . 1 1 129 129 LEU CB C 129 41.790 41.790 40.950 0.840 17934 7816 1 11 . 1 1 129 129 LEU H H 129 8.223 8.223 7.942 0.281 17934 7817 1 11 . 1 1 130 130 ALA N N 130 120.036 120.036 121.294 -1.258 17934 7818 1 11 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.156 0.154 17934 7819 1 11 . 1 1 130 130 ALA C C 130 178.172 178.172 178.887 -0.715 17934 7820 1 11 . 1 1 130 130 ALA CA C 130 55.780 55.780 54.781 0.999 17934 7821 1 11 . 1 1 130 130 ALA CB C 130 19.070 19.070 17.882 1.188 17934 7822 1 11 . 1 1 130 130 ALA H H 130 7.360 7.360 7.932 -0.572 17934 7823 1 11 . 1 1 131 131 ALA N N 131 116.989 116.989 118.581 -1.592 17934 7824 1 11 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.860 -0.150 17934 7825 1 11 . 1 1 131 131 ALA C C 131 180.163 180.163 179.453 0.710 17934 7826 1 11 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.682 1.098 17934 7827 1 11 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.143 -0.313 17934 7828 1 11 . 1 1 131 131 ALA H H 131 7.360 7.360 8.067 -0.707 17934 7829 1 11 . 1 1 132 132 GLU N N 132 119.462 119.462 119.808 -0.346 17934 7830 1 11 . 1 1 132 132 GLU HA H 132 3.888 3.888 3.996 -0.108 17934 7831 1 11 . 1 1 132 132 GLU C C 132 179.243 179.243 178.752 0.491 17934 7832 1 11 . 1 1 132 132 GLU CA C 132 59.539 59.539 59.245 0.294 17934 7833 1 11 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.695 -0.156 17934 7834 1 11 . 1 1 132 132 GLU H H 132 7.673 7.673 7.848 -0.175 17934 7835 1 11 . 1 1 133 133 ILE N N 133 123.218 123.218 121.032 2.186 17934 7836 1 11 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.679 -0.899 17934 7837 1 11 . 1 1 133 133 ILE C C 133 177.421 177.421 178.223 -0.802 17934 7838 1 11 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.460 1.030 17934 7839 1 11 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.830 -1.180 17934 7840 1 11 . 1 1 133 133 ILE H H 133 8.154 8.154 7.947 0.207 17934 7841 1 11 . 1 1 134 134 ILE N N 134 118.244 118.244 120.213 -1.969 17934 7842 1 11 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.765 -0.225 17934 7843 1 11 . 1 1 134 134 ILE C C 134 179.385 179.385 177.744 1.641 17934 7844 1 11 . 1 1 134 134 ILE CA C 134 63.280 63.280 65.025 -1.745 17934 7845 1 11 . 1 1 134 134 ILE CB C 134 36.100 36.100 37.362 -1.262 17934 7846 1 11 . 1 1 134 134 ILE H H 134 7.376 7.376 8.198 -0.822 17934 7847 1 11 . 1 1 135 135 LEU N N 135 123.061 123.061 121.605 1.456 17934 7848 1 11 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.905 0.285 17934 7849 1 11 . 1 1 135 135 LEU C C 135 179.858 179.858 178.804 1.054 17934 7850 1 11 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.817 -0.627 17934 7851 1 11 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.787 0.073 17934 7852 1 11 . 1 1 135 135 LEU H H 135 8.036 8.036 8.497 -0.461 17934 7853 1 11 . 1 1 136 136 THR N N 136 119.647 119.647 114.206 5.441 17934 7854 1 11 . 1 1 136 136 THR HA H 136 3.725 3.725 4.064 -0.339 17934 7855 1 11 . 1 1 136 136 THR C C 136 176.088 176.088 176.539 -0.451 17934 7856 1 11 . 1 1 136 136 THR CA C 136 58.601 58.601 66.555 -7.954 17934 7857 1 11 . 1 1 136 136 THR CB C 136 67.976 67.976 68.922 -0.946 17934 7858 1 11 . 1 1 136 136 THR H H 136 8.508 8.508 8.276 0.232 17934 7859 1 11 . 1 1 137 137 LEU N N 137 123.182 123.182 121.401 1.781 17934 7860 1 11 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.921 -0.181 17934 7861 1 11 . 1 1 137 137 LEU C C 137 178.341 178.341 178.856 -0.515 17934 7862 1 11 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.426 -0.166 17934 7863 1 11 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.730 -0.180 17934 7864 1 11 . 1 1 137 137 LEU H H 137 8.520 8.520 8.439 0.081 17934 7865 1 11 . 1 1 138 138 GLY N N 138 105.266 105.266 105.448 -0.182 17934 7866 1 11 . 1 1 138 138 GLY C C 138 176.973 176.973 176.060 0.913 17934 7867 1 11 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.108 0.244 17934 7868 1 11 . 1 1 138 138 GLY H H 138 7.858 7.858 8.320 -0.462 17934 7869 1 11 . 1 1 139 139 GLN N N 139 123.485 123.485 122.301 1.184 17934 7870 1 11 . 1 1 139 139 GLN C C 139 177.891 177.891 178.500 -0.609 17934 7871 1 11 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.588 0.013 17934 7872 1 11 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.250 -0.117 17934 7873 1 11 . 1 1 139 139 GLN H H 139 8.195 8.195 8.610 -0.415 17934 7874 1 11 . 1 1 140 140 ALA N N 140 122.754 122.754 122.523 0.231 17934 7875 1 11 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.176 -0.467 17934 7876 1 11 . 1 1 140 140 ALA C C 140 178.987 178.987 179.001 -0.014 17934 7877 1 11 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.980 0.800 17934 7878 1 11 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.522 -1.112 17934 7879 1 11 . 1 1 140 140 ALA H H 140 8.530 8.530 8.435 0.095 17934 7880 1 11 . 1 1 141 141 PHE N N 141 116.275 116.275 119.251 -2.976 17934 7881 1 11 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.405 -0.315 17934 7882 1 11 . 1 1 141 141 PHE C C 141 178.129 178.129 177.279 0.850 17934 7883 1 11 . 1 1 141 141 PHE CA C 141 61.240 61.240 60.805 0.435 17934 7884 1 11 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.669 -0.286 17934 7885 1 11 . 1 1 141 141 PHE H H 141 7.920 7.920 8.374 -0.454 17934 7886 1 11 . 1 1 142 142 GLU N N 142 119.967 119.967 119.946 0.021 17934 7887 1 11 . 1 1 142 142 GLU HA H 142 4.227 4.227 4.180 0.047 17934 7888 1 11 . 1 1 142 142 GLU C C 142 179.250 179.250 177.939 1.311 17934 7889 1 11 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.077 1.462 17934 7890 1 11 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.850 -0.311 17934 7891 1 11 . 1 1 142 142 GLU H H 142 7.713 7.713 8.481 -0.768 17934 7892 1 11 . 1 1 143 143 VAL N N 143 120.189 120.189 118.815 1.374 17934 7893 1 11 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.800 -0.117 17934 7894 1 11 . 1 1 143 143 VAL C C 143 178.066 178.066 175.682 2.384 17934 7895 1 11 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.462 2.108 17934 7896 1 11 . 1 1 143 143 VAL CB C 143 31.883 31.883 32.415 -0.532 17934 7897 1 11 . 1 1 143 143 VAL H H 143 8.608 8.608 7.742 0.866 17934 7898 1 11 . 1 1 144 144 ALA N N 144 121.753 121.753 120.564 1.189 17934 7899 1 11 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.574 -0.574 17934 7900 1 11 . 1 1 144 144 ALA C C 144 180.776 180.776 175.355 5.421 17934 7901 1 11 . 1 1 144 144 ALA CA C 144 55.780 55.780 51.536 4.244 17934 7902 1 11 . 1 1 144 144 ALA CB C 144 18.770 18.770 20.007 -1.237 17934 7903 1 11 . 1 1 144 144 ALA H H 144 8.399 8.399 7.326 1.073 17934 7904 1 11 . 1 1 145 145 TYR N N 145 119.962 119.962 119.814 0.148 17934 7905 1 11 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.615 -0.425 17934 7906 1 11 . 1 1 145 145 TYR C C 145 177.645 177.645 174.122 3.523 17934 7907 1 11 . 1 1 145 145 TYR CA C 145 60.880 60.880 55.609 5.271 17934 7908 1 11 . 1 1 145 145 TYR CB C 145 37.980 37.980 39.795 -1.815 17934 7909 1 11 . 1 1 145 145 TYR H H 145 8.190 8.190 8.123 0.067 17934 7910 1 12 . 1 1 13 13 LYS N N 13 120.778 120.778 119.880 0.898 17934 7911 1 12 . 1 1 13 13 LYS C C 13 176.476 176.476 178.145 -1.669 17934 7912 1 12 . 1 1 13 13 LYS CA C 13 58.601 58.601 57.061 1.540 17934 7913 1 12 . 1 1 13 13 LYS CB C 13 32.820 32.820 32.718 0.102 17934 7914 1 12 . 1 1 13 13 LYS H H 13 7.984 7.984 8.054 -0.070 17934 7915 1 12 . 1 1 15 15 ILE HA H 15 3.820 3.820 3.829 -0.009 17934 7916 1 12 . 1 1 15 15 ILE C C 15 176.376 176.376 177.065 -0.689 17934 7917 1 12 . 1 1 15 15 ILE CA C 15 63.570 63.570 62.964 0.606 17934 7918 1 12 . 1 1 15 15 ILE CB C 15 39.380 39.380 36.662 2.718 17934 7919 1 12 . 1 1 16 16 ALA N N 16 121.364 121.364 119.928 1.436 17934 7920 1 12 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.305 0.133 17934 7921 1 12 . 1 1 16 16 ALA C C 16 177.494 177.494 176.336 1.158 17934 7922 1 12 . 1 1 16 16 ALA CA C 16 52.976 52.976 51.354 1.622 17934 7923 1 12 . 1 1 16 16 ALA CB C 16 20.333 20.333 18.851 1.482 17934 7924 1 12 . 1 1 16 16 ALA H H 16 8.081 8.081 7.837 0.244 17934 7925 1 12 . 1 1 17 17 GLN N N 17 118.109 118.109 113.678 4.431 17934 7926 1 12 . 1 1 17 17 GLN HA H 17 4.573 4.573 3.902 0.671 17934 7927 1 12 . 1 1 17 17 GLN C C 17 173.632 173.632 174.652 -1.020 17934 7928 1 12 . 1 1 17 17 GLN CA C 17 54.851 54.851 56.283 -1.432 17934 7929 1 12 . 1 1 17 17 GLN CB C 17 30.477 30.477 25.560 4.917 17934 7930 1 12 . 1 1 17 17 GLN H H 17 7.550 7.550 8.025 -0.475 17934 7931 1 12 . 1 1 18 18 SER N N 18 112.384 112.384 114.716 -2.332 17934 7932 1 12 . 1 1 18 18 SER HA H 18 4.388 4.388 4.718 -0.330 17934 7933 1 12 . 1 1 18 18 SER C C 18 173.780 173.780 174.394 -0.614 17934 7934 1 12 . 1 1 18 18 SER CA C 18 57.664 57.664 57.362 0.302 17934 7935 1 12 . 1 1 18 18 SER CB C 18 65.164 65.164 64.644 0.520 17934 7936 1 12 . 1 1 18 18 SER H H 18 7.666 7.666 7.757 -0.091 17934 7937 1 12 . 1 1 19 19 CYS N N 19 120.116 120.116 121.981 -1.865 17934 7938 1 12 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.387 -0.057 17934 7939 1 12 . 1 1 19 19 CYS C C 19 180.387 180.387 173.219 7.168 17934 7940 1 12 . 1 1 19 19 CYS CA C 19 58.601 58.601 58.638 -0.036 17934 7941 1 12 . 1 1 19 19 CYS CB C 19 30.008 30.008 29.770 0.238 17934 7942 1 12 . 1 1 19 19 CYS H H 19 8.835 8.835 8.739 0.096 17934 7943 1 12 . 1 1 20 20 ASP N N 20 124.416 124.416 123.267 1.149 17934 7944 1 12 . 1 1 20 20 ASP CA C 20 52.976 52.976 52.582 0.394 17934 7945 1 12 . 1 1 20 20 ASP CB C 20 42.195 42.195 43.977 -1.782 17934 7946 1 12 . 1 1 20 20 ASP H H 20 7.847 7.847 8.419 -0.572 17934 7947 1 12 . 1 1 21 21 TYR N N 21 121.296 121.296 123.595 -2.299 17934 7948 1 12 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.692 0.038 17934 7949 1 12 . 1 1 21 21 TYR C C 21 175.793 175.793 174.483 1.310 17934 7950 1 12 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.629 0.571 17934 7951 1 12 . 1 1 21 21 TYR CB C 21 43.240 43.240 42.933 0.307 17934 7952 1 12 . 1 1 21 21 TYR H H 21 9.070 9.070 8.739 0.331 17934 7953 1 12 . 1 1 22 22 LYS N N 22 122.820 122.820 122.885 -0.065 17934 7954 1 12 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.263 -0.071 17934 7955 1 12 . 1 1 22 22 LYS C C 22 175.793 175.793 175.641 0.152 17934 7956 1 12 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.474 0.784 17934 7957 1 12 . 1 1 22 22 LYS CB C 22 33.758 33.758 32.296 1.462 17934 7958 1 12 . 1 1 22 22 LYS H H 22 8.711 8.711 8.718 -0.007 17934 7959 1 12 . 1 1 23 23 ALA N N 23 123.073 123.073 126.686 -3.613 17934 7960 1 12 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.813 -0.083 17934 7961 1 12 . 1 1 23 23 ALA C C 23 174.515 174.515 175.681 -1.166 17934 7962 1 12 . 1 1 23 23 ALA CA C 23 51.570 51.570 49.487 2.083 17934 7963 1 12 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.945 -1.317 17934 7964 1 12 . 1 1 23 23 ALA H H 23 8.727 8.727 8.721 0.006 17934 7965 1 12 . 1 1 24 24 ALA N N 24 122.486 122.486 122.649 -0.163 17934 7966 1 12 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.757 0.424 17934 7967 1 12 . 1 1 24 24 ALA C C 24 176.835 176.835 176.089 0.746 17934 7968 1 12 . 1 1 24 24 ALA CA C 24 51.570 51.570 50.827 0.743 17934 7969 1 12 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.371 -0.251 17934 7970 1 12 . 1 1 24 24 ALA H H 24 8.675 8.675 8.445 0.230 17934 7971 1 12 . 1 1 25 25 TYR N N 25 122.698 122.698 124.901 -2.203 17934 7972 1 12 . 1 1 25 25 TYR HA H 25 5.010 5.010 3.696 1.314 17934 7973 1 12 . 1 1 25 25 TYR CA C 25 54.340 54.340 58.419 -4.079 17934 7974 1 12 . 1 1 25 25 TYR CB C 25 39.850 39.850 38.373 1.477 17934 7975 1 12 . 1 1 25 25 TYR H H 25 8.270 8.270 8.343 -0.073 17934 7976 1 12 . 1 1 26 26 LEU N N 26 127.997 127.997 129.292 -1.295 17934 7977 1 12 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.086 -0.166 17934 7978 1 12 . 1 1 26 26 LEU C C 26 175.983 175.983 176.649 -0.666 17934 7979 1 12 . 1 1 26 26 LEU CA C 26 56.726 56.726 55.801 0.925 17934 7980 1 12 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.017 -1.947 17934 7981 1 12 . 1 1 26 26 LEU H H 26 8.700 8.700 7.554 1.146 17934 7982 1 12 . 1 1 27 27 GLY N N 27 102.901 102.901 101.507 1.394 17934 7983 1 12 . 1 1 27 27 GLY C C 27 176.219 176.219 171.601 4.618 17934 7984 1 12 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.141 -1.540 17934 7985 1 12 . 1 1 27 27 GLY H H 27 5.891 5.891 7.459 -1.568 17934 7986 1 12 . 1 1 28 28 SER N N 28 111.551 111.551 114.679 -3.128 17934 7987 1 12 . 1 1 28 28 SER HA H 28 5.785 5.785 5.314 0.471 17934 7988 1 12 . 1 1 28 28 SER CA C 28 56.258 56.258 58.104 -1.846 17934 7989 1 12 . 1 1 28 28 SER CB C 28 65.632 65.632 66.015 -0.383 17934 7990 1 12 . 1 1 28 28 SER H H 28 7.981 7.981 8.328 -0.347 17934 7991 1 12 . 1 1 29 29 MET N N 29 119.493 119.493 124.357 -4.864 17934 7992 1 12 . 1 1 29 29 MET HA H 29 4.725 4.725 4.748 -0.023 17934 7993 1 12 . 1 1 29 29 MET C C 29 174.143 174.143 174.647 -0.504 17934 7994 1 12 . 1 1 29 29 MET CA C 29 54.036 54.036 54.041 -0.005 17934 7995 1 12 . 1 1 29 29 MET CB C 29 37.268 37.268 36.044 1.224 17934 7996 1 12 . 1 1 29 29 MET H H 29 8.704 8.704 8.938 -0.234 17934 7997 1 12 . 1 1 30 30 LEU N N 30 128.150 128.150 124.945 3.205 17934 7998 1 12 . 1 1 30 30 LEU HA H 30 3.785 3.785 3.521 0.264 17934 7999 1 12 . 1 1 30 30 LEU C C 30 175.857 175.857 175.198 0.659 17934 8000 1 12 . 1 1 30 30 LEU CA C 30 56.250 56.250 54.604 1.646 17934 8001 1 12 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.497 1.163 17934 8002 1 12 . 1 1 30 30 LEU H H 30 8.630 8.630 8.482 0.148 17934 8003 1 12 . 1 1 31 31 ILE N N 31 127.723 127.723 129.217 -1.494 17934 8004 1 12 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.139 0.051 17934 8005 1 12 . 1 1 31 31 ILE C C 31 174.881 174.881 174.781 0.100 17934 8006 1 12 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.892 -2.232 17934 8007 1 12 . 1 1 31 31 ILE CB C 31 37.110 37.110 39.728 -2.618 17934 8008 1 12 . 1 1 31 31 ILE H H 31 8.560 8.560 8.431 0.129 17934 8009 1 12 . 1 1 32 32 LYS HA H 32 4.055 4.055 3.818 0.237 17934 8010 1 12 . 1 1 32 32 LYS C C 32 176.272 176.272 176.077 0.195 17934 8011 1 12 . 1 1 32 32 LYS CA C 32 58.601 58.601 58.215 0.387 17934 8012 1 12 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.590 0.230 17934 8013 1 12 . 1 1 33 33 GLU N N 33 118.638 118.638 118.582 0.056 17934 8014 1 12 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.160 0.228 17934 8015 1 12 . 1 1 33 33 GLU C C 33 173.962 173.962 175.143 -1.181 17934 8016 1 12 . 1 1 33 33 GLU CA C 33 54.851 54.851 55.878 -1.027 17934 8017 1 12 . 1 1 33 33 GLU CB C 33 30.945 30.945 29.787 1.158 17934 8018 1 12 . 1 1 33 33 GLU H H 33 7.723 7.723 8.061 -0.338 17934 8019 1 12 . 1 1 34 34 LEU N N 34 126.535 126.535 123.733 2.802 17934 8020 1 12 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.405 -0.460 17934 8021 1 12 . 1 1 34 34 LEU C C 34 176.870 176.870 176.563 0.307 17934 8022 1 12 . 1 1 34 34 LEU CA C 34 54.850 54.850 54.408 0.442 17934 8023 1 12 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.734 -1.014 17934 8024 1 12 . 1 1 34 34 LEU H H 34 8.446 8.446 8.377 0.069 17934 8025 1 12 . 1 1 35 35 ARG N N 35 128.447 128.447 123.665 4.782 17934 8026 1 12 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.394 0.161 17934 8027 1 12 . 1 1 35 35 ARG C C 35 176.110 176.110 176.202 -0.092 17934 8028 1 12 . 1 1 35 35 ARG CA C 35 54.851 54.851 55.032 -0.181 17934 8029 1 12 . 1 1 35 35 ARG CB C 35 30.477 30.477 30.991 -0.514 17934 8030 1 12 . 1 1 35 35 ARG H H 35 8.680 8.680 8.756 -0.076 17934 8031 1 12 . 1 1 36 36 GLY N N 36 107.406 107.406 112.670 -5.264 17934 8032 1 12 . 1 1 36 36 GLY CA C 36 45.906 45.906 45.690 0.216 17934 8033 1 12 . 1 1 36 36 GLY H H 36 7.182 7.182 8.305 -1.123 17934 8034 1 12 . 1 1 37 37 THR HA H 37 4.060 4.060 4.108 -0.048 17934 8035 1 12 . 1 1 37 37 THR C C 37 176.634 176.634 176.143 0.491 17934 8036 1 12 . 1 1 37 37 THR CA C 37 65.632 65.632 63.735 1.897 17934 8037 1 12 . 1 1 37 37 THR CB C 37 68.445 68.445 68.696 -0.251 17934 8038 1 12 . 1 1 38 38 GLU N N 38 122.251 122.251 121.949 0.302 17934 8039 1 12 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.896 0.230 17934 8040 1 12 . 1 1 38 38 GLU C C 38 179.981 179.981 178.478 1.503 17934 8041 1 12 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.754 0.254 17934 8042 1 12 . 1 1 38 38 GLU CB C 38 29.539 29.539 29.098 0.442 17934 8043 1 12 . 1 1 38 38 GLU H H 38 8.450 8.450 8.257 0.193 17934 8044 1 12 . 1 1 39 39 SER N N 39 115.966 115.966 112.939 3.027 17934 8045 1 12 . 1 1 39 39 SER C C 39 175.991 175.991 176.654 -0.663 17934 8046 1 12 . 1 1 39 39 SER CA C 39 62.820 62.820 62.081 0.739 17934 8047 1 12 . 1 1 39 39 SER H H 39 7.522 7.522 7.857 -0.335 17934 8048 1 12 . 1 1 40 40 THR HA H 40 4.049 4.049 3.939 0.110 17934 8049 1 12 . 1 1 40 40 THR C C 40 175.972 175.972 176.549 -0.577 17934 8050 1 12 . 1 1 40 40 THR CA C 40 66.101 66.101 65.695 0.405 17934 8051 1 12 . 1 1 40 40 THR CB C 40 67.976 67.976 67.794 0.182 17934 8052 1 12 . 1 1 41 41 GLN N N 41 120.354 120.354 119.956 0.398 17934 8053 1 12 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.041 -0.282 17934 8054 1 12 . 1 1 41 41 GLN C C 41 178.483 178.483 178.114 0.369 17934 8055 1 12 . 1 1 41 41 GLN CA C 41 60.476 60.476 58.549 1.927 17934 8056 1 12 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.429 -0.296 17934 8057 1 12 . 1 1 41 41 GLN H H 41 8.271 8.271 8.542 -0.271 17934 8058 1 12 . 1 1 42 42 ASP N N 42 120.757 120.757 121.888 -1.131 17934 8059 1 12 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.380 -0.021 17934 8060 1 12 . 1 1 42 42 ASP C C 42 177.480 177.480 177.813 -0.333 17934 8061 1 12 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.500 0.164 17934 8062 1 12 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.820 1.375 17934 8063 1 12 . 1 1 42 42 ASP H H 42 7.954 7.954 8.107 -0.153 17934 8064 1 12 . 1 1 43 43 ALA N N 43 120.587 120.587 121.827 -1.240 17934 8065 1 12 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.146 -0.156 17934 8066 1 12 . 1 1 43 43 ALA C C 43 179.767 179.767 179.620 0.147 17934 8067 1 12 . 1 1 43 43 ALA CA C 43 55.320 55.320 55.050 0.270 17934 8068 1 12 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.300 0.930 17934 8069 1 12 . 1 1 43 43 ALA H H 43 7.842 7.842 8.144 -0.302 17934 8070 1 12 . 1 1 44 44 CYS N N 44 115.428 115.428 117.657 -2.229 17934 8071 1 12 . 1 1 44 44 CYS HA H 44 3.895 3.895 3.935 -0.040 17934 8072 1 12 . 1 1 44 44 CYS C C 44 176.076 176.076 176.529 -0.453 17934 8073 1 12 . 1 1 44 44 CYS CA C 44 64.695 64.695 63.546 1.149 17934 8074 1 12 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.962 -0.298 17934 8075 1 12 . 1 1 44 44 CYS H H 44 7.900 7.900 8.486 -0.586 17934 8076 1 12 . 1 1 45 45 ALA N N 45 120.487 120.487 122.862 -2.375 17934 8077 1 12 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.868 0.132 17934 8078 1 12 . 1 1 45 45 ALA C C 45 173.506 173.506 179.083 -5.577 17934 8079 1 12 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.319 0.001 17934 8080 1 12 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.228 -0.288 17934 8081 1 12 . 1 1 45 45 ALA H H 45 7.250 7.250 8.079 -0.829 17934 8082 1 12 . 1 1 46 46 LYS N N 46 119.267 119.267 118.449 0.818 17934 8083 1 12 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.855 0.092 17934 8084 1 12 . 1 1 46 46 LYS C C 46 179.561 179.561 178.768 0.793 17934 8085 1 12 . 1 1 46 46 LYS H H 46 8.102 8.102 8.210 -0.108 17934 8086 1 12 . 1 1 47 47 MET N N 47 118.009 118.009 118.425 -0.416 17934 8087 1 12 . 1 1 47 47 MET HA H 47 4.214 4.214 4.089 0.125 17934 8088 1 12 . 1 1 47 47 MET C C 47 179.526 179.526 178.135 1.391 17934 8089 1 12 . 1 1 47 47 MET CA C 47 57.195 57.195 58.359 -1.164 17934 8090 1 12 . 1 1 47 47 MET CB C 47 30.945 30.945 32.589 -1.644 17934 8091 1 12 . 1 1 47 47 MET H H 47 8.585 8.585 7.978 0.607 17934 8092 1 12 . 1 1 48 48 ARG N N 48 119.962 119.962 120.084 -0.122 17934 8093 1 12 . 1 1 48 48 ARG HA H 48 3.856 3.856 4.187 -0.331 17934 8094 1 12 . 1 1 48 48 ARG C C 48 178.875 178.875 178.774 0.101 17934 8095 1 12 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.079 1.866 17934 8096 1 12 . 1 1 48 48 ARG CB C 48 30.477 30.477 30.115 0.362 17934 8097 1 12 . 1 1 48 48 ARG H H 48 8.190 8.190 8.477 -0.287 17934 8098 1 12 . 1 1 49 49 ALA N N 49 120.640 120.640 120.970 -0.330 17934 8099 1 12 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.244 -0.501 17934 8100 1 12 . 1 1 49 49 ALA C C 49 180.169 180.169 178.080 2.089 17934 8101 1 12 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.273 0.578 17934 8102 1 12 . 1 1 49 49 ALA CB C 49 17.821 17.821 18.864 -1.043 17934 8103 1 12 . 1 1 49 49 ALA H H 49 7.671 7.671 8.256 -0.585 17934 8104 1 12 . 1 1 50 50 ASN N N 50 116.063 116.063 116.311 -0.248 17934 8105 1 12 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.765 -0.291 17934 8106 1 12 . 1 1 50 50 ASN C C 50 177.084 177.084 177.308 -0.224 17934 8107 1 12 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.437 0.352 17934 8108 1 12 . 1 1 50 50 ASN CB C 50 38.914 38.914 40.273 -1.359 17934 8109 1 12 . 1 1 50 50 ASN H H 50 7.893 7.893 8.309 -0.416 17934 8110 1 12 . 1 1 51 51 CYS N N 51 116.884 116.884 118.582 -1.698 17934 8111 1 12 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.581 -0.275 17934 8112 1 12 . 1 1 51 51 CYS C C 51 175.002 175.002 175.983 -0.981 17934 8113 1 12 . 1 1 51 51 CYS CA C 51 61.414 61.414 58.733 2.681 17934 8114 1 12 . 1 1 51 51 CYS CB C 51 27.664 27.664 26.565 1.099 17934 8115 1 12 . 1 1 51 51 CYS H H 51 7.770 7.770 8.232 -0.462 17934 8116 1 12 . 1 1 52 52 GLN N N 52 117.831 117.831 120.918 -3.087 17934 8117 1 12 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.158 0.070 17934 8118 1 12 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.421 -1.695 17934 8119 1 12 . 1 1 52 52 GLN CB C 52 29.070 29.070 28.244 0.826 17934 8120 1 12 . 1 1 52 52 GLN H H 52 7.796 7.796 8.283 -0.487 17934 8121 1 12 . 1 1 53 53 LYS N N 53 118.841 118.841 117.777 1.064 17934 8122 1 12 . 1 1 53 53 LYS CA C 53 57.195 57.195 56.385 0.810 17934 8123 1 12 . 1 1 53 53 LYS CB C 53 33.289 33.289 33.186 0.103 17934 8124 1 12 . 1 1 53 53 LYS H H 53 7.686 7.686 7.593 0.093 17934 8125 1 12 . 1 1 55 55 THR HA H 55 4.304 4.304 3.983 0.321 17934 8126 1 12 . 1 1 55 55 THR CA C 55 63.757 63.757 66.668 -2.911 17934 8127 1 12 . 1 1 55 55 THR CB C 55 68.914 68.914 68.936 -0.021 17934 8128 1 12 . 1 1 56 56 GLU N N 56 120.861 120.861 118.686 2.175 17934 8129 1 12 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.174 -0.027 17934 8130 1 12 . 1 1 56 56 GLU C C 56 177.656 177.656 178.659 -1.003 17934 8131 1 12 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.899 -0.766 17934 8132 1 12 . 1 1 56 56 GLU CB C 56 30.008 30.008 29.299 0.709 17934 8133 1 12 . 1 1 56 56 GLU H H 56 8.311 8.311 8.145 0.166 17934 8134 1 12 . 1 1 57 57 GLN N N 57 118.397 118.397 119.243 -0.846 17934 8135 1 12 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.182 -0.040 17934 8136 1 12 . 1 1 57 57 GLN C C 57 177.275 177.275 178.146 -0.871 17934 8137 1 12 . 1 1 57 57 GLN CA C 57 57.664 57.664 58.154 -0.490 17934 8138 1 12 . 1 1 57 57 GLN CB C 57 29.070 29.070 29.099 -0.029 17934 8139 1 12 . 1 1 57 57 GLN H H 57 7.899 7.899 7.893 0.006 17934 8140 1 12 . 1 1 58 58 MET N N 58 118.897 118.897 115.731 3.166 17934 8141 1 12 . 1 1 58 58 MET HA H 58 4.350 4.350 4.324 0.026 17934 8142 1 12 . 1 1 58 58 MET C C 58 177.172 177.172 175.743 1.429 17934 8143 1 12 . 1 1 58 58 MET CA C 58 56.726 56.726 56.568 0.159 17934 8144 1 12 . 1 1 58 58 MET CB C 58 32.196 32.196 32.613 -0.417 17934 8145 1 12 . 1 1 58 58 MET H H 58 8.036 8.036 8.164 -0.128 17934 8146 1 12 . 1 1 59 59 LYS N N 59 119.779 119.779 116.955 2.824 17934 8147 1 12 . 1 1 59 59 LYS HA H 59 4.231 4.231 3.969 0.263 17934 8148 1 12 . 1 1 59 59 LYS C C 59 176.676 176.676 175.618 1.058 17934 8149 1 12 . 1 1 59 59 LYS CA C 59 57.195 57.195 57.516 -0.321 17934 8150 1 12 . 1 1 59 59 LYS CB C 59 32.820 32.820 32.357 0.463 17934 8151 1 12 . 1 1 59 59 LYS H H 59 7.901 7.901 7.424 0.477 17934 8152 1 12 . 1 1 60 60 LYS N N 60 119.993 119.993 120.101 -0.108 17934 8153 1 12 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.224 0.111 17934 8154 1 12 . 1 1 60 60 LYS C C 60 176.336 176.336 176.229 0.107 17934 8155 1 12 . 1 1 60 60 LYS CA C 60 56.258 56.258 56.533 -0.275 17934 8156 1 12 . 1 1 60 60 LYS CB C 60 32.820 32.820 32.952 -0.132 17934 8157 1 12 . 1 1 60 60 LYS H H 60 7.877 7.877 8.204 -0.327 17934 8158 1 12 . 1 1 61 61 VAL N N 61 122.649 122.649 118.527 4.122 17934 8159 1 12 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.488 -0.108 17934 8160 1 12 . 1 1 61 61 VAL C C 61 174.210 174.210 173.962 0.248 17934 8161 1 12 . 1 1 61 61 VAL CA C 61 60.000 60.000 59.636 0.364 17934 8162 1 12 . 1 1 61 61 VAL CB C 61 32.350 32.350 32.556 -0.206 17934 8163 1 12 . 1 1 61 61 VAL H H 61 7.708 7.708 8.460 -0.752 17934 8164 1 12 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.683 -0.020 17934 8165 1 12 . 1 1 62 62 PRO C C 62 176.656 176.656 176.071 0.585 17934 8166 1 12 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.478 0.342 17934 8167 1 12 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.771 -0.888 17934 8168 1 12 . 1 1 63 63 THR N N 63 117.155 117.155 114.388 2.767 17934 8169 1 12 . 1 1 63 63 THR HA H 63 4.830 4.830 4.755 0.075 17934 8170 1 12 . 1 1 63 63 THR C C 63 174.682 174.682 173.910 0.772 17934 8171 1 12 . 1 1 63 63 THR CA C 63 62.820 62.820 63.033 -0.213 17934 8172 1 12 . 1 1 63 63 THR CB C 63 69.382 69.382 70.165 -0.783 17934 8173 1 12 . 1 1 63 63 THR H H 63 8.303 8.303 8.468 -0.165 17934 8174 1 12 . 1 1 64 64 ILE N N 64 121.004 121.004 120.193 0.811 17934 8175 1 12 . 1 1 64 64 ILE CA C 64 58.600 58.600 59.642 -1.042 17934 8176 1 12 . 1 1 64 64 ILE CB C 64 42.690 42.690 42.452 0.238 17934 8177 1 12 . 1 1 64 64 ILE H H 64 9.348 9.348 8.784 0.564 17934 8178 1 12 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.488 0.252 17934 8179 1 12 . 1 1 65 65 ILE C C 65 175.378 175.378 174.885 0.493 17934 8180 1 12 . 1 1 65 65 ILE CA C 65 60.080 60.080 60.852 -0.772 17934 8181 1 12 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.382 1.368 17934 8182 1 12 . 1 1 66 66 LEU N N 66 110.343 110.343 129.762 -19.419 17934 8183 1 12 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.780 0.070 17934 8184 1 12 . 1 1 66 66 LEU C C 66 174.982 174.982 175.587 -0.605 17934 8185 1 12 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.262 -0.352 17934 8186 1 12 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.614 1.616 17934 8187 1 12 . 1 1 66 66 LEU H H 66 9.610 9.610 9.326 0.284 17934 8188 1 12 . 1 1 67 67 SER N N 67 120.990 120.990 119.552 1.438 17934 8189 1 12 . 1 1 67 67 SER HA H 67 5.405 5.405 5.344 0.061 17934 8190 1 12 . 1 1 67 67 SER C C 67 174.405 174.405 173.154 1.251 17934 8191 1 12 . 1 1 67 67 SER CA C 67 57.195 57.195 56.448 0.747 17934 8192 1 12 . 1 1 67 67 SER CB C 67 64.695 64.695 65.188 -0.493 17934 8193 1 12 . 1 1 67 67 SER H H 67 9.260 9.260 8.639 0.621 17934 8194 1 12 . 1 1 68 68 VAL N N 68 128.176 128.176 126.363 1.813 17934 8195 1 12 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.335 0.158 17934 8196 1 12 . 1 1 68 68 VAL C C 68 173.891 173.891 173.199 0.692 17934 8197 1 12 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.970 1.380 17934 8198 1 12 . 1 1 68 68 VAL CB C 68 33.750 33.750 34.721 -0.971 17934 8199 1 12 . 1 1 68 68 VAL H H 68 9.225 9.225 8.797 0.428 17934 8200 1 12 . 1 1 69 69 SER N N 69 121.697 121.697 124.091 -2.394 17934 8201 1 12 . 1 1 69 69 SER HA H 69 4.837 4.837 4.900 -0.063 17934 8202 1 12 . 1 1 69 69 SER C C 69 173.188 173.188 175.206 -2.018 17934 8203 1 12 . 1 1 69 69 SER CA C 69 57.195 57.195 55.328 1.867 17934 8204 1 12 . 1 1 69 69 SER CB C 69 67.976 67.976 65.434 2.542 17934 8205 1 12 . 1 1 69 69 SER H H 69 8.869 8.869 8.843 0.026 17934 8206 1 12 . 1 1 70 70 ALA N N 70 118.689 118.689 128.734 -10.045 17934 8207 1 12 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.262 -0.112 17934 8208 1 12 . 1 1 70 70 ALA C C 70 176.714 176.714 177.078 -0.364 17934 8209 1 12 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.230 -0.320 17934 8210 1 12 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.701 -0.101 17934 8211 1 12 . 1 1 70 70 ALA H H 70 8.810 8.810 8.867 -0.057 17934 8212 1 12 . 1 1 71 71 LYS N N 71 112.633 112.633 115.652 -3.019 17934 8213 1 12 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.402 -0.127 17934 8214 1 12 . 1 1 71 71 LYS C C 71 177.033 177.033 176.257 0.776 17934 8215 1 12 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.455 1.740 17934 8216 1 12 . 1 1 71 71 LYS CB C 71 33.289 33.289 32.913 0.376 17934 8217 1 12 . 1 1 71 71 LYS H H 71 7.830 7.830 7.696 0.134 17934 8218 1 12 . 1 1 72 72 GLY N N 72 108.432 108.432 106.960 1.472 17934 8219 1 12 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.232 0.244 17934 8220 1 12 . 1 1 72 72 GLY H H 72 7.685 7.685 7.684 0.001 17934 8221 1 12 . 1 1 73 73 VAL N N 73 120.414 120.414 115.972 4.442 17934 8222 1 12 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.615 0.385 17934 8223 1 12 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.114 1.356 17934 8224 1 12 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.337 0.293 17934 8225 1 12 . 1 1 73 73 VAL H H 73 8.620 8.620 8.094 0.526 17934 8226 1 12 . 1 1 74 74 LYS N N 74 125.257 125.257 122.560 2.697 17934 8227 1 12 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.371 0.645 17934 8228 1 12 . 1 1 74 74 LYS CA C 74 54.383 54.383 53.931 0.452 17934 8229 1 12 . 1 1 74 74 LYS CB C 74 36.570 36.570 35.668 0.902 17934 8230 1 12 . 1 1 74 74 LYS H H 74 8.783 8.783 7.612 1.171 17934 8231 1 12 . 1 1 75 75 PHE N N 75 119.414 119.414 118.333 1.081 17934 8232 1 12 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.566 0.134 17934 8233 1 12 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.628 -2.708 17934 8234 1 12 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.151 -0.541 17934 8235 1 12 . 1 1 75 75 PHE H H 75 8.432 8.432 9.036 -0.604 17934 8236 1 12 . 1 1 76 76 ILE N N 76 121.430 121.430 122.019 -0.589 17934 8237 1 12 . 1 1 76 76 ILE HA H 76 4.840 4.840 5.008 -0.168 17934 8238 1 12 . 1 1 76 76 ILE C C 76 175.249 175.249 174.530 0.719 17934 8239 1 12 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.725 -0.655 17934 8240 1 12 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.851 -0.631 17934 8241 1 12 . 1 1 76 76 ILE H H 76 8.960 8.960 8.612 0.348 17934 8242 1 12 . 1 1 77 77 ASP N N 77 125.744 125.744 123.166 2.578 17934 8243 1 12 . 1 1 77 77 ASP HA H 77 4.563 4.563 5.082 -0.519 17934 8244 1 12 . 1 1 77 77 ASP C C 77 177.569 177.569 176.194 1.375 17934 8245 1 12 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.929 2.860 17934 8246 1 12 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.792 -0.191 17934 8247 1 12 . 1 1 77 77 ASP H H 77 8.750 8.750 8.893 -0.143 17934 8248 1 12 . 1 1 78 78 ALA N N 78 128.632 128.632 128.877 -0.245 17934 8249 1 12 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.193 -0.223 17934 8250 1 12 . 1 1 78 78 ALA C C 78 178.052 178.052 178.338 -0.286 17934 8251 1 12 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.635 0.195 17934 8252 1 12 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.806 -0.013 17934 8253 1 12 . 1 1 78 78 ALA H H 78 8.700 8.700 8.815 -0.115 17934 8254 1 12 . 1 1 79 79 THR N N 79 113.087 113.087 112.302 0.785 17934 8255 1 12 . 1 1 79 79 THR HA H 79 4.194 4.194 4.227 -0.033 17934 8256 1 12 . 1 1 79 79 THR C C 79 175.587 175.587 176.377 -0.790 17934 8257 1 12 . 1 1 79 79 THR CA C 79 64.695 64.695 64.124 0.571 17934 8258 1 12 . 1 1 79 79 THR CB C 79 69.382 69.382 69.476 -0.094 17934 8259 1 12 . 1 1 79 79 THR H H 79 8.779 8.779 8.076 0.703 17934 8260 1 12 . 1 1 80 80 ASN N N 80 118.434 118.434 117.876 0.558 17934 8261 1 12 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.720 0.017 17934 8262 1 12 . 1 1 80 80 ASN CA C 80 53.445 53.445 53.141 0.305 17934 8263 1 12 . 1 1 80 80 ASN CB C 80 39.383 39.383 38.363 1.020 17934 8264 1 12 . 1 1 80 80 ASN H H 80 8.584 8.584 8.123 0.461 17934 8265 1 12 . 1 1 81 81 LYS N N 81 112.429 112.429 116.286 -3.857 17934 8266 1 12 . 1 1 81 81 LYS C C 81 174.909 174.909 175.125 -0.216 17934 8267 1 12 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.698 -0.034 17934 8268 1 12 . 1 1 81 81 LYS CB C 81 28.602 28.602 30.641 -2.039 17934 8269 1 12 . 1 1 81 81 LYS H H 81 7.966 7.966 8.229 -0.263 17934 8270 1 12 . 1 1 82 82 ASN N N 82 116.806 116.806 115.526 1.280 17934 8271 1 12 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.812 -0.222 17934 8272 1 12 . 1 1 82 82 ASN C C 82 174.999 174.999 173.575 1.424 17934 8273 1 12 . 1 1 82 82 ASN CA C 82 52.976 52.976 51.825 1.151 17934 8274 1 12 . 1 1 82 82 ASN CB C 82 38.445 38.445 41.498 -3.053 17934 8275 1 12 . 1 1 82 82 ASN H H 82 8.455 8.455 7.649 0.806 17934 8276 1 12 . 1 1 83 83 ILE N N 83 122.447 122.447 120.514 1.933 17934 8277 1 12 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.328 -0.298 17934 8278 1 12 . 1 1 83 83 ILE C C 83 176.572 176.572 175.540 1.032 17934 8279 1 12 . 1 1 83 83 ILE CA C 83 62.350 62.350 60.458 1.892 17934 8280 1 12 . 1 1 83 83 ILE CB C 83 37.970 37.970 36.689 1.281 17934 8281 1 12 . 1 1 83 83 ILE H H 83 8.650 8.650 8.398 0.252 17934 8282 1 12 . 1 1 84 84 ILE N N 84 129.339 129.339 127.746 1.593 17934 8283 1 12 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.009 -0.089 17934 8284 1 12 . 1 1 84 84 ILE C C 84 175.873 175.873 175.910 -0.037 17934 8285 1 12 . 1 1 84 84 ILE CA C 84 62.810 62.810 64.238 -1.428 17934 8286 1 12 . 1 1 84 84 ILE CB C 84 38.840 38.840 38.973 -0.133 17934 8287 1 12 . 1 1 84 84 ILE H H 84 8.930 8.930 9.136 -0.206 17934 8288 1 12 . 1 1 85 85 ALA N N 85 118.867 118.867 116.520 2.347 17934 8289 1 12 . 1 1 85 85 ALA C C 85 174.100 174.100 174.659 -0.559 17934 8290 1 12 . 1 1 85 85 ALA CA C 85 51.570 51.570 51.808 -0.238 17934 8291 1 12 . 1 1 85 85 ALA H H 85 7.048 7.048 8.002 -0.954 17934 8292 1 12 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.959 0.195 17934 8293 1 12 . 1 1 87 87 HIS C C 87 174.986 174.986 173.823 1.163 17934 8294 1 12 . 1 1 87 87 HIS CB C 87 34.350 34.350 31.745 2.605 17934 8295 1 12 . 1 1 88 88 GLU N N 88 125.372 125.372 120.300 5.072 17934 8296 1 12 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.247 0.274 17934 8297 1 12 . 1 1 88 88 GLU C C 88 179.047 179.047 178.165 0.882 17934 8298 1 12 . 1 1 88 88 GLU CA C 88 56.726 56.726 57.126 -0.400 17934 8299 1 12 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.327 0.150 17934 8300 1 12 . 1 1 88 88 GLU H H 88 9.106 9.106 8.835 0.271 17934 8301 1 12 . 1 1 89 89 ILE N N 89 124.132 124.132 124.180 -0.048 17934 8302 1 12 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.841 0.178 17934 8303 1 12 . 1 1 89 89 ILE C C 89 176.095 176.095 177.646 -1.551 17934 8304 1 12 . 1 1 89 89 ILE CA C 89 62.351 62.351 64.764 -2.413 17934 8305 1 12 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.187 0.727 17934 8306 1 12 . 1 1 89 89 ILE H H 89 8.055 8.055 8.892 -0.837 17934 8307 1 12 . 1 1 90 90 ARG N N 90 116.949 116.949 116.404 0.545 17934 8308 1 12 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.103 0.235 17934 8309 1 12 . 1 1 90 90 ARG C C 90 176.578 176.578 176.381 0.197 17934 8310 1 12 . 1 1 90 90 ARG CA C 90 57.664 57.664 58.104 -0.440 17934 8311 1 12 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.224 -0.154 17934 8312 1 12 . 1 1 90 90 ARG H H 90 8.045 8.045 8.449 -0.404 17934 8313 1 12 . 1 1 91 91 ASN N N 91 116.320 116.320 116.813 -0.493 17934 8314 1 12 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.715 0.438 17934 8315 1 12 . 1 1 91 91 ASN C C 91 174.595 174.595 176.206 -1.611 17934 8316 1 12 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.812 -2.304 17934 8317 1 12 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.741 0.111 17934 8318 1 12 . 1 1 91 91 ASN H H 91 8.067 8.067 7.926 0.141 17934 8319 1 12 . 1 1 92 92 ILE N N 92 122.441 122.441 121.808 0.633 17934 8320 1 12 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.934 1.139 17934 8321 1 12 . 1 1 92 92 ILE C C 92 175.229 175.229 176.123 -0.894 17934 8322 1 12 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.859 -0.979 17934 8323 1 12 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.327 2.523 17934 8324 1 12 . 1 1 92 92 ILE H H 92 7.483 7.483 8.024 -0.541 17934 8325 1 12 . 1 1 93 93 SER N N 93 120.329 120.329 123.895 -3.566 17934 8326 1 12 . 1 1 93 93 SER HA H 93 4.684 4.684 4.314 0.370 17934 8327 1 12 . 1 1 93 93 SER C C 93 180.744 180.744 174.199 6.545 17934 8328 1 12 . 1 1 93 93 SER CA C 93 57.664 57.664 60.623 -2.959 17934 8329 1 12 . 1 1 93 93 SER CB C 93 66.570 66.570 64.159 2.411 17934 8330 1 12 . 1 1 93 93 SER H H 93 9.545 9.545 8.396 1.149 17934 8331 1 12 . 1 1 94 94 CYS N N 94 110.900 110.900 115.559 -4.659 17934 8332 1 12 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.458 -0.646 17934 8333 1 12 . 1 1 94 94 CYS C C 94 173.973 173.973 172.611 1.362 17934 8334 1 12 . 1 1 94 94 CYS CA C 94 59.539 59.539 57.722 1.817 17934 8335 1 12 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.612 -4.354 17934 8336 1 12 . 1 1 94 94 CYS H H 94 8.858 8.858 8.066 0.792 17934 8337 1 12 . 1 1 95 95 ALA N N 95 121.379 121.379 123.554 -2.175 17934 8338 1 12 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.627 -0.197 17934 8339 1 12 . 1 1 95 95 ALA C C 95 178.098 178.098 175.150 2.948 17934 8340 1 12 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.787 0.863 17934 8341 1 12 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.795 -2.495 17934 8342 1 12 . 1 1 95 95 ALA H H 95 8.360 8.360 8.335 0.025 17934 8343 1 12 . 1 1 96 96 ALA N N 96 122.576 122.576 122.949 -0.373 17934 8344 1 12 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.681 -0.001 17934 8345 1 12 . 1 1 96 96 ALA C C 96 175.716 175.716 174.637 1.079 17934 8346 1 12 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.801 0.639 17934 8347 1 12 . 1 1 96 96 ALA CB C 96 22.700 22.700 21.922 0.778 17934 8348 1 12 . 1 1 96 96 ALA H H 96 9.080 9.080 8.666 0.414 17934 8349 1 12 . 1 1 97 97 GLN N N 97 116.903 116.903 119.133 -2.230 17934 8350 1 12 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.591 0.339 17934 8351 1 12 . 1 1 97 97 GLN C C 97 175.270 175.270 174.247 1.023 17934 8352 1 12 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.978 0.873 17934 8353 1 12 . 1 1 97 97 GLN CB C 97 33.758 33.758 32.085 1.673 17934 8354 1 12 . 1 1 97 97 GLN H H 97 8.369 8.369 8.306 0.063 17934 8355 1 12 . 1 1 98 98 ASP N N 98 124.971 124.971 121.873 3.098 17934 8356 1 12 . 1 1 98 98 ASP C C 98 175.217 175.217 176.145 -0.928 17934 8357 1 12 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.175 -0.136 17934 8358 1 12 . 1 1 98 98 ASP CB C 98 42.195 42.195 42.654 -0.459 17934 8359 1 12 . 1 1 98 98 ASP H H 98 8.395 8.395 8.309 0.086 17934 8360 1 12 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.413 -0.179 17934 8361 1 12 . 1 1 99 99 PRO C C 99 178.433 178.433 177.720 0.713 17934 8362 1 12 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.777 -0.082 17934 8363 1 12 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.098 0.254 17934 8364 1 12 . 1 1 100 100 GLU N N 100 116.223 116.223 119.128 -2.905 17934 8365 1 12 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.099 0.121 17934 8366 1 12 . 1 1 100 100 GLU C C 100 176.678 176.678 176.078 0.600 17934 8367 1 12 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.600 -1.874 17934 8368 1 12 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.840 2.105 17934 8369 1 12 . 1 1 100 100 GLU H H 100 8.643 8.643 8.781 -0.138 17934 8370 1 12 . 1 1 101 101 ASP N N 101 119.053 119.053 118.902 0.151 17934 8371 1 12 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.859 -0.316 17934 8372 1 12 . 1 1 101 101 ASP C C 101 174.771 174.771 176.895 -2.124 17934 8373 1 12 . 1 1 101 101 ASP CA C 101 53.914 53.914 52.238 1.676 17934 8374 1 12 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.923 -0.134 17934 8375 1 12 . 1 1 101 101 ASP H H 101 7.597 7.597 7.837 -0.240 17934 8376 1 12 . 1 1 102 102 LEU N N 102 123.986 123.986 119.532 4.454 17934 8377 1 12 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.377 0.013 17934 8378 1 12 . 1 1 102 102 LEU C C 102 177.141 177.141 176.948 0.193 17934 8379 1 12 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.721 -0.061 17934 8380 1 12 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.020 1.639 17934 8381 1 12 . 1 1 102 102 LEU H H 102 8.534 8.534 7.498 1.036 17934 8382 1 12 . 1 1 103 103 SER N N 103 112.339 112.339 112.575 -0.236 17934 8383 1 12 . 1 1 103 103 SER HA H 103 4.290 4.290 4.238 0.052 17934 8384 1 12 . 1 1 103 103 SER C C 103 174.106 174.106 174.752 -0.646 17934 8385 1 12 . 1 1 103 103 SER CA C 103 60.945 60.945 60.843 0.102 17934 8386 1 12 . 1 1 103 103 SER CB C 103 63.757 63.757 63.328 0.429 17934 8387 1 12 . 1 1 103 103 SER H H 103 7.867 7.867 8.129 -0.262 17934 8388 1 12 . 1 1 104 104 THR N N 104 123.070 123.070 119.456 3.614 17934 8389 1 12 . 1 1 104 104 THR HA H 104 5.373 5.373 4.626 0.747 17934 8390 1 12 . 1 1 104 104 THR C C 104 180.693 180.693 172.670 8.023 17934 8391 1 12 . 1 1 104 104 THR CA C 104 63.289 63.289 62.391 0.899 17934 8392 1 12 . 1 1 104 104 THR CB C 104 69.382 69.382 70.637 -1.255 17934 8393 1 12 . 1 1 104 104 THR H H 104 8.830 8.830 7.914 0.916 17934 8394 1 12 . 1 1 105 105 PHE N N 105 122.582 122.582 123.087 -0.505 17934 8395 1 12 . 1 1 105 105 PHE HA H 105 5.470 5.470 5.051 0.419 17934 8396 1 12 . 1 1 105 105 PHE C C 105 179.211 179.211 172.945 6.266 17934 8397 1 12 . 1 1 105 105 PHE CA C 105 55.320 55.320 54.718 0.602 17934 8398 1 12 . 1 1 105 105 PHE CB C 105 41.790 41.790 40.920 0.870 17934 8399 1 12 . 1 1 105 105 PHE H H 105 9.170 9.170 8.114 1.056 17934 8400 1 12 . 1 1 106 106 ALA N N 106 119.567 119.567 124.895 -5.328 17934 8401 1 12 . 1 1 106 106 ALA C C 106 175.603 175.603 175.551 0.052 17934 8402 1 12 . 1 1 106 106 ALA H H 106 8.770 8.770 9.078 -0.308 17934 8403 1 12 . 1 1 107 107 TYR N N 107 109.933 109.933 120.249 -10.316 17934 8404 1 12 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.016 -0.096 17934 8405 1 12 . 1 1 107 107 TYR C C 107 180.426 180.426 172.752 7.674 17934 8406 1 12 . 1 1 107 107 TYR CA C 107 57.080 57.080 55.133 1.947 17934 8407 1 12 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.048 -0.259 17934 8408 1 12 . 1 1 107 107 TYR H H 107 7.950 7.950 8.828 -0.878 17934 8409 1 12 . 1 1 108 108 ILE N N 108 120.613 120.613 122.456 -1.843 17934 8410 1 12 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.744 0.626 17934 8411 1 12 . 1 1 108 108 ILE C C 108 176.212 176.212 175.909 0.303 17934 8412 1 12 . 1 1 108 108 ILE CA C 108 59.540 59.540 60.937 -1.397 17934 8413 1 12 . 1 1 108 108 ILE CB C 108 39.380 39.380 39.407 -0.027 17934 8414 1 12 . 1 1 108 108 ILE H H 108 8.869 8.869 8.531 0.338 17934 8415 1 12 . 1 1 109 109 THR N N 109 116.505 116.505 119.598 -3.093 17934 8416 1 12 . 1 1 109 109 THR HA H 109 5.669 5.669 4.640 1.029 17934 8417 1 12 . 1 1 109 109 THR C C 109 173.505 173.505 173.398 0.107 17934 8418 1 12 . 1 1 109 109 THR CA C 109 59.070 59.070 60.120 -1.050 17934 8419 1 12 . 1 1 109 109 THR H H 109 9.489 9.489 8.323 1.166 17934 8420 1 12 . 1 1 110 110 LYS N N 110 122.960 122.960 120.967 1.993 17934 8421 1 12 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.287 0.173 17934 8422 1 12 . 1 1 110 110 LYS C C 110 175.937 175.937 176.629 -0.692 17934 8423 1 12 . 1 1 110 110 LYS CA C 110 55.789 55.789 56.498 -0.709 17934 8424 1 12 . 1 1 110 110 LYS CB C 110 34.227 34.227 33.145 1.082 17934 8425 1 12 . 1 1 110 110 LYS H H 110 7.831 7.831 8.257 -0.426 17934 8426 1 12 . 1 1 111 111 ASP N N 111 127.409 127.409 120.889 6.520 17934 8427 1 12 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.663 0.118 17934 8428 1 12 . 1 1 111 111 ASP C C 111 176.396 176.396 177.613 -1.217 17934 8429 1 12 . 1 1 111 111 ASP CA C 111 53.914 53.914 51.915 1.999 17934 8430 1 12 . 1 1 111 111 ASP CB C 111 43.133 43.133 41.808 1.325 17934 8431 1 12 . 1 1 111 111 ASP H H 111 8.769 8.769 8.031 0.738 17934 8432 1 12 . 1 1 112 112 LEU N N 112 125.913 125.913 120.182 5.731 17934 8433 1 12 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.039 0.111 17934 8434 1 12 . 1 1 112 112 LEU C C 112 178.553 178.553 177.670 0.883 17934 8435 1 12 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.485 -0.295 17934 8436 1 12 . 1 1 112 112 LEU CB C 112 41.790 41.790 41.809 -0.019 17934 8437 1 12 . 1 1 112 112 LEU H H 112 8.593 8.593 8.793 -0.200 17934 8438 1 12 . 1 1 113 113 LYS N N 113 117.189 117.189 115.711 1.478 17934 8439 1 12 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.290 -0.028 17934 8440 1 12 . 1 1 113 113 LYS C C 113 177.180 177.180 176.148 1.032 17934 8441 1 12 . 1 1 113 113 LYS CA C 113 58.133 58.133 55.643 2.490 17934 8442 1 12 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.125 0.695 17934 8443 1 12 . 1 1 113 113 LYS H H 113 8.207 8.207 7.851 0.356 17934 8444 1 12 . 1 1 114 114 SER N N 114 112.492 112.492 112.792 -0.300 17934 8445 1 12 . 1 1 114 114 SER CA C 114 58.601 58.601 58.979 -0.378 17934 8446 1 12 . 1 1 114 114 SER CB C 114 65.164 65.164 61.142 4.022 17934 8447 1 12 . 1 1 114 114 SER H H 114 7.755 7.755 8.266 -0.511 17934 8448 1 12 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.680 -0.291 17934 8449 1 12 . 1 1 115 115 ASN C C 115 174.203 174.203 174.770 -0.567 17934 8450 1 12 . 1 1 115 115 ASN CA C 115 54.383 54.383 53.908 0.475 17934 8451 1 12 . 1 1 115 115 ASN CB C 115 37.977 37.977 40.314 -2.337 17934 8452 1 12 . 1 1 116 116 HIS N N 116 116.822 116.822 115.021 1.801 17934 8453 1 12 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.673 0.257 17934 8454 1 12 . 1 1 116 116 HIS C C 116 173.898 173.898 173.312 0.586 17934 8455 1 12 . 1 1 116 116 HIS CA C 116 54.910 54.910 55.342 -0.432 17934 8456 1 12 . 1 1 116 116 HIS CB C 116 32.650 32.650 32.730 -0.080 17934 8457 1 12 . 1 1 116 116 HIS H H 116 7.690 7.690 7.780 -0.090 17934 8458 1 12 . 1 1 117 117 HIS N N 117 118.253 118.253 117.152 1.101 17934 8459 1 12 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.814 0.506 17934 8460 1 12 . 1 1 117 117 HIS C C 117 173.695 173.695 174.450 -0.755 17934 8461 1 12 . 1 1 117 117 HIS CA C 117 56.350 56.350 55.762 0.588 17934 8462 1 12 . 1 1 117 117 HIS CB C 117 32.350 32.350 30.085 2.265 17934 8463 1 12 . 1 1 117 117 HIS H H 117 8.340 8.340 8.787 -0.447 17934 8464 1 12 . 1 1 118 118 TYR N N 118 118.301 118.301 122.274 -3.973 17934 8465 1 12 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.983 0.027 17934 8466 1 12 . 1 1 118 118 TYR C C 118 173.530 173.530 174.768 -1.238 17934 8467 1 12 . 1 1 118 118 TYR CA C 118 56.730 56.730 57.416 -0.686 17934 8468 1 12 . 1 1 118 118 TYR CB C 118 43.240 43.240 41.811 1.429 17934 8469 1 12 . 1 1 118 118 TYR H H 118 9.080 9.080 8.651 0.429 17934 8470 1 12 . 1 1 119 119 CYS N N 119 121.015 121.015 123.360 -2.345 17934 8471 1 12 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.456 0.607 17934 8472 1 12 . 1 1 119 119 CYS C C 119 180.664 180.664 174.054 6.610 17934 8473 1 12 . 1 1 119 119 CYS CA C 119 56.726 56.726 59.271 -2.545 17934 8474 1 12 . 1 1 119 119 CYS CB C 119 29.539 29.539 27.509 2.030 17934 8475 1 12 . 1 1 119 119 CYS H H 119 9.120 9.120 9.071 0.049 17934 8476 1 12 . 1 1 120 120 HIS N N 120 110.134 110.134 126.091 -15.957 17934 8477 1 12 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.795 -0.096 17934 8478 1 12 . 1 1 120 120 HIS C C 120 180.776 180.776 173.761 7.015 17934 8479 1 12 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.765 0.555 17934 8480 1 12 . 1 1 120 120 HIS CB C 120 32.352 32.352 30.985 1.367 17934 8481 1 12 . 1 1 120 120 HIS H H 120 8.482 8.482 8.846 -0.364 17934 8482 1 12 . 1 1 121 121 VAL N N 121 120.855 120.855 124.131 -3.276 17934 8483 1 12 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.647 -0.297 17934 8484 1 12 . 1 1 121 121 VAL C C 121 173.419 173.419 173.131 0.288 17934 8485 1 12 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.153 1.257 17934 8486 1 12 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.802 -0.522 17934 8487 1 12 . 1 1 121 121 VAL H H 121 7.929 7.929 8.842 -0.913 17934 8488 1 12 . 1 1 122 122 PHE N N 122 124.384 124.384 128.189 -3.805 17934 8489 1 12 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.069 0.351 17934 8490 1 12 . 1 1 122 122 PHE C C 122 174.876 174.876 174.153 0.723 17934 8491 1 12 . 1 1 122 122 PHE CA C 122 55.320 55.320 55.765 -0.445 17934 8492 1 12 . 1 1 122 122 PHE CB C 122 44.540 44.540 43.496 1.044 17934 8493 1 12 . 1 1 122 122 PHE H H 122 8.910 8.910 9.352 -0.442 17934 8494 1 12 . 1 1 123 123 THR N N 123 112.451 112.451 113.177 -0.726 17934 8495 1 12 . 1 1 123 123 THR HA H 123 5.147 5.147 4.539 0.608 17934 8496 1 12 . 1 1 123 123 THR C C 123 174.096 174.096 173.319 0.777 17934 8497 1 12 . 1 1 123 123 THR CA C 123 61.843 61.843 59.681 2.162 17934 8498 1 12 . 1 1 123 123 THR CB C 123 71.218 71.218 70.404 0.814 17934 8499 1 12 . 1 1 123 123 THR H H 123 8.668 8.668 8.670 -0.002 17934 8500 1 12 . 1 1 124 124 ALA N N 124 128.922 128.922 126.121 2.801 17934 8501 1 12 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.575 0.145 17934 8502 1 12 . 1 1 124 124 ALA C C 124 177.168 177.168 176.714 0.454 17934 8503 1 12 . 1 1 124 124 ALA CA C 124 50.890 50.890 50.525 0.365 17934 8504 1 12 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.351 -0.251 17934 8505 1 12 . 1 1 124 124 ALA H H 124 9.180 9.180 8.253 0.927 17934 8506 1 12 . 1 1 125 125 PHE N N 125 115.427 115.427 119.456 -4.029 17934 8507 1 12 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.351 -0.061 17934 8508 1 12 . 1 1 125 125 PHE C C 125 174.703 174.703 175.866 -1.163 17934 8509 1 12 . 1 1 125 125 PHE CA C 125 60.470 60.470 58.152 2.318 17934 8510 1 12 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.203 -1.143 17934 8511 1 12 . 1 1 125 125 PHE H H 125 8.560 8.560 8.461 0.099 17934 8512 1 12 . 1 1 126 126 ASP N N 126 115.745 115.745 118.702 -2.957 17934 8513 1 12 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.939 -0.096 17934 8514 1 12 . 1 1 126 126 ASP C C 126 176.532 176.532 176.286 0.246 17934 8515 1 12 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.423 0.022 17934 8516 1 12 . 1 1 126 126 ASP CB C 126 44.070 44.070 43.966 0.104 17934 8517 1 12 . 1 1 126 126 ASP H H 126 7.417 7.417 7.683 -0.266 17934 8518 1 12 . 1 1 127 127 VAL N N 127 121.923 121.923 125.644 -3.721 17934 8519 1 12 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.638 -0.048 17934 8520 1 12 . 1 1 127 127 VAL C C 127 176.863 176.863 177.309 -0.446 17934 8521 1 12 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.755 -1.125 17934 8522 1 12 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.090 -0.260 17934 8523 1 12 . 1 1 127 127 VAL H H 127 8.508 8.508 8.697 -0.189 17934 8524 1 12 . 1 1 128 128 ASN N N 128 118.851 118.851 118.300 0.551 17934 8525 1 12 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.487 -0.011 17934 8526 1 12 . 1 1 128 128 ASN C C 128 178.251 178.251 177.605 0.646 17934 8527 1 12 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.065 0.193 17934 8528 1 12 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.086 -0.109 17934 8529 1 12 . 1 1 128 128 ASN H H 128 8.207 8.207 8.384 -0.177 17934 8530 1 12 . 1 1 129 129 LEU N N 129 122.549 122.549 119.800 2.749 17934 8531 1 12 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.847 0.363 17934 8532 1 12 . 1 1 129 129 LEU C C 129 178.003 178.003 178.205 -0.202 17934 8533 1 12 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.727 -0.537 17934 8534 1 12 . 1 1 129 129 LEU CB C 129 41.790 41.790 40.950 0.840 17934 8535 1 12 . 1 1 129 129 LEU H H 129 8.223 8.223 8.008 0.215 17934 8536 1 12 . 1 1 130 130 ALA N N 130 120.036 120.036 121.762 -1.726 17934 8537 1 12 . 1 1 130 130 ALA HA H 130 3.310 3.310 4.025 -0.715 17934 8538 1 12 . 1 1 130 130 ALA C C 130 178.172 178.172 179.181 -1.009 17934 8539 1 12 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.411 0.369 17934 8540 1 12 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.346 0.724 17934 8541 1 12 . 1 1 130 130 ALA H H 130 7.360 7.360 8.432 -1.072 17934 8542 1 12 . 1 1 131 131 ALA N N 131 116.989 116.989 119.087 -2.098 17934 8543 1 12 . 1 1 131 131 ALA HA H 131 3.710 3.710 4.302 -0.592 17934 8544 1 12 . 1 1 131 131 ALA C C 131 180.163 180.163 179.624 0.539 17934 8545 1 12 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.384 1.396 17934 8546 1 12 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.479 -0.648 17934 8547 1 12 . 1 1 131 131 ALA H H 131 7.360 7.360 8.266 -0.906 17934 8548 1 12 . 1 1 132 132 GLU N N 132 119.462 119.462 119.834 -0.372 17934 8549 1 12 . 1 1 132 132 GLU HA H 132 3.888 3.888 4.035 -0.147 17934 8550 1 12 . 1 1 132 132 GLU C C 132 179.243 179.243 178.453 0.790 17934 8551 1 12 . 1 1 132 132 GLU CA C 132 59.539 59.539 59.040 0.499 17934 8552 1 12 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.461 0.078 17934 8553 1 12 . 1 1 132 132 GLU H H 132 7.673 7.673 7.880 -0.207 17934 8554 1 12 . 1 1 133 133 ILE N N 133 123.218 123.218 120.901 2.317 17934 8555 1 12 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.335 -0.555 17934 8556 1 12 . 1 1 133 133 ILE C C 133 177.421 177.421 177.912 -0.491 17934 8557 1 12 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.191 1.299 17934 8558 1 12 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.255 -0.605 17934 8559 1 12 . 1 1 133 133 ILE H H 133 8.154 8.154 7.905 0.249 17934 8560 1 12 . 1 1 134 134 ILE N N 134 118.244 118.244 119.756 -1.512 17934 8561 1 12 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.507 0.033 17934 8562 1 12 . 1 1 134 134 ILE C C 134 179.385 179.385 177.555 1.830 17934 8563 1 12 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.085 -0.805 17934 8564 1 12 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.886 -0.786 17934 8565 1 12 . 1 1 134 134 ILE H H 134 7.376 7.376 8.042 -0.666 17934 8566 1 12 . 1 1 135 135 LEU N N 135 123.061 123.061 121.131 1.930 17934 8567 1 12 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.794 0.396 17934 8568 1 12 . 1 1 135 135 LEU C C 135 179.858 179.858 178.755 1.103 17934 8569 1 12 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.701 -0.511 17934 8570 1 12 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.866 -0.006 17934 8571 1 12 . 1 1 135 135 LEU H H 135 8.036 8.036 7.985 0.051 17934 8572 1 12 . 1 1 136 136 THR N N 136 119.647 119.647 115.499 4.148 17934 8573 1 12 . 1 1 136 136 THR HA H 136 3.725 3.725 3.888 -0.163 17934 8574 1 12 . 1 1 136 136 THR C C 136 176.088 176.088 176.487 -0.399 17934 8575 1 12 . 1 1 136 136 THR CA C 136 58.601 58.601 66.986 -8.385 17934 8576 1 12 . 1 1 136 136 THR CB C 136 67.976 67.976 68.919 -0.943 17934 8577 1 12 . 1 1 136 136 THR H H 136 8.508 8.508 8.287 0.221 17934 8578 1 12 . 1 1 137 137 LEU N N 137 123.182 123.182 121.841 1.341 17934 8579 1 12 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.744 -0.004 17934 8580 1 12 . 1 1 137 137 LEU C C 137 178.341 178.341 178.991 -0.650 17934 8581 1 12 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.023 0.237 17934 8582 1 12 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.493 0.057 17934 8583 1 12 . 1 1 137 137 LEU H H 137 8.520 8.520 8.266 0.254 17934 8584 1 12 . 1 1 138 138 GLY N N 138 105.266 105.266 105.518 -0.252 17934 8585 1 12 . 1 1 138 138 GLY C C 138 176.973 176.973 176.134 0.839 17934 8586 1 12 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.205 0.147 17934 8587 1 12 . 1 1 138 138 GLY H H 138 7.858 7.858 8.141 -0.283 17934 8588 1 12 . 1 1 139 139 GLN N N 139 123.485 123.485 122.341 1.144 17934 8589 1 12 . 1 1 139 139 GLN C C 139 177.891 177.891 178.446 -0.555 17934 8590 1 12 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.684 -0.083 17934 8591 1 12 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.262 -0.129 17934 8592 1 12 . 1 1 139 139 GLN H H 139 8.195 8.195 8.554 -0.359 17934 8593 1 12 . 1 1 140 140 ALA N N 140 122.754 122.754 120.805 1.949 17934 8594 1 12 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.236 -0.527 17934 8595 1 12 . 1 1 140 140 ALA C C 140 178.987 178.987 179.355 -0.368 17934 8596 1 12 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.512 1.268 17934 8597 1 12 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.217 -0.807 17934 8598 1 12 . 1 1 140 140 ALA H H 140 8.530 8.530 8.436 0.094 17934 8599 1 12 . 1 1 141 141 PHE N N 141 116.275 116.275 119.725 -3.450 17934 8600 1 12 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.362 -0.272 17934 8601 1 12 . 1 1 141 141 PHE C C 141 178.129 178.129 177.224 0.905 17934 8602 1 12 . 1 1 141 141 PHE CA C 141 61.240 61.240 61.010 0.230 17934 8603 1 12 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.333 0.050 17934 8604 1 12 . 1 1 141 141 PHE H H 141 7.920 7.920 8.019 -0.099 17934 8605 1 12 . 1 1 142 142 GLU N N 142 119.967 119.967 120.163 -0.196 17934 8606 1 12 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.907 0.320 17934 8607 1 12 . 1 1 142 142 GLU C C 142 179.250 179.250 178.815 0.435 17934 8608 1 12 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.912 0.627 17934 8609 1 12 . 1 1 142 142 GLU CB C 142 29.539 29.539 30.496 -0.957 17934 8610 1 12 . 1 1 142 142 GLU H H 142 7.713 7.713 8.520 -0.807 17934 8611 1 12 . 1 1 143 143 VAL N N 143 120.189 120.189 120.598 -0.409 17934 8612 1 12 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.745 -0.062 17934 8613 1 12 . 1 1 143 143 VAL C C 143 178.066 178.066 177.291 0.775 17934 8614 1 12 . 1 1 143 143 VAL CA C 143 66.570 66.570 65.148 1.422 17934 8615 1 12 . 1 1 143 143 VAL CB C 143 31.883 31.883 31.202 0.681 17934 8616 1 12 . 1 1 143 143 VAL H H 143 8.608 8.608 8.048 0.560 17934 8617 1 12 . 1 1 144 144 ALA N N 144 121.753 121.753 123.346 -1.593 17934 8618 1 12 . 1 1 144 144 ALA HA H 144 4.000 4.000 3.973 0.027 17934 8619 1 12 . 1 1 144 144 ALA C C 144 180.776 180.776 179.504 1.272 17934 8620 1 12 . 1 1 144 144 ALA CA C 144 55.780 55.780 54.715 1.065 17934 8621 1 12 . 1 1 144 144 ALA CB C 144 18.770 18.770 18.277 0.493 17934 8622 1 12 . 1 1 144 144 ALA H H 144 8.399 8.399 7.534 0.865 17934 8623 1 12 . 1 1 145 145 TYR N N 145 119.962 119.962 118.783 1.179 17934 8624 1 12 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.127 0.063 17934 8625 1 12 . 1 1 145 145 TYR C C 145 177.645 177.645 177.428 0.217 17934 8626 1 12 . 1 1 145 145 TYR CA C 145 60.880 60.880 61.206 -0.326 17934 8627 1 12 . 1 1 145 145 TYR CB C 145 37.980 37.980 38.141 -0.161 17934 8628 1 12 . 1 1 145 145 TYR H H 145 8.190 8.190 8.189 0.001 17934 8629 1 13 . 1 1 13 13 LYS N N 13 120.778 120.778 122.518 -1.740 17934 8630 1 13 . 1 1 13 13 LYS C C 13 176.476 176.476 175.186 1.290 17934 8631 1 13 . 1 1 13 13 LYS CA C 13 58.601 58.601 55.589 3.012 17934 8632 1 13 . 1 1 13 13 LYS CB C 13 32.820 32.820 33.924 -1.104 17934 8633 1 13 . 1 1 13 13 LYS H H 13 7.984 7.984 8.173 -0.189 17934 8634 1 13 . 1 1 15 15 ILE HA H 15 3.820 3.820 3.812 0.008 17934 8635 1 13 . 1 1 15 15 ILE C C 15 176.376 176.376 175.683 0.693 17934 8636 1 13 . 1 1 15 15 ILE CA C 15 63.570 63.570 62.907 0.663 17934 8637 1 13 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.887 1.493 17934 8638 1 13 . 1 1 16 16 ALA N N 16 121.364 121.364 121.018 0.346 17934 8639 1 13 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.285 0.153 17934 8640 1 13 . 1 1 16 16 ALA C C 16 177.494 177.494 176.241 1.253 17934 8641 1 13 . 1 1 16 16 ALA CA C 16 52.976 52.976 51.135 1.841 17934 8642 1 13 . 1 1 16 16 ALA CB C 16 20.333 20.333 18.562 1.771 17934 8643 1 13 . 1 1 16 16 ALA H H 16 8.081 8.081 7.779 0.302 17934 8644 1 13 . 1 1 17 17 GLN N N 17 118.109 118.109 112.512 5.597 17934 8645 1 13 . 1 1 17 17 GLN HA H 17 4.573 4.573 3.820 0.753 17934 8646 1 13 . 1 1 17 17 GLN C C 17 173.632 173.632 174.082 -0.450 17934 8647 1 13 . 1 1 17 17 GLN CA C 17 54.851 54.851 56.245 -1.394 17934 8648 1 13 . 1 1 17 17 GLN CB C 17 30.477 30.477 25.350 5.127 17934 8649 1 13 . 1 1 17 17 GLN H H 17 7.550 7.550 8.175 -0.625 17934 8650 1 13 . 1 1 18 18 SER N N 18 112.384 112.384 114.363 -1.979 17934 8651 1 13 . 1 1 18 18 SER HA H 18 4.388 4.388 5.070 -0.682 17934 8652 1 13 . 1 1 18 18 SER C C 18 173.780 173.780 174.360 -0.580 17934 8653 1 13 . 1 1 18 18 SER CA C 18 57.664 57.664 56.616 1.048 17934 8654 1 13 . 1 1 18 18 SER CB C 18 65.164 65.164 65.910 -0.746 17934 8655 1 13 . 1 1 18 18 SER H H 18 7.666 7.666 7.694 -0.028 17934 8656 1 13 . 1 1 19 19 CYS N N 19 120.116 120.116 126.127 -6.011 17934 8657 1 13 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.723 -0.393 17934 8658 1 13 . 1 1 19 19 CYS C C 19 180.387 180.387 174.044 6.343 17934 8659 1 13 . 1 1 19 19 CYS CA C 19 58.601 58.601 57.439 1.162 17934 8660 1 13 . 1 1 19 19 CYS CB C 19 30.008 30.008 27.894 2.114 17934 8661 1 13 . 1 1 19 19 CYS H H 19 8.835 8.835 8.801 0.034 17934 8662 1 13 . 1 1 20 20 ASP N N 20 124.416 124.416 126.544 -2.128 17934 8663 1 13 . 1 1 20 20 ASP CA C 20 52.976 52.976 54.221 -1.245 17934 8664 1 13 . 1 1 20 20 ASP CB C 20 42.195 42.195 42.820 -0.625 17934 8665 1 13 . 1 1 20 20 ASP H H 20 7.847 7.847 8.866 -1.019 17934 8666 1 13 . 1 1 21 21 TYR N N 21 121.296 121.296 122.651 -1.355 17934 8667 1 13 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.746 -0.016 17934 8668 1 13 . 1 1 21 21 TYR C C 21 175.793 175.793 174.591 1.202 17934 8669 1 13 . 1 1 21 21 TYR CA C 21 57.200 57.200 55.757 1.443 17934 8670 1 13 . 1 1 21 21 TYR CB C 21 43.240 43.240 43.179 0.061 17934 8671 1 13 . 1 1 21 21 TYR H H 21 9.070 9.070 8.873 0.197 17934 8672 1 13 . 1 1 22 22 LYS N N 22 122.820 122.820 121.393 1.427 17934 8673 1 13 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.249 -0.057 17934 8674 1 13 . 1 1 22 22 LYS C C 22 175.793 175.793 175.059 0.734 17934 8675 1 13 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.488 0.770 17934 8676 1 13 . 1 1 22 22 LYS CB C 22 33.758 33.758 33.640 0.118 17934 8677 1 13 . 1 1 22 22 LYS H H 22 8.711 8.711 8.561 0.150 17934 8678 1 13 . 1 1 23 23 ALA N N 23 123.073 123.073 127.195 -4.122 17934 8679 1 13 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.348 0.382 17934 8680 1 13 . 1 1 23 23 ALA C C 23 174.515 174.515 175.784 -1.269 17934 8681 1 13 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.163 1.407 17934 8682 1 13 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.486 -0.858 17934 8683 1 13 . 1 1 23 23 ALA H H 23 8.727 8.727 8.851 -0.124 17934 8684 1 13 . 1 1 24 24 ALA N N 24 122.486 122.486 127.452 -4.966 17934 8685 1 13 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.731 0.450 17934 8686 1 13 . 1 1 24 24 ALA C C 24 176.835 176.835 176.239 0.596 17934 8687 1 13 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.807 -0.237 17934 8688 1 13 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.095 0.025 17934 8689 1 13 . 1 1 24 24 ALA H H 24 8.675 8.675 8.930 -0.255 17934 8690 1 13 . 1 1 25 25 TYR N N 25 122.698 122.698 125.694 -2.996 17934 8691 1 13 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.404 0.606 17934 8692 1 13 . 1 1 25 25 TYR CA C 25 54.340 54.340 55.589 -1.249 17934 8693 1 13 . 1 1 25 25 TYR CB C 25 39.850 39.850 37.791 2.059 17934 8694 1 13 . 1 1 25 25 TYR H H 25 8.270 8.270 8.386 -0.116 17934 8695 1 13 . 1 1 26 26 LEU N N 26 127.997 127.997 129.227 -1.230 17934 8696 1 13 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.110 -0.190 17934 8697 1 13 . 1 1 26 26 LEU C C 26 175.983 175.983 176.738 -0.755 17934 8698 1 13 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.967 -0.241 17934 8699 1 13 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.080 -2.010 17934 8700 1 13 . 1 1 26 26 LEU H H 26 8.700 8.700 8.303 0.397 17934 8701 1 13 . 1 1 27 27 GLY N N 27 102.901 102.901 101.131 1.770 17934 8702 1 13 . 1 1 27 27 GLY C C 27 176.219 176.219 171.776 4.443 17934 8703 1 13 . 1 1 27 27 GLY CA C 27 43.601 43.601 44.881 -1.280 17934 8704 1 13 . 1 1 27 27 GLY H H 27 5.891 5.891 8.209 -2.318 17934 8705 1 13 . 1 1 28 28 SER N N 28 111.551 111.551 114.480 -2.929 17934 8706 1 13 . 1 1 28 28 SER HA H 28 5.785 5.785 5.389 0.396 17934 8707 1 13 . 1 1 28 28 SER CA C 28 56.258 56.258 57.630 -1.372 17934 8708 1 13 . 1 1 28 28 SER CB C 28 65.632 65.632 65.028 0.604 17934 8709 1 13 . 1 1 28 28 SER H H 28 7.981 7.981 8.315 -0.334 17934 8710 1 13 . 1 1 29 29 MET N N 29 119.493 119.493 124.815 -5.322 17934 8711 1 13 . 1 1 29 29 MET HA H 29 4.725 4.725 4.848 -0.123 17934 8712 1 13 . 1 1 29 29 MET C C 29 174.143 174.143 174.369 -0.226 17934 8713 1 13 . 1 1 29 29 MET CA C 29 54.036 54.036 54.099 -0.063 17934 8714 1 13 . 1 1 29 29 MET CB C 29 37.268 37.268 36.501 0.767 17934 8715 1 13 . 1 1 29 29 MET H H 29 8.704 8.704 9.024 -0.320 17934 8716 1 13 . 1 1 30 30 LEU N N 30 128.150 128.150 124.150 4.000 17934 8717 1 13 . 1 1 30 30 LEU HA H 30 3.785 3.785 4.406 -0.621 17934 8718 1 13 . 1 1 30 30 LEU C C 30 175.857 175.857 175.456 0.401 17934 8719 1 13 . 1 1 30 30 LEU CA C 30 56.250 56.250 54.057 2.193 17934 8720 1 13 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.793 0.867 17934 8721 1 13 . 1 1 30 30 LEU H H 30 8.630 8.630 8.482 0.148 17934 8722 1 13 . 1 1 31 31 ILE N N 31 127.723 127.723 126.981 0.742 17934 8723 1 13 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.156 0.034 17934 8724 1 13 . 1 1 31 31 ILE C C 31 174.881 174.881 174.766 0.115 17934 8725 1 13 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.279 -1.619 17934 8726 1 13 . 1 1 31 31 ILE CB C 31 37.110 37.110 35.629 1.481 17934 8727 1 13 . 1 1 31 31 ILE H H 31 8.560 8.560 8.425 0.135 17934 8728 1 13 . 1 1 32 32 LYS HA H 32 4.055 4.055 3.973 0.082 17934 8729 1 13 . 1 1 32 32 LYS C C 32 176.272 176.272 176.991 -0.719 17934 8730 1 13 . 1 1 32 32 LYS CA C 32 58.601 58.601 58.727 -0.126 17934 8731 1 13 . 1 1 32 32 LYS CB C 32 32.820 32.820 33.041 -0.222 17934 8732 1 13 . 1 1 33 33 GLU N N 33 118.638 118.638 120.171 -1.533 17934 8733 1 13 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.264 0.124 17934 8734 1 13 . 1 1 33 33 GLU C C 33 173.962 173.962 175.300 -1.338 17934 8735 1 13 . 1 1 33 33 GLU CA C 33 54.851 54.851 55.685 -0.834 17934 8736 1 13 . 1 1 33 33 GLU CB C 33 30.945 30.945 29.287 1.658 17934 8737 1 13 . 1 1 33 33 GLU H H 33 7.723 7.723 8.238 -0.515 17934 8738 1 13 . 1 1 34 34 LEU N N 34 126.535 126.535 125.033 1.502 17934 8739 1 13 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.302 -0.357 17934 8740 1 13 . 1 1 34 34 LEU C C 34 176.870 176.870 176.851 0.019 17934 8741 1 13 . 1 1 34 34 LEU CA C 34 54.850 54.850 54.338 0.512 17934 8742 1 13 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.226 -0.506 17934 8743 1 13 . 1 1 34 34 LEU H H 34 8.446 8.446 8.360 0.086 17934 8744 1 13 . 1 1 35 35 ARG N N 35 128.447 128.447 124.327 4.120 17934 8745 1 13 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.476 0.079 17934 8746 1 13 . 1 1 35 35 ARG C C 35 176.110 176.110 175.859 0.251 17934 8747 1 13 . 1 1 35 35 ARG CA C 35 54.851 54.851 54.560 0.291 17934 8748 1 13 . 1 1 35 35 ARG CB C 35 30.477 30.477 30.171 0.306 17934 8749 1 13 . 1 1 35 35 ARG H H 35 8.680 8.680 8.605 0.075 17934 8750 1 13 . 1 1 36 36 GLY N N 36 107.406 107.406 113.522 -6.116 17934 8751 1 13 . 1 1 36 36 GLY CA C 36 45.906 45.906 45.034 0.872 17934 8752 1 13 . 1 1 36 36 GLY H H 36 7.182 7.182 8.299 -1.117 17934 8753 1 13 . 1 1 37 37 THR HA H 37 4.060 4.060 3.969 0.091 17934 8754 1 13 . 1 1 37 37 THR C C 37 176.634 176.634 175.952 0.682 17934 8755 1 13 . 1 1 37 37 THR CA C 37 65.632 65.632 63.658 1.974 17934 8756 1 13 . 1 1 37 37 THR CB C 37 68.445 68.445 68.435 0.010 17934 8757 1 13 . 1 1 38 38 GLU N N 38 122.251 122.251 122.288 -0.037 17934 8758 1 13 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.896 0.230 17934 8759 1 13 . 1 1 38 38 GLU C C 38 179.981 179.981 178.400 1.581 17934 8760 1 13 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.638 0.370 17934 8761 1 13 . 1 1 38 38 GLU CB C 38 29.539 29.539 29.414 0.125 17934 8762 1 13 . 1 1 38 38 GLU H H 38 8.450 8.450 8.744 -0.294 17934 8763 1 13 . 1 1 39 39 SER N N 39 115.966 115.966 113.701 2.265 17934 8764 1 13 . 1 1 39 39 SER C C 39 175.991 175.991 176.503 -0.512 17934 8765 1 13 . 1 1 39 39 SER CA C 39 62.820 62.820 62.447 0.373 17934 8766 1 13 . 1 1 39 39 SER H H 39 7.522 7.522 7.771 -0.249 17934 8767 1 13 . 1 1 40 40 THR HA H 40 4.049 4.049 3.925 0.124 17934 8768 1 13 . 1 1 40 40 THR C C 40 175.972 175.972 176.780 -0.808 17934 8769 1 13 . 1 1 40 40 THR CA C 40 66.101 66.101 65.736 0.365 17934 8770 1 13 . 1 1 40 40 THR CB C 40 67.976 67.976 67.795 0.181 17934 8771 1 13 . 1 1 41 41 GLN N N 41 120.354 120.354 121.206 -0.852 17934 8772 1 13 . 1 1 41 41 GLN HA H 41 3.759 3.759 3.947 -0.188 17934 8773 1 13 . 1 1 41 41 GLN C C 41 178.483 178.483 178.194 0.289 17934 8774 1 13 . 1 1 41 41 GLN CA C 41 60.476 60.476 59.154 1.322 17934 8775 1 13 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.375 -0.242 17934 8776 1 13 . 1 1 41 41 GLN H H 41 8.271 8.271 8.519 -0.248 17934 8777 1 13 . 1 1 42 42 ASP N N 42 120.757 120.757 120.538 0.219 17934 8778 1 13 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.399 -0.040 17934 8779 1 13 . 1 1 42 42 ASP C C 42 177.480 177.480 178.042 -0.562 17934 8780 1 13 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.553 0.111 17934 8781 1 13 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.995 1.200 17934 8782 1 13 . 1 1 42 42 ASP H H 42 7.954 7.954 7.968 -0.014 17934 8783 1 13 . 1 1 43 43 ALA N N 43 120.587 120.587 121.965 -1.378 17934 8784 1 13 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.179 -0.189 17934 8785 1 13 . 1 1 43 43 ALA C C 43 179.767 179.767 179.963 -0.196 17934 8786 1 13 . 1 1 43 43 ALA CA C 43 55.320 55.320 54.736 0.584 17934 8787 1 13 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.184 1.046 17934 8788 1 13 . 1 1 43 43 ALA H H 43 7.842 7.842 8.220 -0.378 17934 8789 1 13 . 1 1 44 44 CYS N N 44 115.428 115.428 118.579 -3.151 17934 8790 1 13 . 1 1 44 44 CYS HA H 44 3.895 3.895 4.028 -0.133 17934 8791 1 13 . 1 1 44 44 CYS C C 44 176.076 176.076 176.248 -0.172 17934 8792 1 13 . 1 1 44 44 CYS CA C 44 64.695 64.695 63.041 1.654 17934 8793 1 13 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.832 -0.168 17934 8794 1 13 . 1 1 44 44 CYS H H 44 7.900 7.900 8.468 -0.568 17934 8795 1 13 . 1 1 45 45 ALA N N 45 120.487 120.487 122.509 -2.022 17934 8796 1 13 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.985 0.015 17934 8797 1 13 . 1 1 45 45 ALA C C 45 173.506 173.506 179.063 -5.557 17934 8798 1 13 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.449 -0.129 17934 8799 1 13 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.174 -0.234 17934 8800 1 13 . 1 1 45 45 ALA H H 45 7.250 7.250 8.246 -0.996 17934 8801 1 13 . 1 1 46 46 LYS N N 46 119.267 119.267 119.249 0.018 17934 8802 1 13 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.972 -0.025 17934 8803 1 13 . 1 1 46 46 LYS C C 46 179.561 179.561 178.608 0.953 17934 8804 1 13 . 1 1 46 46 LYS H H 46 8.102 8.102 8.296 -0.194 17934 8805 1 13 . 1 1 47 47 MET N N 47 118.009 118.009 118.016 -0.007 17934 8806 1 13 . 1 1 47 47 MET HA H 47 4.214 4.214 4.218 -0.004 17934 8807 1 13 . 1 1 47 47 MET C C 47 179.526 179.526 177.886 1.640 17934 8808 1 13 . 1 1 47 47 MET CA C 47 57.195 57.195 58.699 -1.504 17934 8809 1 13 . 1 1 47 47 MET CB C 47 30.945 30.945 32.793 -1.848 17934 8810 1 13 . 1 1 47 47 MET H H 47 8.585 8.585 7.912 0.673 17934 8811 1 13 . 1 1 48 48 ARG N N 48 119.962 119.962 120.110 -0.148 17934 8812 1 13 . 1 1 48 48 ARG HA H 48 3.856 3.856 4.064 -0.208 17934 8813 1 13 . 1 1 48 48 ARG C C 48 178.875 178.875 177.818 1.057 17934 8814 1 13 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.104 1.841 17934 8815 1 13 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.849 0.628 17934 8816 1 13 . 1 1 48 48 ARG H H 48 8.190 8.190 8.465 -0.275 17934 8817 1 13 . 1 1 49 49 ALA N N 49 120.640 120.640 121.882 -1.242 17934 8818 1 13 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.365 -0.622 17934 8819 1 13 . 1 1 49 49 ALA C C 49 180.169 180.169 179.697 0.472 17934 8820 1 13 . 1 1 49 49 ALA CA C 49 54.851 54.851 53.705 1.146 17934 8821 1 13 . 1 1 49 49 ALA CB C 49 17.821 17.821 18.992 -1.171 17934 8822 1 13 . 1 1 49 49 ALA H H 49 7.671 7.671 8.466 -0.795 17934 8823 1 13 . 1 1 50 50 ASN N N 50 116.063 116.063 118.565 -2.502 17934 8824 1 13 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.508 -0.034 17934 8825 1 13 . 1 1 50 50 ASN C C 50 177.084 177.084 177.602 -0.518 17934 8826 1 13 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.355 0.434 17934 8827 1 13 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.435 0.479 17934 8828 1 13 . 1 1 50 50 ASN H H 50 7.893 7.893 8.308 -0.415 17934 8829 1 13 . 1 1 51 51 CYS N N 51 116.884 116.884 117.814 -0.930 17934 8830 1 13 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.404 -0.098 17934 8831 1 13 . 1 1 51 51 CYS C C 51 175.002 175.002 175.201 -0.199 17934 8832 1 13 . 1 1 51 51 CYS CA C 51 61.414 61.414 60.027 1.387 17934 8833 1 13 . 1 1 51 51 CYS CB C 51 27.664 27.664 28.323 -0.659 17934 8834 1 13 . 1 1 51 51 CYS H H 51 7.770 7.770 8.473 -0.703 17934 8835 1 13 . 1 1 52 52 GLN N N 52 117.831 117.831 118.690 -0.859 17934 8836 1 13 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.184 0.044 17934 8837 1 13 . 1 1 52 52 GLN CA C 52 56.726 56.726 57.565 -0.839 17934 8838 1 13 . 1 1 52 52 GLN CB C 52 29.070 29.070 28.370 0.700 17934 8839 1 13 . 1 1 52 52 GLN H H 52 7.796 7.796 7.818 -0.022 17934 8840 1 13 . 1 1 53 53 LYS N N 53 118.841 118.841 118.008 0.833 17934 8841 1 13 . 1 1 53 53 LYS CA C 53 57.195 57.195 57.809 -0.614 17934 8842 1 13 . 1 1 53 53 LYS CB C 53 33.289 33.289 33.070 0.219 17934 8843 1 13 . 1 1 53 53 LYS H H 53 7.686 7.686 7.430 0.256 17934 8844 1 13 . 1 1 55 55 THR HA H 55 4.304 4.304 3.964 0.340 17934 8845 1 13 . 1 1 55 55 THR CA C 55 63.757 63.757 65.454 -1.697 17934 8846 1 13 . 1 1 55 55 THR CB C 55 68.914 68.914 68.588 0.326 17934 8847 1 13 . 1 1 56 56 GLU N N 56 120.861 120.861 118.908 1.953 17934 8848 1 13 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.183 -0.036 17934 8849 1 13 . 1 1 56 56 GLU C C 56 177.656 177.656 177.507 0.149 17934 8850 1 13 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.046 0.087 17934 8851 1 13 . 1 1 56 56 GLU CB C 56 30.008 30.008 29.329 0.679 17934 8852 1 13 . 1 1 56 56 GLU H H 56 8.311 8.311 8.553 -0.242 17934 8853 1 13 . 1 1 57 57 GLN N N 57 118.397 118.397 119.713 -1.316 17934 8854 1 13 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.205 -0.063 17934 8855 1 13 . 1 1 57 57 GLN C C 57 177.275 177.275 177.489 -0.214 17934 8856 1 13 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.700 -0.036 17934 8857 1 13 . 1 1 57 57 GLN CB C 57 29.070 29.070 29.039 0.031 17934 8858 1 13 . 1 1 57 57 GLN H H 57 7.899 7.899 8.207 -0.308 17934 8859 1 13 . 1 1 58 58 MET N N 58 118.897 118.897 115.672 3.225 17934 8860 1 13 . 1 1 58 58 MET HA H 58 4.350 4.350 4.607 -0.257 17934 8861 1 13 . 1 1 58 58 MET C C 58 177.172 177.172 176.873 0.299 17934 8862 1 13 . 1 1 58 58 MET CA C 58 56.726 56.726 55.581 1.145 17934 8863 1 13 . 1 1 58 58 MET CB C 58 32.196 32.196 33.772 -1.576 17934 8864 1 13 . 1 1 58 58 MET H H 58 8.036 8.036 8.479 -0.443 17934 8865 1 13 . 1 1 59 59 LYS N N 59 119.779 119.779 120.510 -0.731 17934 8866 1 13 . 1 1 59 59 LYS HA H 59 4.231 4.231 3.893 0.338 17934 8867 1 13 . 1 1 59 59 LYS C C 59 176.676 176.676 175.222 1.454 17934 8868 1 13 . 1 1 59 59 LYS CA C 59 57.195 57.195 57.587 -0.392 17934 8869 1 13 . 1 1 59 59 LYS CB C 59 32.820 32.820 30.569 2.251 17934 8870 1 13 . 1 1 59 59 LYS H H 59 7.901 7.901 7.558 0.343 17934 8871 1 13 . 1 1 60 60 LYS N N 60 119.993 119.993 117.214 2.779 17934 8872 1 13 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.294 0.041 17934 8873 1 13 . 1 1 60 60 LYS C C 60 176.336 176.336 173.987 2.349 17934 8874 1 13 . 1 1 60 60 LYS CA C 60 56.258 56.258 55.987 0.271 17934 8875 1 13 . 1 1 60 60 LYS CB C 60 32.820 32.820 33.957 -1.137 17934 8876 1 13 . 1 1 60 60 LYS H H 60 7.877 7.877 7.675 0.202 17934 8877 1 13 . 1 1 61 61 VAL N N 61 122.649 122.649 122.813 -0.164 17934 8878 1 13 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.477 -0.097 17934 8879 1 13 . 1 1 61 61 VAL C C 61 174.210 174.210 173.625 0.585 17934 8880 1 13 . 1 1 61 61 VAL CA C 61 60.000 60.000 58.706 1.294 17934 8881 1 13 . 1 1 61 61 VAL CB C 61 32.350 32.350 33.551 -1.201 17934 8882 1 13 . 1 1 61 61 VAL H H 61 7.708 7.708 8.108 -0.400 17934 8883 1 13 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.640 0.023 17934 8884 1 13 . 1 1 62 62 PRO C C 62 176.656 176.656 176.065 0.591 17934 8885 1 13 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.543 0.277 17934 8886 1 13 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.831 -0.948 17934 8887 1 13 . 1 1 63 63 THR N N 63 117.155 117.155 117.099 0.056 17934 8888 1 13 . 1 1 63 63 THR HA H 63 4.830 4.830 4.683 0.147 17934 8889 1 13 . 1 1 63 63 THR C C 63 174.682 174.682 173.401 1.281 17934 8890 1 13 . 1 1 63 63 THR CA C 63 62.820 62.820 62.414 0.406 17934 8891 1 13 . 1 1 63 63 THR CB C 63 69.382 69.382 70.193 -0.811 17934 8892 1 13 . 1 1 63 63 THR H H 63 8.303 8.303 8.585 -0.282 17934 8893 1 13 . 1 1 64 64 ILE N N 64 121.004 121.004 124.650 -3.646 17934 8894 1 13 . 1 1 64 64 ILE CA C 64 58.600 58.600 58.116 0.484 17934 8895 1 13 . 1 1 64 64 ILE CB C 64 42.690 42.690 41.667 1.023 17934 8896 1 13 . 1 1 64 64 ILE H H 64 9.348 9.348 8.917 0.431 17934 8897 1 13 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.820 -0.080 17934 8898 1 13 . 1 1 65 65 ILE C C 65 175.378 175.378 175.184 0.194 17934 8899 1 13 . 1 1 65 65 ILE CA C 65 60.080 60.080 60.291 -0.211 17934 8900 1 13 . 1 1 65 65 ILE CB C 65 38.750 38.750 38.084 0.666 17934 8901 1 13 . 1 1 66 66 LEU N N 66 110.343 110.343 129.463 -19.120 17934 8902 1 13 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.866 -0.016 17934 8903 1 13 . 1 1 66 66 LEU C C 66 174.982 174.982 175.769 -0.787 17934 8904 1 13 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.277 -0.367 17934 8905 1 13 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.550 1.681 17934 8906 1 13 . 1 1 66 66 LEU H H 66 9.610 9.610 9.223 0.387 17934 8907 1 13 . 1 1 67 67 SER N N 67 120.990 120.990 120.056 0.934 17934 8908 1 13 . 1 1 67 67 SER HA H 67 5.405 5.405 4.945 0.460 17934 8909 1 13 . 1 1 67 67 SER C C 67 174.405 174.405 173.373 1.032 17934 8910 1 13 . 1 1 67 67 SER CA C 67 57.195 57.195 56.812 0.383 17934 8911 1 13 . 1 1 67 67 SER CB C 67 64.695 64.695 63.822 0.873 17934 8912 1 13 . 1 1 67 67 SER H H 67 9.260 9.260 8.889 0.371 17934 8913 1 13 . 1 1 68 68 VAL N N 68 128.176 128.176 126.007 2.169 17934 8914 1 13 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.275 0.218 17934 8915 1 13 . 1 1 68 68 VAL C C 68 173.891 173.891 173.732 0.159 17934 8916 1 13 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.926 1.424 17934 8917 1 13 . 1 1 68 68 VAL CB C 68 33.750 33.750 33.133 0.618 17934 8918 1 13 . 1 1 68 68 VAL H H 68 9.225 9.225 8.723 0.502 17934 8919 1 13 . 1 1 69 69 SER N N 69 121.697 121.697 124.525 -2.828 17934 8920 1 13 . 1 1 69 69 SER HA H 69 4.837 4.837 5.128 -0.291 17934 8921 1 13 . 1 1 69 69 SER C C 69 173.188 173.188 174.748 -1.560 17934 8922 1 13 . 1 1 69 69 SER CA C 69 57.195 57.195 56.712 0.484 17934 8923 1 13 . 1 1 69 69 SER CB C 69 67.976 67.976 66.089 1.887 17934 8924 1 13 . 1 1 69 69 SER H H 69 8.869 8.869 8.801 0.068 17934 8925 1 13 . 1 1 70 70 ALA N N 70 118.689 118.689 125.880 -7.191 17934 8926 1 13 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.225 -0.075 17934 8927 1 13 . 1 1 70 70 ALA C C 70 176.714 176.714 177.080 -0.366 17934 8928 1 13 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.443 -0.533 17934 8929 1 13 . 1 1 70 70 ALA CB C 70 18.600 18.600 19.206 -0.606 17934 8930 1 13 . 1 1 70 70 ALA H H 70 8.810 8.810 8.630 0.180 17934 8931 1 13 . 1 1 71 71 LYS N N 71 112.633 112.633 113.903 -1.270 17934 8932 1 13 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.451 -0.176 17934 8933 1 13 . 1 1 71 71 LYS C C 71 177.033 177.033 175.579 1.454 17934 8934 1 13 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.306 1.889 17934 8935 1 13 . 1 1 71 71 LYS CB C 71 33.289 33.289 32.573 0.716 17934 8936 1 13 . 1 1 71 71 LYS H H 71 7.830 7.830 8.031 -0.201 17934 8937 1 13 . 1 1 72 72 GLY N N 72 108.432 108.432 108.213 0.219 17934 8938 1 13 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.217 0.259 17934 8939 1 13 . 1 1 72 72 GLY H H 72 7.685 7.685 7.865 -0.180 17934 8940 1 13 . 1 1 73 73 VAL N N 73 120.414 120.414 119.944 0.470 17934 8941 1 13 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.892 0.108 17934 8942 1 13 . 1 1 73 73 VAL CA C 73 60.470 60.470 60.193 0.277 17934 8943 1 13 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.333 0.298 17934 8944 1 13 . 1 1 73 73 VAL H H 73 8.620 8.620 8.168 0.452 17934 8945 1 13 . 1 1 74 74 LYS N N 74 125.257 125.257 128.214 -2.957 17934 8946 1 13 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.629 0.387 17934 8947 1 13 . 1 1 74 74 LYS CA C 74 54.383 54.383 53.775 0.608 17934 8948 1 13 . 1 1 74 74 LYS CB C 74 36.570 36.570 35.134 1.436 17934 8949 1 13 . 1 1 74 74 LYS H H 74 8.783 8.783 8.706 0.077 17934 8950 1 13 . 1 1 75 75 PHE N N 75 119.414 119.414 119.003 0.411 17934 8951 1 13 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.440 0.260 17934 8952 1 13 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.522 -2.602 17934 8953 1 13 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.493 -0.883 17934 8954 1 13 . 1 1 75 75 PHE H H 75 8.432 8.432 8.804 -0.372 17934 8955 1 13 . 1 1 76 76 ILE N N 76 121.430 121.430 120.871 0.559 17934 8956 1 13 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.778 0.062 17934 8957 1 13 . 1 1 76 76 ILE C C 76 175.249 175.249 174.101 1.148 17934 8958 1 13 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.760 -0.690 17934 8959 1 13 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.997 -0.777 17934 8960 1 13 . 1 1 76 76 ILE H H 76 8.960 8.960 8.357 0.603 17934 8961 1 13 . 1 1 77 77 ASP N N 77 125.744 125.744 122.920 2.824 17934 8962 1 13 . 1 1 77 77 ASP HA H 77 4.563 4.563 4.934 -0.371 17934 8963 1 13 . 1 1 77 77 ASP C C 77 177.569 177.569 175.716 1.853 17934 8964 1 13 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.558 3.231 17934 8965 1 13 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.304 0.297 17934 8966 1 13 . 1 1 77 77 ASP H H 77 8.750 8.750 8.707 0.043 17934 8967 1 13 . 1 1 78 78 ALA N N 78 128.632 128.632 128.679 -0.047 17934 8968 1 13 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.293 -0.323 17934 8969 1 13 . 1 1 78 78 ALA C C 78 178.052 178.052 178.192 -0.140 17934 8970 1 13 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.142 0.688 17934 8971 1 13 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.564 0.229 17934 8972 1 13 . 1 1 78 78 ALA H H 78 8.700 8.700 8.789 -0.089 17934 8973 1 13 . 1 1 79 79 THR N N 79 113.087 113.087 114.395 -1.308 17934 8974 1 13 . 1 1 79 79 THR HA H 79 4.194 4.194 4.290 -0.096 17934 8975 1 13 . 1 1 79 79 THR C C 79 175.587 175.587 175.788 -0.201 17934 8976 1 13 . 1 1 79 79 THR CA C 79 64.695 64.695 64.597 0.099 17934 8977 1 13 . 1 1 79 79 THR CB C 79 69.382 69.382 69.316 0.067 17934 8978 1 13 . 1 1 79 79 THR H H 79 8.779 8.779 8.543 0.236 17934 8979 1 13 . 1 1 80 80 ASN N N 80 118.434 118.434 117.063 1.371 17934 8980 1 13 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.716 0.021 17934 8981 1 13 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.881 0.564 17934 8982 1 13 . 1 1 80 80 ASN CB C 80 39.383 39.383 39.633 -0.250 17934 8983 1 13 . 1 1 80 80 ASN H H 80 8.584 8.584 8.227 0.357 17934 8984 1 13 . 1 1 81 81 LYS N N 81 112.429 112.429 114.773 -2.344 17934 8985 1 13 . 1 1 81 81 LYS C C 81 174.909 174.909 175.509 -0.600 17934 8986 1 13 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.603 0.061 17934 8987 1 13 . 1 1 81 81 LYS CB C 81 28.602 28.602 29.887 -1.285 17934 8988 1 13 . 1 1 81 81 LYS H H 81 7.966 7.966 8.412 -0.446 17934 8989 1 13 . 1 1 82 82 ASN N N 82 116.806 116.806 116.472 0.334 17934 8990 1 13 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.794 -0.204 17934 8991 1 13 . 1 1 82 82 ASN C C 82 174.999 174.999 173.877 1.122 17934 8992 1 13 . 1 1 82 82 ASN CA C 82 52.976 52.976 51.793 1.183 17934 8993 1 13 . 1 1 82 82 ASN CB C 82 38.445 38.445 40.267 -1.823 17934 8994 1 13 . 1 1 82 82 ASN H H 82 8.455 8.455 7.780 0.675 17934 8995 1 13 . 1 1 83 83 ILE N N 83 122.447 122.447 119.825 2.622 17934 8996 1 13 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.334 -0.304 17934 8997 1 13 . 1 1 83 83 ILE C C 83 176.572 176.572 175.277 1.295 17934 8998 1 13 . 1 1 83 83 ILE CA C 83 62.350 62.350 60.709 1.641 17934 8999 1 13 . 1 1 83 83 ILE CB C 83 37.970 37.970 37.382 0.588 17934 9000 1 13 . 1 1 83 83 ILE H H 83 8.650 8.650 8.467 0.183 17934 9001 1 13 . 1 1 84 84 ILE N N 84 129.339 129.339 124.601 4.738 17934 9002 1 13 . 1 1 84 84 ILE HA H 84 3.920 3.920 3.913 0.007 17934 9003 1 13 . 1 1 84 84 ILE C C 84 175.873 175.873 175.853 0.020 17934 9004 1 13 . 1 1 84 84 ILE CA C 84 62.810 62.810 60.756 2.054 17934 9005 1 13 . 1 1 84 84 ILE CB C 84 38.840 38.840 37.331 1.509 17934 9006 1 13 . 1 1 84 84 ILE H H 84 8.930 8.930 8.518 0.412 17934 9007 1 13 . 1 1 85 85 ALA N N 85 118.867 118.867 118.449 0.418 17934 9008 1 13 . 1 1 85 85 ALA C C 85 174.100 174.100 174.736 -0.636 17934 9009 1 13 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.355 -0.785 17934 9010 1 13 . 1 1 85 85 ALA H H 85 7.048 7.048 8.077 -1.029 17934 9011 1 13 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.988 0.166 17934 9012 1 13 . 1 1 87 87 HIS C C 87 174.986 174.986 174.116 0.870 17934 9013 1 13 . 1 1 87 87 HIS CB C 87 34.350 34.350 32.193 2.157 17934 9014 1 13 . 1 1 88 88 GLU N N 88 125.372 125.372 119.915 5.457 17934 9015 1 13 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.232 0.289 17934 9016 1 13 . 1 1 88 88 GLU C C 88 179.047 179.047 178.086 0.961 17934 9017 1 13 . 1 1 88 88 GLU CA C 88 56.726 56.726 57.367 -0.641 17934 9018 1 13 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.335 0.142 17934 9019 1 13 . 1 1 88 88 GLU H H 88 9.106 9.106 8.841 0.265 17934 9020 1 13 . 1 1 89 89 ILE N N 89 124.132 124.132 124.225 -0.093 17934 9021 1 13 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.868 0.151 17934 9022 1 13 . 1 1 89 89 ILE C C 89 176.095 176.095 177.486 -1.391 17934 9023 1 13 . 1 1 89 89 ILE CA C 89 62.351 62.351 64.847 -2.496 17934 9024 1 13 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.410 0.504 17934 9025 1 13 . 1 1 89 89 ILE H H 89 8.055 8.055 8.969 -0.914 17934 9026 1 13 . 1 1 90 90 ARG N N 90 116.949 116.949 116.571 0.378 17934 9027 1 13 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.194 0.144 17934 9028 1 13 . 1 1 90 90 ARG C C 90 176.578 176.578 176.278 0.300 17934 9029 1 13 . 1 1 90 90 ARG CA C 90 57.664 57.664 58.345 -0.681 17934 9030 1 13 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.215 -0.145 17934 9031 1 13 . 1 1 90 90 ARG H H 90 8.045 8.045 8.677 -0.632 17934 9032 1 13 . 1 1 91 91 ASN N N 91 116.320 116.320 117.043 -0.723 17934 9033 1 13 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.633 0.520 17934 9034 1 13 . 1 1 91 91 ASN C C 91 174.595 174.595 175.523 -0.928 17934 9035 1 13 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.155 -1.647 17934 9036 1 13 . 1 1 91 91 ASN CB C 91 39.852 39.852 40.002 -0.150 17934 9037 1 13 . 1 1 91 91 ASN H H 91 8.067 8.067 7.689 0.378 17934 9038 1 13 . 1 1 92 92 ILE N N 92 122.441 122.441 122.118 0.323 17934 9039 1 13 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.877 1.196 17934 9040 1 13 . 1 1 92 92 ILE C C 92 175.229 175.229 176.223 -0.994 17934 9041 1 13 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.674 -0.794 17934 9042 1 13 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.512 2.338 17934 9043 1 13 . 1 1 92 92 ILE H H 92 7.483 7.483 7.624 -0.141 17934 9044 1 13 . 1 1 93 93 SER N N 93 120.329 120.329 123.344 -3.015 17934 9045 1 13 . 1 1 93 93 SER HA H 93 4.684 4.684 4.135 0.549 17934 9046 1 13 . 1 1 93 93 SER C C 93 180.744 180.744 174.413 6.331 17934 9047 1 13 . 1 1 93 93 SER CA C 93 57.664 57.664 61.055 -3.391 17934 9048 1 13 . 1 1 93 93 SER CB C 93 66.570 66.570 63.627 2.943 17934 9049 1 13 . 1 1 93 93 SER H H 93 9.545 9.545 8.442 1.103 17934 9050 1 13 . 1 1 94 94 CYS N N 94 110.900 110.900 115.320 -4.420 17934 9051 1 13 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.646 -0.834 17934 9052 1 13 . 1 1 94 94 CYS C C 94 173.973 173.973 172.801 1.172 17934 9053 1 13 . 1 1 94 94 CYS CA C 94 59.539 59.539 58.094 1.445 17934 9054 1 13 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.593 -4.335 17934 9055 1 13 . 1 1 94 94 CYS H H 94 8.858 8.858 8.095 0.763 17934 9056 1 13 . 1 1 95 95 ALA N N 95 121.379 121.379 123.061 -1.682 17934 9057 1 13 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.547 -0.117 17934 9058 1 13 . 1 1 95 95 ALA C C 95 178.098 178.098 174.961 3.137 17934 9059 1 13 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.949 0.701 17934 9060 1 13 . 1 1 95 95 ALA CB C 95 19.300 19.300 22.031 -2.731 17934 9061 1 13 . 1 1 95 95 ALA H H 95 8.360 8.360 8.319 0.041 17934 9062 1 13 . 1 1 96 96 ALA N N 96 122.576 122.576 122.123 0.453 17934 9063 1 13 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.681 -0.001 17934 9064 1 13 . 1 1 96 96 ALA C C 96 175.716 175.716 174.655 1.061 17934 9065 1 13 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.906 0.534 17934 9066 1 13 . 1 1 96 96 ALA CB C 96 22.700 22.700 21.901 0.799 17934 9067 1 13 . 1 1 96 96 ALA H H 96 9.080 9.080 8.609 0.471 17934 9068 1 13 . 1 1 97 97 GLN N N 97 116.903 116.903 119.979 -3.076 17934 9069 1 13 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.749 0.181 17934 9070 1 13 . 1 1 97 97 GLN C C 97 175.270 175.270 174.361 0.909 17934 9071 1 13 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.600 1.251 17934 9072 1 13 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.791 1.967 17934 9073 1 13 . 1 1 97 97 GLN H H 97 8.369 8.369 8.418 -0.049 17934 9074 1 13 . 1 1 98 98 ASP N N 98 124.971 124.971 121.833 3.138 17934 9075 1 13 . 1 1 98 98 ASP C C 98 175.217 175.217 175.757 -0.540 17934 9076 1 13 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.565 -0.526 17934 9077 1 13 . 1 1 98 98 ASP CB C 98 42.195 42.195 41.553 0.642 17934 9078 1 13 . 1 1 98 98 ASP H H 98 8.395 8.395 8.297 0.098 17934 9079 1 13 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.365 -0.131 17934 9080 1 13 . 1 1 99 99 PRO C C 99 178.433 178.433 177.721 0.712 17934 9081 1 13 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.764 -0.069 17934 9082 1 13 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.109 0.243 17934 9083 1 13 . 1 1 100 100 GLU N N 100 116.223 116.223 118.468 -2.245 17934 9084 1 13 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.156 0.064 17934 9085 1 13 . 1 1 100 100 GLU C C 100 176.678 176.678 176.208 0.470 17934 9086 1 13 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.335 -1.609 17934 9087 1 13 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.831 2.114 17934 9088 1 13 . 1 1 100 100 GLU H H 100 8.643 8.643 8.779 -0.136 17934 9089 1 13 . 1 1 101 101 ASP N N 101 119.053 119.053 119.420 -0.367 17934 9090 1 13 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.849 -0.306 17934 9091 1 13 . 1 1 101 101 ASP C C 101 174.771 174.771 176.155 -1.384 17934 9092 1 13 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.362 0.552 17934 9093 1 13 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.647 0.142 17934 9094 1 13 . 1 1 101 101 ASP H H 101 7.597 7.597 8.228 -0.631 17934 9095 1 13 . 1 1 102 102 LEU N N 102 123.986 123.986 121.390 2.596 17934 9096 1 13 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.310 0.080 17934 9097 1 13 . 1 1 102 102 LEU C C 102 177.141 177.141 177.730 -0.589 17934 9098 1 13 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.222 0.438 17934 9099 1 13 . 1 1 102 102 LEU CB C 102 42.660 42.660 42.017 0.643 17934 9100 1 13 . 1 1 102 102 LEU H H 102 8.534 8.534 7.483 1.051 17934 9101 1 13 . 1 1 103 103 SER N N 103 112.339 112.339 113.591 -1.252 17934 9102 1 13 . 1 1 103 103 SER HA H 103 4.290 4.290 4.457 -0.167 17934 9103 1 13 . 1 1 103 103 SER C C 103 174.106 174.106 175.024 -0.918 17934 9104 1 13 . 1 1 103 103 SER CA C 103 60.945 60.945 60.970 -0.025 17934 9105 1 13 . 1 1 103 103 SER CB C 103 63.757 63.757 63.406 0.352 17934 9106 1 13 . 1 1 103 103 SER H H 103 7.867 7.867 8.244 -0.377 17934 9107 1 13 . 1 1 104 104 THR N N 104 123.070 123.070 114.143 8.927 17934 9108 1 13 . 1 1 104 104 THR HA H 104 5.373 5.373 4.442 0.931 17934 9109 1 13 . 1 1 104 104 THR C C 104 180.693 180.693 172.454 8.239 17934 9110 1 13 . 1 1 104 104 THR CA C 104 63.289 63.289 61.805 1.484 17934 9111 1 13 . 1 1 104 104 THR CB C 104 69.382 69.382 70.395 -1.014 17934 9112 1 13 . 1 1 104 104 THR H H 104 8.830 8.830 8.151 0.679 17934 9113 1 13 . 1 1 105 105 PHE N N 105 122.582 122.582 121.432 1.150 17934 9114 1 13 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.936 0.534 17934 9115 1 13 . 1 1 105 105 PHE C C 105 179.211 179.211 172.161 7.050 17934 9116 1 13 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.962 -0.643 17934 9117 1 13 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.868 -0.078 17934 9118 1 13 . 1 1 105 105 PHE H H 105 9.170 9.170 8.452 0.718 17934 9119 1 13 . 1 1 106 106 ALA N N 106 119.567 119.567 122.061 -2.494 17934 9120 1 13 . 1 1 106 106 ALA C C 106 175.603 175.603 175.116 0.487 17934 9121 1 13 . 1 1 106 106 ALA H H 106 8.770 8.770 9.076 -0.306 17934 9122 1 13 . 1 1 107 107 TYR N N 107 109.933 109.933 118.689 -8.756 17934 9123 1 13 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.298 -0.378 17934 9124 1 13 . 1 1 107 107 TYR C C 107 180.426 180.426 172.903 7.523 17934 9125 1 13 . 1 1 107 107 TYR CA C 107 57.080 57.080 54.755 2.325 17934 9126 1 13 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.322 -0.533 17934 9127 1 13 . 1 1 107 107 TYR H H 107 7.950 7.950 8.654 -0.704 17934 9128 1 13 . 1 1 108 108 ILE N N 108 120.613 120.613 118.004 2.609 17934 9129 1 13 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.547 0.823 17934 9130 1 13 . 1 1 108 108 ILE C C 108 176.212 176.212 175.687 0.525 17934 9131 1 13 . 1 1 108 108 ILE CA C 108 59.540 59.540 58.768 0.772 17934 9132 1 13 . 1 1 108 108 ILE CB C 108 39.380 39.380 38.141 1.240 17934 9133 1 13 . 1 1 108 108 ILE H H 108 8.869 8.869 8.641 0.228 17934 9134 1 13 . 1 1 109 109 THR N N 109 116.505 116.505 114.498 2.007 17934 9135 1 13 . 1 1 109 109 THR HA H 109 5.669 5.669 4.573 1.096 17934 9136 1 13 . 1 1 109 109 THR C C 109 173.505 173.505 172.563 0.942 17934 9137 1 13 . 1 1 109 109 THR CA C 109 59.070 59.070 60.425 -1.355 17934 9138 1 13 . 1 1 109 109 THR H H 109 9.489 9.489 8.193 1.296 17934 9139 1 13 . 1 1 110 110 LYS N N 110 122.960 122.960 121.430 1.530 17934 9140 1 13 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.482 -0.022 17934 9141 1 13 . 1 1 110 110 LYS C C 110 175.937 175.937 175.902 0.035 17934 9142 1 13 . 1 1 110 110 LYS CA C 110 55.789 55.789 55.634 0.155 17934 9143 1 13 . 1 1 110 110 LYS CB C 110 34.227 34.227 33.264 0.963 17934 9144 1 13 . 1 1 110 110 LYS H H 110 7.831 7.831 7.915 -0.084 17934 9145 1 13 . 1 1 111 111 ASP N N 111 127.409 127.409 123.762 3.647 17934 9146 1 13 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.901 -0.120 17934 9147 1 13 . 1 1 111 111 ASP C C 111 176.396 176.396 177.288 -0.892 17934 9148 1 13 . 1 1 111 111 ASP CA C 111 53.914 53.914 52.426 1.488 17934 9149 1 13 . 1 1 111 111 ASP CB C 111 43.133 43.133 42.533 0.600 17934 9150 1 13 . 1 1 111 111 ASP H H 111 8.769 8.769 8.091 0.678 17934 9151 1 13 . 1 1 112 112 LEU N N 112 125.913 125.913 124.773 1.140 17934 9152 1 13 . 1 1 112 112 LEU HA H 112 4.150 4.150 3.964 0.186 17934 9153 1 13 . 1 1 112 112 LEU C C 112 178.553 178.553 178.398 0.155 17934 9154 1 13 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.591 -0.401 17934 9155 1 13 . 1 1 112 112 LEU CB C 112 41.790 41.790 41.911 -0.121 17934 9156 1 13 . 1 1 112 112 LEU H H 112 8.593 8.593 8.709 -0.116 17934 9157 1 13 . 1 1 113 113 LYS N N 113 117.189 117.189 118.710 -1.521 17934 9158 1 13 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.079 0.183 17934 9159 1 13 . 1 1 113 113 LYS C C 113 177.180 177.180 176.493 0.687 17934 9160 1 13 . 1 1 113 113 LYS CA C 113 58.133 58.133 58.731 -0.598 17934 9161 1 13 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.853 -0.033 17934 9162 1 13 . 1 1 113 113 LYS H H 113 8.207 8.207 7.780 0.427 17934 9163 1 13 . 1 1 114 114 SER N N 114 112.492 112.492 109.671 2.821 17934 9164 1 13 . 1 1 114 114 SER CA C 114 58.601 58.601 57.392 1.209 17934 9165 1 13 . 1 1 114 114 SER CB C 114 65.164 65.164 65.253 -0.089 17934 9166 1 13 . 1 1 114 114 SER H H 114 7.755 7.755 7.946 -0.191 17934 9167 1 13 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.704 -0.315 17934 9168 1 13 . 1 1 115 115 ASN C C 115 174.203 174.203 175.482 -1.279 17934 9169 1 13 . 1 1 115 115 ASN CA C 115 54.383 54.383 53.083 1.300 17934 9170 1 13 . 1 1 115 115 ASN CB C 115 37.977 37.977 38.344 -0.367 17934 9171 1 13 . 1 1 116 116 HIS N N 116 116.822 116.822 118.562 -1.740 17934 9172 1 13 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.250 0.680 17934 9173 1 13 . 1 1 116 116 HIS C C 116 173.898 173.898 175.415 -1.517 17934 9174 1 13 . 1 1 116 116 HIS CA C 116 54.910 54.910 55.657 -0.747 17934 9175 1 13 . 1 1 116 116 HIS CB C 116 32.650 32.650 30.579 2.071 17934 9176 1 13 . 1 1 116 116 HIS H H 116 7.690 7.690 7.884 -0.194 17934 9177 1 13 . 1 1 117 117 HIS N N 117 118.253 118.253 119.933 -1.680 17934 9178 1 13 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.537 0.783 17934 9179 1 13 . 1 1 117 117 HIS C C 117 173.695 173.695 173.535 0.160 17934 9180 1 13 . 1 1 117 117 HIS CA C 117 56.350 56.350 55.416 0.934 17934 9181 1 13 . 1 1 117 117 HIS CB C 117 32.350 32.350 28.814 3.536 17934 9182 1 13 . 1 1 117 117 HIS H H 117 8.340 8.340 8.392 -0.052 17934 9183 1 13 . 1 1 118 118 TYR N N 118 118.301 118.301 123.148 -4.847 17934 9184 1 13 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.795 0.215 17934 9185 1 13 . 1 1 118 118 TYR C C 118 173.530 173.530 174.651 -1.121 17934 9186 1 13 . 1 1 118 118 TYR CA C 118 56.730 56.730 57.450 -0.720 17934 9187 1 13 . 1 1 118 118 TYR CB C 118 43.240 43.240 40.393 2.847 17934 9188 1 13 . 1 1 118 118 TYR H H 118 9.080 9.080 8.135 0.945 17934 9189 1 13 . 1 1 119 119 CYS N N 119 121.015 121.015 121.622 -0.607 17934 9190 1 13 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.836 0.227 17934 9191 1 13 . 1 1 119 119 CYS C C 119 180.664 180.664 173.671 6.993 17934 9192 1 13 . 1 1 119 119 CYS CA C 119 56.726 56.726 56.197 0.529 17934 9193 1 13 . 1 1 119 119 CYS CB C 119 29.539 29.539 29.907 -0.368 17934 9194 1 13 . 1 1 119 119 CYS H H 119 9.120 9.120 9.306 -0.186 17934 9195 1 13 . 1 1 120 120 HIS N N 120 110.134 110.134 124.420 -14.286 17934 9196 1 13 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.855 -0.156 17934 9197 1 13 . 1 1 120 120 HIS C C 120 180.776 180.776 173.590 7.186 17934 9198 1 13 . 1 1 120 120 HIS CA C 120 55.320 55.320 53.522 1.798 17934 9199 1 13 . 1 1 120 120 HIS CB C 120 32.352 32.352 30.745 1.607 17934 9200 1 13 . 1 1 120 120 HIS H H 120 8.482 8.482 8.448 0.034 17934 9201 1 13 . 1 1 121 121 VAL N N 121 120.855 120.855 123.791 -2.936 17934 9202 1 13 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.103 0.247 17934 9203 1 13 . 1 1 121 121 VAL C C 121 173.419 173.419 173.441 -0.022 17934 9204 1 13 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.640 0.770 17934 9205 1 13 . 1 1 121 121 VAL CB C 121 33.280 33.280 32.855 0.425 17934 9206 1 13 . 1 1 121 121 VAL H H 121 7.929 7.929 8.631 -0.702 17934 9207 1 13 . 1 1 122 122 PHE N N 122 124.384 124.384 128.566 -4.182 17934 9208 1 13 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.205 0.215 17934 9209 1 13 . 1 1 122 122 PHE C C 122 174.876 174.876 174.520 0.356 17934 9210 1 13 . 1 1 122 122 PHE CA C 122 55.320 55.320 54.357 0.963 17934 9211 1 13 . 1 1 122 122 PHE CB C 122 44.540 44.540 42.581 1.959 17934 9212 1 13 . 1 1 122 122 PHE H H 122 8.910 8.910 9.119 -0.209 17934 9213 1 13 . 1 1 123 123 THR N N 123 112.451 112.451 114.103 -1.652 17934 9214 1 13 . 1 1 123 123 THR HA H 123 5.147 5.147 4.701 0.446 17934 9215 1 13 . 1 1 123 123 THR C C 123 174.096 174.096 172.629 1.467 17934 9216 1 13 . 1 1 123 123 THR CA C 123 61.843 61.843 59.482 2.361 17934 9217 1 13 . 1 1 123 123 THR CB C 123 71.218 71.218 71.326 -0.108 17934 9218 1 13 . 1 1 123 123 THR H H 123 8.668 8.668 8.949 -0.281 17934 9219 1 13 . 1 1 124 124 ALA N N 124 128.922 128.922 126.552 2.370 17934 9220 1 13 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.494 0.226 17934 9221 1 13 . 1 1 124 124 ALA C C 124 177.168 177.168 177.800 -0.632 17934 9222 1 13 . 1 1 124 124 ALA CA C 124 50.890 50.890 49.856 1.034 17934 9223 1 13 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.448 -0.348 17934 9224 1 13 . 1 1 124 124 ALA H H 124 9.180 9.180 8.592 0.588 17934 9225 1 13 . 1 1 125 125 PHE N N 125 115.427 115.427 116.750 -1.323 17934 9226 1 13 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.587 -0.297 17934 9227 1 13 . 1 1 125 125 PHE C C 125 174.703 174.703 175.786 -1.083 17934 9228 1 13 . 1 1 125 125 PHE CA C 125 60.470 60.470 57.553 2.917 17934 9229 1 13 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.032 -0.973 17934 9230 1 13 . 1 1 125 125 PHE H H 125 8.560 8.560 8.500 0.060 17934 9231 1 13 . 1 1 126 126 ASP N N 126 115.745 115.745 118.956 -3.211 17934 9232 1 13 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.874 -0.031 17934 9233 1 13 . 1 1 126 126 ASP C C 126 176.532 176.532 176.570 -0.038 17934 9234 1 13 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.158 0.287 17934 9235 1 13 . 1 1 126 126 ASP CB C 126 44.070 44.070 43.097 0.973 17934 9236 1 13 . 1 1 126 126 ASP H H 126 7.417 7.417 7.581 -0.164 17934 9237 1 13 . 1 1 127 127 VAL N N 127 121.923 121.923 122.203 -0.280 17934 9238 1 13 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.774 -0.184 17934 9239 1 13 . 1 1 127 127 VAL C C 127 176.863 176.863 177.643 -0.780 17934 9240 1 13 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.483 -0.853 17934 9241 1 13 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.036 -0.206 17934 9242 1 13 . 1 1 127 127 VAL H H 127 8.508 8.508 8.704 -0.196 17934 9243 1 13 . 1 1 128 128 ASN N N 128 118.851 118.851 118.657 0.194 17934 9244 1 13 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.585 -0.109 17934 9245 1 13 . 1 1 128 128 ASN C C 128 178.251 178.251 177.685 0.566 17934 9246 1 13 . 1 1 128 128 ASN CA C 128 56.258 56.258 55.980 0.278 17934 9247 1 13 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.144 -0.167 17934 9248 1 13 . 1 1 128 128 ASN H H 128 8.207 8.207 8.445 -0.238 17934 9249 1 13 . 1 1 129 129 LEU N N 129 122.549 122.549 120.290 2.259 17934 9250 1 13 . 1 1 129 129 LEU HA H 129 4.210 4.210 4.222 -0.012 17934 9251 1 13 . 1 1 129 129 LEU C C 129 178.003 178.003 178.659 -0.656 17934 9252 1 13 . 1 1 129 129 LEU CA C 129 57.190 57.190 58.024 -0.834 17934 9253 1 13 . 1 1 129 129 LEU CB C 129 41.790 41.790 41.134 0.656 17934 9254 1 13 . 1 1 129 129 LEU H H 129 8.223 8.223 8.088 0.135 17934 9255 1 13 . 1 1 130 130 ALA N N 130 120.036 120.036 121.958 -1.922 17934 9256 1 13 . 1 1 130 130 ALA HA H 130 3.310 3.310 4.181 -0.871 17934 9257 1 13 . 1 1 130 130 ALA C C 130 178.172 178.172 179.262 -1.090 17934 9258 1 13 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.394 0.386 17934 9259 1 13 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.518 0.552 17934 9260 1 13 . 1 1 130 130 ALA H H 130 7.360 7.360 8.151 -0.791 17934 9261 1 13 . 1 1 131 131 ALA N N 131 116.989 116.989 119.702 -2.713 17934 9262 1 13 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.962 -0.252 17934 9263 1 13 . 1 1 131 131 ALA C C 131 180.163 180.163 179.511 0.652 17934 9264 1 13 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.647 1.133 17934 9265 1 13 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.123 -0.293 17934 9266 1 13 . 1 1 131 131 ALA H H 131 7.360 7.360 8.642 -1.282 17934 9267 1 13 . 1 1 132 132 GLU N N 132 119.462 119.462 120.323 -0.861 17934 9268 1 13 . 1 1 132 132 GLU HA H 132 3.888 3.888 4.061 -0.173 17934 9269 1 13 . 1 1 132 132 GLU C C 132 179.243 179.243 178.610 0.633 17934 9270 1 13 . 1 1 132 132 GLU CA C 132 59.539 59.539 59.366 0.173 17934 9271 1 13 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.933 -0.394 17934 9272 1 13 . 1 1 132 132 GLU H H 132 7.673 7.673 8.273 -0.600 17934 9273 1 13 . 1 1 133 133 ILE N N 133 123.218 123.218 120.004 3.214 17934 9274 1 13 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.204 -0.424 17934 9275 1 13 . 1 1 133 133 ILE C C 133 177.421 177.421 177.733 -0.312 17934 9276 1 13 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.347 1.143 17934 9277 1 13 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.719 -1.069 17934 9278 1 13 . 1 1 133 133 ILE H H 133 8.154 8.154 7.980 0.174 17934 9279 1 13 . 1 1 134 134 ILE N N 134 118.244 118.244 119.104 -0.860 17934 9280 1 13 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.327 0.213 17934 9281 1 13 . 1 1 134 134 ILE C C 134 179.385 179.385 177.817 1.568 17934 9282 1 13 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.637 -1.357 17934 9283 1 13 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.626 -0.526 17934 9284 1 13 . 1 1 134 134 ILE H H 134 7.376 7.376 7.832 -0.456 17934 9285 1 13 . 1 1 135 135 LEU N N 135 123.061 123.061 121.317 1.744 17934 9286 1 13 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.869 0.321 17934 9287 1 13 . 1 1 135 135 LEU C C 135 179.858 179.858 179.122 0.736 17934 9288 1 13 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.860 -0.670 17934 9289 1 13 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.070 0.790 17934 9290 1 13 . 1 1 135 135 LEU H H 135 8.036 8.036 8.012 0.024 17934 9291 1 13 . 1 1 136 136 THR N N 136 119.647 119.647 114.999 4.648 17934 9292 1 13 . 1 1 136 136 THR HA H 136 3.725 3.725 3.977 -0.252 17934 9293 1 13 . 1 1 136 136 THR C C 136 176.088 176.088 177.030 -0.942 17934 9294 1 13 . 1 1 136 136 THR CA C 136 58.601 58.601 66.216 -7.615 17934 9295 1 13 . 1 1 136 136 THR CB C 136 67.976 67.976 68.376 -0.400 17934 9296 1 13 . 1 1 136 136 THR H H 136 8.508 8.508 8.250 0.258 17934 9297 1 13 . 1 1 137 137 LEU N N 137 123.182 123.182 122.185 0.997 17934 9298 1 13 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.886 -0.146 17934 9299 1 13 . 1 1 137 137 LEU C C 137 178.341 178.341 178.539 -0.198 17934 9300 1 13 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.114 0.145 17934 9301 1 13 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.457 0.093 17934 9302 1 13 . 1 1 137 137 LEU H H 137 8.520 8.520 8.297 0.223 17934 9303 1 13 . 1 1 138 138 GLY N N 138 105.266 105.266 105.809 -0.543 17934 9304 1 13 . 1 1 138 138 GLY C C 138 176.973 176.973 176.123 0.850 17934 9305 1 13 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.256 0.095 17934 9306 1 13 . 1 1 138 138 GLY H H 138 7.858 7.858 8.117 -0.259 17934 9307 1 13 . 1 1 139 139 GLN N N 139 123.485 123.485 122.459 1.026 17934 9308 1 13 . 1 1 139 139 GLN C C 139 177.891 177.891 177.981 -0.090 17934 9309 1 13 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.948 -0.347 17934 9310 1 13 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.656 -0.523 17934 9311 1 13 . 1 1 139 139 GLN H H 139 8.195 8.195 8.519 -0.324 17934 9312 1 13 . 1 1 140 140 ALA N N 140 122.754 122.754 122.364 0.390 17934 9313 1 13 . 1 1 140 140 ALA HA H 140 3.709 3.709 3.999 -0.290 17934 9314 1 13 . 1 1 140 140 ALA C C 140 178.987 178.987 179.309 -0.322 17934 9315 1 13 . 1 1 140 140 ALA CA C 140 55.780 55.780 55.297 0.483 17934 9316 1 13 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.225 -0.815 17934 9317 1 13 . 1 1 140 140 ALA H H 140 8.530 8.530 8.207 0.323 17934 9318 1 13 . 1 1 141 141 PHE N N 141 116.275 116.275 119.463 -3.188 17934 9319 1 13 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.241 -0.151 17934 9320 1 13 . 1 1 141 141 PHE C C 141 178.129 178.129 177.238 0.891 17934 9321 1 13 . 1 1 141 141 PHE CA C 141 61.240 61.240 59.779 1.461 17934 9322 1 13 . 1 1 141 141 PHE CB C 141 39.383 39.383 38.832 0.551 17934 9323 1 13 . 1 1 141 141 PHE H H 141 7.920 7.920 8.215 -0.295 17934 9324 1 13 . 1 1 142 142 GLU N N 142 119.967 119.967 120.098 -0.131 17934 9325 1 13 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.234 0.993 17934 9326 1 13 . 1 1 142 142 GLU C C 142 179.250 179.250 178.255 0.995 17934 9327 1 13 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.172 1.367 17934 9328 1 13 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.620 -0.081 17934 9329 1 13 . 1 1 142 142 GLU H H 142 7.713 7.713 7.796 -0.083 17934 9330 1 13 . 1 1 143 143 VAL N N 143 120.189 120.189 118.756 1.433 17934 9331 1 13 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.682 0.001 17934 9332 1 13 . 1 1 143 143 VAL C C 143 178.066 178.066 176.183 1.883 17934 9333 1 13 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.392 2.178 17934 9334 1 13 . 1 1 143 143 VAL CB C 143 31.883 31.883 32.348 -0.465 17934 9335 1 13 . 1 1 143 143 VAL H H 143 8.608 8.608 8.012 0.596 17934 9336 1 13 . 1 1 144 144 ALA N N 144 121.753 121.753 119.080 2.673 17934 9337 1 13 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.145 -0.145 17934 9338 1 13 . 1 1 144 144 ALA C C 144 180.776 180.776 177.691 3.085 17934 9339 1 13 . 1 1 144 144 ALA CA C 144 55.780 55.780 52.818 2.962 17934 9340 1 13 . 1 1 144 144 ALA CB C 144 18.770 18.770 16.790 1.980 17934 9341 1 13 . 1 1 144 144 ALA H H 144 8.399 8.399 7.968 0.431 17934 9342 1 13 . 1 1 145 145 TYR N N 145 119.962 119.962 119.244 0.718 17934 9343 1 13 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.108 0.082 17934 9344 1 13 . 1 1 145 145 TYR C C 145 177.645 177.645 177.072 0.573 17934 9345 1 13 . 1 1 145 145 TYR CA C 145 60.880 60.880 60.916 -0.036 17934 9346 1 13 . 1 1 145 145 TYR CB C 145 37.980 37.980 38.663 -0.683 17934 9347 1 13 . 1 1 145 145 TYR H H 145 8.190 8.190 8.605 -0.415 17934 9348 1 14 . 1 1 13 13 LYS N N 13 120.778 120.778 123.972 -3.194 17934 9349 1 14 . 1 1 13 13 LYS C C 13 176.476 176.476 175.882 0.594 17934 9350 1 14 . 1 1 13 13 LYS CA C 13 58.601 58.601 56.931 1.670 17934 9351 1 14 . 1 1 13 13 LYS CB C 13 32.820 32.820 32.489 0.332 17934 9352 1 14 . 1 1 13 13 LYS H H 13 7.984 7.984 8.529 -0.545 17934 9353 1 14 . 1 1 15 15 ILE HA H 15 3.820 3.820 3.888 -0.068 17934 9354 1 14 . 1 1 15 15 ILE C C 15 176.376 176.376 176.577 -0.201 17934 9355 1 14 . 1 1 15 15 ILE CA C 15 63.570 63.570 61.595 1.975 17934 9356 1 14 . 1 1 15 15 ILE CB C 15 39.380 39.380 36.555 2.825 17934 9357 1 14 . 1 1 16 16 ALA N N 16 121.364 121.364 120.210 1.154 17934 9358 1 14 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.413 0.025 17934 9359 1 14 . 1 1 16 16 ALA C C 16 177.494 177.494 177.265 0.229 17934 9360 1 14 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.494 0.482 17934 9361 1 14 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.808 0.525 17934 9362 1 14 . 1 1 16 16 ALA H H 16 8.081 8.081 7.734 0.347 17934 9363 1 14 . 1 1 17 17 GLN N N 17 118.109 118.109 116.320 1.789 17934 9364 1 14 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.441 0.132 17934 9365 1 14 . 1 1 17 17 GLN C C 17 173.632 173.632 174.821 -1.189 17934 9366 1 14 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.100 -0.249 17934 9367 1 14 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.449 0.028 17934 9368 1 14 . 1 1 17 17 GLN H H 17 7.550 7.550 8.090 -0.540 17934 9369 1 14 . 1 1 18 18 SER N N 18 112.384 112.384 114.901 -2.517 17934 9370 1 14 . 1 1 18 18 SER HA H 18 4.388 4.388 4.949 -0.560 17934 9371 1 14 . 1 1 18 18 SER C C 18 173.780 173.780 173.405 0.375 17934 9372 1 14 . 1 1 18 18 SER CA C 18 57.664 57.664 56.674 0.990 17934 9373 1 14 . 1 1 18 18 SER CB C 18 65.164 65.164 65.978 -0.814 17934 9374 1 14 . 1 1 18 18 SER H H 18 7.666 7.666 8.017 -0.351 17934 9375 1 14 . 1 1 19 19 CYS N N 19 120.116 120.116 120.347 -0.231 17934 9376 1 14 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.511 -0.181 17934 9377 1 14 . 1 1 19 19 CYS C C 19 180.387 180.387 172.930 7.457 17934 9378 1 14 . 1 1 19 19 CYS CA C 19 58.601 58.601 59.569 -0.968 17934 9379 1 14 . 1 1 19 19 CYS CB C 19 30.008 30.008 31.374 -1.366 17934 9380 1 14 . 1 1 19 19 CYS H H 19 8.835 8.835 8.854 -0.019 17934 9381 1 14 . 1 1 20 20 ASP N N 20 124.416 124.416 121.665 2.751 17934 9382 1 14 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.635 -0.659 17934 9383 1 14 . 1 1 20 20 ASP CB C 20 42.195 42.195 44.588 -2.393 17934 9384 1 14 . 1 1 20 20 ASP H H 20 7.847 7.847 8.051 -0.204 17934 9385 1 14 . 1 1 21 21 TYR N N 21 121.296 121.296 120.152 1.144 17934 9386 1 14 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.734 -0.004 17934 9387 1 14 . 1 1 21 21 TYR C C 21 175.793 175.793 174.282 1.511 17934 9388 1 14 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.834 0.366 17934 9389 1 14 . 1 1 21 21 TYR CB C 21 43.240 43.240 43.668 -0.428 17934 9390 1 14 . 1 1 21 21 TYR H H 21 9.070 9.070 8.766 0.304 17934 9391 1 14 . 1 1 22 22 LYS N N 22 122.820 122.820 121.605 1.215 17934 9392 1 14 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.290 -0.099 17934 9393 1 14 . 1 1 22 22 LYS C C 22 175.793 175.793 175.456 0.337 17934 9394 1 14 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.514 0.744 17934 9395 1 14 . 1 1 22 22 LYS CB C 22 33.758 33.758 33.407 0.351 17934 9396 1 14 . 1 1 22 22 LYS H H 22 8.711 8.711 8.649 0.062 17934 9397 1 14 . 1 1 23 23 ALA N N 23 123.073 123.073 127.199 -4.126 17934 9398 1 14 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.333 0.397 17934 9399 1 14 . 1 1 23 23 ALA C C 23 174.515 174.515 175.487 -0.972 17934 9400 1 14 . 1 1 23 23 ALA CA C 23 51.570 51.570 49.903 1.667 17934 9401 1 14 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.634 -1.006 17934 9402 1 14 . 1 1 23 23 ALA H H 23 8.727 8.727 8.615 0.112 17934 9403 1 14 . 1 1 24 24 ALA N N 24 122.486 122.486 123.605 -1.119 17934 9404 1 14 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.742 0.439 17934 9405 1 14 . 1 1 24 24 ALA C C 24 176.835 176.835 176.039 0.796 17934 9406 1 14 . 1 1 24 24 ALA CA C 24 51.570 51.570 50.907 0.663 17934 9407 1 14 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.399 -0.279 17934 9408 1 14 . 1 1 24 24 ALA H H 24 8.675 8.675 8.701 -0.026 17934 9409 1 14 . 1 1 25 25 TYR N N 25 122.698 122.698 125.043 -2.345 17934 9410 1 14 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.409 0.602 17934 9411 1 14 . 1 1 25 25 TYR CA C 25 54.340 54.340 59.262 -4.922 17934 9412 1 14 . 1 1 25 25 TYR CB C 25 39.850 39.850 38.610 1.240 17934 9413 1 14 . 1 1 25 25 TYR H H 25 8.270 8.270 8.521 -0.251 17934 9414 1 14 . 1 1 26 26 LEU N N 26 127.997 127.997 129.875 -1.878 17934 9415 1 14 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.395 -0.475 17934 9416 1 14 . 1 1 26 26 LEU C C 26 175.983 175.983 176.967 -0.984 17934 9417 1 14 . 1 1 26 26 LEU CA C 26 56.726 56.726 55.818 0.908 17934 9418 1 14 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.474 -2.404 17934 9419 1 14 . 1 1 26 26 LEU H H 26 8.700 8.700 8.588 0.112 17934 9420 1 14 . 1 1 27 27 GLY N N 27 102.901 102.901 102.622 0.279 17934 9421 1 14 . 1 1 27 27 GLY C C 27 176.219 176.219 171.706 4.513 17934 9422 1 14 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.411 -1.810 17934 9423 1 14 . 1 1 27 27 GLY H H 27 5.891 5.891 7.813 -1.922 17934 9424 1 14 . 1 1 28 28 SER N N 28 111.551 111.551 114.842 -3.291 17934 9425 1 14 . 1 1 28 28 SER HA H 28 5.785 5.785 5.544 0.241 17934 9426 1 14 . 1 1 28 28 SER CA C 28 56.258 56.258 57.133 -0.875 17934 9427 1 14 . 1 1 28 28 SER CB C 28 65.632 65.632 66.752 -1.120 17934 9428 1 14 . 1 1 28 28 SER H H 28 7.981 7.981 8.557 -0.576 17934 9429 1 14 . 1 1 29 29 MET N N 29 119.493 119.493 120.536 -1.043 17934 9430 1 14 . 1 1 29 29 MET HA H 29 4.725 4.725 4.851 -0.126 17934 9431 1 14 . 1 1 29 29 MET C C 29 174.143 174.143 174.120 0.023 17934 9432 1 14 . 1 1 29 29 MET CA C 29 54.036 54.036 52.859 1.177 17934 9433 1 14 . 1 1 29 29 MET CB C 29 37.268 37.268 35.362 1.905 17934 9434 1 14 . 1 1 29 29 MET H H 29 8.704 8.704 8.918 -0.214 17934 9435 1 14 . 1 1 30 30 LEU N N 30 128.150 128.150 124.481 3.669 17934 9436 1 14 . 1 1 30 30 LEU HA H 30 3.785 3.785 4.320 -0.535 17934 9437 1 14 . 1 1 30 30 LEU C C 30 175.857 175.857 175.596 0.261 17934 9438 1 14 . 1 1 30 30 LEU CA C 30 56.250 56.250 53.563 2.687 17934 9439 1 14 . 1 1 30 30 LEU CB C 30 42.660 42.660 42.785 -0.125 17934 9440 1 14 . 1 1 30 30 LEU H H 30 8.630 8.630 8.304 0.326 17934 9441 1 14 . 1 1 31 31 ILE N N 31 127.723 127.723 126.237 1.486 17934 9442 1 14 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.245 -0.055 17934 9443 1 14 . 1 1 31 31 ILE C C 31 174.881 174.881 174.563 0.318 17934 9444 1 14 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.483 -1.823 17934 9445 1 14 . 1 1 31 31 ILE CB C 31 37.110 37.110 37.749 -0.639 17934 9446 1 14 . 1 1 31 31 ILE H H 31 8.560 8.560 8.537 0.023 17934 9447 1 14 . 1 1 32 32 LYS HA H 32 4.055 4.055 3.926 0.129 17934 9448 1 14 . 1 1 32 32 LYS C C 32 176.272 176.272 176.591 -0.319 17934 9449 1 14 . 1 1 32 32 LYS CA C 32 58.601 58.601 56.165 2.436 17934 9450 1 14 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.495 0.325 17934 9451 1 14 . 1 1 33 33 GLU N N 33 118.638 118.638 117.230 1.408 17934 9452 1 14 . 1 1 33 33 GLU HA H 33 4.388 4.388 3.922 0.466 17934 9453 1 14 . 1 1 33 33 GLU C C 33 173.962 173.962 174.897 -0.935 17934 9454 1 14 . 1 1 33 33 GLU CA C 33 54.851 54.851 57.229 -2.378 17934 9455 1 14 . 1 1 33 33 GLU CB C 33 30.945 30.945 28.888 2.057 17934 9456 1 14 . 1 1 33 33 GLU H H 33 7.723 7.723 8.402 -0.679 17934 9457 1 14 . 1 1 34 34 LEU N N 34 126.535 126.535 120.001 6.534 17934 9458 1 14 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.477 -0.532 17934 9459 1 14 . 1 1 34 34 LEU C C 34 176.870 176.870 175.622 1.248 17934 9460 1 14 . 1 1 34 34 LEU CA C 34 54.850 54.850 54.046 0.804 17934 9461 1 14 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.757 -1.037 17934 9462 1 14 . 1 1 34 34 LEU H H 34 8.446 8.446 7.708 0.738 17934 9463 1 14 . 1 1 35 35 ARG N N 35 128.447 128.447 125.632 2.815 17934 9464 1 14 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.678 -0.123 17934 9465 1 14 . 1 1 35 35 ARG C C 35 176.110 176.110 175.220 0.890 17934 9466 1 14 . 1 1 35 35 ARG CA C 35 54.851 54.851 55.307 -0.456 17934 9467 1 14 . 1 1 35 35 ARG CB C 35 30.477 30.477 31.279 -0.802 17934 9468 1 14 . 1 1 35 35 ARG H H 35 8.680 8.680 8.231 0.449 17934 9469 1 14 . 1 1 36 36 GLY N N 36 107.406 107.406 113.745 -6.339 17934 9470 1 14 . 1 1 36 36 GLY CA C 36 45.906 45.906 44.903 1.004 17934 9471 1 14 . 1 1 36 36 GLY H H 36 7.182 7.182 8.356 -1.174 17934 9472 1 14 . 1 1 37 37 THR HA H 37 4.060 4.060 4.062 -0.003 17934 9473 1 14 . 1 1 37 37 THR C C 37 176.634 176.634 175.811 0.823 17934 9474 1 14 . 1 1 37 37 THR CA C 37 65.632 65.632 63.306 2.326 17934 9475 1 14 . 1 1 37 37 THR CB C 37 68.445 68.445 69.089 -0.644 17934 9476 1 14 . 1 1 38 38 GLU N N 38 122.251 122.251 121.709 0.542 17934 9477 1 14 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.941 0.185 17934 9478 1 14 . 1 1 38 38 GLU C C 38 179.981 179.981 178.271 1.710 17934 9479 1 14 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.399 0.609 17934 9480 1 14 . 1 1 38 38 GLU CB C 38 29.539 29.539 28.963 0.576 17934 9481 1 14 . 1 1 38 38 GLU H H 38 8.450 8.450 8.436 0.014 17934 9482 1 14 . 1 1 39 39 SER N N 39 115.966 115.966 113.297 2.669 17934 9483 1 14 . 1 1 39 39 SER C C 39 175.991 175.991 176.122 -0.131 17934 9484 1 14 . 1 1 39 39 SER CA C 39 62.820 62.820 61.582 1.238 17934 9485 1 14 . 1 1 39 39 SER H H 39 7.522 7.522 7.620 -0.098 17934 9486 1 14 . 1 1 40 40 THR HA H 40 4.049 4.049 3.790 0.259 17934 9487 1 14 . 1 1 40 40 THR C C 40 175.972 175.972 176.688 -0.716 17934 9488 1 14 . 1 1 40 40 THR CA C 40 66.101 66.101 65.986 0.115 17934 9489 1 14 . 1 1 40 40 THR CB C 40 67.976 67.976 68.159 -0.183 17934 9490 1 14 . 1 1 41 41 GLN N N 41 120.354 120.354 119.238 1.116 17934 9491 1 14 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.041 -0.282 17934 9492 1 14 . 1 1 41 41 GLN C C 41 178.483 178.483 178.486 -0.003 17934 9493 1 14 . 1 1 41 41 GLN CA C 41 60.476 60.476 58.544 1.932 17934 9494 1 14 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.462 -0.329 17934 9495 1 14 . 1 1 41 41 GLN H H 41 8.271 8.271 8.258 0.013 17934 9496 1 14 . 1 1 42 42 ASP N N 42 120.757 120.757 120.944 -0.187 17934 9497 1 14 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.303 0.056 17934 9498 1 14 . 1 1 42 42 ASP C C 42 177.480 177.480 177.904 -0.424 17934 9499 1 14 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.509 0.155 17934 9500 1 14 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.753 1.442 17934 9501 1 14 . 1 1 42 42 ASP H H 42 7.954 7.954 7.952 0.002 17934 9502 1 14 . 1 1 43 43 ALA N N 43 120.587 120.587 122.513 -1.926 17934 9503 1 14 . 1 1 43 43 ALA HA H 43 3.990 3.990 3.912 0.078 17934 9504 1 14 . 1 1 43 43 ALA C C 43 179.767 179.767 179.177 0.590 17934 9505 1 14 . 1 1 43 43 ALA CA C 43 55.320 55.320 55.784 -0.464 17934 9506 1 14 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.154 1.076 17934 9507 1 14 . 1 1 43 43 ALA H H 43 7.842 7.842 8.277 -0.435 17934 9508 1 14 . 1 1 44 44 CYS N N 44 115.428 115.428 117.557 -2.129 17934 9509 1 14 . 1 1 44 44 CYS HA H 44 3.895 3.895 3.901 -0.006 17934 9510 1 14 . 1 1 44 44 CYS C C 44 176.076 176.076 176.818 -0.742 17934 9511 1 14 . 1 1 44 44 CYS CA C 44 64.695 64.695 62.859 1.835 17934 9512 1 14 . 1 1 44 44 CYS CB C 44 27.664 27.664 26.392 1.272 17934 9513 1 14 . 1 1 44 44 CYS H H 44 7.900 7.900 8.376 -0.476 17934 9514 1 14 . 1 1 45 45 ALA N N 45 120.487 120.487 121.435 -0.948 17934 9515 1 14 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.946 0.054 17934 9516 1 14 . 1 1 45 45 ALA C C 45 173.506 173.506 179.239 -5.733 17934 9517 1 14 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.035 0.285 17934 9518 1 14 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.209 -0.269 17934 9519 1 14 . 1 1 45 45 ALA H H 45 7.250 7.250 7.952 -0.702 17934 9520 1 14 . 1 1 46 46 LYS N N 46 119.267 119.267 119.680 -0.413 17934 9521 1 14 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.935 0.012 17934 9522 1 14 . 1 1 46 46 LYS C C 46 179.561 179.561 178.976 0.585 17934 9523 1 14 . 1 1 46 46 LYS H H 46 8.102 8.102 8.002 0.100 17934 9524 1 14 . 1 1 47 47 MET N N 47 118.009 118.009 118.217 -0.208 17934 9525 1 14 . 1 1 47 47 MET HA H 47 4.214 4.214 4.178 0.036 17934 9526 1 14 . 1 1 47 47 MET C C 47 179.526 179.526 178.419 1.107 17934 9527 1 14 . 1 1 47 47 MET CA C 47 57.195 57.195 58.917 -1.722 17934 9528 1 14 . 1 1 47 47 MET CB C 47 30.945 30.945 32.364 -1.419 17934 9529 1 14 . 1 1 47 47 MET H H 47 8.585 8.585 8.139 0.446 17934 9530 1 14 . 1 1 48 48 ARG N N 48 119.962 119.962 119.430 0.532 17934 9531 1 14 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.901 -0.045 17934 9532 1 14 . 1 1 48 48 ARG C C 48 178.875 178.875 177.575 1.300 17934 9533 1 14 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.005 1.940 17934 9534 1 14 . 1 1 48 48 ARG CB C 48 30.477 30.477 30.030 0.447 17934 9535 1 14 . 1 1 48 48 ARG H H 48 8.190 8.190 8.440 -0.250 17934 9536 1 14 . 1 1 49 49 ALA N N 49 120.640 120.640 119.145 1.495 17934 9537 1 14 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.171 -0.428 17934 9538 1 14 . 1 1 49 49 ALA C C 49 180.169 180.169 179.670 0.499 17934 9539 1 14 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.407 0.444 17934 9540 1 14 . 1 1 49 49 ALA CB C 49 17.821 17.821 19.061 -1.240 17934 9541 1 14 . 1 1 49 49 ALA H H 49 7.671 7.671 8.108 -0.437 17934 9542 1 14 . 1 1 50 50 ASN N N 50 116.063 116.063 118.317 -2.254 17934 9543 1 14 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.517 -0.043 17934 9544 1 14 . 1 1 50 50 ASN C C 50 177.084 177.084 177.191 -0.107 17934 9545 1 14 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.823 -0.034 17934 9546 1 14 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.853 0.061 17934 9547 1 14 . 1 1 50 50 ASN H H 50 7.893 7.893 8.138 -0.245 17934 9548 1 14 . 1 1 51 51 CYS N N 51 116.884 116.884 117.981 -1.097 17934 9549 1 14 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.424 -0.118 17934 9550 1 14 . 1 1 51 51 CYS C C 51 175.002 175.002 175.099 -0.097 17934 9551 1 14 . 1 1 51 51 CYS CA C 51 61.414 61.414 58.445 2.969 17934 9552 1 14 . 1 1 51 51 CYS CB C 51 27.664 27.664 27.500 0.164 17934 9553 1 14 . 1 1 51 51 CYS H H 51 7.770 7.770 8.357 -0.587 17934 9554 1 14 . 1 1 52 52 GLN N N 52 117.831 117.831 119.843 -2.012 17934 9555 1 14 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.004 0.224 17934 9556 1 14 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.492 -1.766 17934 9557 1 14 . 1 1 52 52 GLN CB C 52 29.070 29.070 27.912 1.159 17934 9558 1 14 . 1 1 52 52 GLN H H 52 7.796 7.796 8.169 -0.373 17934 9559 1 14 . 1 1 53 53 LYS N N 53 118.841 118.841 119.702 -0.861 17934 9560 1 14 . 1 1 53 53 LYS CA C 53 57.195 57.195 57.492 -0.297 17934 9561 1 14 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.872 0.417 17934 9562 1 14 . 1 1 53 53 LYS H H 53 7.686 7.686 8.125 -0.439 17934 9563 1 14 . 1 1 55 55 THR HA H 55 4.304 4.304 3.994 0.310 17934 9564 1 14 . 1 1 55 55 THR CA C 55 63.757 63.757 66.108 -2.351 17934 9565 1 14 . 1 1 55 55 THR CB C 55 68.914 68.914 68.685 0.229 17934 9566 1 14 . 1 1 56 56 GLU N N 56 120.861 120.861 118.448 2.413 17934 9567 1 14 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.192 -0.045 17934 9568 1 14 . 1 1 56 56 GLU C C 56 177.656 177.656 179.175 -1.519 17934 9569 1 14 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.844 -0.711 17934 9570 1 14 . 1 1 56 56 GLU CB C 56 30.008 30.008 29.473 0.535 17934 9571 1 14 . 1 1 56 56 GLU H H 56 8.311 8.311 8.464 -0.153 17934 9572 1 14 . 1 1 57 57 GLN N N 57 118.397 118.397 119.259 -0.862 17934 9573 1 14 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.175 -0.033 17934 9574 1 14 . 1 1 57 57 GLN C C 57 177.275 177.275 178.335 -1.060 17934 9575 1 14 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.697 -0.033 17934 9576 1 14 . 1 1 57 57 GLN CB C 57 29.070 29.070 28.710 0.360 17934 9577 1 14 . 1 1 57 57 GLN H H 57 7.899 7.899 8.180 -0.281 17934 9578 1 14 . 1 1 58 58 MET N N 58 118.897 118.897 119.347 -0.450 17934 9579 1 14 . 1 1 58 58 MET HA H 58 4.350 4.350 4.255 0.095 17934 9580 1 14 . 1 1 58 58 MET C C 58 177.172 177.172 176.673 0.499 17934 9581 1 14 . 1 1 58 58 MET CA C 58 56.726 56.726 58.921 -2.195 17934 9582 1 14 . 1 1 58 58 MET CB C 58 32.196 32.196 32.917 -0.721 17934 9583 1 14 . 1 1 58 58 MET H H 58 8.036 8.036 7.815 0.221 17934 9584 1 14 . 1 1 59 59 LYS N N 59 119.779 119.779 114.986 4.793 17934 9585 1 14 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.552 -0.321 17934 9586 1 14 . 1 1 59 59 LYS C C 59 176.676 176.676 176.370 0.306 17934 9587 1 14 . 1 1 59 59 LYS CA C 59 57.195 57.195 55.984 1.211 17934 9588 1 14 . 1 1 59 59 LYS CB C 59 32.820 32.820 31.396 1.424 17934 9589 1 14 . 1 1 59 59 LYS H H 59 7.901 7.901 7.543 0.358 17934 9590 1 14 . 1 1 60 60 LYS N N 60 119.993 119.993 120.284 -0.291 17934 9591 1 14 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.411 -0.076 17934 9592 1 14 . 1 1 60 60 LYS C C 60 176.336 176.336 175.665 0.671 17934 9593 1 14 . 1 1 60 60 LYS CA C 60 56.258 56.258 55.840 0.418 17934 9594 1 14 . 1 1 60 60 LYS CB C 60 32.820 32.820 33.558 -0.738 17934 9595 1 14 . 1 1 60 60 LYS H H 60 7.877 7.877 8.250 -0.373 17934 9596 1 14 . 1 1 61 61 VAL N N 61 122.649 122.649 119.058 3.591 17934 9597 1 14 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.486 -0.106 17934 9598 1 14 . 1 1 61 61 VAL C C 61 174.210 174.210 173.871 0.339 17934 9599 1 14 . 1 1 61 61 VAL CA C 61 60.000 60.000 58.637 1.363 17934 9600 1 14 . 1 1 61 61 VAL CB C 61 32.350 32.350 32.590 -0.240 17934 9601 1 14 . 1 1 61 61 VAL H H 61 7.708 7.708 7.507 0.201 17934 9602 1 14 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.645 0.018 17934 9603 1 14 . 1 1 62 62 PRO C C 62 176.656 176.656 176.255 0.401 17934 9604 1 14 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.546 0.274 17934 9605 1 14 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.528 -0.645 17934 9606 1 14 . 1 1 63 63 THR N N 63 117.155 117.155 116.731 0.424 17934 9607 1 14 . 1 1 63 63 THR HA H 63 4.830 4.830 4.902 -0.072 17934 9608 1 14 . 1 1 63 63 THR C C 63 174.682 174.682 173.536 1.146 17934 9609 1 14 . 1 1 63 63 THR CA C 63 62.820 62.820 62.550 0.270 17934 9610 1 14 . 1 1 63 63 THR CB C 63 69.382 69.382 70.345 -0.963 17934 9611 1 14 . 1 1 63 63 THR H H 63 8.303 8.303 8.530 -0.227 17934 9612 1 14 . 1 1 64 64 ILE N N 64 121.004 121.004 120.530 0.474 17934 9613 1 14 . 1 1 64 64 ILE CA C 64 58.600 58.600 59.602 -1.002 17934 9614 1 14 . 1 1 64 64 ILE CB C 64 42.690 42.690 41.762 0.928 17934 9615 1 14 . 1 1 64 64 ILE H H 64 9.348 9.348 8.784 0.564 17934 9616 1 14 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.110 0.630 17934 9617 1 14 . 1 1 65 65 ILE C C 65 175.378 175.378 174.587 0.791 17934 9618 1 14 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.215 -1.135 17934 9619 1 14 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.612 1.138 17934 9620 1 14 . 1 1 66 66 LEU N N 66 110.343 110.343 130.600 -20.257 17934 9621 1 14 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.922 -0.072 17934 9622 1 14 . 1 1 66 66 LEU C C 66 174.982 174.982 176.036 -1.054 17934 9623 1 14 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.532 -0.622 17934 9624 1 14 . 1 1 66 66 LEU CB C 66 44.230 44.230 43.051 1.179 17934 9625 1 14 . 1 1 66 66 LEU H H 66 9.610 9.610 9.279 0.331 17934 9626 1 14 . 1 1 67 67 SER N N 67 120.990 120.990 120.714 0.276 17934 9627 1 14 . 1 1 67 67 SER HA H 67 5.405 5.405 4.976 0.429 17934 9628 1 14 . 1 1 67 67 SER C C 67 174.405 174.405 172.984 1.421 17934 9629 1 14 . 1 1 67 67 SER CA C 67 57.195 57.195 57.144 0.051 17934 9630 1 14 . 1 1 67 67 SER CB C 67 64.695 64.695 64.122 0.573 17934 9631 1 14 . 1 1 67 67 SER H H 67 9.260 9.260 9.248 0.012 17934 9632 1 14 . 1 1 68 68 VAL N N 68 128.176 128.176 125.803 2.373 17934 9633 1 14 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.416 0.077 17934 9634 1 14 . 1 1 68 68 VAL C C 68 173.891 173.891 173.330 0.561 17934 9635 1 14 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.461 1.889 17934 9636 1 14 . 1 1 68 68 VAL CB C 68 33.750 33.750 33.572 0.178 17934 9637 1 14 . 1 1 68 68 VAL H H 68 9.225 9.225 8.836 0.389 17934 9638 1 14 . 1 1 69 69 SER N N 69 121.697 121.697 123.390 -1.693 17934 9639 1 14 . 1 1 69 69 SER HA H 69 4.837 4.837 4.829 0.008 17934 9640 1 14 . 1 1 69 69 SER C C 69 173.188 173.188 174.767 -1.579 17934 9641 1 14 . 1 1 69 69 SER CA C 69 57.195 57.195 55.895 1.300 17934 9642 1 14 . 1 1 69 69 SER CB C 69 67.976 67.976 65.370 2.606 17934 9643 1 14 . 1 1 69 69 SER H H 69 8.869 8.869 8.880 -0.011 17934 9644 1 14 . 1 1 70 70 ALA N N 70 118.689 118.689 128.222 -9.533 17934 9645 1 14 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.181 -0.031 17934 9646 1 14 . 1 1 70 70 ALA C C 70 176.714 176.714 176.866 -0.152 17934 9647 1 14 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.231 -0.321 17934 9648 1 14 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.319 0.281 17934 9649 1 14 . 1 1 70 70 ALA H H 70 8.810 8.810 9.055 -0.245 17934 9650 1 14 . 1 1 71 71 LYS N N 71 112.633 112.633 113.135 -0.502 17934 9651 1 14 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.422 -0.147 17934 9652 1 14 . 1 1 71 71 LYS C C 71 177.033 177.033 176.020 1.013 17934 9653 1 14 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.680 1.515 17934 9654 1 14 . 1 1 71 71 LYS CB C 71 33.289 33.289 32.654 0.635 17934 9655 1 14 . 1 1 71 71 LYS H H 71 7.830 7.830 7.781 0.049 17934 9656 1 14 . 1 1 72 72 GLY N N 72 108.432 108.432 107.717 0.715 17934 9657 1 14 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.273 0.203 17934 9658 1 14 . 1 1 72 72 GLY H H 72 7.685 7.685 7.778 -0.093 17934 9659 1 14 . 1 1 73 73 VAL N N 73 120.414 120.414 115.485 4.929 17934 9660 1 14 . 1 1 73 73 VAL HA H 73 5.000 5.000 5.121 -0.121 17934 9661 1 14 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.107 1.363 17934 9662 1 14 . 1 1 73 73 VAL CB C 73 35.630 35.630 34.962 0.668 17934 9663 1 14 . 1 1 73 73 VAL H H 73 8.620 8.620 8.210 0.410 17934 9664 1 14 . 1 1 74 74 LYS N N 74 125.257 125.257 122.638 2.619 17934 9665 1 14 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.939 0.077 17934 9666 1 14 . 1 1 74 74 LYS CA C 74 54.383 54.383 53.770 0.613 17934 9667 1 14 . 1 1 74 74 LYS CB C 74 36.570 36.570 36.139 0.431 17934 9668 1 14 . 1 1 74 74 LYS H H 74 8.783 8.783 8.732 0.051 17934 9669 1 14 . 1 1 75 75 PHE N N 75 119.414 119.414 118.129 1.285 17934 9670 1 14 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.478 0.222 17934 9671 1 14 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.757 -2.837 17934 9672 1 14 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.596 -0.986 17934 9673 1 14 . 1 1 75 75 PHE H H 75 8.432 8.432 9.107 -0.675 17934 9674 1 14 . 1 1 76 76 ILE N N 76 121.430 121.430 121.738 -0.308 17934 9675 1 14 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.546 0.294 17934 9676 1 14 . 1 1 76 76 ILE C C 76 175.249 175.249 174.178 1.071 17934 9677 1 14 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.526 -0.456 17934 9678 1 14 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.093 0.127 17934 9679 1 14 . 1 1 76 76 ILE H H 76 8.960 8.960 8.400 0.560 17934 9680 1 14 . 1 1 77 77 ASP N N 77 125.744 125.744 123.862 1.882 17934 9681 1 14 . 1 1 77 77 ASP HA H 77 4.563 4.563 4.899 -0.336 17934 9682 1 14 . 1 1 77 77 ASP C C 77 177.569 177.569 175.602 1.967 17934 9683 1 14 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.860 2.929 17934 9684 1 14 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.182 0.419 17934 9685 1 14 . 1 1 77 77 ASP H H 77 8.750 8.750 8.105 0.645 17934 9686 1 14 . 1 1 78 78 ALA N N 78 128.632 128.632 128.624 0.008 17934 9687 1 14 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.279 -0.309 17934 9688 1 14 . 1 1 78 78 ALA C C 78 178.052 178.052 178.393 -0.341 17934 9689 1 14 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.037 0.793 17934 9690 1 14 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.562 0.231 17934 9691 1 14 . 1 1 78 78 ALA H H 78 8.700 8.700 8.789 -0.089 17934 9692 1 14 . 1 1 79 79 THR N N 79 113.087 113.087 114.923 -1.836 17934 9693 1 14 . 1 1 79 79 THR HA H 79 4.194 4.194 4.191 0.003 17934 9694 1 14 . 1 1 79 79 THR C C 79 175.587 175.587 175.872 -0.285 17934 9695 1 14 . 1 1 79 79 THR CA C 79 64.695 64.695 65.204 -0.508 17934 9696 1 14 . 1 1 79 79 THR CB C 79 69.382 69.382 69.128 0.254 17934 9697 1 14 . 1 1 79 79 THR H H 79 8.779 8.779 8.434 0.345 17934 9698 1 14 . 1 1 80 80 ASN N N 80 118.434 118.434 116.073 2.361 17934 9699 1 14 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.729 0.008 17934 9700 1 14 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.711 0.734 17934 9701 1 14 . 1 1 80 80 ASN CB C 80 39.383 39.383 39.544 -0.161 17934 9702 1 14 . 1 1 80 80 ASN H H 80 8.584 8.584 7.828 0.756 17934 9703 1 14 . 1 1 81 81 LYS N N 81 112.429 112.429 115.618 -3.189 17934 9704 1 14 . 1 1 81 81 LYS C C 81 174.909 174.909 175.848 -0.939 17934 9705 1 14 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.410 0.254 17934 9706 1 14 . 1 1 81 81 LYS CB C 81 28.602 28.602 29.737 -1.135 17934 9707 1 14 . 1 1 81 81 LYS H H 81 7.966 7.966 8.411 -0.445 17934 9708 1 14 . 1 1 82 82 ASN N N 82 116.806 116.806 116.689 0.117 17934 9709 1 14 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.626 -0.036 17934 9710 1 14 . 1 1 82 82 ASN C C 82 174.999 174.999 174.062 0.937 17934 9711 1 14 . 1 1 82 82 ASN CA C 82 52.976 52.976 52.675 0.301 17934 9712 1 14 . 1 1 82 82 ASN CB C 82 38.445 38.445 39.673 -1.228 17934 9713 1 14 . 1 1 82 82 ASN H H 82 8.455 8.455 8.036 0.419 17934 9714 1 14 . 1 1 83 83 ILE N N 83 122.447 122.447 119.707 2.740 17934 9715 1 14 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.229 -0.199 17934 9716 1 14 . 1 1 83 83 ILE C C 83 176.572 176.572 175.632 0.940 17934 9717 1 14 . 1 1 83 83 ILE CA C 83 62.350 62.350 60.561 1.789 17934 9718 1 14 . 1 1 83 83 ILE CB C 83 37.970 37.970 38.206 -0.236 17934 9719 1 14 . 1 1 83 83 ILE H H 83 8.650 8.650 8.299 0.351 17934 9720 1 14 . 1 1 84 84 ILE N N 84 129.339 129.339 127.222 2.117 17934 9721 1 14 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.206 -0.286 17934 9722 1 14 . 1 1 84 84 ILE C C 84 175.873 175.873 176.283 -0.410 17934 9723 1 14 . 1 1 84 84 ILE CA C 84 62.810 62.810 60.914 1.896 17934 9724 1 14 . 1 1 84 84 ILE CB C 84 38.840 38.840 38.521 0.319 17934 9725 1 14 . 1 1 84 84 ILE H H 84 8.930 8.930 8.245 0.685 17934 9726 1 14 . 1 1 85 85 ALA N N 85 118.867 118.867 120.464 -1.597 17934 9727 1 14 . 1 1 85 85 ALA C C 85 174.100 174.100 174.550 -0.450 17934 9728 1 14 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.533 -0.963 17934 9729 1 14 . 1 1 85 85 ALA H H 85 7.048 7.048 8.113 -1.065 17934 9730 1 14 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.817 0.337 17934 9731 1 14 . 1 1 87 87 HIS C C 87 174.986 174.986 173.894 1.092 17934 9732 1 14 . 1 1 87 87 HIS CB C 87 34.350 34.350 33.718 0.632 17934 9733 1 14 . 1 1 88 88 GLU N N 88 125.372 125.372 120.387 4.985 17934 9734 1 14 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.203 0.318 17934 9735 1 14 . 1 1 88 88 GLU C C 88 179.047 179.047 178.051 0.996 17934 9736 1 14 . 1 1 88 88 GLU CA C 88 56.726 56.726 57.583 -0.857 17934 9737 1 14 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.569 -0.092 17934 9738 1 14 . 1 1 88 88 GLU H H 88 9.106 9.106 8.929 0.177 17934 9739 1 14 . 1 1 89 89 ILE N N 89 124.132 124.132 124.234 -0.102 17934 9740 1 14 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.975 0.044 17934 9741 1 14 . 1 1 89 89 ILE C C 89 176.095 176.095 177.594 -1.499 17934 9742 1 14 . 1 1 89 89 ILE CA C 89 62.351 62.351 64.430 -2.079 17934 9743 1 14 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.437 0.477 17934 9744 1 14 . 1 1 89 89 ILE H H 89 8.055 8.055 9.041 -0.986 17934 9745 1 14 . 1 1 90 90 ARG N N 90 116.949 116.949 115.304 1.645 17934 9746 1 14 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.285 0.053 17934 9747 1 14 . 1 1 90 90 ARG C C 90 176.578 176.578 176.206 0.372 17934 9748 1 14 . 1 1 90 90 ARG CA C 90 57.664 57.664 57.997 -0.333 17934 9749 1 14 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.607 -0.537 17934 9750 1 14 . 1 1 90 90 ARG H H 90 8.045 8.045 8.698 -0.653 17934 9751 1 14 . 1 1 91 91 ASN N N 91 116.320 116.320 116.932 -0.612 17934 9752 1 14 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.681 0.472 17934 9753 1 14 . 1 1 91 91 ASN C C 91 174.595 174.595 175.819 -1.224 17934 9754 1 14 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.102 -1.594 17934 9755 1 14 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.646 0.206 17934 9756 1 14 . 1 1 91 91 ASN H H 91 8.067 8.067 7.891 0.176 17934 9757 1 14 . 1 1 92 92 ILE N N 92 122.441 122.441 123.144 -0.703 17934 9758 1 14 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.842 1.231 17934 9759 1 14 . 1 1 92 92 ILE C C 92 175.229 175.229 175.593 -0.364 17934 9760 1 14 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.729 -0.849 17934 9761 1 14 . 1 1 92 92 ILE CB C 92 39.850 39.850 36.892 2.958 17934 9762 1 14 . 1 1 92 92 ILE H H 92 7.483 7.483 7.843 -0.360 17934 9763 1 14 . 1 1 93 93 SER N N 93 120.329 120.329 123.173 -2.844 17934 9764 1 14 . 1 1 93 93 SER HA H 93 4.684 4.684 4.239 0.445 17934 9765 1 14 . 1 1 93 93 SER C C 93 180.744 180.744 174.140 6.604 17934 9766 1 14 . 1 1 93 93 SER CA C 93 57.664 57.664 61.069 -3.405 17934 9767 1 14 . 1 1 93 93 SER CB C 93 66.570 66.570 64.180 2.390 17934 9768 1 14 . 1 1 93 93 SER H H 93 9.545 9.545 8.426 1.119 17934 9769 1 14 . 1 1 94 94 CYS N N 94 110.900 110.900 113.431 -2.531 17934 9770 1 14 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.551 -0.739 17934 9771 1 14 . 1 1 94 94 CYS C C 94 173.973 173.973 172.490 1.483 17934 9772 1 14 . 1 1 94 94 CYS CA C 94 59.539 59.539 57.694 1.845 17934 9773 1 14 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.731 -4.473 17934 9774 1 14 . 1 1 94 94 CYS H H 94 8.858 8.858 8.033 0.825 17934 9775 1 14 . 1 1 95 95 ALA N N 95 121.379 121.379 123.186 -1.807 17934 9776 1 14 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.571 -0.141 17934 9777 1 14 . 1 1 95 95 ALA C C 95 178.098 178.098 175.023 3.075 17934 9778 1 14 . 1 1 95 95 ALA CA C 95 52.650 52.650 52.194 0.456 17934 9779 1 14 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.725 -2.425 17934 9780 1 14 . 1 1 95 95 ALA H H 95 8.360 8.360 8.418 -0.058 17934 9781 1 14 . 1 1 96 96 ALA N N 96 122.576 122.576 123.805 -1.229 17934 9782 1 14 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.689 -0.009 17934 9783 1 14 . 1 1 96 96 ALA C C 96 175.716 175.716 174.914 0.802 17934 9784 1 14 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.854 0.586 17934 9785 1 14 . 1 1 96 96 ALA CB C 96 22.700 22.700 22.204 0.496 17934 9786 1 14 . 1 1 96 96 ALA H H 96 9.080 9.080 8.693 0.387 17934 9787 1 14 . 1 1 97 97 GLN N N 97 116.903 116.903 119.459 -2.556 17934 9788 1 14 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.536 0.394 17934 9789 1 14 . 1 1 97 97 GLN C C 97 175.270 175.270 174.016 1.254 17934 9790 1 14 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.837 1.014 17934 9791 1 14 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.740 2.018 17934 9792 1 14 . 1 1 97 97 GLN H H 97 8.369 8.369 8.157 0.212 17934 9793 1 14 . 1 1 98 98 ASP N N 98 124.971 124.971 121.367 3.604 17934 9794 1 14 . 1 1 98 98 ASP C C 98 175.217 175.217 175.874 -0.657 17934 9795 1 14 . 1 1 98 98 ASP CA C 98 52.039 52.039 51.832 0.207 17934 9796 1 14 . 1 1 98 98 ASP CB C 98 42.195 42.195 41.416 0.778 17934 9797 1 14 . 1 1 98 98 ASP H H 98 8.395 8.395 8.323 0.072 17934 9798 1 14 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.398 -0.164 17934 9799 1 14 . 1 1 99 99 PRO C C 99 178.433 178.433 178.020 0.413 17934 9800 1 14 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.732 -0.037 17934 9801 1 14 . 1 1 99 99 PRO CB C 99 32.352 32.352 31.959 0.393 17934 9802 1 14 . 1 1 100 100 GLU N N 100 116.223 116.223 119.018 -2.795 17934 9803 1 14 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.108 0.112 17934 9804 1 14 . 1 1 100 100 GLU C C 100 176.678 176.678 175.975 0.703 17934 9805 1 14 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.259 -1.533 17934 9806 1 14 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.855 2.090 17934 9807 1 14 . 1 1 100 100 GLU H H 100 8.643 8.643 8.715 -0.072 17934 9808 1 14 . 1 1 101 101 ASP N N 101 119.053 119.053 118.967 0.086 17934 9809 1 14 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.888 -0.345 17934 9810 1 14 . 1 1 101 101 ASP C C 101 174.771 174.771 176.672 -1.901 17934 9811 1 14 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.257 0.657 17934 9812 1 14 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.970 -0.181 17934 9813 1 14 . 1 1 101 101 ASP H H 101 7.597 7.597 7.840 -0.243 17934 9814 1 14 . 1 1 102 102 LEU N N 102 123.986 123.986 121.960 2.026 17934 9815 1 14 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.316 0.074 17934 9816 1 14 . 1 1 102 102 LEU C C 102 177.141 177.141 177.327 -0.186 17934 9817 1 14 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.023 0.637 17934 9818 1 14 . 1 1 102 102 LEU CB C 102 42.660 42.660 42.022 0.638 17934 9819 1 14 . 1 1 102 102 LEU H H 102 8.534 8.534 7.657 0.877 17934 9820 1 14 . 1 1 103 103 SER N N 103 112.339 112.339 111.971 0.368 17934 9821 1 14 . 1 1 103 103 SER HA H 103 4.290 4.290 4.205 0.085 17934 9822 1 14 . 1 1 103 103 SER C C 103 174.106 174.106 175.059 -0.953 17934 9823 1 14 . 1 1 103 103 SER CA C 103 60.945 60.945 60.733 0.212 17934 9824 1 14 . 1 1 103 103 SER CB C 103 63.757 63.757 63.094 0.662 17934 9825 1 14 . 1 1 103 103 SER H H 103 7.867 7.867 8.348 -0.481 17934 9826 1 14 . 1 1 104 104 THR N N 104 123.070 123.070 119.338 3.732 17934 9827 1 14 . 1 1 104 104 THR HA H 104 5.373 5.373 4.989 0.384 17934 9828 1 14 . 1 1 104 104 THR C C 104 180.693 180.693 172.633 8.060 17934 9829 1 14 . 1 1 104 104 THR CA C 104 63.289 63.289 62.715 0.574 17934 9830 1 14 . 1 1 104 104 THR CB C 104 69.382 69.382 70.624 -1.242 17934 9831 1 14 . 1 1 104 104 THR H H 104 8.830 8.830 7.895 0.935 17934 9832 1 14 . 1 1 105 105 PHE N N 105 122.582 122.582 124.006 -1.424 17934 9833 1 14 . 1 1 105 105 PHE HA H 105 5.470 5.470 5.015 0.455 17934 9834 1 14 . 1 1 105 105 PHE C C 105 179.211 179.211 172.351 6.860 17934 9835 1 14 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.360 -0.040 17934 9836 1 14 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.874 -0.084 17934 9837 1 14 . 1 1 105 105 PHE H H 105 9.170 9.170 8.981 0.189 17934 9838 1 14 . 1 1 106 106 ALA N N 106 119.567 119.567 125.097 -5.530 17934 9839 1 14 . 1 1 106 106 ALA C C 106 175.603 175.603 175.181 0.422 17934 9840 1 14 . 1 1 106 106 ALA H H 106 8.770 8.770 8.788 -0.018 17934 9841 1 14 . 1 1 107 107 TYR N N 107 109.933 109.933 118.365 -8.432 17934 9842 1 14 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.326 -0.406 17934 9843 1 14 . 1 1 107 107 TYR C C 107 180.426 180.426 172.922 7.504 17934 9844 1 14 . 1 1 107 107 TYR CA C 107 57.080 57.080 54.656 2.424 17934 9845 1 14 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.188 -0.399 17934 9846 1 14 . 1 1 107 107 TYR H H 107 7.950 7.950 8.248 -0.298 17934 9847 1 14 . 1 1 108 108 ILE N N 108 120.613 120.613 117.734 2.879 17934 9848 1 14 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.677 0.693 17934 9849 1 14 . 1 1 108 108 ILE C C 108 176.212 176.212 175.795 0.417 17934 9850 1 14 . 1 1 108 108 ILE CA C 108 59.540 59.540 58.734 0.805 17934 9851 1 14 . 1 1 108 108 ILE CB C 108 39.380 39.380 38.970 0.410 17934 9852 1 14 . 1 1 108 108 ILE H H 108 8.869 8.869 8.665 0.204 17934 9853 1 14 . 1 1 109 109 THR N N 109 116.505 116.505 114.356 2.149 17934 9854 1 14 . 1 1 109 109 THR HA H 109 5.669 5.669 4.783 0.886 17934 9855 1 14 . 1 1 109 109 THR C C 109 173.505 173.505 173.579 -0.074 17934 9856 1 14 . 1 1 109 109 THR CA C 109 59.070 59.070 60.935 -1.865 17934 9857 1 14 . 1 1 109 109 THR H H 109 9.489 9.489 7.903 1.586 17934 9858 1 14 . 1 1 110 110 LYS N N 110 122.960 122.960 122.021 0.939 17934 9859 1 14 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.261 0.199 17934 9860 1 14 . 1 1 110 110 LYS C C 110 175.937 175.937 175.489 0.448 17934 9861 1 14 . 1 1 110 110 LYS CA C 110 55.789 55.789 56.651 -0.862 17934 9862 1 14 . 1 1 110 110 LYS CB C 110 34.227 34.227 32.673 1.554 17934 9863 1 14 . 1 1 110 110 LYS H H 110 7.831 7.831 8.497 -0.666 17934 9864 1 14 . 1 1 111 111 ASP N N 111 127.409 127.409 123.242 4.167 17934 9865 1 14 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.843 -0.062 17934 9866 1 14 . 1 1 111 111 ASP C C 111 176.396 176.396 178.132 -1.736 17934 9867 1 14 . 1 1 111 111 ASP CA C 111 53.914 53.914 54.626 -0.712 17934 9868 1 14 . 1 1 111 111 ASP CB C 111 43.133 43.133 42.026 1.107 17934 9869 1 14 . 1 1 111 111 ASP H H 111 8.769 8.769 8.443 0.326 17934 9870 1 14 . 1 1 112 112 LEU N N 112 125.913 125.913 120.808 5.105 17934 9871 1 14 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.600 -0.450 17934 9872 1 14 . 1 1 112 112 LEU C C 112 178.553 178.553 177.371 1.182 17934 9873 1 14 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.817 -0.627 17934 9874 1 14 . 1 1 112 112 LEU CB C 112 41.790 41.790 42.139 -0.349 17934 9875 1 14 . 1 1 112 112 LEU H H 112 8.593 8.593 8.751 -0.158 17934 9876 1 14 . 1 1 113 113 LYS N N 113 117.189 117.189 117.195 -0.006 17934 9877 1 14 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.373 -0.111 17934 9878 1 14 . 1 1 113 113 LYS C C 113 177.180 177.180 175.737 1.443 17934 9879 1 14 . 1 1 113 113 LYS CA C 113 58.133 58.133 55.403 2.731 17934 9880 1 14 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.501 0.319 17934 9881 1 14 . 1 1 113 113 LYS H H 113 8.207 8.207 8.241 -0.034 17934 9882 1 14 . 1 1 114 114 SER N N 114 112.492 112.492 113.079 -0.587 17934 9883 1 14 . 1 1 114 114 SER CA C 114 58.601 58.601 58.530 0.071 17934 9884 1 14 . 1 1 114 114 SER CB C 114 65.164 65.164 61.651 3.513 17934 9885 1 14 . 1 1 114 114 SER H H 114 7.755 7.755 7.930 -0.175 17934 9886 1 14 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.661 -0.272 17934 9887 1 14 . 1 1 115 115 ASN C C 115 174.203 174.203 174.592 -0.389 17934 9888 1 14 . 1 1 115 115 ASN CA C 115 54.383 54.383 54.864 -0.481 17934 9889 1 14 . 1 1 115 115 ASN CB C 115 37.977 37.977 39.157 -1.180 17934 9890 1 14 . 1 1 116 116 HIS N N 116 116.822 116.822 115.200 1.622 17934 9891 1 14 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.686 0.244 17934 9892 1 14 . 1 1 116 116 HIS C C 116 173.898 173.898 173.803 0.095 17934 9893 1 14 . 1 1 116 116 HIS CA C 116 54.910 54.910 55.503 -0.593 17934 9894 1 14 . 1 1 116 116 HIS CB C 116 32.650 32.650 31.731 0.919 17934 9895 1 14 . 1 1 116 116 HIS H H 116 7.690 7.690 7.772 -0.082 17934 9896 1 14 . 1 1 117 117 HIS N N 117 118.253 118.253 120.847 -2.594 17934 9897 1 14 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.445 0.875 17934 9898 1 14 . 1 1 117 117 HIS C C 117 173.695 173.695 173.643 0.052 17934 9899 1 14 . 1 1 117 117 HIS CA C 117 56.350 56.350 57.038 -0.688 17934 9900 1 14 . 1 1 117 117 HIS CB C 117 32.350 32.350 28.671 3.679 17934 9901 1 14 . 1 1 117 117 HIS H H 117 8.340 8.340 8.805 -0.465 17934 9902 1 14 . 1 1 118 118 TYR N N 118 118.301 118.301 126.071 -7.770 17934 9903 1 14 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.968 0.042 17934 9904 1 14 . 1 1 118 118 TYR C C 118 173.530 173.530 174.551 -1.021 17934 9905 1 14 . 1 1 118 118 TYR CA C 118 56.730 56.730 56.750 -0.020 17934 9906 1 14 . 1 1 118 118 TYR CB C 118 43.240 43.240 41.619 1.621 17934 9907 1 14 . 1 1 118 118 TYR H H 118 9.080 9.080 7.946 1.134 17934 9908 1 14 . 1 1 119 119 CYS N N 119 121.015 121.015 121.525 -0.510 17934 9909 1 14 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.356 0.707 17934 9910 1 14 . 1 1 119 119 CYS C C 119 180.664 180.664 173.306 7.358 17934 9911 1 14 . 1 1 119 119 CYS CA C 119 56.726 56.726 56.962 -0.236 17934 9912 1 14 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.539 1.000 17934 9913 1 14 . 1 1 119 119 CYS H H 119 9.120 9.120 8.922 0.198 17934 9914 1 14 . 1 1 120 120 HIS N N 120 110.134 110.134 122.330 -12.196 17934 9915 1 14 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.674 0.025 17934 9916 1 14 . 1 1 120 120 HIS C C 120 180.776 180.776 173.421 7.355 17934 9917 1 14 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.208 1.112 17934 9918 1 14 . 1 1 120 120 HIS CB C 120 32.352 32.352 30.267 2.085 17934 9919 1 14 . 1 1 120 120 HIS H H 120 8.482 8.482 8.362 0.120 17934 9920 1 14 . 1 1 121 121 VAL N N 121 120.855 120.855 123.098 -2.243 17934 9921 1 14 . 1 1 121 121 VAL HA H 121 4.350 4.350 3.737 0.613 17934 9922 1 14 . 1 1 121 121 VAL C C 121 173.419 173.419 172.990 0.429 17934 9923 1 14 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.455 0.955 17934 9924 1 14 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.654 -0.374 17934 9925 1 14 . 1 1 121 121 VAL H H 121 7.929 7.929 8.550 -0.621 17934 9926 1 14 . 1 1 122 122 PHE N N 122 124.384 124.384 127.277 -2.893 17934 9927 1 14 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.230 0.190 17934 9928 1 14 . 1 1 122 122 PHE C C 122 174.876 174.876 174.783 0.093 17934 9929 1 14 . 1 1 122 122 PHE CA C 122 55.320 55.320 54.359 0.961 17934 9930 1 14 . 1 1 122 122 PHE CB C 122 44.540 44.540 42.471 2.069 17934 9931 1 14 . 1 1 122 122 PHE H H 122 8.910 8.910 8.528 0.382 17934 9932 1 14 . 1 1 123 123 THR N N 123 112.451 112.451 112.630 -0.179 17934 9933 1 14 . 1 1 123 123 THR HA H 123 5.147 5.147 4.711 0.436 17934 9934 1 14 . 1 1 123 123 THR C C 123 174.096 174.096 173.533 0.563 17934 9935 1 14 . 1 1 123 123 THR CA C 123 61.843 61.843 60.119 1.724 17934 9936 1 14 . 1 1 123 123 THR CB C 123 71.218 71.218 70.335 0.883 17934 9937 1 14 . 1 1 123 123 THR H H 123 8.668 8.668 9.046 -0.378 17934 9938 1 14 . 1 1 124 124 ALA N N 124 128.922 128.922 126.144 2.778 17934 9939 1 14 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.439 0.281 17934 9940 1 14 . 1 1 124 124 ALA C C 124 177.168 177.168 176.754 0.414 17934 9941 1 14 . 1 1 124 124 ALA CA C 124 50.890 50.890 50.741 0.149 17934 9942 1 14 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.379 -0.279 17934 9943 1 14 . 1 1 124 124 ALA H H 124 9.180 9.180 8.300 0.880 17934 9944 1 14 . 1 1 125 125 PHE N N 125 115.427 115.427 118.249 -2.822 17934 9945 1 14 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.481 -0.191 17934 9946 1 14 . 1 1 125 125 PHE C C 125 174.703 174.703 175.886 -1.183 17934 9947 1 14 . 1 1 125 125 PHE CA C 125 60.470 60.470 58.140 2.330 17934 9948 1 14 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.368 -1.308 17934 9949 1 14 . 1 1 125 125 PHE H H 125 8.560 8.560 7.808 0.752 17934 9950 1 14 . 1 1 126 126 ASP N N 126 115.745 115.745 119.628 -3.883 17934 9951 1 14 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.928 -0.085 17934 9952 1 14 . 1 1 126 126 ASP C C 126 176.532 176.532 176.188 0.344 17934 9953 1 14 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.471 -0.027 17934 9954 1 14 . 1 1 126 126 ASP CB C 126 44.070 44.070 44.018 0.052 17934 9955 1 14 . 1 1 126 126 ASP H H 126 7.417 7.417 7.700 -0.283 17934 9956 1 14 . 1 1 127 127 VAL N N 127 121.923 121.923 125.174 -3.251 17934 9957 1 14 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.572 0.018 17934 9958 1 14 . 1 1 127 127 VAL C C 127 176.863 176.863 177.087 -0.224 17934 9959 1 14 . 1 1 127 127 VAL CA C 127 65.630 65.630 67.075 -1.445 17934 9960 1 14 . 1 1 127 127 VAL CB C 127 31.830 31.830 31.945 -0.115 17934 9961 1 14 . 1 1 127 127 VAL H H 127 8.508 8.508 8.647 -0.139 17934 9962 1 14 . 1 1 128 128 ASN N N 128 118.851 118.851 116.933 1.918 17934 9963 1 14 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.324 0.152 17934 9964 1 14 . 1 1 128 128 ASN C C 128 178.251 178.251 177.392 0.859 17934 9965 1 14 . 1 1 128 128 ASN CA C 128 56.258 56.258 55.916 0.342 17934 9966 1 14 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.114 -0.137 17934 9967 1 14 . 1 1 128 128 ASN H H 128 8.207 8.207 8.444 -0.237 17934 9968 1 14 . 1 1 129 129 LEU N N 129 122.549 122.549 120.066 2.483 17934 9969 1 14 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.722 0.488 17934 9970 1 14 . 1 1 129 129 LEU C C 129 178.003 178.003 177.603 0.400 17934 9971 1 14 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.748 -0.558 17934 9972 1 14 . 1 1 129 129 LEU CB C 129 41.790 41.790 41.578 0.212 17934 9973 1 14 . 1 1 129 129 LEU H H 129 8.223 8.223 7.958 0.265 17934 9974 1 14 . 1 1 130 130 ALA N N 130 120.036 120.036 121.904 -1.868 17934 9975 1 14 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.662 -0.352 17934 9976 1 14 . 1 1 130 130 ALA C C 130 178.172 178.172 178.901 -0.729 17934 9977 1 14 . 1 1 130 130 ALA CA C 130 55.780 55.780 54.998 0.782 17934 9978 1 14 . 1 1 130 130 ALA CB C 130 19.070 19.070 17.815 1.255 17934 9979 1 14 . 1 1 130 130 ALA H H 130 7.360 7.360 8.040 -0.680 17934 9980 1 14 . 1 1 131 131 ALA N N 131 116.989 116.989 119.919 -2.930 17934 9981 1 14 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.961 -0.251 17934 9982 1 14 . 1 1 131 131 ALA C C 131 180.163 180.163 179.924 0.239 17934 9983 1 14 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.704 1.076 17934 9984 1 14 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.002 -0.172 17934 9985 1 14 . 1 1 131 131 ALA H H 131 7.360 7.360 8.400 -1.040 17934 9986 1 14 . 1 1 132 132 GLU N N 132 119.462 119.462 119.818 -0.356 17934 9987 1 14 . 1 1 132 132 GLU HA H 132 3.888 3.888 3.950 -0.062 17934 9988 1 14 . 1 1 132 132 GLU C C 132 179.243 179.243 178.771 0.472 17934 9989 1 14 . 1 1 132 132 GLU CA C 132 59.539 59.539 59.257 0.283 17934 9990 1 14 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.217 0.322 17934 9991 1 14 . 1 1 132 132 GLU H H 132 7.673 7.673 7.960 -0.287 17934 9992 1 14 . 1 1 133 133 ILE N N 133 123.218 123.218 120.625 2.593 17934 9993 1 14 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.602 -0.822 17934 9994 1 14 . 1 1 133 133 ILE C C 133 177.421 177.421 178.368 -0.947 17934 9995 1 14 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.228 1.262 17934 9996 1 14 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.591 -0.941 17934 9997 1 14 . 1 1 133 133 ILE H H 133 8.154 8.154 7.837 0.317 17934 9998 1 14 . 1 1 134 134 ILE N N 134 118.244 118.244 119.380 -1.136 17934 9999 1 14 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.507 0.033 17934 10000 1 14 . 1 1 134 134 ILE C C 134 179.385 179.385 177.747 1.638 17934 10001 1 14 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.703 -1.423 17934 10002 1 14 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.962 -0.862 17934 10003 1 14 . 1 1 134 134 ILE H H 134 7.376 7.376 8.065 -0.689 17934 10004 1 14 . 1 1 135 135 LEU N N 135 123.061 123.061 120.260 2.801 17934 10005 1 14 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.907 0.283 17934 10006 1 14 . 1 1 135 135 LEU C C 135 179.858 179.858 178.945 0.913 17934 10007 1 14 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.494 -0.304 17934 10008 1 14 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.938 -0.077 17934 10009 1 14 . 1 1 135 135 LEU H H 135 8.036 8.036 8.094 -0.058 17934 10010 1 14 . 1 1 136 136 THR N N 136 119.647 119.647 115.305 4.342 17934 10011 1 14 . 1 1 136 136 THR HA H 136 3.725 3.725 3.915 -0.190 17934 10012 1 14 . 1 1 136 136 THR C C 136 176.088 176.088 176.423 -0.335 17934 10013 1 14 . 1 1 136 136 THR CA C 136 58.601 58.601 67.397 -8.796 17934 10014 1 14 . 1 1 136 136 THR CB C 136 67.976 67.976 69.034 -1.058 17934 10015 1 14 . 1 1 136 136 THR H H 136 8.508 8.508 8.404 0.104 17934 10016 1 14 . 1 1 137 137 LEU N N 137 123.182 123.182 121.626 1.556 17934 10017 1 14 . 1 1 137 137 LEU HA H 137 3.740 3.740 4.016 -0.276 17934 10018 1 14 . 1 1 137 137 LEU C C 137 178.341 178.341 178.985 -0.644 17934 10019 1 14 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.417 -0.157 17934 10020 1 14 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.367 0.183 17934 10021 1 14 . 1 1 137 137 LEU H H 137 8.520 8.520 8.609 -0.089 17934 10022 1 14 . 1 1 138 138 GLY N N 138 105.266 105.266 105.446 -0.180 17934 10023 1 14 . 1 1 138 138 GLY C C 138 176.973 176.973 176.345 0.628 17934 10024 1 14 . 1 1 138 138 GLY CA C 138 47.351 47.351 46.989 0.362 17934 10025 1 14 . 1 1 138 138 GLY H H 138 7.858 7.858 7.978 -0.120 17934 10026 1 14 . 1 1 139 139 GLN N N 139 123.485 123.485 122.001 1.484 17934 10027 1 14 . 1 1 139 139 GLN C C 139 177.891 177.891 178.689 -0.798 17934 10028 1 14 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.710 -0.109 17934 10029 1 14 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.353 -0.220 17934 10030 1 14 . 1 1 139 139 GLN H H 139 8.195 8.195 8.575 -0.380 17934 10031 1 14 . 1 1 140 140 ALA N N 140 122.754 122.754 121.936 0.818 17934 10032 1 14 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.288 -0.579 17934 10033 1 14 . 1 1 140 140 ALA C C 140 178.987 178.987 179.397 -0.410 17934 10034 1 14 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.701 1.079 17934 10035 1 14 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.491 -1.081 17934 10036 1 14 . 1 1 140 140 ALA H H 140 8.530 8.530 8.602 -0.072 17934 10037 1 14 . 1 1 141 141 PHE N N 141 116.275 116.275 120.607 -4.332 17934 10038 1 14 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.674 -0.584 17934 10039 1 14 . 1 1 141 141 PHE C C 141 178.129 178.129 176.955 1.174 17934 10040 1 14 . 1 1 141 141 PHE CA C 141 61.240 61.240 58.965 2.275 17934 10041 1 14 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.412 -0.029 17934 10042 1 14 . 1 1 141 141 PHE H H 141 7.920 7.920 8.339 -0.419 17934 10043 1 14 . 1 1 142 142 GLU N N 142 119.967 119.967 119.518 0.449 17934 10044 1 14 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.607 0.620 17934 10045 1 14 . 1 1 142 142 GLU C C 142 179.250 179.250 178.141 1.109 17934 10046 1 14 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.298 1.241 17934 10047 1 14 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.892 -0.353 17934 10048 1 14 . 1 1 142 142 GLU H H 142 7.713 7.713 8.145 -0.432 17934 10049 1 14 . 1 1 143 143 VAL N N 143 120.189 120.189 118.720 1.469 17934 10050 1 14 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.598 0.085 17934 10051 1 14 . 1 1 143 143 VAL C C 143 178.066 178.066 175.454 2.612 17934 10052 1 14 . 1 1 143 143 VAL CA C 143 66.570 66.570 63.974 2.596 17934 10053 1 14 . 1 1 143 143 VAL CB C 143 31.883 31.883 31.855 0.028 17934 10054 1 14 . 1 1 143 143 VAL H H 143 8.608 8.608 7.639 0.969 17934 10055 1 14 . 1 1 144 144 ALA N N 144 121.753 121.753 118.181 3.572 17934 10056 1 14 . 1 1 144 144 ALA HA H 144 4.000 4.000 3.941 0.059 17934 10057 1 14 . 1 1 144 144 ALA C C 144 180.776 180.776 177.396 3.380 17934 10058 1 14 . 1 1 144 144 ALA CA C 144 55.780 55.780 52.601 3.179 17934 10059 1 14 . 1 1 144 144 ALA CB C 144 18.770 18.770 16.296 2.474 17934 10060 1 14 . 1 1 144 144 ALA H H 144 8.399 8.399 7.335 1.064 17934 10061 1 14 . 1 1 145 145 TYR N N 145 119.962 119.962 119.284 0.678 17934 10062 1 14 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.073 0.117 17934 10063 1 14 . 1 1 145 145 TYR C C 145 177.645 177.645 177.597 0.048 17934 10064 1 14 . 1 1 145 145 TYR CA C 145 60.880 60.880 62.675 -1.795 17934 10065 1 14 . 1 1 145 145 TYR CB C 145 37.980 37.980 38.268 -0.288 17934 10066 1 14 . 1 1 145 145 TYR H H 145 8.190 8.190 8.032 0.158 17934 10067 1 15 . 1 1 13 13 LYS N N 13 120.778 120.778 122.324 -1.546 17934 10068 1 15 . 1 1 13 13 LYS C C 13 176.476 176.476 177.144 -0.668 17934 10069 1 15 . 1 1 13 13 LYS CA C 13 58.601 58.601 56.334 2.267 17934 10070 1 15 . 1 1 13 13 LYS CB C 13 32.820 32.820 32.177 0.643 17934 10071 1 15 . 1 1 13 13 LYS H H 13 7.984 7.984 8.082 -0.098 17934 10072 1 15 . 1 1 15 15 ILE HA H 15 3.820 3.820 3.967 -0.147 17934 10073 1 15 . 1 1 15 15 ILE C C 15 176.376 176.376 176.566 -0.190 17934 10074 1 15 . 1 1 15 15 ILE CA C 15 63.570 63.570 63.085 0.485 17934 10075 1 15 . 1 1 15 15 ILE CB C 15 39.380 39.380 38.020 1.359 17934 10076 1 15 . 1 1 16 16 ALA N N 16 121.364 121.364 119.709 1.655 17934 10077 1 15 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.507 -0.069 17934 10078 1 15 . 1 1 16 16 ALA C C 16 177.494 177.494 177.639 -0.145 17934 10079 1 15 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.733 0.242 17934 10080 1 15 . 1 1 16 16 ALA CB C 16 20.333 20.333 20.450 -0.117 17934 10081 1 15 . 1 1 16 16 ALA H H 16 8.081 8.081 7.809 0.272 17934 10082 1 15 . 1 1 17 17 GLN N N 17 118.109 118.109 116.093 2.016 17934 10083 1 15 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.581 -0.008 17934 10084 1 15 . 1 1 17 17 GLN C C 17 173.632 173.632 174.506 -0.874 17934 10085 1 15 . 1 1 17 17 GLN CA C 17 54.851 54.851 54.909 -0.058 17934 10086 1 15 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.586 -0.109 17934 10087 1 15 . 1 1 17 17 GLN H H 17 7.550 7.550 8.063 -0.513 17934 10088 1 15 . 1 1 18 18 SER N N 18 112.384 112.384 114.316 -1.932 17934 10089 1 15 . 1 1 18 18 SER HA H 18 4.388 4.388 4.790 -0.402 17934 10090 1 15 . 1 1 18 18 SER C C 18 173.780 173.780 172.070 1.710 17934 10091 1 15 . 1 1 18 18 SER CA C 18 57.664 57.664 57.982 -0.318 17934 10092 1 15 . 1 1 18 18 SER CB C 18 65.164 65.164 65.380 -0.216 17934 10093 1 15 . 1 1 18 18 SER H H 18 7.666 7.666 7.990 -0.324 17934 10094 1 15 . 1 1 19 19 CYS N N 19 120.116 120.116 120.263 -0.147 17934 10095 1 15 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.643 -0.313 17934 10096 1 15 . 1 1 19 19 CYS C C 19 180.387 180.387 172.860 7.527 17934 10097 1 15 . 1 1 19 19 CYS CA C 19 58.601 58.601 56.543 2.058 17934 10098 1 15 . 1 1 19 19 CYS CB C 19 30.008 30.008 30.719 -0.711 17934 10099 1 15 . 1 1 19 19 CYS H H 19 8.835 8.835 8.742 0.093 17934 10100 1 15 . 1 1 20 20 ASP N N 20 124.416 124.416 122.020 2.396 17934 10101 1 15 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.368 -0.392 17934 10102 1 15 . 1 1 20 20 ASP CB C 20 42.195 42.195 44.812 -2.617 17934 10103 1 15 . 1 1 20 20 ASP H H 20 7.847 7.847 7.658 0.189 17934 10104 1 15 . 1 1 21 21 TYR N N 21 121.296 121.296 119.747 1.549 17934 10105 1 15 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.700 0.030 17934 10106 1 15 . 1 1 21 21 TYR C C 21 175.793 175.793 174.483 1.310 17934 10107 1 15 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.597 0.603 17934 10108 1 15 . 1 1 21 21 TYR CB C 21 43.240 43.240 43.134 0.106 17934 10109 1 15 . 1 1 21 21 TYR H H 21 9.070 9.070 8.610 0.460 17934 10110 1 15 . 1 1 22 22 LYS N N 22 122.820 122.820 120.771 2.049 17934 10111 1 15 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.192 -0.000 17934 10112 1 15 . 1 1 22 22 LYS C C 22 175.793 175.793 175.476 0.317 17934 10113 1 15 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.533 0.725 17934 10114 1 15 . 1 1 22 22 LYS CB C 22 33.758 33.758 33.744 0.014 17934 10115 1 15 . 1 1 22 22 LYS H H 22 8.711 8.711 8.532 0.179 17934 10116 1 15 . 1 1 23 23 ALA N N 23 123.073 123.073 124.548 -1.475 17934 10117 1 15 . 1 1 23 23 ALA HA H 23 4.730 4.730 3.756 0.974 17934 10118 1 15 . 1 1 23 23 ALA C C 23 174.515 174.515 174.872 -0.357 17934 10119 1 15 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.714 0.856 17934 10120 1 15 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.943 -1.315 17934 10121 1 15 . 1 1 23 23 ALA H H 23 8.727 8.727 8.660 0.067 17934 10122 1 15 . 1 1 24 24 ALA N N 24 122.486 122.486 122.552 -0.066 17934 10123 1 15 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.937 0.244 17934 10124 1 15 . 1 1 24 24 ALA C C 24 176.835 176.835 176.218 0.617 17934 10125 1 15 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.484 0.086 17934 10126 1 15 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.487 -0.367 17934 10127 1 15 . 1 1 24 24 ALA H H 24 8.675 8.675 8.623 0.052 17934 10128 1 15 . 1 1 25 25 TYR N N 25 122.698 122.698 126.043 -3.345 17934 10129 1 15 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.329 0.681 17934 10130 1 15 . 1 1 25 25 TYR CA C 25 54.340 54.340 55.573 -1.233 17934 10131 1 15 . 1 1 25 25 TYR CB C 25 39.850 39.850 38.460 1.390 17934 10132 1 15 . 1 1 25 25 TYR H H 25 8.270 8.270 8.470 -0.200 17934 10133 1 15 . 1 1 26 26 LEU N N 26 127.997 127.997 129.053 -1.056 17934 10134 1 15 . 1 1 26 26 LEU HA H 26 3.920 3.920 3.991 -0.071 17934 10135 1 15 . 1 1 26 26 LEU C C 26 175.983 175.983 176.834 -0.851 17934 10136 1 15 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.364 0.362 17934 10137 1 15 . 1 1 26 26 LEU CB C 26 41.070 41.070 42.926 -1.856 17934 10138 1 15 . 1 1 26 26 LEU H H 26 8.700 8.700 8.005 0.695 17934 10139 1 15 . 1 1 27 27 GLY N N 27 102.901 102.901 101.411 1.490 17934 10140 1 15 . 1 1 27 27 GLY C C 27 176.219 176.219 171.615 4.604 17934 10141 1 15 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.158 -1.557 17934 10142 1 15 . 1 1 27 27 GLY H H 27 5.891 5.891 7.714 -1.823 17934 10143 1 15 . 1 1 28 28 SER N N 28 111.551 111.551 114.940 -3.389 17934 10144 1 15 . 1 1 28 28 SER HA H 28 5.785 5.785 5.406 0.379 17934 10145 1 15 . 1 1 28 28 SER CA C 28 56.258 56.258 57.158 -0.900 17934 10146 1 15 . 1 1 28 28 SER CB C 28 65.632 65.632 66.308 -0.676 17934 10147 1 15 . 1 1 28 28 SER H H 28 7.981 7.981 8.337 -0.356 17934 10148 1 15 . 1 1 29 29 MET N N 29 119.493 119.493 121.142 -1.649 17934 10149 1 15 . 1 1 29 29 MET HA H 29 4.725 4.725 4.820 -0.095 17934 10150 1 15 . 1 1 29 29 MET C C 29 174.143 174.143 174.838 -0.695 17934 10151 1 15 . 1 1 29 29 MET CA C 29 54.036 54.036 52.767 1.269 17934 10152 1 15 . 1 1 29 29 MET CB C 29 37.268 37.268 35.340 1.928 17934 10153 1 15 . 1 1 29 29 MET H H 29 8.704 8.704 8.948 -0.244 17934 10154 1 15 . 1 1 30 30 LEU N N 30 128.150 128.150 123.999 4.151 17934 10155 1 15 . 1 1 30 30 LEU HA H 30 3.785 3.785 3.477 0.308 17934 10156 1 15 . 1 1 30 30 LEU C C 30 175.857 175.857 175.119 0.738 17934 10157 1 15 . 1 1 30 30 LEU CA C 30 56.250 56.250 54.002 2.248 17934 10158 1 15 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.680 0.980 17934 10159 1 15 . 1 1 30 30 LEU H H 30 8.630 8.630 8.432 0.198 17934 10160 1 15 . 1 1 31 31 ILE N N 31 127.723 127.723 127.412 0.311 17934 10161 1 15 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.017 0.173 17934 10162 1 15 . 1 1 31 31 ILE C C 31 174.881 174.881 175.209 -0.328 17934 10163 1 15 . 1 1 31 31 ILE CA C 31 57.660 57.660 58.834 -1.173 17934 10164 1 15 . 1 1 31 31 ILE CB C 31 37.110 37.110 35.349 1.761 17934 10165 1 15 . 1 1 31 31 ILE H H 31 8.560 8.560 8.253 0.307 17934 10166 1 15 . 1 1 32 32 LYS HA H 32 4.055 4.055 3.691 0.364 17934 10167 1 15 . 1 1 32 32 LYS C C 32 176.272 176.272 176.679 -0.407 17934 10168 1 15 . 1 1 32 32 LYS CA C 32 58.601 58.601 58.934 -0.333 17934 10169 1 15 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.582 0.238 17934 10170 1 15 . 1 1 33 33 GLU N N 33 118.638 118.638 119.298 -0.660 17934 10171 1 15 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.264 0.124 17934 10172 1 15 . 1 1 33 33 GLU C C 33 173.962 173.962 174.968 -1.006 17934 10173 1 15 . 1 1 33 33 GLU CA C 33 54.851 54.851 55.462 -0.611 17934 10174 1 15 . 1 1 33 33 GLU CB C 33 30.945 30.945 29.115 1.830 17934 10175 1 15 . 1 1 33 33 GLU H H 33 7.723 7.723 8.208 -0.485 17934 10176 1 15 . 1 1 34 34 LEU N N 34 126.535 126.535 127.067 -0.532 17934 10177 1 15 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.170 -0.225 17934 10178 1 15 . 1 1 34 34 LEU C C 34 176.870 176.870 176.465 0.405 17934 10179 1 15 . 1 1 34 34 LEU CA C 34 54.850 54.850 54.498 0.352 17934 10180 1 15 . 1 1 34 34 LEU CB C 34 41.720 41.720 41.888 -0.168 17934 10181 1 15 . 1 1 34 34 LEU H H 34 8.446 8.446 8.134 0.312 17934 10182 1 15 . 1 1 35 35 ARG N N 35 128.447 128.447 125.397 3.050 17934 10183 1 15 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.575 -0.020 17934 10184 1 15 . 1 1 35 35 ARG C C 35 176.110 176.110 176.059 0.051 17934 10185 1 15 . 1 1 35 35 ARG CA C 35 54.851 54.851 54.839 0.012 17934 10186 1 15 . 1 1 35 35 ARG CB C 35 30.477 30.477 31.057 -0.580 17934 10187 1 15 . 1 1 35 35 ARG H H 35 8.680 8.680 8.021 0.659 17934 10188 1 15 . 1 1 36 36 GLY N N 36 107.406 107.406 112.539 -5.133 17934 10189 1 15 . 1 1 36 36 GLY CA C 36 45.906 45.906 44.926 0.980 17934 10190 1 15 . 1 1 36 36 GLY H H 36 7.182 7.182 8.587 -1.405 17934 10191 1 15 . 1 1 37 37 THR HA H 37 4.060 4.060 4.101 -0.041 17934 10192 1 15 . 1 1 37 37 THR C C 37 176.634 176.634 176.285 0.349 17934 10193 1 15 . 1 1 37 37 THR CA C 37 65.632 65.632 63.914 1.718 17934 10194 1 15 . 1 1 37 37 THR CB C 37 68.445 68.445 68.988 -0.543 17934 10195 1 15 . 1 1 38 38 GLU N N 38 122.251 122.251 122.185 0.066 17934 10196 1 15 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.956 0.170 17934 10197 1 15 . 1 1 38 38 GLU C C 38 179.981 179.981 178.546 1.435 17934 10198 1 15 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.715 0.293 17934 10199 1 15 . 1 1 38 38 GLU CB C 38 29.539 29.539 29.088 0.451 17934 10200 1 15 . 1 1 38 38 GLU H H 38 8.450 8.450 8.726 -0.276 17934 10201 1 15 . 1 1 39 39 SER N N 39 115.966 115.966 113.796 2.170 17934 10202 1 15 . 1 1 39 39 SER C C 39 175.991 175.991 176.268 -0.277 17934 10203 1 15 . 1 1 39 39 SER CA C 39 62.820 62.820 62.779 0.041 17934 10204 1 15 . 1 1 39 39 SER H H 39 7.522 7.522 7.741 -0.219 17934 10205 1 15 . 1 1 40 40 THR HA H 40 4.049 4.049 3.934 0.115 17934 10206 1 15 . 1 1 40 40 THR C C 40 175.972 175.972 176.746 -0.774 17934 10207 1 15 . 1 1 40 40 THR CA C 40 66.101 66.101 65.362 0.738 17934 10208 1 15 . 1 1 40 40 THR CB C 40 67.976 67.976 68.334 -0.358 17934 10209 1 15 . 1 1 41 41 GLN N N 41 120.354 120.354 121.211 -0.857 17934 10210 1 15 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.024 -0.265 17934 10211 1 15 . 1 1 41 41 GLN C C 41 178.483 178.483 177.935 0.548 17934 10212 1 15 . 1 1 41 41 GLN CA C 41 60.476 60.476 59.051 1.425 17934 10213 1 15 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.105 0.028 17934 10214 1 15 . 1 1 41 41 GLN H H 41 8.271 8.271 8.482 -0.211 17934 10215 1 15 . 1 1 42 42 ASP N N 42 120.757 120.757 120.864 -0.107 17934 10216 1 15 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.388 -0.029 17934 10217 1 15 . 1 1 42 42 ASP C C 42 177.480 177.480 177.913 -0.433 17934 10218 1 15 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.196 0.468 17934 10219 1 15 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.892 1.303 17934 10220 1 15 . 1 1 42 42 ASP H H 42 7.954 7.954 8.126 -0.172 17934 10221 1 15 . 1 1 43 43 ALA N N 43 120.587 120.587 122.010 -1.423 17934 10222 1 15 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.167 -0.177 17934 10223 1 15 . 1 1 43 43 ALA C C 43 179.767 179.767 179.969 -0.202 17934 10224 1 15 . 1 1 43 43 ALA CA C 43 55.320 55.320 54.829 0.491 17934 10225 1 15 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.249 0.981 17934 10226 1 15 . 1 1 43 43 ALA H H 43 7.842 7.842 8.356 -0.514 17934 10227 1 15 . 1 1 44 44 CYS N N 44 115.428 115.428 118.893 -3.465 17934 10228 1 15 . 1 1 44 44 CYS HA H 44 3.895 3.895 4.072 -0.177 17934 10229 1 15 . 1 1 44 44 CYS C C 44 176.076 176.076 176.439 -0.363 17934 10230 1 15 . 1 1 44 44 CYS CA C 44 64.695 64.695 62.628 2.067 17934 10231 1 15 . 1 1 44 44 CYS CB C 44 27.664 27.664 26.919 0.745 17934 10232 1 15 . 1 1 44 44 CYS H H 44 7.900 7.900 8.308 -0.408 17934 10233 1 15 . 1 1 45 45 ALA N N 45 120.487 120.487 122.967 -2.480 17934 10234 1 15 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.992 0.008 17934 10235 1 15 . 1 1 45 45 ALA C C 45 173.506 173.506 179.264 -5.758 17934 10236 1 15 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.365 -0.045 17934 10237 1 15 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.242 -0.302 17934 10238 1 15 . 1 1 45 45 ALA H H 45 7.250 7.250 8.104 -0.854 17934 10239 1 15 . 1 1 46 46 LYS N N 46 119.267 119.267 119.245 0.022 17934 10240 1 15 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.956 -0.009 17934 10241 1 15 . 1 1 46 46 LYS C C 46 179.561 179.561 178.799 0.762 17934 10242 1 15 . 1 1 46 46 LYS H H 46 8.102 8.102 8.216 -0.114 17934 10243 1 15 . 1 1 47 47 MET N N 47 118.009 118.009 118.373 -0.364 17934 10244 1 15 . 1 1 47 47 MET HA H 47 4.214 4.214 4.126 0.088 17934 10245 1 15 . 1 1 47 47 MET C C 47 179.526 179.526 177.771 1.755 17934 10246 1 15 . 1 1 47 47 MET CA C 47 57.195 57.195 58.992 -1.798 17934 10247 1 15 . 1 1 47 47 MET CB C 47 30.945 30.945 32.417 -1.472 17934 10248 1 15 . 1 1 47 47 MET H H 47 8.585 8.585 7.913 0.672 17934 10249 1 15 . 1 1 48 48 ARG N N 48 119.962 119.962 120.341 -0.379 17934 10250 1 15 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.916 -0.060 17934 10251 1 15 . 1 1 48 48 ARG C C 48 178.875 178.875 177.120 1.755 17934 10252 1 15 . 1 1 48 48 ARG CA C 48 60.945 60.945 58.719 2.225 17934 10253 1 15 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.447 1.030 17934 10254 1 15 . 1 1 48 48 ARG H H 48 8.190 8.190 8.399 -0.209 17934 10255 1 15 . 1 1 49 49 ALA N N 49 120.640 120.640 117.061 3.579 17934 10256 1 15 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.141 -0.398 17934 10257 1 15 . 1 1 49 49 ALA C C 49 180.169 180.169 179.516 0.653 17934 10258 1 15 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.075 0.776 17934 10259 1 15 . 1 1 49 49 ALA CB C 49 17.821 17.821 19.197 -1.376 17934 10260 1 15 . 1 1 49 49 ALA H H 49 7.671 7.671 7.874 -0.203 17934 10261 1 15 . 1 1 50 50 ASN N N 50 116.063 116.063 118.477 -2.414 17934 10262 1 15 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.514 -0.040 17934 10263 1 15 . 1 1 50 50 ASN C C 50 177.084 177.084 177.257 -0.173 17934 10264 1 15 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.432 0.357 17934 10265 1 15 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.646 0.268 17934 10266 1 15 . 1 1 50 50 ASN H H 50 7.893 7.893 8.248 -0.355 17934 10267 1 15 . 1 1 51 51 CYS N N 51 116.884 116.884 117.494 -0.610 17934 10268 1 15 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.404 -0.098 17934 10269 1 15 . 1 1 51 51 CYS C C 51 175.002 175.002 175.386 -0.384 17934 10270 1 15 . 1 1 51 51 CYS CA C 51 61.414 61.414 58.170 3.244 17934 10271 1 15 . 1 1 51 51 CYS CB C 51 27.664 27.664 27.180 0.484 17934 10272 1 15 . 1 1 51 51 CYS H H 51 7.770 7.770 8.391 -0.621 17934 10273 1 15 . 1 1 52 52 GLN N N 52 117.831 117.831 120.705 -2.874 17934 10274 1 15 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.252 -0.024 17934 10275 1 15 . 1 1 52 52 GLN CA C 52 56.726 56.726 57.019 -0.292 17934 10276 1 15 . 1 1 52 52 GLN CB C 52 29.070 29.070 27.754 1.316 17934 10277 1 15 . 1 1 52 52 GLN H H 52 7.796 7.796 8.163 -0.367 17934 10278 1 15 . 1 1 53 53 LYS N N 53 118.841 118.841 119.701 -0.860 17934 10279 1 15 . 1 1 53 53 LYS CA C 53 57.195 57.195 57.922 -0.727 17934 10280 1 15 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.481 0.808 17934 10281 1 15 . 1 1 53 53 LYS H H 53 7.686 7.686 7.632 0.054 17934 10282 1 15 . 1 1 55 55 THR HA H 55 4.304 4.304 3.931 0.373 17934 10283 1 15 . 1 1 55 55 THR CA C 55 63.757 63.757 65.797 -2.040 17934 10284 1 15 . 1 1 55 55 THR CB C 55 68.914 68.914 68.291 0.623 17934 10285 1 15 . 1 1 56 56 GLU N N 56 120.861 120.861 119.078 1.783 17934 10286 1 15 . 1 1 56 56 GLU HA H 56 4.147 4.147 3.972 0.175 17934 10287 1 15 . 1 1 56 56 GLU C C 56 177.656 177.656 179.057 -1.401 17934 10288 1 15 . 1 1 56 56 GLU CA C 56 58.133 58.133 59.657 -1.524 17934 10289 1 15 . 1 1 56 56 GLU CB C 56 30.008 30.008 28.076 1.931 17934 10290 1 15 . 1 1 56 56 GLU H H 56 8.311 8.311 8.964 -0.653 17934 10291 1 15 . 1 1 57 57 GLN N N 57 118.397 118.397 119.328 -0.931 17934 10292 1 15 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.294 -0.152 17934 10293 1 15 . 1 1 57 57 GLN C C 57 177.275 177.275 177.494 -0.219 17934 10294 1 15 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.827 -0.163 17934 10295 1 15 . 1 1 57 57 GLN CB C 57 29.070 29.070 28.994 0.076 17934 10296 1 15 . 1 1 57 57 GLN H H 57 7.899 7.899 7.705 0.194 17934 10297 1 15 . 1 1 58 58 MET N N 58 118.897 118.897 118.696 0.201 17934 10298 1 15 . 1 1 58 58 MET HA H 58 4.350 4.350 4.225 0.125 17934 10299 1 15 . 1 1 58 58 MET C C 58 177.172 177.172 177.720 -0.548 17934 10300 1 15 . 1 1 58 58 MET CA C 58 56.726 56.726 58.330 -1.604 17934 10301 1 15 . 1 1 58 58 MET CB C 58 32.196 32.196 32.881 -0.685 17934 10302 1 15 . 1 1 58 58 MET H H 58 8.036 8.036 7.998 0.038 17934 10303 1 15 . 1 1 59 59 LYS N N 59 119.779 119.779 117.415 2.364 17934 10304 1 15 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.031 0.200 17934 10305 1 15 . 1 1 59 59 LYS C C 59 176.676 176.676 176.610 0.066 17934 10306 1 15 . 1 1 59 59 LYS CA C 59 57.195 57.195 58.025 -0.830 17934 10307 1 15 . 1 1 59 59 LYS CB C 59 32.820 32.820 32.353 0.467 17934 10308 1 15 . 1 1 59 59 LYS H H 59 7.901 7.901 8.080 -0.179 17934 10309 1 15 . 1 1 60 60 LYS N N 60 119.993 119.993 117.399 2.594 17934 10310 1 15 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.467 -0.132 17934 10311 1 15 . 1 1 60 60 LYS C C 60 176.336 176.336 174.656 1.680 17934 10312 1 15 . 1 1 60 60 LYS CA C 60 56.258 56.258 55.614 0.644 17934 10313 1 15 . 1 1 60 60 LYS CB C 60 32.820 32.820 33.036 -0.216 17934 10314 1 15 . 1 1 60 60 LYS H H 60 7.877 7.877 7.334 0.543 17934 10315 1 15 . 1 1 61 61 VAL N N 61 122.649 122.649 119.693 2.956 17934 10316 1 15 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.875 -0.495 17934 10317 1 15 . 1 1 61 61 VAL C C 61 174.210 174.210 174.228 -0.018 17934 10318 1 15 . 1 1 61 61 VAL CA C 61 60.000 60.000 57.983 2.017 17934 10319 1 15 . 1 1 61 61 VAL CB C 61 32.350 32.350 33.337 -0.987 17934 10320 1 15 . 1 1 61 61 VAL H H 61 7.708 7.708 8.163 -0.455 17934 10321 1 15 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.728 -0.065 17934 10322 1 15 . 1 1 62 62 PRO C C 62 176.656 176.656 176.556 0.100 17934 10323 1 15 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.602 0.217 17934 10324 1 15 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.523 -0.640 17934 10325 1 15 . 1 1 63 63 THR N N 63 117.155 117.155 117.404 -0.249 17934 10326 1 15 . 1 1 63 63 THR HA H 63 4.830 4.830 4.850 -0.020 17934 10327 1 15 . 1 1 63 63 THR C C 63 174.682 174.682 174.088 0.594 17934 10328 1 15 . 1 1 63 63 THR CA C 63 62.820 62.820 63.156 -0.335 17934 10329 1 15 . 1 1 63 63 THR CB C 63 69.382 69.382 70.142 -0.760 17934 10330 1 15 . 1 1 63 63 THR H H 63 8.303 8.303 8.631 -0.328 17934 10331 1 15 . 1 1 64 64 ILE N N 64 121.004 121.004 120.372 0.632 17934 10332 1 15 . 1 1 64 64 ILE CA C 64 58.600 58.600 59.729 -1.129 17934 10333 1 15 . 1 1 64 64 ILE CB C 64 42.690 42.690 42.107 0.583 17934 10334 1 15 . 1 1 64 64 ILE H H 64 9.348 9.348 8.804 0.544 17934 10335 1 15 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.155 0.585 17934 10336 1 15 . 1 1 65 65 ILE C C 65 175.378 175.378 174.814 0.564 17934 10337 1 15 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.285 -1.204 17934 10338 1 15 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.104 1.646 17934 10339 1 15 . 1 1 66 66 LEU N N 66 110.343 110.343 129.926 -19.583 17934 10340 1 15 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.658 0.192 17934 10341 1 15 . 1 1 66 66 LEU C C 66 174.982 174.982 175.258 -0.276 17934 10342 1 15 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.282 -0.372 17934 10343 1 15 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.326 1.904 17934 10344 1 15 . 1 1 66 66 LEU H H 66 9.610 9.610 9.225 0.385 17934 10345 1 15 . 1 1 67 67 SER N N 67 120.990 120.990 119.698 1.292 17934 10346 1 15 . 1 1 67 67 SER HA H 67 5.405 5.405 4.785 0.620 17934 10347 1 15 . 1 1 67 67 SER C C 67 174.405 174.405 172.687 1.718 17934 10348 1 15 . 1 1 67 67 SER CA C 67 57.195 57.195 56.837 0.358 17934 10349 1 15 . 1 1 67 67 SER CB C 67 64.695 64.695 64.759 -0.064 17934 10350 1 15 . 1 1 67 67 SER H H 67 9.260 9.260 8.659 0.601 17934 10351 1 15 . 1 1 68 68 VAL N N 68 128.176 128.176 126.393 1.783 17934 10352 1 15 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.298 0.195 17934 10353 1 15 . 1 1 68 68 VAL C C 68 173.891 173.891 172.893 0.998 17934 10354 1 15 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.483 1.867 17934 10355 1 15 . 1 1 68 68 VAL CB C 68 33.750 33.750 33.807 -0.057 17934 10356 1 15 . 1 1 68 68 VAL H H 68 9.225 9.225 8.892 0.333 17934 10357 1 15 . 1 1 69 69 SER N N 69 121.697 121.697 123.554 -1.857 17934 10358 1 15 . 1 1 69 69 SER HA H 69 4.837 4.837 4.843 -0.006 17934 10359 1 15 . 1 1 69 69 SER C C 69 173.188 173.188 174.827 -1.639 17934 10360 1 15 . 1 1 69 69 SER CA C 69 57.195 57.195 55.261 1.934 17934 10361 1 15 . 1 1 69 69 SER CB C 69 67.976 67.976 65.126 2.850 17934 10362 1 15 . 1 1 69 69 SER H H 69 8.869 8.869 8.896 -0.027 17934 10363 1 15 . 1 1 70 70 ALA N N 70 118.689 118.689 127.193 -8.504 17934 10364 1 15 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.276 -0.126 17934 10365 1 15 . 1 1 70 70 ALA C C 70 176.714 176.714 177.443 -0.729 17934 10366 1 15 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.135 -0.225 17934 10367 1 15 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.769 -0.169 17934 10368 1 15 . 1 1 70 70 ALA H H 70 8.810 8.810 8.772 0.038 17934 10369 1 15 . 1 1 71 71 LYS N N 71 112.633 112.633 117.700 -5.067 17934 10370 1 15 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.351 -0.076 17934 10371 1 15 . 1 1 71 71 LYS C C 71 177.033 177.033 175.718 1.315 17934 10372 1 15 . 1 1 71 71 LYS CA C 71 57.195 57.195 54.850 2.345 17934 10373 1 15 . 1 1 71 71 LYS CB C 71 33.289 33.289 33.134 0.155 17934 10374 1 15 . 1 1 71 71 LYS H H 71 7.830 7.830 7.368 0.462 17934 10375 1 15 . 1 1 72 72 GLY N N 72 108.432 108.432 106.444 1.988 17934 10376 1 15 . 1 1 72 72 GLY CA C 72 45.476 45.476 44.903 0.573 17934 10377 1 15 . 1 1 72 72 GLY H H 72 7.685 7.685 7.644 0.041 17934 10378 1 15 . 1 1 73 73 VAL N N 73 120.414 120.414 120.726 -0.312 17934 10379 1 15 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.364 0.636 17934 10380 1 15 . 1 1 73 73 VAL CA C 73 60.470 60.470 60.954 -0.484 17934 10381 1 15 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.632 -0.002 17934 10382 1 15 . 1 1 73 73 VAL H H 73 8.620 8.620 8.252 0.368 17934 10383 1 15 . 1 1 74 74 LYS N N 74 125.257 125.257 124.189 1.068 17934 10384 1 15 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.521 0.495 17934 10385 1 15 . 1 1 74 74 LYS CA C 74 54.383 54.383 54.488 -0.105 17934 10386 1 15 . 1 1 74 74 LYS CB C 74 36.570 36.570 35.799 0.771 17934 10387 1 15 . 1 1 74 74 LYS H H 74 8.783 8.783 8.462 0.321 17934 10388 1 15 . 1 1 75 75 PHE N N 75 119.414 119.414 117.921 1.493 17934 10389 1 15 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.235 0.465 17934 10390 1 15 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.349 -2.429 17934 10391 1 15 . 1 1 75 75 PHE CB C 75 40.610 40.610 42.493 -1.883 17934 10392 1 15 . 1 1 75 75 PHE H H 75 8.432 8.432 9.062 -0.630 17934 10393 1 15 . 1 1 76 76 ILE N N 76 121.430 121.430 119.571 1.859 17934 10394 1 15 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.658 0.182 17934 10395 1 15 . 1 1 76 76 ILE C C 76 175.249 175.249 174.250 0.999 17934 10396 1 15 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.835 -0.765 17934 10397 1 15 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.858 -0.638 17934 10398 1 15 . 1 1 76 76 ILE H H 76 8.960 8.960 9.084 -0.124 17934 10399 1 15 . 1 1 77 77 ASP N N 77 125.744 125.744 124.186 1.558 17934 10400 1 15 . 1 1 77 77 ASP HA H 77 4.563 4.563 4.993 -0.430 17934 10401 1 15 . 1 1 77 77 ASP C C 77 177.569 177.569 175.735 1.834 17934 10402 1 15 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.758 3.031 17934 10403 1 15 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.717 -0.116 17934 10404 1 15 . 1 1 77 77 ASP H H 77 8.750 8.750 8.262 0.488 17934 10405 1 15 . 1 1 78 78 ALA N N 78 128.632 128.632 128.542 0.090 17934 10406 1 15 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.311 -0.341 17934 10407 1 15 . 1 1 78 78 ALA C C 78 178.052 178.052 178.455 -0.403 17934 10408 1 15 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.065 0.765 17934 10409 1 15 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.539 0.254 17934 10410 1 15 . 1 1 78 78 ALA H H 78 8.700 8.700 8.810 -0.110 17934 10411 1 15 . 1 1 79 79 THR N N 79 113.087 113.087 114.998 -1.911 17934 10412 1 15 . 1 1 79 79 THR HA H 79 4.194 4.194 4.192 0.002 17934 10413 1 15 . 1 1 79 79 THR C C 79 175.587 175.587 175.953 -0.366 17934 10414 1 15 . 1 1 79 79 THR CA C 79 64.695 64.695 65.467 -0.772 17934 10415 1 15 . 1 1 79 79 THR CB C 79 69.382 69.382 69.237 0.145 17934 10416 1 15 . 1 1 79 79 THR H H 79 8.779 8.779 8.556 0.223 17934 10417 1 15 . 1 1 80 80 ASN N N 80 118.434 118.434 116.715 1.719 17934 10418 1 15 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.753 -0.016 17934 10419 1 15 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.895 0.550 17934 10420 1 15 . 1 1 80 80 ASN CB C 80 39.383 39.383 39.414 -0.031 17934 10421 1 15 . 1 1 80 80 ASN H H 80 8.584 8.584 7.926 0.658 17934 10422 1 15 . 1 1 81 81 LYS N N 81 112.429 112.429 114.599 -2.170 17934 10423 1 15 . 1 1 81 81 LYS C C 81 174.909 174.909 174.828 0.081 17934 10424 1 15 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.519 0.145 17934 10425 1 15 . 1 1 81 81 LYS CB C 81 28.602 28.602 29.578 -0.976 17934 10426 1 15 . 1 1 81 81 LYS H H 81 7.966 7.966 8.504 -0.538 17934 10427 1 15 . 1 1 82 82 ASN N N 82 116.806 116.806 116.851 -0.045 17934 10428 1 15 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.808 -0.218 17934 10429 1 15 . 1 1 82 82 ASN C C 82 174.999 174.999 175.297 -0.298 17934 10430 1 15 . 1 1 82 82 ASN CA C 82 52.976 52.976 51.823 1.153 17934 10431 1 15 . 1 1 82 82 ASN CB C 82 38.445 38.445 39.342 -0.897 17934 10432 1 15 . 1 1 82 82 ASN H H 82 8.455 8.455 7.944 0.511 17934 10433 1 15 . 1 1 83 83 ILE N N 83 122.447 122.447 121.942 0.505 17934 10434 1 15 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.030 -0.000 17934 10435 1 15 . 1 1 83 83 ILE C C 83 176.572 176.572 176.009 0.563 17934 10436 1 15 . 1 1 83 83 ILE CA C 83 62.350 62.350 61.309 1.041 17934 10437 1 15 . 1 1 83 83 ILE CB C 83 37.970 37.970 36.561 1.409 17934 10438 1 15 . 1 1 83 83 ILE H H 83 8.650 8.650 8.710 -0.060 17934 10439 1 15 . 1 1 84 84 ILE N N 84 129.339 129.339 126.969 2.370 17934 10440 1 15 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.095 -0.175 17934 10441 1 15 . 1 1 84 84 ILE C C 84 175.873 175.873 175.850 0.023 17934 10442 1 15 . 1 1 84 84 ILE CA C 84 62.810 62.810 60.827 1.983 17934 10443 1 15 . 1 1 84 84 ILE CB C 84 38.840 38.840 36.966 1.874 17934 10444 1 15 . 1 1 84 84 ILE H H 84 8.930 8.930 8.521 0.409 17934 10445 1 15 . 1 1 85 85 ALA N N 85 118.867 118.867 119.124 -0.257 17934 10446 1 15 . 1 1 85 85 ALA C C 85 174.100 174.100 174.761 -0.661 17934 10447 1 15 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.304 -0.734 17934 10448 1 15 . 1 1 85 85 ALA H H 85 7.048 7.048 8.189 -1.141 17934 10449 1 15 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.929 0.225 17934 10450 1 15 . 1 1 87 87 HIS C C 87 174.986 174.986 173.782 1.204 17934 10451 1 15 . 1 1 87 87 HIS CB C 87 34.350 34.350 32.192 2.158 17934 10452 1 15 . 1 1 88 88 GLU N N 88 125.372 125.372 120.264 5.108 17934 10453 1 15 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.327 0.194 17934 10454 1 15 . 1 1 88 88 GLU C C 88 179.047 179.047 178.284 0.763 17934 10455 1 15 . 1 1 88 88 GLU CA C 88 56.726 56.726 56.764 -0.038 17934 10456 1 15 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.346 0.131 17934 10457 1 15 . 1 1 88 88 GLU H H 88 9.106 9.106 8.899 0.207 17934 10458 1 15 . 1 1 89 89 ILE N N 89 124.132 124.132 123.873 0.259 17934 10459 1 15 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.926 0.093 17934 10460 1 15 . 1 1 89 89 ILE C C 89 176.095 176.095 176.942 -0.847 17934 10461 1 15 . 1 1 89 89 ILE CA C 89 62.351 62.351 65.141 -2.790 17934 10462 1 15 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.313 0.601 17934 10463 1 15 . 1 1 89 89 ILE H H 89 8.055 8.055 8.646 -0.591 17934 10464 1 15 . 1 1 90 90 ARG N N 90 116.949 116.949 116.297 0.652 17934 10465 1 15 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.300 0.038 17934 10466 1 15 . 1 1 90 90 ARG C C 90 176.578 176.578 176.847 -0.269 17934 10467 1 15 . 1 1 90 90 ARG CA C 90 57.664 57.664 57.824 -0.160 17934 10468 1 15 . 1 1 90 90 ARG CB C 90 29.070 29.070 28.964 0.106 17934 10469 1 15 . 1 1 90 90 ARG H H 90 8.045 8.045 8.653 -0.608 17934 10470 1 15 . 1 1 91 91 ASN N N 91 116.320 116.320 117.240 -0.920 17934 10471 1 15 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.636 0.517 17934 10472 1 15 . 1 1 91 91 ASN C C 91 174.595 174.595 175.728 -1.133 17934 10473 1 15 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.308 -1.800 17934 10474 1 15 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.508 0.344 17934 10475 1 15 . 1 1 91 91 ASN H H 91 8.067 8.067 7.829 0.238 17934 10476 1 15 . 1 1 92 92 ILE N N 92 122.441 122.441 121.731 0.710 17934 10477 1 15 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.810 1.263 17934 10478 1 15 . 1 1 92 92 ILE C C 92 175.229 175.229 176.071 -0.842 17934 10479 1 15 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.692 -0.812 17934 10480 1 15 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.205 2.645 17934 10481 1 15 . 1 1 92 92 ILE H H 92 7.483 7.483 7.834 -0.351 17934 10482 1 15 . 1 1 93 93 SER N N 93 120.329 120.329 123.490 -3.161 17934 10483 1 15 . 1 1 93 93 SER HA H 93 4.684 4.684 4.235 0.449 17934 10484 1 15 . 1 1 93 93 SER C C 93 180.744 180.744 174.014 6.730 17934 10485 1 15 . 1 1 93 93 SER CA C 93 57.664 57.664 60.465 -2.801 17934 10486 1 15 . 1 1 93 93 SER CB C 93 66.570 66.570 64.026 2.543 17934 10487 1 15 . 1 1 93 93 SER H H 93 9.545 9.545 8.317 1.228 17934 10488 1 15 . 1 1 94 94 CYS N N 94 110.900 110.900 114.933 -4.033 17934 10489 1 15 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.452 -0.640 17934 10490 1 15 . 1 1 94 94 CYS C C 94 173.973 173.973 172.782 1.191 17934 10491 1 15 . 1 1 94 94 CYS CA C 94 59.539 59.539 57.912 1.627 17934 10492 1 15 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.922 -4.664 17934 10493 1 15 . 1 1 94 94 CYS H H 94 8.858 8.858 7.760 1.098 17934 10494 1 15 . 1 1 95 95 ALA N N 95 121.379 121.379 122.062 -0.683 17934 10495 1 15 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.673 -0.243 17934 10496 1 15 . 1 1 95 95 ALA C C 95 178.098 178.098 175.289 2.809 17934 10497 1 15 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.938 0.712 17934 10498 1 15 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.686 -2.386 17934 10499 1 15 . 1 1 95 95 ALA H H 95 8.360 8.360 8.472 -0.112 17934 10500 1 15 . 1 1 96 96 ALA N N 96 122.576 122.576 124.309 -1.733 17934 10501 1 15 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.847 -0.167 17934 10502 1 15 . 1 1 96 96 ALA C C 96 175.716 175.716 174.706 1.010 17934 10503 1 15 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.714 0.726 17934 10504 1 15 . 1 1 96 96 ALA CB C 96 22.700 22.700 22.294 0.406 17934 10505 1 15 . 1 1 96 96 ALA H H 96 9.080 9.080 8.808 0.272 17934 10506 1 15 . 1 1 97 97 GLN N N 97 116.903 116.903 119.967 -3.064 17934 10507 1 15 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.772 0.158 17934 10508 1 15 . 1 1 97 97 GLN C C 97 175.270 175.270 174.276 0.994 17934 10509 1 15 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.886 0.965 17934 10510 1 15 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.956 1.802 17934 10511 1 15 . 1 1 97 97 GLN H H 97 8.369 8.369 8.462 -0.093 17934 10512 1 15 . 1 1 98 98 ASP N N 98 124.971 124.971 121.803 3.168 17934 10513 1 15 . 1 1 98 98 ASP C C 98 175.217 175.217 175.800 -0.583 17934 10514 1 15 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.730 -0.691 17934 10515 1 15 . 1 1 98 98 ASP CB C 98 42.195 42.195 41.871 0.324 17934 10516 1 15 . 1 1 98 98 ASP H H 98 8.395 8.395 8.310 0.085 17934 10517 1 15 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.371 -0.137 17934 10518 1 15 . 1 1 99 99 PRO C C 99 178.433 178.433 177.758 0.675 17934 10519 1 15 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.677 0.018 17934 10520 1 15 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.233 0.119 17934 10521 1 15 . 1 1 100 100 GLU N N 100 116.223 116.223 117.618 -1.395 17934 10522 1 15 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.174 0.046 17934 10523 1 15 . 1 1 100 100 GLU C C 100 176.678 176.678 175.933 0.745 17934 10524 1 15 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.098 -1.372 17934 10525 1 15 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.693 2.252 17934 10526 1 15 . 1 1 100 100 GLU H H 100 8.643 8.643 8.774 -0.131 17934 10527 1 15 . 1 1 101 101 ASP N N 101 119.053 119.053 119.394 -0.341 17934 10528 1 15 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.858 -0.315 17934 10529 1 15 . 1 1 101 101 ASP C C 101 174.771 174.771 176.082 -1.311 17934 10530 1 15 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.284 0.630 17934 10531 1 15 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.772 0.017 17934 10532 1 15 . 1 1 101 101 ASP H H 101 7.597 7.597 8.243 -0.646 17934 10533 1 15 . 1 1 102 102 LEU N N 102 123.986 123.986 121.600 2.386 17934 10534 1 15 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.269 0.121 17934 10535 1 15 . 1 1 102 102 LEU C C 102 177.141 177.141 177.917 -0.776 17934 10536 1 15 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.196 0.464 17934 10537 1 15 . 1 1 102 102 LEU CB C 102 42.660 42.660 42.022 0.638 17934 10538 1 15 . 1 1 102 102 LEU H H 102 8.534 8.534 7.735 0.799 17934 10539 1 15 . 1 1 103 103 SER N N 103 112.339 112.339 112.981 -0.642 17934 10540 1 15 . 1 1 103 103 SER HA H 103 4.290 4.290 4.439 -0.149 17934 10541 1 15 . 1 1 103 103 SER C C 103 174.106 174.106 174.689 -0.583 17934 10542 1 15 . 1 1 103 103 SER CA C 103 60.945 60.945 60.860 0.085 17934 10543 1 15 . 1 1 103 103 SER CB C 103 63.757 63.757 63.553 0.204 17934 10544 1 15 . 1 1 103 103 SER H H 103 7.867 7.867 8.337 -0.470 17934 10545 1 15 . 1 1 104 104 THR N N 104 123.070 123.070 116.573 6.497 17934 10546 1 15 . 1 1 104 104 THR HA H 104 5.373 5.373 4.462 0.911 17934 10547 1 15 . 1 1 104 104 THR C C 104 180.693 180.693 173.085 7.608 17934 10548 1 15 . 1 1 104 104 THR CA C 104 63.289 63.289 63.654 -0.365 17934 10549 1 15 . 1 1 104 104 THR CB C 104 69.382 69.382 70.415 -1.033 17934 10550 1 15 . 1 1 104 104 THR H H 104 8.830 8.830 8.025 0.805 17934 10551 1 15 . 1 1 105 105 PHE N N 105 122.582 122.582 119.585 2.997 17934 10552 1 15 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.935 0.535 17934 10553 1 15 . 1 1 105 105 PHE C C 105 179.211 179.211 172.403 6.808 17934 10554 1 15 . 1 1 105 105 PHE CA C 105 55.320 55.320 56.303 -0.983 17934 10555 1 15 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.807 -0.017 17934 10556 1 15 . 1 1 105 105 PHE H H 105 9.170 9.170 8.628 0.542 17934 10557 1 15 . 1 1 106 106 ALA N N 106 119.567 119.567 122.146 -2.579 17934 10558 1 15 . 1 1 106 106 ALA C C 106 175.603 175.603 175.322 0.281 17934 10559 1 15 . 1 1 106 106 ALA H H 106 8.770 8.770 9.130 -0.360 17934 10560 1 15 . 1 1 107 107 TYR N N 107 109.933 109.933 118.098 -8.165 17934 10561 1 15 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.064 -0.144 17934 10562 1 15 . 1 1 107 107 TYR C C 107 180.426 180.426 172.994 7.432 17934 10563 1 15 . 1 1 107 107 TYR CA C 107 57.080 57.080 55.028 2.052 17934 10564 1 15 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.356 -0.567 17934 10565 1 15 . 1 1 107 107 TYR H H 107 7.950 7.950 8.979 -1.029 17934 10566 1 15 . 1 1 108 108 ILE N N 108 120.613 120.613 121.383 -0.770 17934 10567 1 15 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.551 0.819 17934 10568 1 15 . 1 1 108 108 ILE C C 108 176.212 176.212 176.311 -0.099 17934 10569 1 15 . 1 1 108 108 ILE CA C 108 59.540 59.540 59.605 -0.065 17934 10570 1 15 . 1 1 108 108 ILE CB C 108 39.380 39.380 36.349 3.031 17934 10571 1 15 . 1 1 108 108 ILE H H 108 8.869 8.869 8.288 0.581 17934 10572 1 15 . 1 1 109 109 THR N N 109 116.505 116.505 118.725 -2.220 17934 10573 1 15 . 1 1 109 109 THR HA H 109 5.669 5.669 4.553 1.116 17934 10574 1 15 . 1 1 109 109 THR C C 109 173.505 173.505 173.405 0.100 17934 10575 1 15 . 1 1 109 109 THR CA C 109 59.070 59.070 60.312 -1.242 17934 10576 1 15 . 1 1 109 109 THR H H 109 9.489 9.489 8.650 0.839 17934 10577 1 15 . 1 1 110 110 LYS N N 110 122.960 122.960 122.795 0.165 17934 10578 1 15 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.354 0.106 17934 10579 1 15 . 1 1 110 110 LYS C C 110 175.937 175.937 176.173 -0.236 17934 10580 1 15 . 1 1 110 110 LYS CA C 110 55.789 55.789 55.630 0.159 17934 10581 1 15 . 1 1 110 110 LYS CB C 110 34.227 34.227 32.866 1.361 17934 10582 1 15 . 1 1 110 110 LYS H H 110 7.831 7.831 8.195 -0.364 17934 10583 1 15 . 1 1 111 111 ASP N N 111 127.409 127.409 124.046 3.363 17934 10584 1 15 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.822 -0.041 17934 10585 1 15 . 1 1 111 111 ASP C C 111 176.396 176.396 177.062 -0.666 17934 10586 1 15 . 1 1 111 111 ASP CA C 111 53.914 53.914 53.654 0.260 17934 10587 1 15 . 1 1 111 111 ASP CB C 111 43.133 43.133 41.316 1.817 17934 10588 1 15 . 1 1 111 111 ASP H H 111 8.769 8.769 8.374 0.395 17934 10589 1 15 . 1 1 112 112 LEU N N 112 125.913 125.913 119.002 6.911 17934 10590 1 15 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.041 0.109 17934 10591 1 15 . 1 1 112 112 LEU C C 112 178.553 178.553 177.482 1.071 17934 10592 1 15 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.208 -0.018 17934 10593 1 15 . 1 1 112 112 LEU CB C 112 41.790 41.790 41.766 0.024 17934 10594 1 15 . 1 1 112 112 LEU H H 112 8.593 8.593 8.502 0.091 17934 10595 1 15 . 1 1 113 113 LYS N N 113 117.189 117.189 116.755 0.434 17934 10596 1 15 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.166 0.096 17934 10597 1 15 . 1 1 113 113 LYS C C 113 177.180 177.180 175.708 1.472 17934 10598 1 15 . 1 1 113 113 LYS CA C 113 58.133 58.133 56.911 1.222 17934 10599 1 15 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.501 0.319 17934 10600 1 15 . 1 1 113 113 LYS H H 113 8.207 8.207 8.072 0.135 17934 10601 1 15 . 1 1 114 114 SER N N 114 112.492 112.492 116.254 -3.762 17934 10602 1 15 . 1 1 114 114 SER CA C 114 58.601 58.601 57.048 1.553 17934 10603 1 15 . 1 1 114 114 SER CB C 114 65.164 65.164 65.993 -0.829 17934 10604 1 15 . 1 1 114 114 SER H H 114 7.755 7.755 7.589 0.166 17934 10605 1 15 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.530 -0.141 17934 10606 1 15 . 1 1 115 115 ASN C C 115 174.203 174.203 174.771 -0.568 17934 10607 1 15 . 1 1 115 115 ASN CA C 115 54.383 54.383 53.587 0.796 17934 10608 1 15 . 1 1 115 115 ASN CB C 115 37.977 37.977 38.554 -0.577 17934 10609 1 15 . 1 1 116 116 HIS N N 116 116.822 116.822 119.455 -2.633 17934 10610 1 15 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.515 0.415 17934 10611 1 15 . 1 1 116 116 HIS C C 116 173.898 173.898 175.540 -1.642 17934 10612 1 15 . 1 1 116 116 HIS CA C 116 54.910 54.910 56.216 -1.306 17934 10613 1 15 . 1 1 116 116 HIS CB C 116 32.650 32.650 30.605 2.045 17934 10614 1 15 . 1 1 116 116 HIS H H 116 7.690 7.690 7.756 -0.066 17934 10615 1 15 . 1 1 117 117 HIS N N 117 118.253 118.253 122.478 -4.225 17934 10616 1 15 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.451 0.869 17934 10617 1 15 . 1 1 117 117 HIS C C 117 173.695 173.695 173.948 -0.253 17934 10618 1 15 . 1 1 117 117 HIS CA C 117 56.350 56.350 57.278 -0.928 17934 10619 1 15 . 1 1 117 117 HIS CB C 117 32.350 32.350 27.992 4.358 17934 10620 1 15 . 1 1 117 117 HIS H H 117 8.340 8.340 8.936 -0.596 17934 10621 1 15 . 1 1 118 118 TYR N N 118 118.301 118.301 123.724 -5.423 17934 10622 1 15 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.808 0.202 17934 10623 1 15 . 1 1 118 118 TYR C C 118 173.530 173.530 174.965 -1.435 17934 10624 1 15 . 1 1 118 118 TYR CA C 118 56.730 56.730 57.211 -0.481 17934 10625 1 15 . 1 1 118 118 TYR CB C 118 43.240 43.240 41.177 2.063 17934 10626 1 15 . 1 1 118 118 TYR H H 118 9.080 9.080 8.289 0.791 17934 10627 1 15 . 1 1 119 119 CYS N N 119 121.015 121.015 122.604 -1.589 17934 10628 1 15 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.606 0.457 17934 10629 1 15 . 1 1 119 119 CYS C C 119 180.664 180.664 173.836 6.828 17934 10630 1 15 . 1 1 119 119 CYS CA C 119 56.726 56.726 56.354 0.372 17934 10631 1 15 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.044 1.495 17934 10632 1 15 . 1 1 119 119 CYS H H 119 9.120 9.120 9.045 0.075 17934 10633 1 15 . 1 1 120 120 HIS N N 120 110.134 110.134 126.049 -15.915 17934 10634 1 15 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.865 -0.166 17934 10635 1 15 . 1 1 120 120 HIS C C 120 180.776 180.776 173.777 6.999 17934 10636 1 15 . 1 1 120 120 HIS CA C 120 55.320 55.320 55.784 -0.464 17934 10637 1 15 . 1 1 120 120 HIS CB C 120 32.352 32.352 30.856 1.496 17934 10638 1 15 . 1 1 120 120 HIS H H 120 8.482 8.482 8.906 -0.424 17934 10639 1 15 . 1 1 121 121 VAL N N 121 120.855 120.855 125.363 -4.508 17934 10640 1 15 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.490 -0.140 17934 10641 1 15 . 1 1 121 121 VAL C C 121 173.419 173.419 173.068 0.351 17934 10642 1 15 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.910 0.500 17934 10643 1 15 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.460 -0.180 17934 10644 1 15 . 1 1 121 121 VAL H H 121 7.929 7.929 8.741 -0.812 17934 10645 1 15 . 1 1 122 122 PHE N N 122 124.384 124.384 128.265 -3.881 17934 10646 1 15 . 1 1 122 122 PHE HA H 122 5.420 5.420 4.992 0.428 17934 10647 1 15 . 1 1 122 122 PHE C C 122 174.876 174.876 173.759 1.117 17934 10648 1 15 . 1 1 122 122 PHE CA C 122 55.320 55.320 56.669 -1.349 17934 10649 1 15 . 1 1 122 122 PHE CB C 122 44.540 44.540 43.823 0.717 17934 10650 1 15 . 1 1 122 122 PHE H H 122 8.910 8.910 9.251 -0.341 17934 10651 1 15 . 1 1 123 123 THR N N 123 112.451 112.451 113.350 -0.899 17934 10652 1 15 . 1 1 123 123 THR HA H 123 5.147 5.147 4.550 0.597 17934 10653 1 15 . 1 1 123 123 THR C C 123 174.096 174.096 172.543 1.553 17934 10654 1 15 . 1 1 123 123 THR CA C 123 61.843 61.843 59.452 2.391 17934 10655 1 15 . 1 1 123 123 THR CB C 123 71.218 71.218 70.937 0.281 17934 10656 1 15 . 1 1 123 123 THR H H 123 8.668 8.668 8.954 -0.286 17934 10657 1 15 . 1 1 124 124 ALA N N 124 128.922 128.922 126.102 2.820 17934 10658 1 15 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.471 0.249 17934 10659 1 15 . 1 1 124 124 ALA C C 124 177.168 177.168 176.632 0.536 17934 10660 1 15 . 1 1 124 124 ALA CA C 124 50.890 50.890 49.791 1.099 17934 10661 1 15 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.307 -0.207 17934 10662 1 15 . 1 1 124 124 ALA H H 124 9.180 9.180 8.548 0.632 17934 10663 1 15 . 1 1 125 125 PHE N N 125 115.427 115.427 116.417 -0.990 17934 10664 1 15 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.542 -0.252 17934 10665 1 15 . 1 1 125 125 PHE C C 125 174.703 174.703 176.315 -1.612 17934 10666 1 15 . 1 1 125 125 PHE CA C 125 60.470 60.470 57.995 2.475 17934 10667 1 15 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.252 -1.192 17934 10668 1 15 . 1 1 125 125 PHE H H 125 8.560 8.560 8.558 0.002 17934 10669 1 15 . 1 1 126 126 ASP N N 126 115.745 115.745 119.811 -4.066 17934 10670 1 15 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.900 -0.057 17934 10671 1 15 . 1 1 126 126 ASP C C 126 176.532 176.532 176.454 0.078 17934 10672 1 15 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.624 -0.179 17934 10673 1 15 . 1 1 126 126 ASP CB C 126 44.070 44.070 44.384 -0.314 17934 10674 1 15 . 1 1 126 126 ASP H H 126 7.417 7.417 7.777 -0.360 17934 10675 1 15 . 1 1 127 127 VAL N N 127 121.923 121.923 124.187 -2.264 17934 10676 1 15 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.793 -0.203 17934 10677 1 15 . 1 1 127 127 VAL C C 127 176.863 176.863 177.349 -0.486 17934 10678 1 15 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.114 -0.484 17934 10679 1 15 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.188 -0.358 17934 10680 1 15 . 1 1 127 127 VAL H H 127 8.508 8.508 8.729 -0.221 17934 10681 1 15 . 1 1 128 128 ASN N N 128 118.851 118.851 118.816 0.035 17934 10682 1 15 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.451 0.025 17934 10683 1 15 . 1 1 128 128 ASN C C 128 178.251 178.251 177.381 0.870 17934 10684 1 15 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.287 -0.029 17934 10685 1 15 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.138 -0.161 17934 10686 1 15 . 1 1 128 128 ASN H H 128 8.207 8.207 8.367 -0.160 17934 10687 1 15 . 1 1 129 129 LEU N N 129 122.549 122.549 120.344 2.205 17934 10688 1 15 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.674 0.536 17934 10689 1 15 . 1 1 129 129 LEU C C 129 178.003 178.003 178.107 -0.104 17934 10690 1 15 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.339 -0.149 17934 10691 1 15 . 1 1 129 129 LEU CB C 129 41.790 41.790 40.610 1.180 17934 10692 1 15 . 1 1 129 129 LEU H H 129 8.223 8.223 7.911 0.312 17934 10693 1 15 . 1 1 130 130 ALA N N 130 120.036 120.036 121.956 -1.920 17934 10694 1 15 . 1 1 130 130 ALA HA H 130 3.310 3.310 4.025 -0.715 17934 10695 1 15 . 1 1 130 130 ALA C C 130 178.172 178.172 179.250 -1.078 17934 10696 1 15 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.462 0.318 17934 10697 1 15 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.255 0.816 17934 10698 1 15 . 1 1 130 130 ALA H H 130 7.360 7.360 8.157 -0.797 17934 10699 1 15 . 1 1 131 131 ALA N N 131 116.989 116.989 119.379 -2.390 17934 10700 1 15 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.928 -0.218 17934 10701 1 15 . 1 1 131 131 ALA C C 131 180.163 180.163 179.746 0.417 17934 10702 1 15 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.607 1.173 17934 10703 1 15 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.155 -0.325 17934 10704 1 15 . 1 1 131 131 ALA H H 131 7.360 7.360 8.194 -0.834 17934 10705 1 15 . 1 1 132 132 GLU N N 132 119.462 119.462 120.096 -0.634 17934 10706 1 15 . 1 1 132 132 GLU HA H 132 3.888 3.888 4.026 -0.138 17934 10707 1 15 . 1 1 132 132 GLU C C 132 179.243 179.243 178.799 0.444 17934 10708 1 15 . 1 1 132 132 GLU CA C 132 59.539 59.539 59.395 0.144 17934 10709 1 15 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.366 0.173 17934 10710 1 15 . 1 1 132 132 GLU H H 132 7.673 7.673 8.252 -0.579 17934 10711 1 15 . 1 1 133 133 ILE N N 133 123.218 123.218 120.642 2.576 17934 10712 1 15 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.656 -0.876 17934 10713 1 15 . 1 1 133 133 ILE C C 133 177.421 177.421 177.965 -0.544 17934 10714 1 15 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.569 0.921 17934 10715 1 15 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.907 -1.257 17934 10716 1 15 . 1 1 133 133 ILE H H 133 8.154 8.154 8.349 -0.195 17934 10717 1 15 . 1 1 134 134 ILE N N 134 118.244 118.244 118.979 -0.735 17934 10718 1 15 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.501 0.039 17934 10719 1 15 . 1 1 134 134 ILE C C 134 179.385 179.385 178.486 0.899 17934 10720 1 15 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.430 -1.150 17934 10721 1 15 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.509 -0.409 17934 10722 1 15 . 1 1 134 134 ILE H H 134 7.376 7.376 7.980 -0.604 17934 10723 1 15 . 1 1 135 135 LEU N N 135 123.061 123.061 121.686 1.375 17934 10724 1 15 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.978 0.212 17934 10725 1 15 . 1 1 135 135 LEU C C 135 179.858 179.858 178.961 0.897 17934 10726 1 15 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.833 -0.643 17934 10727 1 15 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.149 0.711 17934 10728 1 15 . 1 1 135 135 LEU H H 135 8.036 8.036 8.236 -0.200 17934 10729 1 15 . 1 1 136 136 THR N N 136 119.647 119.647 116.025 3.622 17934 10730 1 15 . 1 1 136 136 THR HA H 136 3.725 3.725 3.911 -0.186 17934 10731 1 15 . 1 1 136 136 THR C C 136 176.088 176.088 176.767 -0.679 17934 10732 1 15 . 1 1 136 136 THR CA C 136 58.601 58.601 66.805 -8.204 17934 10733 1 15 . 1 1 136 136 THR CB C 136 67.976 67.976 68.747 -0.771 17934 10734 1 15 . 1 1 136 136 THR H H 136 8.508 8.508 8.248 0.260 17934 10735 1 15 . 1 1 137 137 LEU N N 137 123.182 123.182 122.177 1.005 17934 10736 1 15 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.866 -0.126 17934 10737 1 15 . 1 1 137 137 LEU C C 137 178.341 178.341 178.901 -0.560 17934 10738 1 15 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.671 -0.411 17934 10739 1 15 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.025 0.525 17934 10740 1 15 . 1 1 137 137 LEU H H 137 8.520 8.520 8.597 -0.077 17934 10741 1 15 . 1 1 138 138 GLY N N 138 105.266 105.266 105.262 0.004 17934 10742 1 15 . 1 1 138 138 GLY C C 138 176.973 176.973 175.876 1.097 17934 10743 1 15 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.146 0.205 17934 10744 1 15 . 1 1 138 138 GLY H H 138 7.858 7.858 7.952 -0.094 17934 10745 1 15 . 1 1 139 139 GLN N N 139 123.485 123.485 122.876 0.609 17934 10746 1 15 . 1 1 139 139 GLN C C 139 177.891 177.891 178.447 -0.556 17934 10747 1 15 . 1 1 139 139 GLN CA C 139 58.601 58.601 57.812 0.789 17934 10748 1 15 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.157 -0.024 17934 10749 1 15 . 1 1 139 139 GLN H H 139 8.195 8.195 8.390 -0.195 17934 10750 1 15 . 1 1 140 140 ALA N N 140 122.754 122.754 123.360 -0.606 17934 10751 1 15 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.165 -0.456 17934 10752 1 15 . 1 1 140 140 ALA C C 140 178.987 178.987 179.323 -0.336 17934 10753 1 15 . 1 1 140 140 ALA CA C 140 55.780 55.780 55.040 0.740 17934 10754 1 15 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.110 -0.700 17934 10755 1 15 . 1 1 140 140 ALA H H 140 8.530 8.530 8.314 0.216 17934 10756 1 15 . 1 1 141 141 PHE N N 141 116.275 116.275 117.927 -1.652 17934 10757 1 15 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.478 -0.388 17934 10758 1 15 . 1 1 141 141 PHE C C 141 178.129 178.129 177.078 1.051 17934 10759 1 15 . 1 1 141 141 PHE CA C 141 61.240 61.240 59.860 1.380 17934 10760 1 15 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.084 0.298 17934 10761 1 15 . 1 1 141 141 PHE H H 141 7.920 7.920 8.220 -0.300 17934 10762 1 15 . 1 1 142 142 GLU N N 142 119.967 119.967 119.841 0.126 17934 10763 1 15 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.493 0.734 17934 10764 1 15 . 1 1 142 142 GLU C C 142 179.250 179.250 177.922 1.328 17934 10765 1 15 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.091 1.448 17934 10766 1 15 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.810 -0.271 17934 10767 1 15 . 1 1 142 142 GLU H H 142 7.713 7.713 7.952 -0.239 17934 10768 1 15 . 1 1 143 143 VAL N N 143 120.189 120.189 119.969 0.220 17934 10769 1 15 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.709 -0.026 17934 10770 1 15 . 1 1 143 143 VAL C C 143 178.066 178.066 176.099 1.967 17934 10771 1 15 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.614 1.956 17934 10772 1 15 . 1 1 143 143 VAL CB C 143 31.883 31.883 32.268 -0.385 17934 10773 1 15 . 1 1 143 143 VAL H H 143 8.608 8.608 7.651 0.957 17934 10774 1 15 . 1 1 144 144 ALA N N 144 121.753 121.753 120.610 1.143 17934 10775 1 15 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.041 -0.041 17934 10776 1 15 . 1 1 144 144 ALA C C 144 180.776 180.776 176.619 4.157 17934 10777 1 15 . 1 1 144 144 ALA CA C 144 55.780 55.780 52.836 2.944 17934 10778 1 15 . 1 1 144 144 ALA CB C 144 18.770 18.770 16.908 1.862 17934 10779 1 15 . 1 1 144 144 ALA H H 144 8.399 8.399 7.461 0.938 17934 10780 1 15 . 1 1 145 145 TYR N N 145 119.962 119.962 112.978 6.984 17934 10781 1 15 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.049 0.141 17934 10782 1 15 . 1 1 145 145 TYR C C 145 177.645 177.645 175.178 2.467 17934 10783 1 15 . 1 1 145 145 TYR CA C 145 60.880 60.880 59.204 1.676 17934 10784 1 15 . 1 1 145 145 TYR CB C 145 37.980 37.980 35.759 2.221 17934 10785 1 15 . 1 1 145 145 TYR H H 145 8.190 8.190 8.693 -0.503 17934 10786 1 16 . 1 1 13 13 LYS N N 13 120.778 120.778 122.019 -1.241 17934 10787 1 16 . 1 1 13 13 LYS C C 13 176.476 176.476 175.451 1.025 17934 10788 1 16 . 1 1 13 13 LYS CA C 13 58.601 58.601 55.713 2.888 17934 10789 1 16 . 1 1 13 13 LYS CB C 13 32.820 32.820 34.052 -1.232 17934 10790 1 16 . 1 1 13 13 LYS H H 13 7.984 7.984 8.211 -0.227 17934 10791 1 16 . 1 1 15 15 ILE HA H 15 3.820 3.820 3.840 -0.020 17934 10792 1 16 . 1 1 15 15 ILE C C 15 176.376 176.376 175.909 0.467 17934 10793 1 16 . 1 1 15 15 ILE CA C 15 63.570 63.570 62.419 1.151 17934 10794 1 16 . 1 1 15 15 ILE CB C 15 39.380 39.380 38.417 0.963 17934 10795 1 16 . 1 1 16 16 ALA N N 16 121.364 121.364 120.653 0.711 17934 10796 1 16 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.494 -0.056 17934 10797 1 16 . 1 1 16 16 ALA C C 16 177.494 177.494 177.473 0.021 17934 10798 1 16 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.752 0.224 17934 10799 1 16 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.444 0.889 17934 10800 1 16 . 1 1 16 16 ALA H H 16 8.081 8.081 7.794 0.287 17934 10801 1 16 . 1 1 17 17 GLN N N 17 118.109 118.109 115.509 2.600 17934 10802 1 16 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.538 0.035 17934 10803 1 16 . 1 1 17 17 GLN C C 17 173.632 173.632 174.735 -1.103 17934 10804 1 16 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.338 -0.487 17934 10805 1 16 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.448 0.029 17934 10806 1 16 . 1 1 17 17 GLN H H 17 7.550 7.550 8.252 -0.702 17934 10807 1 16 . 1 1 18 18 SER N N 18 112.384 112.384 114.089 -1.705 17934 10808 1 16 . 1 1 18 18 SER HA H 18 4.388 4.388 4.711 -0.323 17934 10809 1 16 . 1 1 18 18 SER C C 18 173.780 173.780 172.703 1.077 17934 10810 1 16 . 1 1 18 18 SER CA C 18 57.664 57.664 57.516 0.148 17934 10811 1 16 . 1 1 18 18 SER CB C 18 65.164 65.164 65.313 -0.149 17934 10812 1 16 . 1 1 18 18 SER H H 18 7.666 7.666 8.050 -0.384 17934 10813 1 16 . 1 1 19 19 CYS N N 19 120.116 120.116 120.934 -0.818 17934 10814 1 16 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.522 -0.192 17934 10815 1 16 . 1 1 19 19 CYS C C 19 180.387 180.387 173.208 7.179 17934 10816 1 16 . 1 1 19 19 CYS CA C 19 58.601 58.601 58.304 0.297 17934 10817 1 16 . 1 1 19 19 CYS CB C 19 30.008 30.008 30.932 -0.924 17934 10818 1 16 . 1 1 19 19 CYS H H 19 8.835 8.835 9.051 -0.216 17934 10819 1 16 . 1 1 20 20 ASP N N 20 124.416 124.416 122.147 2.269 17934 10820 1 16 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.614 -0.638 17934 10821 1 16 . 1 1 20 20 ASP CB C 20 42.195 42.195 44.696 -2.501 17934 10822 1 16 . 1 1 20 20 ASP H H 20 7.847 7.847 7.509 0.338 17934 10823 1 16 . 1 1 21 21 TYR N N 21 121.296 121.296 120.214 1.082 17934 10824 1 16 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.722 0.008 17934 10825 1 16 . 1 1 21 21 TYR C C 21 175.793 175.793 174.182 1.611 17934 10826 1 16 . 1 1 21 21 TYR CA C 21 57.200 57.200 55.992 1.208 17934 10827 1 16 . 1 1 21 21 TYR CB C 21 43.240 43.240 42.873 0.367 17934 10828 1 16 . 1 1 21 21 TYR H H 21 9.070 9.070 8.921 0.149 17934 10829 1 16 . 1 1 22 22 LYS N N 22 122.820 122.820 120.444 2.376 17934 10830 1 16 . 1 1 22 22 LYS HA H 22 5.192 5.192 4.799 0.393 17934 10831 1 16 . 1 1 22 22 LYS C C 22 175.793 175.793 175.449 0.344 17934 10832 1 16 . 1 1 22 22 LYS CA C 22 56.258 56.258 56.266 -0.008 17934 10833 1 16 . 1 1 22 22 LYS CB C 22 33.758 33.758 33.971 -0.213 17934 10834 1 16 . 1 1 22 22 LYS H H 22 8.711 8.711 8.774 -0.063 17934 10835 1 16 . 1 1 23 23 ALA N N 23 123.073 123.073 124.771 -1.698 17934 10836 1 16 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.595 0.135 17934 10837 1 16 . 1 1 23 23 ALA C C 23 174.515 174.515 175.046 -0.531 17934 10838 1 16 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.674 0.896 17934 10839 1 16 . 1 1 23 23 ALA CB C 23 21.628 21.628 23.349 -1.721 17934 10840 1 16 . 1 1 23 23 ALA H H 23 8.727 8.727 8.674 0.053 17934 10841 1 16 . 1 1 24 24 ALA N N 24 122.486 122.486 123.813 -1.327 17934 10842 1 16 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.848 0.333 17934 10843 1 16 . 1 1 24 24 ALA C C 24 176.835 176.835 176.056 0.779 17934 10844 1 16 . 1 1 24 24 ALA CA C 24 51.570 51.570 50.630 0.940 17934 10845 1 16 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.882 -0.762 17934 10846 1 16 . 1 1 24 24 ALA H H 24 8.675 8.675 8.976 -0.301 17934 10847 1 16 . 1 1 25 25 TYR N N 25 122.698 122.698 125.807 -3.109 17934 10848 1 16 . 1 1 25 25 TYR HA H 25 5.010 5.010 3.937 1.073 17934 10849 1 16 . 1 1 25 25 TYR CA C 25 54.340 54.340 55.517 -1.177 17934 10850 1 16 . 1 1 25 25 TYR CB C 25 39.850 39.850 37.633 2.217 17934 10851 1 16 . 1 1 25 25 TYR H H 25 8.270 8.270 8.449 -0.179 17934 10852 1 16 . 1 1 26 26 LEU N N 26 127.997 127.997 128.244 -0.247 17934 10853 1 16 . 1 1 26 26 LEU HA H 26 3.920 3.920 3.993 -0.073 17934 10854 1 16 . 1 1 26 26 LEU C C 26 175.983 175.983 176.590 -0.607 17934 10855 1 16 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.151 0.575 17934 10856 1 16 . 1 1 26 26 LEU CB C 26 41.070 41.070 42.896 -1.826 17934 10857 1 16 . 1 1 26 26 LEU H H 26 8.700 8.700 7.869 0.831 17934 10858 1 16 . 1 1 27 27 GLY N N 27 102.901 102.901 101.260 1.641 17934 10859 1 16 . 1 1 27 27 GLY C C 27 176.219 176.219 171.644 4.575 17934 10860 1 16 . 1 1 27 27 GLY CA C 27 43.601 43.601 44.844 -1.243 17934 10861 1 16 . 1 1 27 27 GLY H H 27 5.891 5.891 7.722 -1.831 17934 10862 1 16 . 1 1 28 28 SER N N 28 111.551 111.551 114.601 -3.050 17934 10863 1 16 . 1 1 28 28 SER HA H 28 5.785 5.785 5.378 0.407 17934 10864 1 16 . 1 1 28 28 SER CA C 28 56.258 56.258 57.469 -1.211 17934 10865 1 16 . 1 1 28 28 SER CB C 28 65.632 65.632 66.580 -0.948 17934 10866 1 16 . 1 1 28 28 SER H H 28 7.981 7.981 8.292 -0.311 17934 10867 1 16 . 1 1 29 29 MET N N 29 119.493 119.493 119.955 -0.462 17934 10868 1 16 . 1 1 29 29 MET HA H 29 4.725 4.725 4.868 -0.143 17934 10869 1 16 . 1 1 29 29 MET C C 29 174.143 174.143 174.194 -0.051 17934 10870 1 16 . 1 1 29 29 MET CA C 29 54.036 54.036 54.224 -0.188 17934 10871 1 16 . 1 1 29 29 MET CB C 29 37.268 37.268 36.662 0.606 17934 10872 1 16 . 1 1 29 29 MET H H 29 8.704 8.704 9.044 -0.340 17934 10873 1 16 . 1 1 30 30 LEU N N 30 128.150 128.150 122.942 5.208 17934 10874 1 16 . 1 1 30 30 LEU HA H 30 3.785 3.785 3.559 0.226 17934 10875 1 16 . 1 1 30 30 LEU C C 30 175.857 175.857 175.031 0.826 17934 10876 1 16 . 1 1 30 30 LEU CA C 30 56.250 56.250 53.869 2.381 17934 10877 1 16 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.395 1.264 17934 10878 1 16 . 1 1 30 30 LEU H H 30 8.630 8.630 8.370 0.260 17934 10879 1 16 . 1 1 31 31 ILE N N 31 127.723 127.723 128.273 -0.550 17934 10880 1 16 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.055 0.135 17934 10881 1 16 . 1 1 31 31 ILE C C 31 174.881 174.881 175.111 -0.230 17934 10882 1 16 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.200 -1.540 17934 10883 1 16 . 1 1 31 31 ILE CB C 31 37.110 37.110 37.387 -0.277 17934 10884 1 16 . 1 1 31 31 ILE H H 31 8.560 8.560 8.137 0.423 17934 10885 1 16 . 1 1 32 32 LYS HA H 32 4.055 4.055 3.639 0.416 17934 10886 1 16 . 1 1 32 32 LYS C C 32 176.272 176.272 176.905 -0.633 17934 10887 1 16 . 1 1 32 32 LYS CA C 32 58.601 58.601 57.847 0.754 17934 10888 1 16 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.827 -0.007 17934 10889 1 16 . 1 1 33 33 GLU N N 33 118.638 118.638 120.710 -2.072 17934 10890 1 16 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.326 0.062 17934 10891 1 16 . 1 1 33 33 GLU C C 33 173.962 173.962 175.284 -1.322 17934 10892 1 16 . 1 1 33 33 GLU CA C 33 54.851 54.851 55.523 -0.671 17934 10893 1 16 . 1 1 33 33 GLU CB C 33 30.945 30.945 29.133 1.812 17934 10894 1 16 . 1 1 33 33 GLU H H 33 7.723 7.723 8.153 -0.430 17934 10895 1 16 . 1 1 34 34 LEU N N 34 126.535 126.535 124.908 1.627 17934 10896 1 16 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.233 -0.288 17934 10897 1 16 . 1 1 34 34 LEU C C 34 176.870 176.870 177.121 -0.251 17934 10898 1 16 . 1 1 34 34 LEU CA C 34 54.850 54.850 55.129 -0.279 17934 10899 1 16 . 1 1 34 34 LEU CB C 34 41.720 41.720 41.732 -0.012 17934 10900 1 16 . 1 1 34 34 LEU H H 34 8.446 8.446 8.343 0.103 17934 10901 1 16 . 1 1 35 35 ARG N N 35 128.447 128.447 123.557 4.890 17934 10902 1 16 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.570 -0.015 17934 10903 1 16 . 1 1 35 35 ARG C C 35 176.110 176.110 176.183 -0.073 17934 10904 1 16 . 1 1 35 35 ARG CA C 35 54.851 54.851 54.602 0.249 17934 10905 1 16 . 1 1 35 35 ARG CB C 35 30.477 30.477 30.803 -0.326 17934 10906 1 16 . 1 1 35 35 ARG H H 35 8.680 8.680 8.436 0.244 17934 10907 1 16 . 1 1 36 36 GLY N N 36 107.406 107.406 112.666 -5.260 17934 10908 1 16 . 1 1 36 36 GLY CA C 36 45.906 45.906 45.513 0.393 17934 10909 1 16 . 1 1 36 36 GLY H H 36 7.182 7.182 8.516 -1.334 17934 10910 1 16 . 1 1 37 37 THR HA H 37 4.060 4.060 4.156 -0.096 17934 10911 1 16 . 1 1 37 37 THR C C 37 176.634 176.634 176.086 0.548 17934 10912 1 16 . 1 1 37 37 THR CA C 37 65.632 65.632 63.541 2.091 17934 10913 1 16 . 1 1 37 37 THR CB C 37 68.445 68.445 68.779 -0.335 17934 10914 1 16 . 1 1 38 38 GLU N N 38 122.251 122.251 122.315 -0.064 17934 10915 1 16 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.939 0.187 17934 10916 1 16 . 1 1 38 38 GLU C C 38 179.981 179.981 178.411 1.570 17934 10917 1 16 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.444 0.564 17934 10918 1 16 . 1 1 38 38 GLU CB C 38 29.539 29.539 28.998 0.541 17934 10919 1 16 . 1 1 38 38 GLU H H 38 8.450 8.450 8.590 -0.140 17934 10920 1 16 . 1 1 39 39 SER N N 39 115.966 115.966 114.358 1.608 17934 10921 1 16 . 1 1 39 39 SER C C 39 175.991 175.991 176.477 -0.486 17934 10922 1 16 . 1 1 39 39 SER CA C 39 62.820 62.820 61.604 1.216 17934 10923 1 16 . 1 1 39 39 SER H H 39 7.522 7.522 7.707 -0.185 17934 10924 1 16 . 1 1 40 40 THR HA H 40 4.049 4.049 3.887 0.162 17934 10925 1 16 . 1 1 40 40 THR C C 40 175.972 175.972 176.543 -0.571 17934 10926 1 16 . 1 1 40 40 THR CA C 40 66.101 66.101 65.315 0.786 17934 10927 1 16 . 1 1 40 40 THR CB C 40 67.976 67.976 68.329 -0.353 17934 10928 1 16 . 1 1 41 41 GLN N N 41 120.354 120.354 120.040 0.314 17934 10929 1 16 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.067 -0.308 17934 10930 1 16 . 1 1 41 41 GLN C C 41 178.483 178.483 177.688 0.795 17934 10931 1 16 . 1 1 41 41 GLN CA C 41 60.476 60.476 58.645 1.831 17934 10932 1 16 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.505 -0.372 17934 10933 1 16 . 1 1 41 41 GLN H H 41 8.271 8.271 8.583 -0.312 17934 10934 1 16 . 1 1 42 42 ASP N N 42 120.757 120.757 121.854 -1.097 17934 10935 1 16 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.383 -0.024 17934 10936 1 16 . 1 1 42 42 ASP C C 42 177.480 177.480 177.849 -0.369 17934 10937 1 16 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.747 -0.083 17934 10938 1 16 . 1 1 42 42 ASP CB C 42 42.195 42.195 41.170 1.025 17934 10939 1 16 . 1 1 42 42 ASP H H 42 7.954 7.954 8.040 -0.086 17934 10940 1 16 . 1 1 43 43 ALA N N 43 120.587 120.587 122.498 -1.911 17934 10941 1 16 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.128 -0.138 17934 10942 1 16 . 1 1 43 43 ALA C C 43 179.767 179.767 179.557 0.210 17934 10943 1 16 . 1 1 43 43 ALA CA C 43 55.320 55.320 55.295 0.025 17934 10944 1 16 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.336 0.894 17934 10945 1 16 . 1 1 43 43 ALA H H 43 7.842 7.842 8.380 -0.538 17934 10946 1 16 . 1 1 44 44 CYS N N 44 115.428 115.428 118.164 -2.736 17934 10947 1 16 . 1 1 44 44 CYS HA H 44 3.895 3.895 4.010 -0.115 17934 10948 1 16 . 1 1 44 44 CYS C C 44 176.076 176.076 176.291 -0.215 17934 10949 1 16 . 1 1 44 44 CYS CA C 44 64.695 64.695 61.880 2.815 17934 10950 1 16 . 1 1 44 44 CYS CB C 44 27.664 27.664 26.359 1.305 17934 10951 1 16 . 1 1 44 44 CYS H H 44 7.900 7.900 8.387 -0.487 17934 10952 1 16 . 1 1 45 45 ALA N N 45 120.487 120.487 122.132 -1.645 17934 10953 1 16 . 1 1 45 45 ALA HA H 45 4.000 4.000 4.001 -0.001 17934 10954 1 16 . 1 1 45 45 ALA C C 45 173.506 173.506 179.046 -5.540 17934 10955 1 16 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.256 0.064 17934 10956 1 16 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.184 -0.244 17934 10957 1 16 . 1 1 45 45 ALA H H 45 7.250 7.250 7.932 -0.682 17934 10958 1 16 . 1 1 46 46 LYS N N 46 119.267 119.267 119.440 -0.173 17934 10959 1 16 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.905 0.042 17934 10960 1 16 . 1 1 46 46 LYS C C 46 179.561 179.561 178.912 0.649 17934 10961 1 16 . 1 1 46 46 LYS H H 46 8.102 8.102 8.140 -0.038 17934 10962 1 16 . 1 1 47 47 MET N N 47 118.009 118.009 117.870 0.139 17934 10963 1 16 . 1 1 47 47 MET HA H 47 4.214 4.214 4.190 0.024 17934 10964 1 16 . 1 1 47 47 MET C C 47 179.526 179.526 177.770 1.756 17934 10965 1 16 . 1 1 47 47 MET CA C 47 57.195 57.195 58.628 -1.433 17934 10966 1 16 . 1 1 47 47 MET CB C 47 30.945 30.945 32.969 -2.024 17934 10967 1 16 . 1 1 47 47 MET H H 47 8.585 8.585 8.376 0.209 17934 10968 1 16 . 1 1 48 48 ARG N N 48 119.962 119.962 120.359 -0.397 17934 10969 1 16 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.962 -0.106 17934 10970 1 16 . 1 1 48 48 ARG C C 48 178.875 178.875 177.335 1.540 17934 10971 1 16 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.204 1.741 17934 10972 1 16 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.923 0.554 17934 10973 1 16 . 1 1 48 48 ARG H H 48 8.190 8.190 8.404 -0.214 17934 10974 1 16 . 1 1 49 49 ALA N N 49 120.640 120.640 119.576 1.064 17934 10975 1 16 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.179 -0.436 17934 10976 1 16 . 1 1 49 49 ALA C C 49 180.169 180.169 179.527 0.642 17934 10977 1 16 . 1 1 49 49 ALA CA C 49 54.851 54.851 53.941 0.910 17934 10978 1 16 . 1 1 49 49 ALA CB C 49 17.821 17.821 19.457 -1.636 17934 10979 1 16 . 1 1 49 49 ALA H H 49 7.671 7.671 8.275 -0.604 17934 10980 1 16 . 1 1 50 50 ASN N N 50 116.063 116.063 118.469 -2.406 17934 10981 1 16 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.529 -0.055 17934 10982 1 16 . 1 1 50 50 ASN C C 50 177.084 177.084 177.286 -0.202 17934 10983 1 16 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.116 0.673 17934 10984 1 16 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.472 0.442 17934 10985 1 16 . 1 1 50 50 ASN H H 50 7.893 7.893 8.133 -0.240 17934 10986 1 16 . 1 1 51 51 CYS N N 51 116.884 116.884 117.982 -1.098 17934 10987 1 16 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.460 -0.154 17934 10988 1 16 . 1 1 51 51 CYS C C 51 175.002 175.002 175.395 -0.393 17934 10989 1 16 . 1 1 51 51 CYS CA C 51 61.414 61.414 57.866 3.548 17934 10990 1 16 . 1 1 51 51 CYS CB C 51 27.664 27.664 26.890 0.774 17934 10991 1 16 . 1 1 51 51 CYS H H 51 7.770 7.770 8.299 -0.529 17934 10992 1 16 . 1 1 52 52 GLN N N 52 117.831 117.831 120.174 -2.343 17934 10993 1 16 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.201 0.027 17934 10994 1 16 . 1 1 52 52 GLN CA C 52 56.726 56.726 57.460 -0.734 17934 10995 1 16 . 1 1 52 52 GLN CB C 52 29.070 29.070 27.808 1.262 17934 10996 1 16 . 1 1 52 52 GLN H H 52 7.796 7.796 8.074 -0.278 17934 10997 1 16 . 1 1 53 53 LYS N N 53 118.841 118.841 119.743 -0.902 17934 10998 1 16 . 1 1 53 53 LYS CA C 53 57.195 57.195 58.410 -1.216 17934 10999 1 16 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.561 0.728 17934 11000 1 16 . 1 1 53 53 LYS H H 53 7.686 7.686 7.643 0.043 17934 11001 1 16 . 1 1 55 55 THR HA H 55 4.304 4.304 4.058 0.246 17934 11002 1 16 . 1 1 55 55 THR CA C 55 63.757 63.757 64.832 -1.075 17934 11003 1 16 . 1 1 55 55 THR CB C 55 68.914 68.914 68.692 0.222 17934 11004 1 16 . 1 1 56 56 GLU N N 56 120.861 120.861 119.684 1.177 17934 11005 1 16 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.048 0.099 17934 11006 1 16 . 1 1 56 56 GLU C C 56 177.656 177.656 177.677 -0.021 17934 11007 1 16 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.899 -0.766 17934 11008 1 16 . 1 1 56 56 GLU CB C 56 30.008 30.008 28.700 1.308 17934 11009 1 16 . 1 1 56 56 GLU H H 56 8.311 8.311 8.409 -0.098 17934 11010 1 16 . 1 1 57 57 GLN N N 57 118.397 118.397 117.168 1.229 17934 11011 1 16 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.178 -0.036 17934 11012 1 16 . 1 1 57 57 GLN C C 57 177.275 177.275 178.405 -1.130 17934 11013 1 16 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.636 0.028 17934 11014 1 16 . 1 1 57 57 GLN CB C 57 29.070 29.070 28.861 0.209 17934 11015 1 16 . 1 1 57 57 GLN H H 57 7.899 7.899 7.493 0.406 17934 11016 1 16 . 1 1 58 58 MET N N 58 118.897 118.897 116.450 2.447 17934 11017 1 16 . 1 1 58 58 MET HA H 58 4.350 4.350 4.367 -0.017 17934 11018 1 16 . 1 1 58 58 MET C C 58 177.172 177.172 176.808 0.364 17934 11019 1 16 . 1 1 58 58 MET CA C 58 56.726 56.726 57.298 -0.572 17934 11020 1 16 . 1 1 58 58 MET CB C 58 32.196 32.196 32.998 -0.802 17934 11021 1 16 . 1 1 58 58 MET H H 58 8.036 8.036 7.699 0.337 17934 11022 1 16 . 1 1 59 59 LYS N N 59 119.779 119.779 117.021 2.758 17934 11023 1 16 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.354 -0.123 17934 11024 1 16 . 1 1 59 59 LYS C C 59 176.676 176.676 175.615 1.061 17934 11025 1 16 . 1 1 59 59 LYS CA C 59 57.195 57.195 55.797 1.398 17934 11026 1 16 . 1 1 59 59 LYS CB C 59 32.820 32.820 33.158 -0.338 17934 11027 1 16 . 1 1 59 59 LYS H H 59 7.901 7.901 7.636 0.265 17934 11028 1 16 . 1 1 60 60 LYS N N 60 119.993 119.993 120.080 -0.087 17934 11029 1 16 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.524 -0.189 17934 11030 1 16 . 1 1 60 60 LYS C C 60 176.336 176.336 174.705 1.631 17934 11031 1 16 . 1 1 60 60 LYS CA C 60 56.258 56.258 55.647 0.612 17934 11032 1 16 . 1 1 60 60 LYS CB C 60 32.820 32.820 32.983 -0.164 17934 11033 1 16 . 1 1 60 60 LYS H H 60 7.877 7.877 7.207 0.670 17934 11034 1 16 . 1 1 61 61 VAL N N 61 122.649 122.649 120.360 2.289 17934 11035 1 16 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.490 -0.110 17934 11036 1 16 . 1 1 61 61 VAL C C 61 174.210 174.210 173.864 0.346 17934 11037 1 16 . 1 1 61 61 VAL CA C 61 60.000 60.000 58.100 1.900 17934 11038 1 16 . 1 1 61 61 VAL CB C 61 32.350 32.350 33.770 -1.420 17934 11039 1 16 . 1 1 61 61 VAL H H 61 7.708 7.708 7.995 -0.287 17934 11040 1 16 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.685 -0.022 17934 11041 1 16 . 1 1 62 62 PRO C C 62 176.656 176.656 176.422 0.234 17934 11042 1 16 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.738 0.082 17934 11043 1 16 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.200 -0.317 17934 11044 1 16 . 1 1 63 63 THR N N 63 117.155 117.155 117.285 -0.130 17934 11045 1 16 . 1 1 63 63 THR HA H 63 4.830 4.830 4.718 0.112 17934 11046 1 16 . 1 1 63 63 THR C C 63 174.682 174.682 173.846 0.836 17934 11047 1 16 . 1 1 63 63 THR CA C 63 62.820 62.820 62.686 0.134 17934 11048 1 16 . 1 1 63 63 THR CB C 63 69.382 69.382 70.261 -0.879 17934 11049 1 16 . 1 1 63 63 THR H H 63 8.303 8.303 8.449 -0.146 17934 11050 1 16 . 1 1 64 64 ILE N N 64 121.004 121.004 120.527 0.477 17934 11051 1 16 . 1 1 64 64 ILE CA C 64 58.600 58.600 59.680 -1.080 17934 11052 1 16 . 1 1 64 64 ILE CB C 64 42.690 42.690 42.137 0.553 17934 11053 1 16 . 1 1 64 64 ILE H H 64 9.348 9.348 8.800 0.548 17934 11054 1 16 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.020 0.720 17934 11055 1 16 . 1 1 65 65 ILE C C 65 175.378 175.378 174.505 0.873 17934 11056 1 16 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.733 -1.653 17934 11057 1 16 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.370 1.380 17934 11058 1 16 . 1 1 66 66 LEU N N 66 110.343 110.343 130.178 -19.835 17934 11059 1 16 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.757 0.093 17934 11060 1 16 . 1 1 66 66 LEU C C 66 174.982 174.982 175.495 -0.513 17934 11061 1 16 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.122 -0.212 17934 11062 1 16 . 1 1 66 66 LEU CB C 66 44.230 44.230 43.079 1.151 17934 11063 1 16 . 1 1 66 66 LEU H H 66 9.610 9.610 9.165 0.445 17934 11064 1 16 . 1 1 67 67 SER N N 67 120.990 120.990 120.697 0.293 17934 11065 1 16 . 1 1 67 67 SER HA H 67 5.405 5.405 4.875 0.530 17934 11066 1 16 . 1 1 67 67 SER C C 67 174.405 174.405 173.309 1.096 17934 11067 1 16 . 1 1 67 67 SER CA C 67 57.195 57.195 57.030 0.165 17934 11068 1 16 . 1 1 67 67 SER CB C 67 64.695 64.695 64.190 0.505 17934 11069 1 16 . 1 1 67 67 SER H H 67 9.260 9.260 9.084 0.176 17934 11070 1 16 . 1 1 68 68 VAL N N 68 128.176 128.176 126.490 1.686 17934 11071 1 16 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.443 0.050 17934 11072 1 16 . 1 1 68 68 VAL C C 68 173.891 173.891 173.415 0.476 17934 11073 1 16 . 1 1 68 68 VAL CA C 68 62.350 62.350 61.091 1.259 17934 11074 1 16 . 1 1 68 68 VAL CB C 68 33.750 33.750 33.954 -0.204 17934 11075 1 16 . 1 1 68 68 VAL H H 68 9.225 9.225 8.713 0.512 17934 11076 1 16 . 1 1 69 69 SER N N 69 121.697 121.697 123.987 -2.290 17934 11077 1 16 . 1 1 69 69 SER HA H 69 4.837 4.837 4.950 -0.113 17934 11078 1 16 . 1 1 69 69 SER C C 69 173.188 173.188 175.079 -1.891 17934 11079 1 16 . 1 1 69 69 SER CA C 69 57.195 57.195 55.286 1.909 17934 11080 1 16 . 1 1 69 69 SER CB C 69 67.976 67.976 65.264 2.712 17934 11081 1 16 . 1 1 69 69 SER H H 69 8.869 8.869 8.759 0.110 17934 11082 1 16 . 1 1 70 70 ALA N N 70 118.689 118.689 127.427 -8.738 17934 11083 1 16 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.237 -0.087 17934 11084 1 16 . 1 1 70 70 ALA C C 70 176.714 176.714 177.398 -0.684 17934 11085 1 16 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.104 -0.194 17934 11086 1 16 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.739 -0.139 17934 11087 1 16 . 1 1 70 70 ALA H H 70 8.810 8.810 9.157 -0.347 17934 11088 1 16 . 1 1 71 71 LYS N N 71 112.633 112.633 116.523 -3.890 17934 11089 1 16 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.421 -0.146 17934 11090 1 16 . 1 1 71 71 LYS C C 71 177.033 177.033 176.093 0.940 17934 11091 1 16 . 1 1 71 71 LYS CA C 71 57.195 57.195 54.595 2.600 17934 11092 1 16 . 1 1 71 71 LYS CB C 71 33.289 33.289 33.876 -0.587 17934 11093 1 16 . 1 1 71 71 LYS H H 71 7.830 7.830 7.793 0.037 17934 11094 1 16 . 1 1 72 72 GLY N N 72 108.432 108.432 106.578 1.854 17934 11095 1 16 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.356 0.120 17934 11096 1 16 . 1 1 72 72 GLY H H 72 7.685 7.685 7.577 0.108 17934 11097 1 16 . 1 1 73 73 VAL N N 73 120.414 120.414 117.800 2.614 17934 11098 1 16 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.807 0.193 17934 11099 1 16 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.710 0.760 17934 11100 1 16 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.646 -0.016 17934 11101 1 16 . 1 1 73 73 VAL H H 73 8.620 8.620 7.797 0.823 17934 11102 1 16 . 1 1 74 74 LYS N N 74 125.257 125.257 123.767 1.490 17934 11103 1 16 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.535 0.481 17934 11104 1 16 . 1 1 74 74 LYS CA C 74 54.383 54.383 53.867 0.516 17934 11105 1 16 . 1 1 74 74 LYS CB C 74 36.570 36.570 36.041 0.529 17934 11106 1 16 . 1 1 74 74 LYS H H 74 8.783 8.783 8.667 0.116 17934 11107 1 16 . 1 1 75 75 PHE N N 75 119.414 119.414 118.029 1.385 17934 11108 1 16 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.638 0.062 17934 11109 1 16 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.112 -2.192 17934 11110 1 16 . 1 1 75 75 PHE CB C 75 40.610 40.610 40.895 -0.285 17934 11111 1 16 . 1 1 75 75 PHE H H 75 8.432 8.432 8.780 -0.348 17934 11112 1 16 . 1 1 76 76 ILE N N 76 121.430 121.430 122.351 -0.921 17934 11113 1 16 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.932 -0.092 17934 11114 1 16 . 1 1 76 76 ILE C C 76 175.249 175.249 174.519 0.730 17934 11115 1 16 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.621 -0.551 17934 11116 1 16 . 1 1 76 76 ILE CB C 76 41.220 41.220 42.462 -1.242 17934 11117 1 16 . 1 1 76 76 ILE H H 76 8.960 8.960 8.374 0.586 17934 11118 1 16 . 1 1 77 77 ASP N N 77 125.744 125.744 123.474 2.270 17934 11119 1 16 . 1 1 77 77 ASP HA H 77 4.563 4.563 5.042 -0.479 17934 11120 1 16 . 1 1 77 77 ASP C C 77 177.569 177.569 176.378 1.191 17934 11121 1 16 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.603 3.186 17934 11122 1 16 . 1 1 77 77 ASP CB C 77 43.601 43.601 41.683 1.918 17934 11123 1 16 . 1 1 77 77 ASP H H 77 8.750 8.750 8.571 0.179 17934 11124 1 16 . 1 1 78 78 ALA N N 78 128.632 128.632 124.710 3.922 17934 11125 1 16 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.305 -0.335 17934 11126 1 16 . 1 1 78 78 ALA C C 78 178.052 178.052 177.741 0.311 17934 11127 1 16 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.182 0.648 17934 11128 1 16 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.309 0.484 17934 11129 1 16 . 1 1 78 78 ALA H H 78 8.700 8.700 8.791 -0.091 17934 11130 1 16 . 1 1 79 79 THR N N 79 113.087 113.087 110.534 2.553 17934 11131 1 16 . 1 1 79 79 THR HA H 79 4.194 4.194 4.196 -0.002 17934 11132 1 16 . 1 1 79 79 THR C C 79 175.587 175.587 175.310 0.277 17934 11133 1 16 . 1 1 79 79 THR CA C 79 64.695 64.695 64.268 0.427 17934 11134 1 16 . 1 1 79 79 THR CB C 79 69.382 69.382 68.755 0.627 17934 11135 1 16 . 1 1 79 79 THR H H 79 8.779 8.779 8.005 0.774 17934 11136 1 16 . 1 1 80 80 ASN N N 80 118.434 118.434 118.514 -0.080 17934 11137 1 16 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.717 0.020 17934 11138 1 16 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.832 0.613 17934 11139 1 16 . 1 1 80 80 ASN CB C 80 39.383 39.383 38.991 0.392 17934 11140 1 16 . 1 1 80 80 ASN H H 80 8.584 8.584 7.810 0.774 17934 11141 1 16 . 1 1 81 81 LYS N N 81 112.429 112.429 117.396 -4.967 17934 11142 1 16 . 1 1 81 81 LYS C C 81 174.909 174.909 174.981 -0.072 17934 11143 1 16 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.764 -0.100 17934 11144 1 16 . 1 1 81 81 LYS CB C 81 28.602 28.602 30.748 -2.146 17934 11145 1 16 . 1 1 81 81 LYS H H 81 7.966 7.966 8.399 -0.433 17934 11146 1 16 . 1 1 82 82 ASN N N 82 116.806 116.806 116.121 0.685 17934 11147 1 16 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.748 -0.158 17934 11148 1 16 . 1 1 82 82 ASN C C 82 174.999 174.999 174.813 0.186 17934 11149 1 16 . 1 1 82 82 ASN CA C 82 52.976 52.976 52.522 0.454 17934 11150 1 16 . 1 1 82 82 ASN CB C 82 38.445 38.445 40.405 -1.960 17934 11151 1 16 . 1 1 82 82 ASN H H 82 8.455 8.455 8.052 0.403 17934 11152 1 16 . 1 1 83 83 ILE N N 83 122.447 122.447 120.890 1.557 17934 11153 1 16 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.348 -0.318 17934 11154 1 16 . 1 1 83 83 ILE C C 83 176.572 176.572 175.901 0.671 17934 11155 1 16 . 1 1 83 83 ILE CA C 83 62.350 62.350 60.278 2.072 17934 11156 1 16 . 1 1 83 83 ILE CB C 83 37.970 37.970 36.517 1.453 17934 11157 1 16 . 1 1 83 83 ILE H H 83 8.650 8.650 8.364 0.286 17934 11158 1 16 . 1 1 84 84 ILE N N 84 129.339 129.339 128.173 1.166 17934 11159 1 16 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.078 -0.158 17934 11160 1 16 . 1 1 84 84 ILE C C 84 175.873 175.873 175.883 -0.010 17934 11161 1 16 . 1 1 84 84 ILE CA C 84 62.810 62.810 64.047 -1.237 17934 11162 1 16 . 1 1 84 84 ILE CB C 84 38.840 38.840 38.707 0.133 17934 11163 1 16 . 1 1 84 84 ILE H H 84 8.930 8.930 8.875 0.055 17934 11164 1 16 . 1 1 85 85 ALA N N 85 118.867 118.867 118.203 0.664 17934 11165 1 16 . 1 1 85 85 ALA C C 85 174.100 174.100 174.456 -0.356 17934 11166 1 16 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.455 -0.885 17934 11167 1 16 . 1 1 85 85 ALA H H 85 7.048 7.048 7.902 -0.854 17934 11168 1 16 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.781 0.373 17934 11169 1 16 . 1 1 87 87 HIS C C 87 174.986 174.986 173.974 1.012 17934 11170 1 16 . 1 1 87 87 HIS CB C 87 34.350 34.350 34.468 -0.118 17934 11171 1 16 . 1 1 88 88 GLU N N 88 125.372 125.372 121.841 3.531 17934 11172 1 16 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.166 0.355 17934 11173 1 16 . 1 1 88 88 GLU C C 88 179.047 179.047 177.568 1.479 17934 11174 1 16 . 1 1 88 88 GLU CA C 88 56.726 56.726 57.108 -0.382 17934 11175 1 16 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.083 0.394 17934 11176 1 16 . 1 1 88 88 GLU H H 88 9.106 9.106 8.622 0.484 17934 11177 1 16 . 1 1 89 89 ILE N N 89 124.132 124.132 123.826 0.306 17934 11178 1 16 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.800 0.219 17934 11179 1 16 . 1 1 89 89 ILE C C 89 176.095 176.095 177.370 -1.275 17934 11180 1 16 . 1 1 89 89 ILE CA C 89 62.351 62.351 65.320 -2.969 17934 11181 1 16 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.383 0.531 17934 11182 1 16 . 1 1 89 89 ILE H H 89 8.055 8.055 8.875 -0.820 17934 11183 1 16 . 1 1 90 90 ARG N N 90 116.949 116.949 114.672 2.277 17934 11184 1 16 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.581 -0.243 17934 11185 1 16 . 1 1 90 90 ARG C C 90 176.578 176.578 176.190 0.388 17934 11186 1 16 . 1 1 90 90 ARG CA C 90 57.664 57.664 57.843 -0.179 17934 11187 1 16 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.532 -0.462 17934 11188 1 16 . 1 1 90 90 ARG H H 90 8.045 8.045 8.557 -0.512 17934 11189 1 16 . 1 1 91 91 ASN N N 91 116.320 116.320 116.147 0.173 17934 11190 1 16 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.723 0.430 17934 11191 1 16 . 1 1 91 91 ASN C C 91 174.595 174.595 175.237 -0.642 17934 11192 1 16 . 1 1 91 91 ASN CA C 91 52.508 52.508 53.600 -1.092 17934 11193 1 16 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.823 0.029 17934 11194 1 16 . 1 1 91 91 ASN H H 91 8.067 8.067 7.704 0.363 17934 11195 1 16 . 1 1 92 92 ILE N N 92 122.441 122.441 121.875 0.566 17934 11196 1 16 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.813 1.260 17934 11197 1 16 . 1 1 92 92 ILE C C 92 175.229 175.229 175.757 -0.528 17934 11198 1 16 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.390 -0.510 17934 11199 1 16 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.306 2.544 17934 11200 1 16 . 1 1 92 92 ILE H H 92 7.483 7.483 7.563 -0.080 17934 11201 1 16 . 1 1 93 93 SER N N 93 120.329 120.329 123.442 -3.113 17934 11202 1 16 . 1 1 93 93 SER HA H 93 4.684 4.684 4.208 0.476 17934 11203 1 16 . 1 1 93 93 SER C C 93 180.744 180.744 174.412 6.332 17934 11204 1 16 . 1 1 93 93 SER CA C 93 57.664 57.664 61.436 -3.772 17934 11205 1 16 . 1 1 93 93 SER CB C 93 66.570 66.570 63.887 2.683 17934 11206 1 16 . 1 1 93 93 SER H H 93 9.545 9.545 8.493 1.052 17934 11207 1 16 . 1 1 94 94 CYS N N 94 110.900 110.900 116.278 -5.378 17934 11208 1 16 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.681 -0.869 17934 11209 1 16 . 1 1 94 94 CYS C C 94 173.973 173.973 172.456 1.517 17934 11210 1 16 . 1 1 94 94 CYS CA C 94 59.539 59.539 58.857 0.682 17934 11211 1 16 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.351 -4.093 17934 11212 1 16 . 1 1 94 94 CYS H H 94 8.858 8.858 8.077 0.781 17934 11213 1 16 . 1 1 95 95 ALA N N 95 121.379 121.379 123.556 -2.177 17934 11214 1 16 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.687 -0.257 17934 11215 1 16 . 1 1 95 95 ALA C C 95 178.098 178.098 174.862 3.236 17934 11216 1 16 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.861 0.789 17934 11217 1 16 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.792 -2.492 17934 11218 1 16 . 1 1 95 95 ALA H H 95 8.360 8.360 8.538 -0.178 17934 11219 1 16 . 1 1 96 96 ALA N N 96 122.576 122.576 124.861 -2.285 17934 11220 1 16 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.786 -0.106 17934 11221 1 16 . 1 1 96 96 ALA C C 96 175.716 175.716 174.767 0.949 17934 11222 1 16 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.643 0.797 17934 11223 1 16 . 1 1 96 96 ALA CB C 96 22.700 22.700 22.206 0.494 17934 11224 1 16 . 1 1 96 96 ALA H H 96 9.080 9.080 8.850 0.230 17934 11225 1 16 . 1 1 97 97 GLN N N 97 116.903 116.903 120.658 -3.755 17934 11226 1 16 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.679 0.251 17934 11227 1 16 . 1 1 97 97 GLN C C 97 175.270 175.270 174.020 1.250 17934 11228 1 16 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.792 1.059 17934 11229 1 16 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.952 1.806 17934 11230 1 16 . 1 1 97 97 GLN H H 97 8.369 8.369 8.280 0.089 17934 11231 1 16 . 1 1 98 98 ASP N N 98 124.971 124.971 122.138 2.833 17934 11232 1 16 . 1 1 98 98 ASP C C 98 175.217 175.217 175.722 -0.505 17934 11233 1 16 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.811 -0.772 17934 11234 1 16 . 1 1 98 98 ASP CB C 98 42.195 42.195 42.506 -0.311 17934 11235 1 16 . 1 1 98 98 ASP H H 98 8.395 8.395 8.420 -0.025 17934 11236 1 16 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.365 -0.131 17934 11237 1 16 . 1 1 99 99 PRO C C 99 178.433 178.433 177.596 0.837 17934 11238 1 16 . 1 1 99 99 PRO CA C 99 64.695 64.695 65.296 -0.602 17934 11239 1 16 . 1 1 99 99 PRO CB C 99 32.352 32.352 31.974 0.378 17934 11240 1 16 . 1 1 100 100 GLU N N 100 116.223 116.223 118.208 -1.985 17934 11241 1 16 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.139 0.081 17934 11242 1 16 . 1 1 100 100 GLU C C 100 176.678 176.678 175.753 0.925 17934 11243 1 16 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.505 -1.778 17934 11244 1 16 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.794 2.151 17934 11245 1 16 . 1 1 100 100 GLU H H 100 8.643 8.643 8.675 -0.032 17934 11246 1 16 . 1 1 101 101 ASP N N 101 119.053 119.053 119.226 -0.173 17934 11247 1 16 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.871 -0.328 17934 11248 1 16 . 1 1 101 101 ASP C C 101 174.771 174.771 176.088 -1.317 17934 11249 1 16 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.041 0.873 17934 11250 1 16 . 1 1 101 101 ASP CB C 101 40.789 40.789 41.229 -0.440 17934 11251 1 16 . 1 1 101 101 ASP H H 101 7.597 7.597 7.971 -0.374 17934 11252 1 16 . 1 1 102 102 LEU N N 102 123.986 123.986 120.882 3.104 17934 11253 1 16 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.272 0.118 17934 11254 1 16 . 1 1 102 102 LEU C C 102 177.141 177.141 177.837 -0.696 17934 11255 1 16 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.442 0.218 17934 11256 1 16 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.298 1.362 17934 11257 1 16 . 1 1 102 102 LEU H H 102 8.534 8.534 7.596 0.938 17934 11258 1 16 . 1 1 103 103 SER N N 103 112.339 112.339 111.899 0.440 17934 11259 1 16 . 1 1 103 103 SER HA H 103 4.290 4.290 4.317 -0.027 17934 11260 1 16 . 1 1 103 103 SER C C 103 174.106 174.106 175.089 -0.983 17934 11261 1 16 . 1 1 103 103 SER CA C 103 60.945 60.945 60.973 -0.028 17934 11262 1 16 . 1 1 103 103 SER CB C 103 63.757 63.757 63.402 0.355 17934 11263 1 16 . 1 1 103 103 SER H H 103 7.867 7.867 8.228 -0.361 17934 11264 1 16 . 1 1 104 104 THR N N 104 123.070 123.070 119.703 3.367 17934 11265 1 16 . 1 1 104 104 THR HA H 104 5.373 5.373 4.411 0.962 17934 11266 1 16 . 1 1 104 104 THR C C 104 180.693 180.693 173.223 7.470 17934 11267 1 16 . 1 1 104 104 THR CA C 104 63.289 63.289 63.922 -0.633 17934 11268 1 16 . 1 1 104 104 THR CB C 104 69.382 69.382 68.319 1.063 17934 11269 1 16 . 1 1 104 104 THR H H 104 8.830 8.830 8.083 0.747 17934 11270 1 16 . 1 1 105 105 PHE N N 105 122.582 122.582 126.043 -3.461 17934 11271 1 16 . 1 1 105 105 PHE HA H 105 5.470 5.470 5.085 0.385 17934 11272 1 16 . 1 1 105 105 PHE C C 105 179.211 179.211 172.462 6.749 17934 11273 1 16 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.282 0.038 17934 11274 1 16 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.967 -0.177 17934 11275 1 16 . 1 1 105 105 PHE H H 105 9.170 9.170 8.929 0.241 17934 11276 1 16 . 1 1 106 106 ALA N N 106 119.567 119.567 127.518 -7.951 17934 11277 1 16 . 1 1 106 106 ALA C C 106 175.603 175.603 175.374 0.229 17934 11278 1 16 . 1 1 106 106 ALA H H 106 8.770 8.770 9.209 -0.439 17934 11279 1 16 . 1 1 107 107 TYR N N 107 109.933 109.933 121.049 -11.116 17934 11280 1 16 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.459 -0.539 17934 11281 1 16 . 1 1 107 107 TYR C C 107 180.426 180.426 173.303 7.123 17934 11282 1 16 . 1 1 107 107 TYR CA C 107 57.080 57.080 54.314 2.766 17934 11283 1 16 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.475 -0.686 17934 11284 1 16 . 1 1 107 107 TYR H H 107 7.950 7.950 8.970 -1.020 17934 11285 1 16 . 1 1 108 108 ILE N N 108 120.613 120.613 117.841 2.772 17934 11286 1 16 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.660 0.710 17934 11287 1 16 . 1 1 108 108 ILE C C 108 176.212 176.212 175.951 0.261 17934 11288 1 16 . 1 1 108 108 ILE CA C 108 59.540 59.540 59.066 0.474 17934 11289 1 16 . 1 1 108 108 ILE CB C 108 39.380 39.380 38.687 0.693 17934 11290 1 16 . 1 1 108 108 ILE H H 108 8.869 8.869 8.759 0.110 17934 11291 1 16 . 1 1 109 109 THR N N 109 116.505 116.505 117.767 -1.262 17934 11292 1 16 . 1 1 109 109 THR HA H 109 5.669 5.669 4.773 0.896 17934 11293 1 16 . 1 1 109 109 THR C C 109 173.505 173.505 173.620 -0.115 17934 11294 1 16 . 1 1 109 109 THR CA C 109 59.070 59.070 60.695 -1.625 17934 11295 1 16 . 1 1 109 109 THR H H 109 9.489 9.489 8.129 1.360 17934 11296 1 16 . 1 1 110 110 LYS N N 110 122.960 122.960 120.659 2.301 17934 11297 1 16 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.141 0.319 17934 11298 1 16 . 1 1 110 110 LYS C C 110 175.937 175.937 175.933 0.004 17934 11299 1 16 . 1 1 110 110 LYS CA C 110 55.789 55.789 56.334 -0.545 17934 11300 1 16 . 1 1 110 110 LYS CB C 110 34.227 34.227 32.804 1.423 17934 11301 1 16 . 1 1 110 110 LYS H H 110 7.831 7.831 8.627 -0.796 17934 11302 1 16 . 1 1 111 111 ASP N N 111 127.409 127.409 120.388 7.021 17934 11303 1 16 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.641 0.140 17934 11304 1 16 . 1 1 111 111 ASP C C 111 176.396 176.396 177.487 -1.091 17934 11305 1 16 . 1 1 111 111 ASP CA C 111 53.914 53.914 52.231 1.683 17934 11306 1 16 . 1 1 111 111 ASP CB C 111 43.133 43.133 41.964 1.169 17934 11307 1 16 . 1 1 111 111 ASP H H 111 8.769 8.769 8.518 0.251 17934 11308 1 16 . 1 1 112 112 LEU N N 112 125.913 125.913 121.411 4.502 17934 11309 1 16 . 1 1 112 112 LEU HA H 112 4.150 4.150 3.881 0.270 17934 11310 1 16 . 1 1 112 112 LEU C C 112 178.553 178.553 177.799 0.754 17934 11311 1 16 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.542 -0.352 17934 11312 1 16 . 1 1 112 112 LEU CB C 112 41.790 41.790 41.892 -0.102 17934 11313 1 16 . 1 1 112 112 LEU H H 112 8.593 8.593 8.564 0.029 17934 11314 1 16 . 1 1 113 113 LYS N N 113 117.189 117.189 115.426 1.763 17934 11315 1 16 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.236 0.026 17934 11316 1 16 . 1 1 113 113 LYS C C 113 177.180 177.180 175.705 1.475 17934 11317 1 16 . 1 1 113 113 LYS CA C 113 58.133 58.133 55.983 2.150 17934 11318 1 16 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.451 0.369 17934 11319 1 16 . 1 1 113 113 LYS H H 113 8.207 8.207 7.675 0.532 17934 11320 1 16 . 1 1 114 114 SER N N 114 112.492 112.492 113.190 -0.698 17934 11321 1 16 . 1 1 114 114 SER CA C 114 58.601 58.601 58.610 -0.009 17934 11322 1 16 . 1 1 114 114 SER CB C 114 65.164 65.164 61.699 3.465 17934 11323 1 16 . 1 1 114 114 SER H H 114 7.755 7.755 8.255 -0.500 17934 11324 1 16 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.809 -0.420 17934 11325 1 16 . 1 1 115 115 ASN C C 115 174.203 174.203 175.300 -1.097 17934 11326 1 16 . 1 1 115 115 ASN CA C 115 54.383 54.383 54.545 -0.162 17934 11327 1 16 . 1 1 115 115 ASN CB C 115 37.977 37.977 40.481 -2.504 17934 11328 1 16 . 1 1 116 116 HIS N N 116 116.822 116.822 117.467 -0.645 17934 11329 1 16 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.834 0.096 17934 11330 1 16 . 1 1 116 116 HIS C C 116 173.898 173.898 173.533 0.365 17934 11331 1 16 . 1 1 116 116 HIS CA C 116 54.910 54.910 54.404 0.506 17934 11332 1 16 . 1 1 116 116 HIS CB C 116 32.650 32.650 32.799 -0.149 17934 11333 1 16 . 1 1 116 116 HIS H H 116 7.690 7.690 8.033 -0.343 17934 11334 1 16 . 1 1 117 117 HIS N N 117 118.253 118.253 120.697 -2.444 17934 11335 1 16 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.733 0.587 17934 11336 1 16 . 1 1 117 117 HIS C C 117 173.695 173.695 173.772 -0.077 17934 11337 1 16 . 1 1 117 117 HIS CA C 117 56.350 56.350 55.252 1.098 17934 11338 1 16 . 1 1 117 117 HIS CB C 117 32.350 32.350 29.607 2.743 17934 11339 1 16 . 1 1 117 117 HIS H H 117 8.340 8.340 8.308 0.032 17934 11340 1 16 . 1 1 118 118 TYR N N 118 118.301 118.301 126.360 -8.059 17934 11341 1 16 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.932 0.078 17934 11342 1 16 . 1 1 118 118 TYR C C 118 173.530 173.530 174.852 -1.322 17934 11343 1 16 . 1 1 118 118 TYR CA C 118 56.730 56.730 56.811 -0.081 17934 11344 1 16 . 1 1 118 118 TYR CB C 118 43.240 43.240 41.480 1.760 17934 11345 1 16 . 1 1 118 118 TYR H H 118 9.080 9.080 8.356 0.724 17934 11346 1 16 . 1 1 119 119 CYS N N 119 121.015 121.015 122.688 -1.673 17934 11347 1 16 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.501 0.562 17934 11348 1 16 . 1 1 119 119 CYS C C 119 180.664 180.664 173.994 6.670 17934 11349 1 16 . 1 1 119 119 CYS CA C 119 56.726 56.726 57.542 -0.816 17934 11350 1 16 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.634 0.904 17934 11351 1 16 . 1 1 119 119 CYS H H 119 9.120 9.120 9.080 0.040 17934 11352 1 16 . 1 1 120 120 HIS N N 120 110.134 110.134 125.882 -15.748 17934 11353 1 16 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.855 -0.156 17934 11354 1 16 . 1 1 120 120 HIS C C 120 180.776 180.776 173.822 6.954 17934 11355 1 16 . 1 1 120 120 HIS CA C 120 55.320 55.320 55.221 0.099 17934 11356 1 16 . 1 1 120 120 HIS CB C 120 32.352 32.352 30.779 1.573 17934 11357 1 16 . 1 1 120 120 HIS H H 120 8.482 8.482 8.923 -0.441 17934 11358 1 16 . 1 1 121 121 VAL N N 121 120.855 120.855 123.686 -2.831 17934 11359 1 16 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.337 0.013 17934 11360 1 16 . 1 1 121 121 VAL C C 121 173.419 173.419 172.946 0.473 17934 11361 1 16 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.651 0.759 17934 11362 1 16 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.117 0.163 17934 11363 1 16 . 1 1 121 121 VAL H H 121 7.929 7.929 8.581 -0.652 17934 11364 1 16 . 1 1 122 122 PHE N N 122 124.384 124.384 128.063 -3.679 17934 11365 1 16 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.097 0.323 17934 11366 1 16 . 1 1 122 122 PHE C C 122 174.876 174.876 174.337 0.539 17934 11367 1 16 . 1 1 122 122 PHE CA C 122 55.320 55.320 55.433 -0.113 17934 11368 1 16 . 1 1 122 122 PHE CB C 122 44.540 44.540 43.066 1.474 17934 11369 1 16 . 1 1 122 122 PHE H H 122 8.910 8.910 8.895 0.015 17934 11370 1 16 . 1 1 123 123 THR N N 123 112.451 112.451 113.717 -1.266 17934 11371 1 16 . 1 1 123 123 THR HA H 123 5.147 5.147 4.711 0.436 17934 11372 1 16 . 1 1 123 123 THR C C 123 174.096 174.096 173.391 0.705 17934 11373 1 16 . 1 1 123 123 THR CA C 123 61.843 61.843 59.569 2.274 17934 11374 1 16 . 1 1 123 123 THR CB C 123 71.218 71.218 70.555 0.663 17934 11375 1 16 . 1 1 123 123 THR H H 123 8.668 8.668 8.844 -0.176 17934 11376 1 16 . 1 1 124 124 ALA N N 124 128.922 128.922 125.221 3.701 17934 11377 1 16 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.776 -0.056 17934 11378 1 16 . 1 1 124 124 ALA C C 124 177.168 177.168 176.742 0.426 17934 11379 1 16 . 1 1 124 124 ALA CA C 124 50.890 50.890 50.289 0.601 17934 11380 1 16 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.701 -0.601 17934 11381 1 16 . 1 1 124 124 ALA H H 124 9.180 9.180 8.357 0.823 17934 11382 1 16 . 1 1 125 125 PHE N N 125 115.427 115.427 118.681 -3.254 17934 11383 1 16 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.363 -0.073 17934 11384 1 16 . 1 1 125 125 PHE C C 125 174.703 174.703 175.472 -0.769 17934 11385 1 16 . 1 1 125 125 PHE CA C 125 60.470 60.470 58.494 1.976 17934 11386 1 16 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.366 -1.306 17934 11387 1 16 . 1 1 125 125 PHE H H 125 8.560 8.560 9.162 -0.602 17934 11388 1 16 . 1 1 126 126 ASP N N 126 115.745 115.745 118.712 -2.967 17934 11389 1 16 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.888 -0.045 17934 11390 1 16 . 1 1 126 126 ASP C C 126 176.532 176.532 176.144 0.388 17934 11391 1 16 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.450 -0.005 17934 11392 1 16 . 1 1 126 126 ASP CB C 126 44.070 44.070 42.864 1.206 17934 11393 1 16 . 1 1 126 126 ASP H H 126 7.417 7.417 7.834 -0.417 17934 11394 1 16 . 1 1 127 127 VAL N N 127 121.923 121.923 123.116 -1.193 17934 11395 1 16 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.654 -0.064 17934 11396 1 16 . 1 1 127 127 VAL C C 127 176.863 176.863 176.527 0.336 17934 11397 1 16 . 1 1 127 127 VAL CA C 127 65.630 65.630 65.809 -0.179 17934 11398 1 16 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.095 -0.265 17934 11399 1 16 . 1 1 127 127 VAL H H 127 8.508 8.508 8.756 -0.248 17934 11400 1 16 . 1 1 128 128 ASN N N 128 118.851 118.851 118.653 0.198 17934 11401 1 16 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.488 -0.012 17934 11402 1 16 . 1 1 128 128 ASN C C 128 178.251 178.251 177.609 0.642 17934 11403 1 16 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.213 0.045 17934 11404 1 16 . 1 1 128 128 ASN CB C 128 37.977 37.977 37.974 0.003 17934 11405 1 16 . 1 1 128 128 ASN H H 128 8.207 8.207 8.338 -0.131 17934 11406 1 16 . 1 1 129 129 LEU N N 129 122.549 122.549 119.841 2.708 17934 11407 1 16 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.765 0.445 17934 11408 1 16 . 1 1 129 129 LEU C C 129 178.003 178.003 178.270 -0.267 17934 11409 1 16 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.158 0.032 17934 11410 1 16 . 1 1 129 129 LEU CB C 129 41.790 41.790 41.156 0.634 17934 11411 1 16 . 1 1 129 129 LEU H H 129 8.223 8.223 7.507 0.716 17934 11412 1 16 . 1 1 130 130 ALA N N 130 120.036 120.036 122.795 -2.759 17934 11413 1 16 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.862 -0.552 17934 11414 1 16 . 1 1 130 130 ALA C C 130 178.172 178.172 178.597 -0.425 17934 11415 1 16 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.156 0.624 17934 11416 1 16 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.102 0.968 17934 11417 1 16 . 1 1 130 130 ALA H H 130 7.360 7.360 8.492 -1.132 17934 11418 1 16 . 1 1 131 131 ALA N N 131 116.989 116.989 120.472 -3.483 17934 11419 1 16 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.913 -0.203 17934 11420 1 16 . 1 1 131 131 ALA C C 131 180.163 180.163 179.908 0.255 17934 11421 1 16 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.932 0.848 17934 11422 1 16 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.172 -0.342 17934 11423 1 16 . 1 1 131 131 ALA H H 131 7.360 7.360 7.946 -0.586 17934 11424 1 16 . 1 1 132 132 GLU N N 132 119.462 119.462 119.349 0.113 17934 11425 1 16 . 1 1 132 132 GLU HA H 132 3.888 3.888 3.946 -0.058 17934 11426 1 16 . 1 1 132 132 GLU C C 132 179.243 179.243 178.878 0.365 17934 11427 1 16 . 1 1 132 132 GLU CA C 132 59.539 59.539 59.365 0.174 17934 11428 1 16 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.512 0.027 17934 11429 1 16 . 1 1 132 132 GLU H H 132 7.673 7.673 7.992 -0.319 17934 11430 1 16 . 1 1 133 133 ILE N N 133 123.218 123.218 120.946 2.272 17934 11431 1 16 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.619 -0.839 17934 11432 1 16 . 1 1 133 133 ILE C C 133 177.421 177.421 178.264 -0.843 17934 11433 1 16 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.387 1.103 17934 11434 1 16 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.774 -1.124 17934 11435 1 16 . 1 1 133 133 ILE H H 133 8.154 8.154 7.738 0.416 17934 11436 1 16 . 1 1 134 134 ILE N N 134 118.244 118.244 118.823 -0.579 17934 11437 1 16 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.512 0.028 17934 11438 1 16 . 1 1 134 134 ILE C C 134 179.385 179.385 178.087 1.298 17934 11439 1 16 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.736 -1.456 17934 11440 1 16 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.536 -0.436 17934 11441 1 16 . 1 1 134 134 ILE H H 134 7.376 7.376 7.898 -0.522 17934 11442 1 16 . 1 1 135 135 LEU N N 135 123.061 123.061 119.689 3.372 17934 11443 1 16 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.979 0.210 17934 11444 1 16 . 1 1 135 135 LEU C C 135 179.858 179.858 179.293 0.565 17934 11445 1 16 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.885 -0.695 17934 11446 1 16 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.199 0.661 17934 11447 1 16 . 1 1 135 135 LEU H H 135 8.036 8.036 8.023 0.013 17934 11448 1 16 . 1 1 136 136 THR N N 136 119.647 119.647 115.200 4.447 17934 11449 1 16 . 1 1 136 136 THR HA H 136 3.725 3.725 4.045 -0.320 17934 11450 1 16 . 1 1 136 136 THR C C 136 176.088 176.088 176.735 -0.647 17934 11451 1 16 . 1 1 136 136 THR CA C 136 58.601 58.601 66.497 -7.896 17934 11452 1 16 . 1 1 136 136 THR CB C 136 67.976 67.976 68.763 -0.787 17934 11453 1 16 . 1 1 136 136 THR H H 136 8.508 8.508 8.401 0.107 17934 11454 1 16 . 1 1 137 137 LEU N N 137 123.182 123.182 121.403 1.779 17934 11455 1 16 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.855 -0.115 17934 11456 1 16 . 1 1 137 137 LEU C C 137 178.341 178.341 178.551 -0.210 17934 11457 1 16 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.781 -0.521 17934 11458 1 16 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.140 0.410 17934 11459 1 16 . 1 1 137 137 LEU H H 137 8.520 8.520 8.642 -0.122 17934 11460 1 16 . 1 1 138 138 GLY N N 138 105.266 105.266 105.203 0.063 17934 11461 1 16 . 1 1 138 138 GLY C C 138 176.973 176.973 175.643 1.330 17934 11462 1 16 . 1 1 138 138 GLY CA C 138 47.351 47.351 46.724 0.627 17934 11463 1 16 . 1 1 138 138 GLY H H 138 7.858 7.858 7.814 0.044 17934 11464 1 16 . 1 1 139 139 GLN N N 139 123.485 123.485 122.326 1.159 17934 11465 1 16 . 1 1 139 139 GLN C C 139 177.891 177.891 178.276 -0.385 17934 11466 1 16 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.597 0.004 17934 11467 1 16 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.559 -0.426 17934 11468 1 16 . 1 1 139 139 GLN H H 139 8.195 8.195 8.445 -0.250 17934 11469 1 16 . 1 1 140 140 ALA N N 140 122.754 122.754 122.460 0.294 17934 11470 1 16 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.199 -0.490 17934 11471 1 16 . 1 1 140 140 ALA C C 140 178.987 178.987 179.396 -0.409 17934 11472 1 16 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.874 0.905 17934 11473 1 16 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.134 -0.725 17934 11474 1 16 . 1 1 140 140 ALA H H 140 8.530 8.530 8.527 0.003 17934 11475 1 16 . 1 1 141 141 PHE N N 141 116.275 116.275 119.843 -3.568 17934 11476 1 16 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.223 -0.133 17934 11477 1 16 . 1 1 141 141 PHE C C 141 178.129 178.129 177.319 0.810 17934 11478 1 16 . 1 1 141 141 PHE CA C 141 61.240 61.240 60.195 1.045 17934 11479 1 16 . 1 1 141 141 PHE CB C 141 39.383 39.383 38.600 0.783 17934 11480 1 16 . 1 1 141 141 PHE H H 141 7.920 7.920 8.264 -0.344 17934 11481 1 16 . 1 1 142 142 GLU N N 142 119.967 119.967 119.185 0.782 17934 11482 1 16 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.569 0.658 17934 11483 1 16 . 1 1 142 142 GLU C C 142 179.250 179.250 177.988 1.262 17934 11484 1 16 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.328 1.211 17934 11485 1 16 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.840 -0.301 17934 11486 1 16 . 1 1 142 142 GLU H H 142 7.713 7.713 7.904 -0.191 17934 11487 1 16 . 1 1 143 143 VAL N N 143 120.189 120.189 118.954 1.235 17934 11488 1 16 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.728 -0.045 17934 11489 1 16 . 1 1 143 143 VAL C C 143 178.066 178.066 175.890 2.176 17934 11490 1 16 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.668 1.902 17934 11491 1 16 . 1 1 143 143 VAL CB C 143 31.883 31.883 32.286 -0.403 17934 11492 1 16 . 1 1 143 143 VAL H H 143 8.608 8.608 7.757 0.851 17934 11493 1 16 . 1 1 144 144 ALA N N 144 121.753 121.753 119.025 2.728 17934 11494 1 16 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.000 0.000 17934 11495 1 16 . 1 1 144 144 ALA C C 144 180.776 180.776 176.169 4.607 17934 11496 1 16 . 1 1 144 144 ALA CA C 144 55.780 55.780 52.656 3.124 17934 11497 1 16 . 1 1 144 144 ALA CB C 144 18.770 18.770 16.708 2.062 17934 11498 1 16 . 1 1 144 144 ALA H H 144 8.399 8.399 7.540 0.859 17934 11499 1 16 . 1 1 145 145 TYR N N 145 119.962 119.962 120.520 -0.558 17934 11500 1 16 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.430 -0.240 17934 11501 1 16 . 1 1 145 145 TYR C C 145 177.645 177.645 174.626 3.019 17934 11502 1 16 . 1 1 145 145 TYR CA C 145 60.880 60.880 58.315 2.565 17934 11503 1 16 . 1 1 145 145 TYR CB C 145 37.980 37.980 39.873 -1.893 17934 11504 1 16 . 1 1 145 145 TYR H H 145 8.190 8.190 8.092 0.098 17934 11505 1 17 . 1 1 13 13 LYS N N 13 120.778 120.778 120.437 0.341 17934 11506 1 17 . 1 1 13 13 LYS C C 13 176.476 176.476 178.079 -1.603 17934 11507 1 17 . 1 1 13 13 LYS CA C 13 58.601 58.601 56.930 1.671 17934 11508 1 17 . 1 1 13 13 LYS CB C 13 32.820 32.820 32.591 0.229 17934 11509 1 17 . 1 1 13 13 LYS H H 13 7.984 7.984 8.330 -0.346 17934 11510 1 17 . 1 1 15 15 ILE HA H 15 3.820 3.820 4.076 -0.256 17934 11511 1 17 . 1 1 15 15 ILE C C 15 176.376 176.376 176.506 -0.130 17934 11512 1 17 . 1 1 15 15 ILE CA C 15 63.570 63.570 62.292 1.278 17934 11513 1 17 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.783 1.597 17934 11514 1 17 . 1 1 16 16 ALA N N 16 121.364 121.364 120.432 0.932 17934 11515 1 17 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.576 -0.138 17934 11516 1 17 . 1 1 16 16 ALA C C 16 177.494 177.494 178.084 -0.590 17934 11517 1 17 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.693 0.283 17934 11518 1 17 . 1 1 16 16 ALA CB C 16 20.333 20.333 20.463 -0.130 17934 11519 1 17 . 1 1 16 16 ALA H H 16 8.081 8.081 8.125 -0.044 17934 11520 1 17 . 1 1 17 17 GLN N N 17 118.109 118.109 116.437 1.672 17934 11521 1 17 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.615 -0.042 17934 11522 1 17 . 1 1 17 17 GLN C C 17 173.632 173.632 174.517 -0.885 17934 11523 1 17 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.048 -0.197 17934 11524 1 17 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.602 -0.125 17934 11525 1 17 . 1 1 17 17 GLN H H 17 7.550 7.550 7.990 -0.440 17934 11526 1 17 . 1 1 18 18 SER N N 18 112.384 112.384 114.900 -2.516 17934 11527 1 17 . 1 1 18 18 SER HA H 18 4.388 4.388 5.275 -0.887 17934 11528 1 17 . 1 1 18 18 SER C C 18 173.780 173.780 172.355 1.425 17934 11529 1 17 . 1 1 18 18 SER CA C 18 57.664 57.664 58.010 -0.346 17934 11530 1 17 . 1 1 18 18 SER CB C 18 65.164 65.164 65.221 -0.057 17934 11531 1 17 . 1 1 18 18 SER H H 18 7.666 7.666 8.157 -0.491 17934 11532 1 17 . 1 1 19 19 CYS N N 19 120.116 120.116 120.941 -0.825 17934 11533 1 17 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.717 -0.387 17934 11534 1 17 . 1 1 19 19 CYS C C 19 180.387 180.387 172.619 7.768 17934 11535 1 17 . 1 1 19 19 CYS CA C 19 58.601 58.601 56.379 2.222 17934 11536 1 17 . 1 1 19 19 CYS CB C 19 30.008 30.008 30.911 -0.903 17934 11537 1 17 . 1 1 19 19 CYS H H 19 8.835 8.835 8.877 -0.042 17934 11538 1 17 . 1 1 20 20 ASP N N 20 124.416 124.416 120.729 3.687 17934 11539 1 17 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.054 -0.078 17934 11540 1 17 . 1 1 20 20 ASP CB C 20 42.195 42.195 44.573 -2.378 17934 11541 1 17 . 1 1 20 20 ASP H H 20 7.847 7.847 7.697 0.150 17934 11542 1 17 . 1 1 21 21 TYR N N 21 121.296 121.296 120.523 0.773 17934 11543 1 17 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.750 -0.020 17934 11544 1 17 . 1 1 21 21 TYR C C 21 175.793 175.793 174.016 1.777 17934 11545 1 17 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.629 0.571 17934 11546 1 17 . 1 1 21 21 TYR CB C 21 43.240 43.240 42.606 0.634 17934 11547 1 17 . 1 1 21 21 TYR H H 21 9.070 9.070 8.913 0.157 17934 11548 1 17 . 1 1 22 22 LYS N N 22 122.820 122.820 121.565 1.255 17934 11549 1 17 . 1 1 22 22 LYS HA H 22 5.192 5.192 4.545 0.647 17934 11550 1 17 . 1 1 22 22 LYS C C 22 175.793 175.793 175.591 0.202 17934 11551 1 17 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.962 0.296 17934 11552 1 17 . 1 1 22 22 LYS CB C 22 33.758 33.758 32.154 1.605 17934 11553 1 17 . 1 1 22 22 LYS H H 22 8.711 8.711 8.789 -0.078 17934 11554 1 17 . 1 1 23 23 ALA N N 23 123.073 123.073 127.327 -4.254 17934 11555 1 17 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.394 0.336 17934 11556 1 17 . 1 1 23 23 ALA C C 23 174.515 174.515 175.539 -1.024 17934 11557 1 17 . 1 1 23 23 ALA CA C 23 51.570 51.570 49.956 1.614 17934 11558 1 17 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.099 -0.471 17934 11559 1 17 . 1 1 23 23 ALA H H 23 8.727 8.727 8.486 0.241 17934 11560 1 17 . 1 1 24 24 ALA N N 24 122.486 122.486 121.748 0.738 17934 11561 1 17 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.631 0.550 17934 11562 1 17 . 1 1 24 24 ALA C C 24 176.835 176.835 175.535 1.300 17934 11563 1 17 . 1 1 24 24 ALA CA C 24 51.570 51.570 50.311 1.259 17934 11564 1 17 . 1 1 24 24 ALA CB C 24 20.120 20.120 21.040 -0.920 17934 11565 1 17 . 1 1 24 24 ALA H H 24 8.675 8.675 8.771 -0.096 17934 11566 1 17 . 1 1 25 25 TYR N N 25 122.698 122.698 125.546 -2.848 17934 11567 1 17 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.461 0.549 17934 11568 1 17 . 1 1 25 25 TYR CA C 25 54.340 54.340 58.455 -4.115 17934 11569 1 17 . 1 1 25 25 TYR CB C 25 39.850 39.850 38.585 1.265 17934 11570 1 17 . 1 1 25 25 TYR H H 25 8.270 8.270 8.601 -0.331 17934 11571 1 17 . 1 1 26 26 LEU N N 26 127.997 127.997 128.968 -0.971 17934 11572 1 17 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.436 -0.516 17934 11573 1 17 . 1 1 26 26 LEU C C 26 175.983 175.983 176.590 -0.607 17934 11574 1 17 . 1 1 26 26 LEU CA C 26 56.726 56.726 55.836 0.891 17934 11575 1 17 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.398 -2.328 17934 11576 1 17 . 1 1 26 26 LEU H H 26 8.700 8.700 8.354 0.346 17934 11577 1 17 . 1 1 27 27 GLY N N 27 102.901 102.901 102.819 0.082 17934 11578 1 17 . 1 1 27 27 GLY C C 27 176.219 176.219 171.717 4.502 17934 11579 1 17 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.473 -1.872 17934 11580 1 17 . 1 1 27 27 GLY H H 27 5.891 5.891 7.851 -1.960 17934 11581 1 17 . 1 1 28 28 SER N N 28 111.551 111.551 114.581 -3.030 17934 11582 1 17 . 1 1 28 28 SER HA H 28 5.785 5.785 5.435 0.350 17934 11583 1 17 . 1 1 28 28 SER CA C 28 56.258 56.258 57.611 -1.353 17934 11584 1 17 . 1 1 28 28 SER CB C 28 65.632 65.632 65.498 0.134 17934 11585 1 17 . 1 1 28 28 SER H H 28 7.981 7.981 8.598 -0.618 17934 11586 1 17 . 1 1 29 29 MET N N 29 119.493 119.493 125.227 -5.734 17934 11587 1 17 . 1 1 29 29 MET HA H 29 4.725 4.725 4.753 -0.028 17934 11588 1 17 . 1 1 29 29 MET C C 29 174.143 174.143 174.495 -0.352 17934 11589 1 17 . 1 1 29 29 MET CA C 29 54.036 54.036 53.694 0.342 17934 11590 1 17 . 1 1 29 29 MET CB C 29 37.268 37.268 36.556 0.712 17934 11591 1 17 . 1 1 29 29 MET H H 29 8.704 8.704 8.811 -0.107 17934 11592 1 17 . 1 1 30 30 LEU N N 30 128.150 128.150 126.400 1.750 17934 11593 1 17 . 1 1 30 30 LEU HA H 30 3.785 3.785 4.049 -0.264 17934 11594 1 17 . 1 1 30 30 LEU C C 30 175.857 175.857 175.167 0.690 17934 11595 1 17 . 1 1 30 30 LEU CA C 30 56.250 56.250 54.182 2.068 17934 11596 1 17 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.627 1.033 17934 11597 1 17 . 1 1 30 30 LEU H H 30 8.630 8.630 8.502 0.128 17934 11598 1 17 . 1 1 31 31 ILE N N 31 127.723 127.723 127.898 -0.175 17934 11599 1 17 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.205 -0.015 17934 11600 1 17 . 1 1 31 31 ILE C C 31 174.881 174.881 174.630 0.251 17934 11601 1 17 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.024 -1.364 17934 11602 1 17 . 1 1 31 31 ILE CB C 31 37.110 37.110 37.363 -0.253 17934 11603 1 17 . 1 1 31 31 ILE H H 31 8.560 8.560 8.415 0.145 17934 11604 1 17 . 1 1 32 32 LYS HA H 32 4.055 4.055 4.381 -0.326 17934 11605 1 17 . 1 1 32 32 LYS C C 32 176.272 176.272 176.645 -0.373 17934 11606 1 17 . 1 1 32 32 LYS CA C 32 58.601 58.601 56.103 2.498 17934 11607 1 17 . 1 1 32 32 LYS CB C 32 32.820 32.820 33.803 -0.983 17934 11608 1 17 . 1 1 33 33 GLU N N 33 118.638 118.638 118.150 0.488 17934 11609 1 17 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.008 0.380 17934 11610 1 17 . 1 1 33 33 GLU C C 33 173.962 173.962 174.506 -0.544 17934 11611 1 17 . 1 1 33 33 GLU CA C 33 54.851 54.851 57.285 -2.434 17934 11612 1 17 . 1 1 33 33 GLU CB C 33 30.945 30.945 28.997 1.948 17934 11613 1 17 . 1 1 33 33 GLU H H 33 7.723 7.723 8.677 -0.954 17934 11614 1 17 . 1 1 34 34 LEU N N 34 126.535 126.535 120.441 6.094 17934 11615 1 17 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.479 -0.534 17934 11616 1 17 . 1 1 34 34 LEU C C 34 176.870 176.870 175.768 1.102 17934 11617 1 17 . 1 1 34 34 LEU CA C 34 54.850 54.850 53.921 0.929 17934 11618 1 17 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.355 -0.635 17934 11619 1 17 . 1 1 34 34 LEU H H 34 8.446 8.446 7.825 0.621 17934 11620 1 17 . 1 1 35 35 ARG N N 35 128.447 128.447 126.412 2.035 17934 11621 1 17 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.495 0.060 17934 11622 1 17 . 1 1 35 35 ARG C C 35 176.110 176.110 175.273 0.837 17934 11623 1 17 . 1 1 35 35 ARG CA C 35 54.851 54.851 55.104 -0.253 17934 11624 1 17 . 1 1 35 35 ARG CB C 35 30.477 30.477 31.363 -0.887 17934 11625 1 17 . 1 1 35 35 ARG H H 35 8.680 8.680 8.350 0.330 17934 11626 1 17 . 1 1 36 36 GLY N N 36 107.406 107.406 112.329 -4.923 17934 11627 1 17 . 1 1 36 36 GLY CA C 36 45.906 45.906 44.817 1.089 17934 11628 1 17 . 1 1 36 36 GLY H H 36 7.182 7.182 8.047 -0.865 17934 11629 1 17 . 1 1 37 37 THR HA H 37 4.060 4.060 4.100 -0.040 17934 11630 1 17 . 1 1 37 37 THR C C 37 176.634 176.634 175.975 0.659 17934 11631 1 17 . 1 1 37 37 THR CA C 37 65.632 65.632 63.734 1.898 17934 11632 1 17 . 1 1 37 37 THR CB C 37 68.445 68.445 69.293 -0.848 17934 11633 1 17 . 1 1 38 38 GLU N N 38 122.251 122.251 121.671 0.580 17934 11634 1 17 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.932 0.194 17934 11635 1 17 . 1 1 38 38 GLU C C 38 179.981 179.981 178.273 1.708 17934 11636 1 17 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.497 0.511 17934 11637 1 17 . 1 1 38 38 GLU CB C 38 29.539 29.539 28.869 0.670 17934 11638 1 17 . 1 1 38 38 GLU H H 38 8.450 8.450 8.384 0.066 17934 11639 1 17 . 1 1 39 39 SER N N 39 115.966 115.966 113.163 2.803 17934 11640 1 17 . 1 1 39 39 SER C C 39 175.991 175.991 176.393 -0.402 17934 11641 1 17 . 1 1 39 39 SER CA C 39 62.820 62.820 61.552 1.268 17934 11642 1 17 . 1 1 39 39 SER H H 39 7.522 7.522 7.732 -0.210 17934 11643 1 17 . 1 1 40 40 THR HA H 40 4.049 4.049 3.897 0.152 17934 11644 1 17 . 1 1 40 40 THR C C 40 175.972 175.972 177.279 -1.307 17934 11645 1 17 . 1 1 40 40 THR CA C 40 66.101 66.101 65.356 0.745 17934 11646 1 17 . 1 1 40 40 THR CB C 40 67.976 67.976 68.183 -0.207 17934 11647 1 17 . 1 1 41 41 GLN N N 41 120.354 120.354 118.516 1.838 17934 11648 1 17 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.072 -0.313 17934 11649 1 17 . 1 1 41 41 GLN C C 41 178.483 178.483 178.255 0.228 17934 11650 1 17 . 1 1 41 41 GLN CA C 41 60.476 60.476 58.997 1.479 17934 11651 1 17 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.053 0.080 17934 11652 1 17 . 1 1 41 41 GLN H H 41 8.271 8.271 8.243 0.028 17934 11653 1 17 . 1 1 42 42 ASP N N 42 120.757 120.757 121.599 -0.842 17934 11654 1 17 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.409 -0.050 17934 11655 1 17 . 1 1 42 42 ASP C C 42 177.480 177.480 177.930 -0.450 17934 11656 1 17 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.413 0.251 17934 11657 1 17 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.766 1.429 17934 11658 1 17 . 1 1 42 42 ASP H H 42 7.954 7.954 8.128 -0.174 17934 11659 1 17 . 1 1 43 43 ALA N N 43 120.587 120.587 122.164 -1.577 17934 11660 1 17 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.053 -0.063 17934 11661 1 17 . 1 1 43 43 ALA C C 43 179.767 179.767 179.162 0.605 17934 11662 1 17 . 1 1 43 43 ALA CA C 43 55.320 55.320 55.177 0.143 17934 11663 1 17 . 1 1 43 43 ALA CB C 43 19.230 19.230 17.974 1.256 17934 11664 1 17 . 1 1 43 43 ALA H H 43 7.842 7.842 8.239 -0.397 17934 11665 1 17 . 1 1 44 44 CYS N N 44 115.428 115.428 117.551 -2.123 17934 11666 1 17 . 1 1 44 44 CYS HA H 44 3.895 3.895 3.883 0.012 17934 11667 1 17 . 1 1 44 44 CYS C C 44 176.076 176.076 176.120 -0.044 17934 11668 1 17 . 1 1 44 44 CYS CA C 44 64.695 64.695 62.965 1.730 17934 11669 1 17 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.890 -0.226 17934 11670 1 17 . 1 1 44 44 CYS H H 44 7.900 7.900 8.365 -0.465 17934 11671 1 17 . 1 1 45 45 ALA N N 45 120.487 120.487 121.937 -1.450 17934 11672 1 17 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.906 0.094 17934 11673 1 17 . 1 1 45 45 ALA C C 45 173.506 173.506 179.270 -5.764 17934 11674 1 17 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.057 0.263 17934 11675 1 17 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.116 -0.176 17934 11676 1 17 . 1 1 45 45 ALA H H 45 7.250 7.250 7.890 -0.640 17934 11677 1 17 . 1 1 46 46 LYS N N 46 119.267 119.267 119.382 -0.115 17934 11678 1 17 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.886 0.061 17934 11679 1 17 . 1 1 46 46 LYS C C 46 179.561 179.561 178.782 0.779 17934 11680 1 17 . 1 1 46 46 LYS H H 46 8.102 8.102 8.025 0.077 17934 11681 1 17 . 1 1 47 47 MET N N 47 118.009 118.009 118.071 -0.062 17934 11682 1 17 . 1 1 47 47 MET HA H 47 4.214 4.214 4.140 0.074 17934 11683 1 17 . 1 1 47 47 MET C C 47 179.526 179.526 178.223 1.303 17934 11684 1 17 . 1 1 47 47 MET CA C 47 57.195 57.195 59.111 -1.916 17934 11685 1 17 . 1 1 47 47 MET CB C 47 30.945 30.945 32.765 -1.820 17934 11686 1 17 . 1 1 47 47 MET H H 47 8.585 8.585 8.080 0.505 17934 11687 1 17 . 1 1 48 48 ARG N N 48 119.962 119.962 119.595 0.367 17934 11688 1 17 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.913 -0.057 17934 11689 1 17 . 1 1 48 48 ARG C C 48 178.875 178.875 177.887 0.988 17934 11690 1 17 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.358 1.587 17934 11691 1 17 . 1 1 48 48 ARG CB C 48 30.477 30.477 30.175 0.302 17934 11692 1 17 . 1 1 48 48 ARG H H 48 8.190 8.190 8.553 -0.363 17934 11693 1 17 . 1 1 49 49 ALA N N 49 120.640 120.640 119.434 1.206 17934 11694 1 17 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.195 -0.452 17934 11695 1 17 . 1 1 49 49 ALA C C 49 180.169 180.169 178.807 1.362 17934 11696 1 17 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.184 0.666 17934 11697 1 17 . 1 1 49 49 ALA CB C 49 17.821 17.821 19.298 -1.477 17934 11698 1 17 . 1 1 49 49 ALA H H 49 7.671 7.671 7.769 -0.098 17934 11699 1 17 . 1 1 50 50 ASN N N 50 116.063 116.063 119.136 -3.073 17934 11700 1 17 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.449 0.025 17934 11701 1 17 . 1 1 50 50 ASN C C 50 177.084 177.084 177.172 -0.088 17934 11702 1 17 . 1 1 50 50 ASN CA C 50 55.789 55.789 56.027 -0.238 17934 11703 1 17 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.740 0.174 17934 11704 1 17 . 1 1 50 50 ASN H H 50 7.893 7.893 8.115 -0.222 17934 11705 1 17 . 1 1 51 51 CYS N N 51 116.884 116.884 117.304 -0.420 17934 11706 1 17 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.116 0.190 17934 11707 1 17 . 1 1 51 51 CYS C C 51 175.002 175.002 176.382 -1.380 17934 11708 1 17 . 1 1 51 51 CYS CA C 51 61.414 61.414 61.504 -0.090 17934 11709 1 17 . 1 1 51 51 CYS CB C 51 27.664 27.664 28.117 -0.454 17934 11710 1 17 . 1 1 51 51 CYS H H 51 7.770 7.770 8.617 -0.847 17934 11711 1 17 . 1 1 52 52 GLN N N 52 117.831 117.831 118.874 -1.043 17934 11712 1 17 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.108 0.120 17934 11713 1 17 . 1 1 52 52 GLN CA C 52 56.726 56.726 57.867 -1.141 17934 11714 1 17 . 1 1 52 52 GLN CB C 52 29.070 29.070 27.935 1.135 17934 11715 1 17 . 1 1 52 52 GLN H H 52 7.796 7.796 8.163 -0.367 17934 11716 1 17 . 1 1 53 53 LYS N N 53 118.841 118.841 118.480 0.361 17934 11717 1 17 . 1 1 53 53 LYS CA C 53 57.195 57.195 57.344 -0.149 17934 11718 1 17 . 1 1 53 53 LYS CB C 53 33.289 33.289 33.047 0.242 17934 11719 1 17 . 1 1 53 53 LYS H H 53 7.686 7.686 7.972 -0.286 17934 11720 1 17 . 1 1 55 55 THR HA H 55 4.304 4.304 4.343 -0.039 17934 11721 1 17 . 1 1 55 55 THR CA C 55 63.757 63.757 63.990 -0.233 17934 11722 1 17 . 1 1 55 55 THR CB C 55 68.914 68.914 69.145 -0.231 17934 11723 1 17 . 1 1 56 56 GLU N N 56 120.861 120.861 120.118 0.743 17934 11724 1 17 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.034 0.113 17934 11725 1 17 . 1 1 56 56 GLU C C 56 177.656 177.656 178.000 -0.344 17934 11726 1 17 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.986 -0.853 17934 11727 1 17 . 1 1 56 56 GLU CB C 56 30.008 30.008 29.032 0.976 17934 11728 1 17 . 1 1 56 56 GLU H H 56 8.311 8.311 8.640 -0.329 17934 11729 1 17 . 1 1 57 57 GLN N N 57 118.397 118.397 116.977 1.420 17934 11730 1 17 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.192 -0.050 17934 11731 1 17 . 1 1 57 57 GLN C C 57 177.275 177.275 177.849 -0.574 17934 11732 1 17 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.347 0.317 17934 11733 1 17 . 1 1 57 57 GLN CB C 57 29.070 29.070 28.850 0.220 17934 11734 1 17 . 1 1 57 57 GLN H H 57 7.899 7.899 7.499 0.400 17934 11735 1 17 . 1 1 58 58 MET N N 58 118.897 118.897 118.645 0.252 17934 11736 1 17 . 1 1 58 58 MET HA H 58 4.350 4.350 4.101 0.249 17934 11737 1 17 . 1 1 58 58 MET C C 58 177.172 177.172 178.158 -0.986 17934 11738 1 17 . 1 1 58 58 MET CA C 58 56.726 56.726 57.790 -1.064 17934 11739 1 17 . 1 1 58 58 MET CB C 58 32.196 32.196 31.942 0.254 17934 11740 1 17 . 1 1 58 58 MET H H 58 8.036 8.036 8.123 -0.087 17934 11741 1 17 . 1 1 59 59 LYS N N 59 119.779 119.779 119.725 0.054 17934 11742 1 17 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.038 0.193 17934 11743 1 17 . 1 1 59 59 LYS C C 59 176.676 176.676 176.963 -0.287 17934 11744 1 17 . 1 1 59 59 LYS CA C 59 57.195 57.195 58.437 -1.242 17934 11745 1 17 . 1 1 59 59 LYS CB C 59 32.820 32.820 32.537 0.283 17934 11746 1 17 . 1 1 59 59 LYS H H 59 7.901 7.901 7.500 0.401 17934 11747 1 17 . 1 1 60 60 LYS N N 60 119.993 119.993 117.599 2.394 17934 11748 1 17 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.437 -0.102 17934 11749 1 17 . 1 1 60 60 LYS C C 60 176.336 176.336 174.719 1.617 17934 11750 1 17 . 1 1 60 60 LYS CA C 60 56.258 56.258 55.770 0.488 17934 11751 1 17 . 1 1 60 60 LYS CB C 60 32.820 32.820 34.499 -1.679 17934 11752 1 17 . 1 1 60 60 LYS H H 60 7.877 7.877 7.913 -0.036 17934 11753 1 17 . 1 1 61 61 VAL N N 61 122.649 122.649 121.625 1.024 17934 11754 1 17 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.584 -0.204 17934 11755 1 17 . 1 1 61 61 VAL C C 61 174.210 174.210 174.221 -0.011 17934 11756 1 17 . 1 1 61 61 VAL CA C 61 60.000 60.000 58.153 1.847 17934 11757 1 17 . 1 1 61 61 VAL CB C 61 32.350 32.350 32.124 0.226 17934 11758 1 17 . 1 1 61 61 VAL H H 61 7.708 7.708 8.202 -0.494 17934 11759 1 17 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.638 0.025 17934 11760 1 17 . 1 1 62 62 PRO C C 62 176.656 176.656 176.055 0.601 17934 11761 1 17 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.676 0.144 17934 11762 1 17 . 1 1 62 62 PRO CB C 62 31.883 31.883 31.794 0.089 17934 11763 1 17 . 1 1 63 63 THR N N 63 117.155 117.155 121.915 -4.760 17934 11764 1 17 . 1 1 63 63 THR HA H 63 4.830 4.830 4.882 -0.052 17934 11765 1 17 . 1 1 63 63 THR C C 63 174.682 174.682 173.566 1.116 17934 11766 1 17 . 1 1 63 63 THR CA C 63 62.820 62.820 62.882 -0.062 17934 11767 1 17 . 1 1 63 63 THR CB C 63 69.382 69.382 69.817 -0.435 17934 11768 1 17 . 1 1 63 63 THR H H 63 8.303 8.303 8.509 -0.206 17934 11769 1 17 . 1 1 64 64 ILE N N 64 121.004 121.004 125.860 -4.856 17934 11770 1 17 . 1 1 64 64 ILE CA C 64 58.600 58.600 58.209 0.391 17934 11771 1 17 . 1 1 64 64 ILE CB C 64 42.690 42.690 41.435 1.255 17934 11772 1 17 . 1 1 64 64 ILE H H 64 9.348 9.348 8.799 0.549 17934 11773 1 17 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.210 0.530 17934 11774 1 17 . 1 1 65 65 ILE C C 65 175.378 175.378 175.013 0.365 17934 11775 1 17 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.777 -1.697 17934 11776 1 17 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.557 1.193 17934 11777 1 17 . 1 1 66 66 LEU N N 66 110.343 110.343 130.751 -20.408 17934 11778 1 17 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.878 -0.028 17934 11779 1 17 . 1 1 66 66 LEU C C 66 174.982 174.982 175.538 -0.556 17934 11780 1 17 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.332 -0.422 17934 11781 1 17 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.850 1.380 17934 11782 1 17 . 1 1 66 66 LEU H H 66 9.610 9.610 9.295 0.315 17934 11783 1 17 . 1 1 67 67 SER N N 67 120.990 120.990 120.862 0.128 17934 11784 1 17 . 1 1 67 67 SER HA H 67 5.405 5.405 5.287 0.118 17934 11785 1 17 . 1 1 67 67 SER C C 67 174.405 174.405 172.822 1.583 17934 11786 1 17 . 1 1 67 67 SER CA C 67 57.195 57.195 56.784 0.411 17934 11787 1 17 . 1 1 67 67 SER CB C 67 64.695 64.695 64.425 0.270 17934 11788 1 17 . 1 1 67 67 SER H H 67 9.260 9.260 9.321 -0.061 17934 11789 1 17 . 1 1 68 68 VAL N N 68 128.176 128.176 126.131 2.045 17934 11790 1 17 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.509 -0.016 17934 11791 1 17 . 1 1 68 68 VAL C C 68 173.891 173.891 173.203 0.688 17934 11792 1 17 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.006 2.344 17934 11793 1 17 . 1 1 68 68 VAL CB C 68 33.750 33.750 34.199 -0.449 17934 11794 1 17 . 1 1 68 68 VAL H H 68 9.225 9.225 8.656 0.569 17934 11795 1 17 . 1 1 69 69 SER N N 69 121.697 121.697 122.952 -1.255 17934 11796 1 17 . 1 1 69 69 SER HA H 69 4.837 4.837 5.313 -0.476 17934 11797 1 17 . 1 1 69 69 SER C C 69 173.188 173.188 174.856 -1.668 17934 11798 1 17 . 1 1 69 69 SER CA C 69 57.195 57.195 56.182 1.013 17934 11799 1 17 . 1 1 69 69 SER CB C 69 67.976 67.976 66.548 1.428 17934 11800 1 17 . 1 1 69 69 SER H H 69 8.869 8.869 8.891 -0.022 17934 11801 1 17 . 1 1 70 70 ALA N N 70 118.689 118.689 125.303 -6.614 17934 11802 1 17 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.347 -0.197 17934 11803 1 17 . 1 1 70 70 ALA C C 70 176.714 176.714 178.119 -1.405 17934 11804 1 17 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.091 -0.181 17934 11805 1 17 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.639 -0.039 17934 11806 1 17 . 1 1 70 70 ALA H H 70 8.810 8.810 9.087 -0.277 17934 11807 1 17 . 1 1 71 71 LYS N N 71 112.633 112.633 116.758 -4.125 17934 11808 1 17 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.458 -0.183 17934 11809 1 17 . 1 1 71 71 LYS C C 71 177.033 177.033 175.722 1.311 17934 11810 1 17 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.070 2.125 17934 11811 1 17 . 1 1 71 71 LYS CB C 71 33.289 33.289 33.319 -0.030 17934 11812 1 17 . 1 1 71 71 LYS H H 71 7.830 7.830 7.642 0.188 17934 11813 1 17 . 1 1 72 72 GLY N N 72 108.432 108.432 106.045 2.387 17934 11814 1 17 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.184 0.293 17934 11815 1 17 . 1 1 72 72 GLY H H 72 7.685 7.685 7.612 0.073 17934 11816 1 17 . 1 1 73 73 VAL N N 73 120.414 120.414 116.514 3.900 17934 11817 1 17 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.929 0.071 17934 11818 1 17 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.516 0.954 17934 11819 1 17 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.718 -0.088 17934 11820 1 17 . 1 1 73 73 VAL H H 73 8.620 8.620 7.983 0.637 17934 11821 1 17 . 1 1 74 74 LYS N N 74 125.257 125.257 125.513 -0.256 17934 11822 1 17 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.368 0.648 17934 11823 1 17 . 1 1 74 74 LYS CA C 74 54.383 54.383 54.907 -0.524 17934 11824 1 17 . 1 1 74 74 LYS CB C 74 36.570 36.570 36.563 0.007 17934 11825 1 17 . 1 1 74 74 LYS H H 74 8.783 8.783 8.726 0.057 17934 11826 1 17 . 1 1 75 75 PHE N N 75 119.414 119.414 121.655 -2.241 17934 11827 1 17 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.489 0.211 17934 11828 1 17 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.085 -2.165 17934 11829 1 17 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.430 -0.820 17934 11830 1 17 . 1 1 75 75 PHE H H 75 8.432 8.432 8.872 -0.440 17934 11831 1 17 . 1 1 76 76 ILE N N 76 121.430 121.430 121.171 0.259 17934 11832 1 17 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.626 0.214 17934 11833 1 17 . 1 1 76 76 ILE C C 76 175.249 175.249 174.130 1.119 17934 11834 1 17 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.627 -0.557 17934 11835 1 17 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.933 -0.713 17934 11836 1 17 . 1 1 76 76 ILE H H 76 8.960 8.960 8.502 0.458 17934 11837 1 17 . 1 1 77 77 ASP N N 77 125.744 125.744 123.391 2.353 17934 11838 1 17 . 1 1 77 77 ASP HA H 77 4.563 4.563 4.908 -0.345 17934 11839 1 17 . 1 1 77 77 ASP C C 77 177.569 177.569 175.597 1.972 17934 11840 1 17 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.682 3.107 17934 11841 1 17 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.528 0.073 17934 11842 1 17 . 1 1 77 77 ASP H H 77 8.750 8.750 8.099 0.651 17934 11843 1 17 . 1 1 78 78 ALA N N 78 128.632 128.632 127.870 0.762 17934 11844 1 17 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.323 -0.353 17934 11845 1 17 . 1 1 78 78 ALA C C 78 178.052 178.052 178.082 -0.030 17934 11846 1 17 . 1 1 78 78 ALA CA C 78 54.830 54.830 53.985 0.845 17934 11847 1 17 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.470 0.323 17934 11848 1 17 . 1 1 78 78 ALA H H 78 8.700 8.700 8.777 -0.078 17934 11849 1 17 . 1 1 79 79 THR N N 79 113.087 113.087 115.856 -2.769 17934 11850 1 17 . 1 1 79 79 THR HA H 79 4.194 4.194 4.200 -0.006 17934 11851 1 17 . 1 1 79 79 THR C C 79 175.587 175.587 175.745 -0.158 17934 11852 1 17 . 1 1 79 79 THR CA C 79 64.695 64.695 64.787 -0.091 17934 11853 1 17 . 1 1 79 79 THR CB C 79 69.382 69.382 69.067 0.315 17934 11854 1 17 . 1 1 79 79 THR H H 79 8.779 8.779 8.757 0.022 17934 11855 1 17 . 1 1 80 80 ASN N N 80 118.434 118.434 115.889 2.545 17934 11856 1 17 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.812 -0.075 17934 11857 1 17 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.705 0.740 17934 11858 1 17 . 1 1 80 80 ASN CB C 80 39.383 39.383 38.899 0.484 17934 11859 1 17 . 1 1 80 80 ASN H H 80 8.584 8.584 7.774 0.810 17934 11860 1 17 . 1 1 81 81 LYS N N 81 112.429 112.429 115.073 -2.644 17934 11861 1 17 . 1 1 81 81 LYS C C 81 174.909 174.909 175.368 -0.459 17934 11862 1 17 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.906 -0.242 17934 11863 1 17 . 1 1 81 81 LYS CB C 81 28.602 28.602 30.078 -1.476 17934 11864 1 17 . 1 1 81 81 LYS H H 81 7.966 7.966 8.320 -0.354 17934 11865 1 17 . 1 1 82 82 ASN N N 82 116.806 116.806 117.472 -0.666 17934 11866 1 17 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.657 -0.067 17934 11867 1 17 . 1 1 82 82 ASN C C 82 174.999 174.999 173.889 1.110 17934 11868 1 17 . 1 1 82 82 ASN CA C 82 52.976 52.976 52.565 0.411 17934 11869 1 17 . 1 1 82 82 ASN CB C 82 38.445 38.445 40.498 -2.053 17934 11870 1 17 . 1 1 82 82 ASN H H 82 8.455 8.455 8.412 0.043 17934 11871 1 17 . 1 1 83 83 ILE N N 83 122.447 122.447 122.014 0.433 17934 11872 1 17 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.150 -0.120 17934 11873 1 17 . 1 1 83 83 ILE C C 83 176.572 176.572 175.723 0.849 17934 11874 1 17 . 1 1 83 83 ILE CA C 83 62.350 62.350 61.866 0.484 17934 11875 1 17 . 1 1 83 83 ILE CB C 83 37.970 37.970 37.717 0.253 17934 11876 1 17 . 1 1 83 83 ILE H H 83 8.650 8.650 8.347 0.303 17934 11877 1 17 . 1 1 84 84 ILE N N 84 129.339 129.339 129.606 -0.267 17934 11878 1 17 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.105 -0.185 17934 11879 1 17 . 1 1 84 84 ILE C C 84 175.873 175.873 175.596 0.277 17934 11880 1 17 . 1 1 84 84 ILE CA C 84 62.810 62.810 62.499 0.311 17934 11881 1 17 . 1 1 84 84 ILE CB C 84 38.840 38.840 39.231 -0.391 17934 11882 1 17 . 1 1 84 84 ILE H H 84 8.930 8.930 8.254 0.676 17934 11883 1 17 . 1 1 85 85 ALA N N 85 118.867 118.867 118.688 0.179 17934 11884 1 17 . 1 1 85 85 ALA C C 85 174.100 174.100 174.481 -0.381 17934 11885 1 17 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.067 -0.497 17934 11886 1 17 . 1 1 85 85 ALA H H 85 7.048 7.048 8.011 -0.963 17934 11887 1 17 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.878 0.276 17934 11888 1 17 . 1 1 87 87 HIS C C 87 174.986 174.986 174.615 0.371 17934 11889 1 17 . 1 1 87 87 HIS CB C 87 34.350 34.350 34.185 0.165 17934 11890 1 17 . 1 1 88 88 GLU N N 88 125.372 125.372 121.566 3.806 17934 11891 1 17 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.175 0.346 17934 11892 1 17 . 1 1 88 88 GLU C C 88 179.047 179.047 177.792 1.255 17934 11893 1 17 . 1 1 88 88 GLU CA C 88 56.726 56.726 57.169 -0.443 17934 11894 1 17 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.219 0.258 17934 11895 1 17 . 1 1 88 88 GLU H H 88 9.106 9.106 8.843 0.263 17934 11896 1 17 . 1 1 89 89 ILE N N 89 124.132 124.132 124.415 -0.283 17934 11897 1 17 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.859 0.160 17934 11898 1 17 . 1 1 89 89 ILE C C 89 176.095 176.095 177.774 -1.679 17934 11899 1 17 . 1 1 89 89 ILE CA C 89 62.351 62.351 65.168 -2.817 17934 11900 1 17 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.036 0.878 17934 11901 1 17 . 1 1 89 89 ILE H H 89 8.055 8.055 8.822 -0.767 17934 11902 1 17 . 1 1 90 90 ARG N N 90 116.949 116.949 118.217 -1.268 17934 11903 1 17 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.267 0.071 17934 11904 1 17 . 1 1 90 90 ARG C C 90 176.578 176.578 176.758 -0.180 17934 11905 1 17 . 1 1 90 90 ARG CA C 90 57.664 57.664 58.323 -0.659 17934 11906 1 17 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.059 0.011 17934 11907 1 17 . 1 1 90 90 ARG H H 90 8.045 8.045 8.561 -0.516 17934 11908 1 17 . 1 1 91 91 ASN N N 91 116.320 116.320 116.796 -0.476 17934 11909 1 17 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.694 0.459 17934 11910 1 17 . 1 1 91 91 ASN C C 91 174.595 174.595 175.672 -1.077 17934 11911 1 17 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.005 -1.497 17934 11912 1 17 . 1 1 91 91 ASN CB C 91 39.852 39.852 40.121 -0.269 17934 11913 1 17 . 1 1 91 91 ASN H H 91 8.067 8.067 8.000 0.067 17934 11914 1 17 . 1 1 92 92 ILE N N 92 122.441 122.441 121.336 1.105 17934 11915 1 17 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.834 1.239 17934 11916 1 17 . 1 1 92 92 ILE C C 92 175.229 175.229 175.529 -0.300 17934 11917 1 17 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.814 -0.934 17934 11918 1 17 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.433 2.417 17934 11919 1 17 . 1 1 92 92 ILE H H 92 7.483 7.483 7.687 -0.204 17934 11920 1 17 . 1 1 93 93 SER N N 93 120.329 120.329 123.098 -2.769 17934 11921 1 17 . 1 1 93 93 SER HA H 93 4.684 4.684 4.177 0.507 17934 11922 1 17 . 1 1 93 93 SER C C 93 180.744 180.744 173.894 6.850 17934 11923 1 17 . 1 1 93 93 SER CA C 93 57.664 57.664 60.499 -2.835 17934 11924 1 17 . 1 1 93 93 SER CB C 93 66.570 66.570 63.992 2.578 17934 11925 1 17 . 1 1 93 93 SER H H 93 9.545 9.545 8.566 0.979 17934 11926 1 17 . 1 1 94 94 CYS N N 94 110.900 110.900 116.860 -5.960 17934 11927 1 17 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.488 -0.676 17934 11928 1 17 . 1 1 94 94 CYS C C 94 173.973 173.973 172.336 1.637 17934 11929 1 17 . 1 1 94 94 CYS CA C 94 59.539 59.539 57.637 1.902 17934 11930 1 17 . 1 1 94 94 CYS CB C 94 26.258 26.258 29.541 -3.283 17934 11931 1 17 . 1 1 94 94 CYS H H 94 8.858 8.858 7.877 0.981 17934 11932 1 17 . 1 1 95 95 ALA N N 95 121.379 121.379 128.865 -7.486 17934 11933 1 17 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.687 -0.257 17934 11934 1 17 . 1 1 95 95 ALA C C 95 178.098 178.098 175.736 2.362 17934 11935 1 17 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.229 1.421 17934 11936 1 17 . 1 1 95 95 ALA CB C 95 19.300 19.300 20.838 -1.538 17934 11937 1 17 . 1 1 95 95 ALA H H 95 8.360 8.360 8.651 -0.291 17934 11938 1 17 . 1 1 96 96 ALA N N 96 122.576 122.576 125.112 -2.536 17934 11939 1 17 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.704 -0.024 17934 11940 1 17 . 1 1 96 96 ALA C C 96 175.716 175.716 175.057 0.659 17934 11941 1 17 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.725 0.715 17934 11942 1 17 . 1 1 96 96 ALA CB C 96 22.700 22.700 22.252 0.448 17934 11943 1 17 . 1 1 96 96 ALA H H 96 9.080 9.080 8.684 0.396 17934 11944 1 17 . 1 1 97 97 GLN N N 97 116.903 116.903 120.696 -3.793 17934 11945 1 17 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.673 0.257 17934 11946 1 17 . 1 1 97 97 GLN C C 97 175.270 175.270 173.749 1.521 17934 11947 1 17 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.763 1.088 17934 11948 1 17 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.311 2.447 17934 11949 1 17 . 1 1 97 97 GLN H H 97 8.369 8.369 8.130 0.239 17934 11950 1 17 . 1 1 98 98 ASP N N 98 124.971 124.971 121.433 3.538 17934 11951 1 17 . 1 1 98 98 ASP C C 98 175.217 175.217 176.186 -0.969 17934 11952 1 17 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.409 -0.370 17934 11953 1 17 . 1 1 98 98 ASP CB C 98 42.195 42.195 41.947 0.248 17934 11954 1 17 . 1 1 98 98 ASP H H 98 8.395 8.395 8.308 0.087 17934 11955 1 17 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.357 -0.123 17934 11956 1 17 . 1 1 99 99 PRO C C 99 178.433 178.433 177.719 0.714 17934 11957 1 17 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.671 0.024 17934 11958 1 17 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.378 -0.026 17934 11959 1 17 . 1 1 100 100 GLU N N 100 116.223 116.223 118.132 -1.909 17934 11960 1 17 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.134 0.086 17934 11961 1 17 . 1 1 100 100 GLU C C 100 176.678 176.678 175.988 0.690 17934 11962 1 17 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.352 -1.626 17934 11963 1 17 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.331 2.614 17934 11964 1 17 . 1 1 100 100 GLU H H 100 8.643 8.643 8.866 -0.223 17934 11965 1 17 . 1 1 101 101 ASP N N 101 119.053 119.053 119.872 -0.819 17934 11966 1 17 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.854 -0.311 17934 11967 1 17 . 1 1 101 101 ASP C C 101 174.771 174.771 176.511 -1.740 17934 11968 1 17 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.269 0.645 17934 11969 1 17 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.980 -0.191 17934 11970 1 17 . 1 1 101 101 ASP H H 101 7.597 7.597 8.150 -0.553 17934 11971 1 17 . 1 1 102 102 LEU N N 102 123.986 123.986 121.709 2.277 17934 11972 1 17 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.338 0.052 17934 11973 1 17 . 1 1 102 102 LEU C C 102 177.141 177.141 177.255 -0.114 17934 11974 1 17 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.916 -0.256 17934 11975 1 17 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.443 1.217 17934 11976 1 17 . 1 1 102 102 LEU H H 102 8.534 8.534 7.515 1.019 17934 11977 1 17 . 1 1 103 103 SER N N 103 112.339 112.339 112.573 -0.234 17934 11978 1 17 . 1 1 103 103 SER HA H 103 4.290 4.290 4.225 0.065 17934 11979 1 17 . 1 1 103 103 SER C C 103 174.106 174.106 175.036 -0.930 17934 11980 1 17 . 1 1 103 103 SER CA C 103 60.945 60.945 60.771 0.174 17934 11981 1 17 . 1 1 103 103 SER CB C 103 63.757 63.757 63.437 0.320 17934 11982 1 17 . 1 1 103 103 SER H H 103 7.867 7.867 8.264 -0.397 17934 11983 1 17 . 1 1 104 104 THR N N 104 123.070 123.070 117.974 5.096 17934 11984 1 17 . 1 1 104 104 THR HA H 104 5.373 5.373 4.530 0.843 17934 11985 1 17 . 1 1 104 104 THR C C 104 180.693 180.693 172.895 7.798 17934 11986 1 17 . 1 1 104 104 THR CA C 104 63.289 63.289 62.782 0.507 17934 11987 1 17 . 1 1 104 104 THR CB C 104 69.382 69.382 70.665 -1.283 17934 11988 1 17 . 1 1 104 104 THR H H 104 8.830 8.830 8.050 0.780 17934 11989 1 17 . 1 1 105 105 PHE N N 105 122.582 122.582 118.904 3.678 17934 11990 1 17 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.759 0.711 17934 11991 1 17 . 1 1 105 105 PHE C C 105 179.211 179.211 172.146 7.065 17934 11992 1 17 . 1 1 105 105 PHE CA C 105 55.320 55.320 56.554 -1.234 17934 11993 1 17 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.218 0.572 17934 11994 1 17 . 1 1 105 105 PHE H H 105 9.170 9.170 8.658 0.512 17934 11995 1 17 . 1 1 106 106 ALA N N 106 119.567 119.567 120.317 -0.750 17934 11996 1 17 . 1 1 106 106 ALA C C 106 175.603 175.603 174.870 0.733 17934 11997 1 17 . 1 1 106 106 ALA H H 106 8.770 8.770 8.985 -0.215 17934 11998 1 17 . 1 1 107 107 TYR N N 107 109.933 109.933 115.659 -5.726 17934 11999 1 17 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.300 -0.380 17934 12000 1 17 . 1 1 107 107 TYR C C 107 180.426 180.426 172.677 7.749 17934 12001 1 17 . 1 1 107 107 TYR CA C 107 57.080 57.080 55.889 1.191 17934 12002 1 17 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.013 -0.224 17934 12003 1 17 . 1 1 107 107 TYR H H 107 7.950 7.950 8.514 -0.564 17934 12004 1 17 . 1 1 108 108 ILE N N 108 120.613 120.613 117.929 2.684 17934 12005 1 17 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.961 0.409 17934 12006 1 17 . 1 1 108 108 ILE C C 108 176.212 176.212 175.715 0.497 17934 12007 1 17 . 1 1 108 108 ILE CA C 108 59.540 59.540 58.608 0.932 17934 12008 1 17 . 1 1 108 108 ILE CB C 108 39.380 39.380 39.075 0.305 17934 12009 1 17 . 1 1 108 108 ILE H H 108 8.869 8.869 8.875 -0.006 17934 12010 1 17 . 1 1 109 109 THR N N 109 116.505 116.505 115.074 1.431 17934 12011 1 17 . 1 1 109 109 THR HA H 109 5.669 5.669 4.803 0.866 17934 12012 1 17 . 1 1 109 109 THR C C 109 173.505 173.505 173.951 -0.446 17934 12013 1 17 . 1 1 109 109 THR CA C 109 59.070 59.070 60.565 -1.494 17934 12014 1 17 . 1 1 109 109 THR H H 109 9.489 9.489 8.524 0.965 17934 12015 1 17 . 1 1 110 110 LYS N N 110 122.960 122.960 121.760 1.200 17934 12016 1 17 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.100 0.360 17934 12017 1 17 . 1 1 110 110 LYS C C 110 175.937 175.937 176.232 -0.295 17934 12018 1 17 . 1 1 110 110 LYS CA C 110 55.789 55.789 57.031 -1.242 17934 12019 1 17 . 1 1 110 110 LYS CB C 110 34.227 34.227 32.785 1.442 17934 12020 1 17 . 1 1 110 110 LYS H H 110 7.831 7.831 8.014 -0.183 17934 12021 1 17 . 1 1 111 111 ASP N N 111 127.409 127.409 119.274 8.135 17934 12022 1 17 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.898 -0.117 17934 12023 1 17 . 1 1 111 111 ASP C C 111 176.396 176.396 177.787 -1.391 17934 12024 1 17 . 1 1 111 111 ASP CA C 111 53.914 53.914 52.483 1.431 17934 12025 1 17 . 1 1 111 111 ASP CB C 111 43.133 43.133 42.093 1.040 17934 12026 1 17 . 1 1 111 111 ASP H H 111 8.769 8.769 7.829 0.940 17934 12027 1 17 . 1 1 112 112 LEU N N 112 125.913 125.913 119.771 6.142 17934 12028 1 17 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.087 0.063 17934 12029 1 17 . 1 1 112 112 LEU C C 112 178.553 178.553 178.640 -0.087 17934 12030 1 17 . 1 1 112 112 LEU CA C 112 57.190 57.190 58.147 -0.957 17934 12031 1 17 . 1 1 112 112 LEU CB C 112 41.790 41.790 41.870 -0.080 17934 12032 1 17 . 1 1 112 112 LEU H H 112 8.593 8.593 8.757 -0.164 17934 12033 1 17 . 1 1 113 113 LYS N N 113 117.189 117.189 117.961 -0.772 17934 12034 1 17 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.274 -0.012 17934 12035 1 17 . 1 1 113 113 LYS C C 113 177.180 177.180 176.227 0.953 17934 12036 1 17 . 1 1 113 113 LYS CA C 113 58.133 58.133 56.576 1.557 17934 12037 1 17 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.664 0.156 17934 12038 1 17 . 1 1 113 113 LYS H H 113 8.207 8.207 8.182 0.025 17934 12039 1 17 . 1 1 114 114 SER N N 114 112.492 112.492 111.690 0.802 17934 12040 1 17 . 1 1 114 114 SER CA C 114 58.601 58.601 58.704 -0.103 17934 12041 1 17 . 1 1 114 114 SER CB C 114 65.164 65.164 61.377 3.787 17934 12042 1 17 . 1 1 114 114 SER H H 114 7.755 7.755 8.124 -0.369 17934 12043 1 17 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.893 -0.504 17934 12044 1 17 . 1 1 115 115 ASN C C 115 174.203 174.203 174.480 -0.277 17934 12045 1 17 . 1 1 115 115 ASN CA C 115 54.383 54.383 53.021 1.362 17934 12046 1 17 . 1 1 115 115 ASN CB C 115 37.977 37.977 40.801 -2.824 17934 12047 1 17 . 1 1 116 116 HIS N N 116 116.822 116.822 116.346 0.476 17934 12048 1 17 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.611 0.319 17934 12049 1 17 . 1 1 116 116 HIS C C 116 173.898 173.898 172.579 1.319 17934 12050 1 17 . 1 1 116 116 HIS CA C 116 54.910 54.910 55.158 -0.248 17934 12051 1 17 . 1 1 116 116 HIS CB C 116 32.650 32.650 33.465 -0.815 17934 12052 1 17 . 1 1 116 116 HIS H H 116 7.690 7.690 8.643 -0.953 17934 12053 1 17 . 1 1 117 117 HIS N N 117 118.253 118.253 118.884 -0.631 17934 12054 1 17 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.883 0.437 17934 12055 1 17 . 1 1 117 117 HIS C C 117 173.695 173.695 173.697 -0.002 17934 12056 1 17 . 1 1 117 117 HIS CA C 117 56.350 56.350 55.021 1.329 17934 12057 1 17 . 1 1 117 117 HIS CB C 117 32.350 32.350 30.044 2.306 17934 12058 1 17 . 1 1 117 117 HIS H H 117 8.340 8.340 8.634 -0.294 17934 12059 1 17 . 1 1 118 118 TYR N N 118 118.301 118.301 124.174 -5.873 17934 12060 1 17 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.360 0.650 17934 12061 1 17 . 1 1 118 118 TYR C C 118 173.530 173.530 173.739 -0.209 17934 12062 1 17 . 1 1 118 118 TYR CA C 118 56.730 56.730 58.801 -2.071 17934 12063 1 17 . 1 1 118 118 TYR CB C 118 43.240 43.240 39.955 3.285 17934 12064 1 17 . 1 1 118 118 TYR H H 118 9.080 9.080 8.287 0.793 17934 12065 1 17 . 1 1 119 119 CYS N N 119 121.015 121.015 124.017 -3.002 17934 12066 1 17 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.545 0.518 17934 12067 1 17 . 1 1 119 119 CYS C C 119 180.664 180.664 173.018 7.646 17934 12068 1 17 . 1 1 119 119 CYS CA C 119 56.726 56.726 56.338 0.388 17934 12069 1 17 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.648 0.891 17934 12070 1 17 . 1 1 119 119 CYS H H 119 9.120 9.120 8.824 0.296 17934 12071 1 17 . 1 1 120 120 HIS N N 120 110.134 110.134 127.945 -17.811 17934 12072 1 17 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.634 0.065 17934 12073 1 17 . 1 1 120 120 HIS C C 120 180.776 180.776 173.507 7.269 17934 12074 1 17 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.068 1.252 17934 12075 1 17 . 1 1 120 120 HIS CB C 120 32.352 32.352 30.218 2.134 17934 12076 1 17 . 1 1 120 120 HIS H H 120 8.482 8.482 8.369 0.113 17934 12077 1 17 . 1 1 121 121 VAL N N 121 120.855 120.855 123.441 -2.586 17934 12078 1 17 . 1 1 121 121 VAL HA H 121 4.350 4.350 3.999 0.351 17934 12079 1 17 . 1 1 121 121 VAL C C 121 173.419 173.419 172.976 0.443 17934 12080 1 17 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.392 1.018 17934 12081 1 17 . 1 1 121 121 VAL CB C 121 33.280 33.280 32.629 0.651 17934 12082 1 17 . 1 1 121 121 VAL H H 121 7.929 7.929 8.116 -0.187 17934 12083 1 17 . 1 1 122 122 PHE N N 122 124.384 124.384 127.528 -3.144 17934 12084 1 17 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.342 0.078 17934 12085 1 17 . 1 1 122 122 PHE C C 122 174.876 174.876 174.356 0.520 17934 12086 1 17 . 1 1 122 122 PHE CA C 122 55.320 55.320 54.539 0.781 17934 12087 1 17 . 1 1 122 122 PHE CB C 122 44.540 44.540 42.759 1.781 17934 12088 1 17 . 1 1 122 122 PHE H H 122 8.910 8.910 8.835 0.075 17934 12089 1 17 . 1 1 123 123 THR N N 123 112.451 112.451 113.744 -1.293 17934 12090 1 17 . 1 1 123 123 THR HA H 123 5.147 5.147 4.501 0.646 17934 12091 1 17 . 1 1 123 123 THR C C 123 174.096 174.096 172.545 1.551 17934 12092 1 17 . 1 1 123 123 THR CA C 123 61.843 61.843 59.288 2.555 17934 12093 1 17 . 1 1 123 123 THR CB C 123 71.218 71.218 71.004 0.214 17934 12094 1 17 . 1 1 123 123 THR H H 123 8.668 8.668 8.736 -0.068 17934 12095 1 17 . 1 1 124 124 ALA N N 124 128.922 128.922 127.782 1.140 17934 12096 1 17 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.429 0.291 17934 12097 1 17 . 1 1 124 124 ALA C C 124 177.168 177.168 176.663 0.505 17934 12098 1 17 . 1 1 124 124 ALA CA C 124 50.890 50.890 50.365 0.525 17934 12099 1 17 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.333 -0.233 17934 12100 1 17 . 1 1 124 124 ALA H H 124 9.180 9.180 7.822 1.358 17934 12101 1 17 . 1 1 125 125 PHE N N 125 115.427 115.427 117.762 -2.335 17934 12102 1 17 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.500 -0.210 17934 12103 1 17 . 1 1 125 125 PHE C C 125 174.703 174.703 175.941 -1.238 17934 12104 1 17 . 1 1 125 125 PHE CA C 125 60.470 60.470 57.461 3.009 17934 12105 1 17 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.335 -1.275 17934 12106 1 17 . 1 1 125 125 PHE H H 125 8.560 8.560 7.741 0.819 17934 12107 1 17 . 1 1 126 126 ASP N N 126 115.745 115.745 120.191 -4.446 17934 12108 1 17 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.893 -0.050 17934 12109 1 17 . 1 1 126 126 ASP C C 126 176.532 176.532 176.240 0.292 17934 12110 1 17 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.377 0.069 17934 12111 1 17 . 1 1 126 126 ASP CB C 126 44.070 44.070 43.843 0.227 17934 12112 1 17 . 1 1 126 126 ASP H H 126 7.417 7.417 7.632 -0.215 17934 12113 1 17 . 1 1 127 127 VAL N N 127 121.923 121.923 124.553 -2.630 17934 12114 1 17 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.671 -0.081 17934 12115 1 17 . 1 1 127 127 VAL C C 127 176.863 176.863 177.195 -0.332 17934 12116 1 17 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.216 -0.586 17934 12117 1 17 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.042 -0.212 17934 12118 1 17 . 1 1 127 127 VAL H H 127 8.508 8.508 8.794 -0.286 17934 12119 1 17 . 1 1 128 128 ASN N N 128 118.851 118.851 118.651 0.200 17934 12120 1 17 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.542 -0.066 17934 12121 1 17 . 1 1 128 128 ASN C C 128 178.251 178.251 177.483 0.768 17934 12122 1 17 . 1 1 128 128 ASN CA C 128 56.258 56.258 55.898 0.360 17934 12123 1 17 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.314 -0.337 17934 12124 1 17 . 1 1 128 128 ASN H H 128 8.207 8.207 8.373 -0.166 17934 12125 1 17 . 1 1 129 129 LEU N N 129 122.549 122.549 121.407 1.142 17934 12126 1 17 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.885 0.325 17934 12127 1 17 . 1 1 129 129 LEU C C 129 178.003 178.003 178.714 -0.711 17934 12128 1 17 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.286 -0.096 17934 12129 1 17 . 1 1 129 129 LEU CB C 129 41.790 41.790 40.487 1.303 17934 12130 1 17 . 1 1 129 129 LEU H H 129 8.223 8.223 7.890 0.333 17934 12131 1 17 . 1 1 130 130 ALA N N 130 120.036 120.036 121.686 -1.650 17934 12132 1 17 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.819 -0.509 17934 12133 1 17 . 1 1 130 130 ALA C C 130 178.172 178.172 179.082 -0.910 17934 12134 1 17 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.440 0.340 17934 12135 1 17 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.159 0.911 17934 12136 1 17 . 1 1 130 130 ALA H H 130 7.360 7.360 8.218 -0.858 17934 12137 1 17 . 1 1 131 131 ALA N N 131 116.989 116.989 119.980 -2.991 17934 12138 1 17 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.808 -0.098 17934 12139 1 17 . 1 1 131 131 ALA C C 131 180.163 180.163 179.768 0.395 17934 12140 1 17 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.848 0.932 17934 12141 1 17 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.046 -0.215 17934 12142 1 17 . 1 1 131 131 ALA H H 131 7.360 7.360 8.080 -0.720 17934 12143 1 17 . 1 1 132 132 GLU N N 132 119.462 119.462 119.706 -0.244 17934 12144 1 17 . 1 1 132 132 GLU HA H 132 3.888 3.888 4.017 -0.129 17934 12145 1 17 . 1 1 132 132 GLU C C 132 179.243 179.243 178.758 0.485 17934 12146 1 17 . 1 1 132 132 GLU CA C 132 59.539 59.539 59.392 0.146 17934 12147 1 17 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.666 -0.128 17934 12148 1 17 . 1 1 132 132 GLU H H 132 7.673 7.673 8.009 -0.336 17934 12149 1 17 . 1 1 133 133 ILE N N 133 123.218 123.218 120.658 2.560 17934 12150 1 17 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.676 -0.896 17934 12151 1 17 . 1 1 133 133 ILE C C 133 177.421 177.421 178.301 -0.880 17934 12152 1 17 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.746 0.744 17934 12153 1 17 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.888 -1.238 17934 12154 1 17 . 1 1 133 133 ILE H H 133 8.154 8.154 8.442 -0.288 17934 12155 1 17 . 1 1 134 134 ILE N N 134 118.244 118.244 118.256 -0.012 17934 12156 1 17 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.476 0.064 17934 12157 1 17 . 1 1 134 134 ILE C C 134 179.385 179.385 178.617 0.768 17934 12158 1 17 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.398 -1.118 17934 12159 1 17 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.570 -0.470 17934 12160 1 17 . 1 1 134 134 ILE H H 134 7.376 7.376 8.096 -0.720 17934 12161 1 17 . 1 1 135 135 LEU N N 135 123.061 123.061 121.199 1.862 17934 12162 1 17 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.900 0.290 17934 12163 1 17 . 1 1 135 135 LEU C C 135 179.858 179.858 178.570 1.288 17934 12164 1 17 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.387 -0.197 17934 12165 1 17 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.795 0.065 17934 12166 1 17 . 1 1 135 135 LEU H H 135 8.036 8.036 8.136 -0.100 17934 12167 1 17 . 1 1 136 136 THR N N 136 119.647 119.647 114.237 5.410 17934 12168 1 17 . 1 1 136 136 THR HA H 136 3.725 3.725 3.975 -0.250 17934 12169 1 17 . 1 1 136 136 THR C C 136 176.088 176.088 176.623 -0.535 17934 12170 1 17 . 1 1 136 136 THR CA C 136 58.601 58.601 66.279 -7.678 17934 12171 1 17 . 1 1 136 136 THR CB C 136 67.976 67.976 69.276 -1.300 17934 12172 1 17 . 1 1 136 136 THR H H 136 8.508 8.508 8.318 0.190 17934 12173 1 17 . 1 1 137 137 LEU N N 137 123.182 123.182 121.876 1.306 17934 12174 1 17 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.951 -0.211 17934 12175 1 17 . 1 1 137 137 LEU C C 137 178.341 178.341 178.545 -0.204 17934 12176 1 17 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.697 -0.437 17934 12177 1 17 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.148 0.402 17934 12178 1 17 . 1 1 137 137 LEU H H 137 8.520 8.520 8.647 -0.127 17934 12179 1 17 . 1 1 138 138 GLY N N 138 105.266 105.266 105.140 0.126 17934 12180 1 17 . 1 1 138 138 GLY C C 138 176.973 176.973 175.852 1.121 17934 12181 1 17 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.037 0.314 17934 12182 1 17 . 1 1 138 138 GLY H H 138 7.858 7.858 7.977 -0.119 17934 12183 1 17 . 1 1 139 139 GLN N N 139 123.485 123.485 123.507 -0.022 17934 12184 1 17 . 1 1 139 139 GLN C C 139 177.891 177.891 178.352 -0.461 17934 12185 1 17 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.622 -0.021 17934 12186 1 17 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.348 -0.215 17934 12187 1 17 . 1 1 139 139 GLN H H 139 8.195 8.195 8.011 0.184 17934 12188 1 17 . 1 1 140 140 ALA N N 140 122.754 122.754 122.899 -0.145 17934 12189 1 17 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.150 -0.441 17934 12190 1 17 . 1 1 140 140 ALA C C 140 178.987 178.987 179.354 -0.367 17934 12191 1 17 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.858 0.923 17934 12192 1 17 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.022 -0.612 17934 12193 1 17 . 1 1 140 140 ALA H H 140 8.530 8.530 8.371 0.159 17934 12194 1 17 . 1 1 141 141 PHE N N 141 116.275 116.275 119.330 -3.055 17934 12195 1 17 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.524 -0.434 17934 12196 1 17 . 1 1 141 141 PHE C C 141 178.129 178.129 177.259 0.870 17934 12197 1 17 . 1 1 141 141 PHE CA C 141 61.240 61.240 59.635 1.605 17934 12198 1 17 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.020 0.363 17934 12199 1 17 . 1 1 141 141 PHE H H 141 7.920 7.920 8.217 -0.297 17934 12200 1 17 . 1 1 142 142 GLU N N 142 119.967 119.967 118.110 1.857 17934 12201 1 17 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.846 0.381 17934 12202 1 17 . 1 1 142 142 GLU C C 142 179.250 179.250 177.832 1.418 17934 12203 1 17 . 1 1 142 142 GLU CA C 142 59.539 59.539 57.874 1.665 17934 12204 1 17 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.829 -0.290 17934 12205 1 17 . 1 1 142 142 GLU H H 142 7.713 7.713 7.945 -0.232 17934 12206 1 17 . 1 1 143 143 VAL N N 143 120.189 120.189 119.447 0.742 17934 12207 1 17 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.782 -0.099 17934 12208 1 17 . 1 1 143 143 VAL C C 143 178.066 178.066 176.552 1.514 17934 12209 1 17 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.012 2.558 17934 12210 1 17 . 1 1 143 143 VAL CB C 143 31.883 31.883 31.691 0.192 17934 12211 1 17 . 1 1 143 143 VAL H H 143 8.608 8.608 7.508 1.100 17934 12212 1 17 . 1 1 144 144 ALA N N 144 121.753 121.753 121.803 -0.050 17934 12213 1 17 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.067 -0.067 17934 12214 1 17 . 1 1 144 144 ALA C C 144 180.776 180.776 176.138 4.638 17934 12215 1 17 . 1 1 144 144 ALA CA C 144 55.780 55.780 52.678 3.102 17934 12216 1 17 . 1 1 144 144 ALA CB C 144 18.770 18.770 19.336 -0.566 17934 12217 1 17 . 1 1 144 144 ALA H H 144 8.399 8.399 7.375 1.024 17934 12218 1 17 . 1 1 145 145 TYR N N 145 119.962 119.962 116.644 3.318 17934 12219 1 17 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.860 -0.670 17934 12220 1 17 . 1 1 145 145 TYR C C 145 177.645 177.645 174.388 3.257 17934 12221 1 17 . 1 1 145 145 TYR CA C 145 60.880 60.880 56.748 4.132 17934 12222 1 17 . 1 1 145 145 TYR CB C 145 37.980 37.980 40.197 -2.217 17934 12223 1 17 . 1 1 145 145 TYR H H 145 8.190 8.190 7.776 0.414 17934 12224 1 18 . 1 1 13 13 LYS N N 13 120.778 120.778 124.522 -3.744 17934 12225 1 18 . 1 1 13 13 LYS C C 13 176.476 176.476 175.460 1.016 17934 12226 1 18 . 1 1 13 13 LYS CA C 13 58.601 58.601 56.114 2.487 17934 12227 1 18 . 1 1 13 13 LYS CB C 13 32.820 32.820 32.962 -0.142 17934 12228 1 18 . 1 1 13 13 LYS H H 13 7.984 7.984 8.469 -0.485 17934 12229 1 18 . 1 1 15 15 ILE HA H 15 3.820 3.820 4.052 -0.232 17934 12230 1 18 . 1 1 15 15 ILE C C 15 176.376 176.376 175.926 0.450 17934 12231 1 18 . 1 1 15 15 ILE CA C 15 63.570 63.570 62.772 0.798 17934 12232 1 18 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.947 1.433 17934 12233 1 18 . 1 1 16 16 ALA N N 16 121.364 121.364 121.074 0.290 17934 12234 1 18 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.432 0.006 17934 12235 1 18 . 1 1 16 16 ALA C C 16 177.494 177.494 177.442 0.052 17934 12236 1 18 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.640 0.336 17934 12237 1 18 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.377 0.957 17934 12238 1 18 . 1 1 16 16 ALA H H 16 8.081 8.081 7.768 0.313 17934 12239 1 18 . 1 1 17 17 GLN N N 17 118.109 118.109 116.005 2.104 17934 12240 1 18 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.438 0.135 17934 12241 1 18 . 1 1 17 17 GLN C C 17 173.632 173.632 174.482 -0.850 17934 12242 1 18 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.075 -0.223 17934 12243 1 18 . 1 1 17 17 GLN CB C 17 30.477 30.477 30.533 -0.056 17934 12244 1 18 . 1 1 17 17 GLN H H 17 7.550 7.550 8.157 -0.607 17934 12245 1 18 . 1 1 18 18 SER N N 18 112.384 112.384 114.344 -1.960 17934 12246 1 18 . 1 1 18 18 SER HA H 18 4.388 4.388 5.092 -0.704 17934 12247 1 18 . 1 1 18 18 SER C C 18 173.780 173.780 172.958 0.822 17934 12248 1 18 . 1 1 18 18 SER CA C 18 57.664 57.664 57.310 0.354 17934 12249 1 18 . 1 1 18 18 SER CB C 18 65.164 65.164 65.344 -0.180 17934 12250 1 18 . 1 1 18 18 SER H H 18 7.666 7.666 7.891 -0.225 17934 12251 1 18 . 1 1 19 19 CYS N N 19 120.116 120.116 123.629 -3.513 17934 12252 1 18 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.483 -0.153 17934 12253 1 18 . 1 1 19 19 CYS C C 19 180.387 180.387 173.951 6.436 17934 12254 1 18 . 1 1 19 19 CYS CA C 19 58.601 58.601 58.385 0.216 17934 12255 1 18 . 1 1 19 19 CYS CB C 19 30.008 30.008 28.292 1.716 17934 12256 1 18 . 1 1 19 19 CYS H H 19 8.835 8.835 8.673 0.162 17934 12257 1 18 . 1 1 20 20 ASP N N 20 124.416 124.416 124.620 -0.204 17934 12258 1 18 . 1 1 20 20 ASP CA C 20 52.976 52.976 52.777 0.199 17934 12259 1 18 . 1 1 20 20 ASP CB C 20 42.195 42.195 43.488 -1.293 17934 12260 1 18 . 1 1 20 20 ASP H H 20 7.847 7.847 8.435 -0.588 17934 12261 1 18 . 1 1 21 21 TYR N N 21 121.296 121.296 124.038 -2.742 17934 12262 1 18 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.818 -0.088 17934 12263 1 18 . 1 1 21 21 TYR C C 21 175.793 175.793 174.144 1.649 17934 12264 1 18 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.512 0.688 17934 12265 1 18 . 1 1 21 21 TYR CB C 21 43.240 43.240 43.145 0.095 17934 12266 1 18 . 1 1 21 21 TYR H H 21 9.070 9.070 8.836 0.234 17934 12267 1 18 . 1 1 22 22 LYS N N 22 122.820 122.820 121.813 1.007 17934 12268 1 18 . 1 1 22 22 LYS HA H 22 5.192 5.192 4.979 0.213 17934 12269 1 18 . 1 1 22 22 LYS C C 22 175.793 175.793 175.247 0.546 17934 12270 1 18 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.782 0.475 17934 12271 1 18 . 1 1 22 22 LYS CB C 22 33.758 33.758 33.152 0.606 17934 12272 1 18 . 1 1 22 22 LYS H H 22 8.711 8.711 8.741 -0.030 17934 12273 1 18 . 1 1 23 23 ALA N N 23 123.073 123.073 128.052 -4.979 17934 12274 1 18 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.863 -0.133 17934 12275 1 18 . 1 1 23 23 ALA C C 23 174.515 174.515 176.014 -1.499 17934 12276 1 18 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.421 1.149 17934 12277 1 18 . 1 1 23 23 ALA CB C 23 21.628 21.628 21.941 -0.313 17934 12278 1 18 . 1 1 23 23 ALA H H 23 8.727 8.727 8.903 -0.176 17934 12279 1 18 . 1 1 24 24 ALA N N 24 122.486 122.486 128.679 -6.193 17934 12280 1 18 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.547 0.634 17934 12281 1 18 . 1 1 24 24 ALA C C 24 176.835 176.835 176.217 0.618 17934 12282 1 18 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.829 -0.259 17934 12283 1 18 . 1 1 24 24 ALA CB C 24 20.120 20.120 19.865 0.255 17934 12284 1 18 . 1 1 24 24 ALA H H 24 8.675 8.675 9.063 -0.388 17934 12285 1 18 . 1 1 25 25 TYR N N 25 122.698 122.698 125.179 -2.481 17934 12286 1 18 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.286 0.724 17934 12287 1 18 . 1 1 25 25 TYR CA C 25 54.340 54.340 57.194 -2.854 17934 12288 1 18 . 1 1 25 25 TYR CB C 25 39.850 39.850 37.605 2.245 17934 12289 1 18 . 1 1 25 25 TYR H H 25 8.270 8.270 8.487 -0.217 17934 12290 1 18 . 1 1 26 26 LEU N N 26 127.997 127.997 129.190 -1.193 17934 12291 1 18 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.227 -0.307 17934 12292 1 18 . 1 1 26 26 LEU C C 26 175.983 175.983 177.007 -1.024 17934 12293 1 18 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.441 0.285 17934 12294 1 18 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.334 -2.264 17934 12295 1 18 . 1 1 26 26 LEU H H 26 8.700 8.700 8.291 0.409 17934 12296 1 18 . 1 1 27 27 GLY N N 27 102.901 102.901 101.746 1.155 17934 12297 1 18 . 1 1 27 27 GLY C C 27 176.219 176.219 171.562 4.657 17934 12298 1 18 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.031 -1.430 17934 12299 1 18 . 1 1 27 27 GLY H H 27 5.891 5.891 8.219 -2.328 17934 12300 1 18 . 1 1 28 28 SER N N 28 111.551 111.551 115.583 -4.032 17934 12301 1 18 . 1 1 28 28 SER HA H 28 5.785 5.785 5.372 0.413 17934 12302 1 18 . 1 1 28 28 SER CA C 28 56.258 56.258 57.858 -1.600 17934 12303 1 18 . 1 1 28 28 SER CB C 28 65.632 65.632 65.089 0.543 17934 12304 1 18 . 1 1 28 28 SER H H 28 7.981 7.981 8.547 -0.566 17934 12305 1 18 . 1 1 29 29 MET N N 29 119.493 119.493 122.907 -3.414 17934 12306 1 18 . 1 1 29 29 MET HA H 29 4.725 4.725 4.774 -0.049 17934 12307 1 18 . 1 1 29 29 MET C C 29 174.143 174.143 174.005 0.138 17934 12308 1 18 . 1 1 29 29 MET CA C 29 54.036 54.036 54.152 -0.116 17934 12309 1 18 . 1 1 29 29 MET CB C 29 37.268 37.268 36.258 1.010 17934 12310 1 18 . 1 1 29 29 MET H H 29 8.704 8.704 8.868 -0.164 17934 12311 1 18 . 1 1 30 30 LEU N N 30 128.150 128.150 123.006 5.144 17934 12312 1 18 . 1 1 30 30 LEU HA H 30 3.785 3.785 3.789 -0.004 17934 12313 1 18 . 1 1 30 30 LEU C C 30 175.857 175.857 175.061 0.796 17934 12314 1 18 . 1 1 30 30 LEU CA C 30 56.250 56.250 53.979 2.271 17934 12315 1 18 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.578 1.082 17934 12316 1 18 . 1 1 30 30 LEU H H 30 8.630 8.630 8.295 0.335 17934 12317 1 18 . 1 1 31 31 ILE N N 31 127.723 127.723 128.927 -1.204 17934 12318 1 18 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.073 0.117 17934 12319 1 18 . 1 1 31 31 ILE C C 31 174.881 174.881 175.068 -0.187 17934 12320 1 18 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.913 -2.253 17934 12321 1 18 . 1 1 31 31 ILE CB C 31 37.110 37.110 39.111 -2.001 17934 12322 1 18 . 1 1 31 31 ILE H H 31 8.560 8.560 8.420 0.140 17934 12323 1 18 . 1 1 32 32 LYS HA H 32 4.055 4.055 3.749 0.306 17934 12324 1 18 . 1 1 32 32 LYS C C 32 176.272 176.272 176.954 -0.682 17934 12325 1 18 . 1 1 32 32 LYS CA C 32 58.601 58.601 58.621 -0.020 17934 12326 1 18 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.822 -0.002 17934 12327 1 18 . 1 1 33 33 GLU N N 33 118.638 118.638 120.276 -1.638 17934 12328 1 18 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.309 0.079 17934 12329 1 18 . 1 1 33 33 GLU C C 33 173.962 173.962 175.404 -1.442 17934 12330 1 18 . 1 1 33 33 GLU CA C 33 54.851 54.851 55.354 -0.503 17934 12331 1 18 . 1 1 33 33 GLU CB C 33 30.945 30.945 29.209 1.736 17934 12332 1 18 . 1 1 33 33 GLU H H 33 7.723 7.723 8.173 -0.450 17934 12333 1 18 . 1 1 34 34 LEU N N 34 126.535 126.535 126.093 0.442 17934 12334 1 18 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.275 -0.330 17934 12335 1 18 . 1 1 34 34 LEU C C 34 176.870 176.870 176.331 0.539 17934 12336 1 18 . 1 1 34 34 LEU CA C 34 54.850 54.850 55.237 -0.387 17934 12337 1 18 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.237 -0.517 17934 12338 1 18 . 1 1 34 34 LEU H H 34 8.446 8.446 8.139 0.307 17934 12339 1 18 . 1 1 35 35 ARG N N 35 128.447 128.447 125.039 3.408 17934 12340 1 18 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.548 0.007 17934 12341 1 18 . 1 1 35 35 ARG C C 35 176.110 176.110 176.126 -0.016 17934 12342 1 18 . 1 1 35 35 ARG CA C 35 54.851 54.851 54.675 0.176 17934 12343 1 18 . 1 1 35 35 ARG CB C 35 30.477 30.477 31.071 -0.594 17934 12344 1 18 . 1 1 35 35 ARG H H 35 8.680 8.680 8.541 0.139 17934 12345 1 18 . 1 1 36 36 GLY N N 36 107.406 107.406 113.756 -6.350 17934 12346 1 18 . 1 1 36 36 GLY CA C 36 45.906 45.906 45.739 0.167 17934 12347 1 18 . 1 1 36 36 GLY H H 36 7.182 7.182 8.746 -1.564 17934 12348 1 18 . 1 1 37 37 THR HA H 37 4.060 4.060 4.169 -0.109 17934 12349 1 18 . 1 1 37 37 THR C C 37 176.634 176.634 176.132 0.502 17934 12350 1 18 . 1 1 37 37 THR CA C 37 65.632 65.632 63.838 1.794 17934 12351 1 18 . 1 1 37 37 THR CB C 37 68.445 68.445 68.782 -0.337 17934 12352 1 18 . 1 1 38 38 GLU N N 38 122.251 122.251 122.017 0.234 17934 12353 1 18 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.922 0.204 17934 12354 1 18 . 1 1 38 38 GLU C C 38 179.981 179.981 178.371 1.610 17934 12355 1 18 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.692 0.316 17934 12356 1 18 . 1 1 38 38 GLU CB C 38 29.539 29.539 29.333 0.206 17934 12357 1 18 . 1 1 38 38 GLU H H 38 8.450 8.450 8.410 0.040 17934 12358 1 18 . 1 1 39 39 SER N N 39 115.966 115.966 112.889 3.077 17934 12359 1 18 . 1 1 39 39 SER C C 39 175.991 175.991 176.296 -0.305 17934 12360 1 18 . 1 1 39 39 SER CA C 39 62.820 62.820 61.961 0.859 17934 12361 1 18 . 1 1 39 39 SER H H 39 7.522 7.522 7.687 -0.165 17934 12362 1 18 . 1 1 40 40 THR HA H 40 4.049 4.049 3.877 0.172 17934 12363 1 18 . 1 1 40 40 THR C C 40 175.972 175.972 176.788 -0.816 17934 12364 1 18 . 1 1 40 40 THR CA C 40 66.101 66.101 65.825 0.276 17934 12365 1 18 . 1 1 40 40 THR CB C 40 67.976 67.976 68.182 -0.206 17934 12366 1 18 . 1 1 41 41 GLN N N 41 120.354 120.354 117.863 2.491 17934 12367 1 18 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.164 -0.405 17934 12368 1 18 . 1 1 41 41 GLN C C 41 178.483 178.483 178.159 0.324 17934 12369 1 18 . 1 1 41 41 GLN CA C 41 60.476 60.476 57.907 2.568 17934 12370 1 18 . 1 1 41 41 GLN CB C 41 28.133 28.133 27.726 0.407 17934 12371 1 18 . 1 1 41 41 GLN H H 41 8.271 8.271 8.407 -0.136 17934 12372 1 18 . 1 1 42 42 ASP N N 42 120.757 120.757 121.905 -1.148 17934 12373 1 18 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.459 -0.100 17934 12374 1 18 . 1 1 42 42 ASP C C 42 177.480 177.480 177.870 -0.390 17934 12375 1 18 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.015 0.649 17934 12376 1 18 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.866 1.329 17934 12377 1 18 . 1 1 42 42 ASP H H 42 7.954 7.954 8.156 -0.202 17934 12378 1 18 . 1 1 43 43 ALA N N 43 120.587 120.587 122.351 -1.764 17934 12379 1 18 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.210 -0.220 17934 12380 1 18 . 1 1 43 43 ALA C C 43 179.767 179.767 179.598 0.169 17934 12381 1 18 . 1 1 43 43 ALA CA C 43 55.320 55.320 55.161 0.159 17934 12382 1 18 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.366 0.864 17934 12383 1 18 . 1 1 43 43 ALA H H 43 7.842 7.842 8.307 -0.465 17934 12384 1 18 . 1 1 44 44 CYS N N 44 115.428 115.428 117.482 -2.054 17934 12385 1 18 . 1 1 44 44 CYS HA H 44 3.895 3.895 4.030 -0.135 17934 12386 1 18 . 1 1 44 44 CYS C C 44 176.076 176.076 176.386 -0.310 17934 12387 1 18 . 1 1 44 44 CYS CA C 44 64.695 64.695 62.862 1.833 17934 12388 1 18 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.230 0.434 17934 12389 1 18 . 1 1 44 44 CYS H H 44 7.900 7.900 8.458 -0.558 17934 12390 1 18 . 1 1 45 45 ALA N N 45 120.487 120.487 122.893 -2.406 17934 12391 1 18 . 1 1 45 45 ALA HA H 45 4.000 4.000 4.024 -0.024 17934 12392 1 18 . 1 1 45 45 ALA C C 45 173.506 173.506 179.281 -5.775 17934 12393 1 18 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.302 0.018 17934 12394 1 18 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.433 -0.493 17934 12395 1 18 . 1 1 45 45 ALA H H 45 7.250 7.250 8.132 -0.882 17934 12396 1 18 . 1 1 46 46 LYS N N 46 119.267 119.267 118.702 0.565 17934 12397 1 18 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.904 0.043 17934 12398 1 18 . 1 1 46 46 LYS C C 46 179.561 179.561 178.952 0.609 17934 12399 1 18 . 1 1 46 46 LYS H H 46 8.102 8.102 8.114 -0.012 17934 12400 1 18 . 1 1 47 47 MET N N 47 118.009 118.009 118.579 -0.570 17934 12401 1 18 . 1 1 47 47 MET HA H 47 4.214 4.214 4.116 0.098 17934 12402 1 18 . 1 1 47 47 MET C C 47 179.526 179.526 177.960 1.566 17934 12403 1 18 . 1 1 47 47 MET CA C 47 57.195 57.195 58.866 -1.671 17934 12404 1 18 . 1 1 47 47 MET CB C 47 30.945 30.945 32.679 -1.734 17934 12405 1 18 . 1 1 47 47 MET H H 47 8.585 8.585 8.422 0.163 17934 12406 1 18 . 1 1 48 48 ARG N N 48 119.962 119.962 119.869 0.093 17934 12407 1 18 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.993 -0.137 17934 12408 1 18 . 1 1 48 48 ARG C C 48 178.875 178.875 177.752 1.123 17934 12409 1 18 . 1 1 48 48 ARG CA C 48 60.945 60.945 58.749 2.196 17934 12410 1 18 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.508 0.969 17934 12411 1 18 . 1 1 48 48 ARG H H 48 8.190 8.190 8.276 -0.086 17934 12412 1 18 . 1 1 49 49 ALA N N 49 120.640 120.640 120.261 0.379 17934 12413 1 18 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.127 -0.384 17934 12414 1 18 . 1 1 49 49 ALA C C 49 180.169 180.169 178.841 1.328 17934 12415 1 18 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.470 0.381 17934 12416 1 18 . 1 1 49 49 ALA CB C 49 17.821 17.821 19.235 -1.415 17934 12417 1 18 . 1 1 49 49 ALA H H 49 7.671 7.671 8.205 -0.534 17934 12418 1 18 . 1 1 50 50 ASN N N 50 116.063 116.063 118.824 -2.761 17934 12419 1 18 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.465 0.009 17934 12420 1 18 . 1 1 50 50 ASN C C 50 177.084 177.084 177.595 -0.511 17934 12421 1 18 . 1 1 50 50 ASN CA C 50 55.789 55.789 56.073 -0.284 17934 12422 1 18 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.771 0.143 17934 12423 1 18 . 1 1 50 50 ASN H H 50 7.893 7.893 8.435 -0.542 17934 12424 1 18 . 1 1 51 51 CYS N N 51 116.884 116.884 118.195 -1.311 17934 12425 1 18 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.074 0.232 17934 12426 1 18 . 1 1 51 51 CYS C C 51 175.002 175.002 176.001 -0.999 17934 12427 1 18 . 1 1 51 51 CYS CA C 51 61.414 61.414 61.400 0.014 17934 12428 1 18 . 1 1 51 51 CYS CB C 51 27.664 27.664 26.294 1.370 17934 12429 1 18 . 1 1 51 51 CYS H H 51 7.770 7.770 8.355 -0.585 17934 12430 1 18 . 1 1 52 52 GLN N N 52 117.831 117.831 118.867 -1.036 17934 12431 1 18 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.078 0.150 17934 12432 1 18 . 1 1 52 52 GLN CA C 52 56.726 56.726 57.953 -1.226 17934 12433 1 18 . 1 1 52 52 GLN CB C 52 29.070 29.070 28.069 1.002 17934 12434 1 18 . 1 1 52 52 GLN H H 52 7.796 7.796 8.224 -0.428 17934 12435 1 18 . 1 1 53 53 LYS N N 53 118.841 118.841 120.391 -1.550 17934 12436 1 18 . 1 1 53 53 LYS CA C 53 57.195 57.195 58.295 -1.100 17934 12437 1 18 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.776 0.513 17934 12438 1 18 . 1 1 53 53 LYS H H 53 7.686 7.686 8.274 -0.588 17934 12439 1 18 . 1 1 55 55 THR HA H 55 4.304 4.304 4.287 0.017 17934 12440 1 18 . 1 1 55 55 THR CA C 55 63.757 63.757 64.366 -0.609 17934 12441 1 18 . 1 1 55 55 THR CB C 55 68.914 68.914 69.333 -0.419 17934 12442 1 18 . 1 1 56 56 GLU N N 56 120.861 120.861 120.128 0.733 17934 12443 1 18 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.096 0.051 17934 12444 1 18 . 1 1 56 56 GLU C C 56 177.656 177.656 177.897 -0.241 17934 12445 1 18 . 1 1 56 56 GLU CA C 56 58.133 58.133 59.198 -1.065 17934 12446 1 18 . 1 1 56 56 GLU CB C 56 30.008 30.008 28.930 1.078 17934 12447 1 18 . 1 1 56 56 GLU H H 56 8.311 8.311 8.623 -0.312 17934 12448 1 18 . 1 1 57 57 GLN N N 57 118.397 118.397 116.729 1.668 17934 12449 1 18 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.140 0.002 17934 12450 1 18 . 1 1 57 57 GLN C C 57 177.275 177.275 178.039 -0.764 17934 12451 1 18 . 1 1 57 57 GLN CA C 57 57.664 57.664 56.915 0.749 17934 12452 1 18 . 1 1 57 57 GLN CB C 57 29.070 29.070 28.781 0.289 17934 12453 1 18 . 1 1 57 57 GLN H H 57 7.899 7.899 7.557 0.342 17934 12454 1 18 . 1 1 58 58 MET N N 58 118.897 118.897 118.858 0.039 17934 12455 1 18 . 1 1 58 58 MET HA H 58 4.350 4.350 4.149 0.201 17934 12456 1 18 . 1 1 58 58 MET C C 58 177.172 177.172 176.534 0.638 17934 12457 1 18 . 1 1 58 58 MET CA C 58 56.726 56.726 58.431 -1.706 17934 12458 1 18 . 1 1 58 58 MET CB C 58 32.196 32.196 33.281 -1.085 17934 12459 1 18 . 1 1 58 58 MET H H 58 8.036 8.036 7.512 0.524 17934 12460 1 18 . 1 1 59 59 LYS N N 59 119.779 119.779 116.576 3.203 17934 12461 1 18 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.432 -0.201 17934 12462 1 18 . 1 1 59 59 LYS C C 59 176.676 176.676 175.104 1.572 17934 12463 1 18 . 1 1 59 59 LYS CA C 59 57.195 57.195 56.100 1.095 17934 12464 1 18 . 1 1 59 59 LYS CB C 59 32.820 32.820 33.562 -0.742 17934 12465 1 18 . 1 1 59 59 LYS H H 59 7.901 7.901 7.966 -0.065 17934 12466 1 18 . 1 1 60 60 LYS N N 60 119.993 119.993 116.682 3.311 17934 12467 1 18 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.058 0.277 17934 12468 1 18 . 1 1 60 60 LYS C C 60 176.336 176.336 175.265 1.071 17934 12469 1 18 . 1 1 60 60 LYS CA C 60 56.258 56.258 56.818 -0.560 17934 12470 1 18 . 1 1 60 60 LYS CB C 60 32.820 32.820 30.763 2.057 17934 12471 1 18 . 1 1 60 60 LYS H H 60 7.877 7.877 8.638 -0.761 17934 12472 1 18 . 1 1 61 61 VAL N N 61 122.649 122.649 117.817 4.832 17934 12473 1 18 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.544 -0.164 17934 12474 1 18 . 1 1 61 61 VAL C C 61 174.210 174.210 174.757 -0.547 17934 12475 1 18 . 1 1 61 61 VAL CA C 61 60.000 60.000 58.942 1.058 17934 12476 1 18 . 1 1 61 61 VAL CB C 61 32.350 32.350 32.715 -0.365 17934 12477 1 18 . 1 1 61 61 VAL H H 61 7.708 7.708 7.940 -0.232 17934 12478 1 18 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.697 -0.034 17934 12479 1 18 . 1 1 62 62 PRO C C 62 176.656 176.656 176.119 0.537 17934 12480 1 18 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.587 0.233 17934 12481 1 18 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.898 -1.016 17934 12482 1 18 . 1 1 63 63 THR N N 63 117.155 117.155 116.283 0.872 17934 12483 1 18 . 1 1 63 63 THR HA H 63 4.830 4.830 4.580 0.251 17934 12484 1 18 . 1 1 63 63 THR C C 63 174.682 174.682 173.256 1.426 17934 12485 1 18 . 1 1 63 63 THR CA C 63 62.820 62.820 62.342 0.478 17934 12486 1 18 . 1 1 63 63 THR CB C 63 69.382 69.382 70.295 -0.913 17934 12487 1 18 . 1 1 63 63 THR H H 63 8.303 8.303 8.283 0.020 17934 12488 1 18 . 1 1 64 64 ILE N N 64 121.004 121.004 125.034 -4.030 17934 12489 1 18 . 1 1 64 64 ILE CA C 64 58.600 58.600 58.504 0.096 17934 12490 1 18 . 1 1 64 64 ILE CB C 64 42.690 42.690 41.189 1.501 17934 12491 1 18 . 1 1 64 64 ILE H H 64 9.348 9.348 8.894 0.454 17934 12492 1 18 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.640 0.100 17934 12493 1 18 . 1 1 65 65 ILE C C 65 175.378 175.378 175.011 0.367 17934 12494 1 18 . 1 1 65 65 ILE CA C 65 60.080 60.080 60.690 -0.609 17934 12495 1 18 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.869 0.881 17934 12496 1 18 . 1 1 66 66 LEU N N 66 110.343 110.343 129.633 -19.290 17934 12497 1 18 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.836 0.014 17934 12498 1 18 . 1 1 66 66 LEU C C 66 174.982 174.982 175.533 -0.551 17934 12499 1 18 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.346 -0.436 17934 12500 1 18 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.652 1.578 17934 12501 1 18 . 1 1 66 66 LEU H H 66 9.610 9.610 9.261 0.349 17934 12502 1 18 . 1 1 67 67 SER N N 67 120.990 120.990 120.524 0.466 17934 12503 1 18 . 1 1 67 67 SER HA H 67 5.405 5.405 5.491 -0.086 17934 12504 1 18 . 1 1 67 67 SER C C 67 174.405 174.405 173.180 1.225 17934 12505 1 18 . 1 1 67 67 SER CA C 67 57.195 57.195 56.223 0.972 17934 12506 1 18 . 1 1 67 67 SER CB C 67 64.695 64.695 64.624 0.071 17934 12507 1 18 . 1 1 67 67 SER H H 67 9.260 9.260 8.702 0.558 17934 12508 1 18 . 1 1 68 68 VAL N N 68 128.176 128.176 125.744 2.432 17934 12509 1 18 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.406 0.087 17934 12510 1 18 . 1 1 68 68 VAL C C 68 173.891 173.891 173.719 0.172 17934 12511 1 18 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.724 1.626 17934 12512 1 18 . 1 1 68 68 VAL CB C 68 33.750 33.750 35.565 -1.815 17934 12513 1 18 . 1 1 68 68 VAL H H 68 9.225 9.225 8.690 0.535 17934 12514 1 18 . 1 1 69 69 SER N N 69 121.697 121.697 122.318 -0.621 17934 12515 1 18 . 1 1 69 69 SER HA H 69 4.837 4.837 4.955 -0.118 17934 12516 1 18 . 1 1 69 69 SER C C 69 173.188 173.188 174.466 -1.278 17934 12517 1 18 . 1 1 69 69 SER CA C 69 57.195 57.195 57.116 0.079 17934 12518 1 18 . 1 1 69 69 SER CB C 69 67.976 67.976 66.342 1.634 17934 12519 1 18 . 1 1 69 69 SER H H 69 8.869 8.869 8.572 0.297 17934 12520 1 18 . 1 1 70 70 ALA N N 70 118.689 118.689 125.085 -6.396 17934 12521 1 18 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.255 -0.105 17934 12522 1 18 . 1 1 70 70 ALA C C 70 176.714 176.714 177.435 -0.721 17934 12523 1 18 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.037 -0.127 17934 12524 1 18 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.670 -0.070 17934 12525 1 18 . 1 1 70 70 ALA H H 70 8.810 8.810 9.112 -0.302 17934 12526 1 18 . 1 1 71 71 LYS N N 71 112.633 112.633 114.965 -2.332 17934 12527 1 18 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.451 -0.176 17934 12528 1 18 . 1 1 71 71 LYS C C 71 177.033 177.033 176.036 0.997 17934 12529 1 18 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.379 1.816 17934 12530 1 18 . 1 1 71 71 LYS CB C 71 33.289 33.289 33.119 0.170 17934 12531 1 18 . 1 1 71 71 LYS H H 71 7.830 7.830 8.212 -0.382 17934 12532 1 18 . 1 1 72 72 GLY N N 72 108.432 108.432 106.333 2.099 17934 12533 1 18 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.192 0.284 17934 12534 1 18 . 1 1 72 72 GLY H H 72 7.685 7.685 7.660 0.025 17934 12535 1 18 . 1 1 73 73 VAL N N 73 120.414 120.414 119.400 1.014 17934 12536 1 18 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.687 0.313 17934 12537 1 18 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.676 0.794 17934 12538 1 18 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.055 0.575 17934 12539 1 18 . 1 1 73 73 VAL H H 73 8.620 8.620 8.376 0.244 17934 12540 1 18 . 1 1 74 74 LYS N N 74 125.257 125.257 126.454 -1.197 17934 12541 1 18 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.339 0.677 17934 12542 1 18 . 1 1 74 74 LYS CA C 74 54.383 54.383 54.307 0.076 17934 12543 1 18 . 1 1 74 74 LYS CB C 74 36.570 36.570 35.317 1.253 17934 12544 1 18 . 1 1 74 74 LYS H H 74 8.783 8.783 8.326 0.457 17934 12545 1 18 . 1 1 75 75 PHE N N 75 119.414 119.414 117.588 1.826 17934 12546 1 18 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.437 0.263 17934 12547 1 18 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.344 -2.424 17934 12548 1 18 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.846 -1.236 17934 12549 1 18 . 1 1 75 75 PHE H H 75 8.432 8.432 9.114 -0.682 17934 12550 1 18 . 1 1 76 76 ILE N N 76 121.430 121.430 120.407 1.023 17934 12551 1 18 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.508 0.332 17934 12552 1 18 . 1 1 76 76 ILE C C 76 175.249 175.249 173.979 1.270 17934 12553 1 18 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.771 -0.701 17934 12554 1 18 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.915 -0.695 17934 12555 1 18 . 1 1 76 76 ILE H H 76 8.960 8.960 8.370 0.590 17934 12556 1 18 . 1 1 77 77 ASP N N 77 125.744 125.744 122.757 2.987 17934 12557 1 18 . 1 1 77 77 ASP HA H 77 4.563 4.563 5.012 -0.449 17934 12558 1 18 . 1 1 77 77 ASP C C 77 177.569 177.569 176.117 1.452 17934 12559 1 18 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.090 3.699 17934 12560 1 18 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.010 0.591 17934 12561 1 18 . 1 1 77 77 ASP H H 77 8.750 8.750 8.154 0.596 17934 12562 1 18 . 1 1 78 78 ALA N N 78 128.632 128.632 128.312 0.320 17934 12563 1 18 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.375 -0.405 17934 12564 1 18 . 1 1 78 78 ALA C C 78 178.052 178.052 178.113 -0.061 17934 12565 1 18 . 1 1 78 78 ALA CA C 78 54.830 54.830 53.947 0.883 17934 12566 1 18 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.405 0.388 17934 12567 1 18 . 1 1 78 78 ALA H H 78 8.700 8.700 8.844 -0.144 17934 12568 1 18 . 1 1 79 79 THR N N 79 113.087 113.087 114.531 -1.444 17934 12569 1 18 . 1 1 79 79 THR HA H 79 4.194 4.194 4.206 -0.012 17934 12570 1 18 . 1 1 79 79 THR C C 79 175.587 175.587 175.945 -0.358 17934 12571 1 18 . 1 1 79 79 THR CA C 79 64.695 64.695 65.201 -0.506 17934 12572 1 18 . 1 1 79 79 THR CB C 79 69.382 69.382 69.344 0.038 17934 12573 1 18 . 1 1 79 79 THR H H 79 8.779 8.779 8.344 0.435 17934 12574 1 18 . 1 1 80 80 ASN N N 80 118.434 118.434 116.159 2.275 17934 12575 1 18 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.857 -0.120 17934 12576 1 18 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.446 0.999 17934 12577 1 18 . 1 1 80 80 ASN CB C 80 39.383 39.383 39.702 -0.319 17934 12578 1 18 . 1 1 80 80 ASN H H 80 8.584 8.584 8.252 0.332 17934 12579 1 18 . 1 1 81 81 LYS N N 81 112.429 112.429 116.846 -4.417 17934 12580 1 18 . 1 1 81 81 LYS C C 81 174.909 174.909 175.405 -0.496 17934 12581 1 18 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.701 -0.037 17934 12582 1 18 . 1 1 81 81 LYS CB C 81 28.602 28.602 30.372 -1.770 17934 12583 1 18 . 1 1 81 81 LYS H H 81 7.966 7.966 8.406 -0.440 17934 12584 1 18 . 1 1 82 82 ASN N N 82 116.806 116.806 116.080 0.726 17934 12585 1 18 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.678 -0.088 17934 12586 1 18 . 1 1 82 82 ASN C C 82 174.999 174.999 174.096 0.903 17934 12587 1 18 . 1 1 82 82 ASN CA C 82 52.976 52.976 53.418 -0.442 17934 12588 1 18 . 1 1 82 82 ASN CB C 82 38.445 38.445 40.031 -1.586 17934 12589 1 18 . 1 1 82 82 ASN H H 82 8.455 8.455 8.153 0.302 17934 12590 1 18 . 1 1 83 83 ILE N N 83 122.447 122.447 118.255 4.192 17934 12591 1 18 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.500 -0.470 17934 12592 1 18 . 1 1 83 83 ILE C C 83 176.572 176.572 175.546 1.026 17934 12593 1 18 . 1 1 83 83 ILE CA C 83 62.350 62.350 60.007 2.343 17934 12594 1 18 . 1 1 83 83 ILE CB C 83 37.970 37.970 37.835 0.135 17934 12595 1 18 . 1 1 83 83 ILE H H 83 8.650 8.650 8.479 0.171 17934 12596 1 18 . 1 1 84 84 ILE N N 84 129.339 129.339 125.510 3.829 17934 12597 1 18 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.304 -0.384 17934 12598 1 18 . 1 1 84 84 ILE C C 84 175.873 175.873 176.025 -0.152 17934 12599 1 18 . 1 1 84 84 ILE CA C 84 62.810 62.810 61.272 1.538 17934 12600 1 18 . 1 1 84 84 ILE CB C 84 38.840 38.840 38.112 0.728 17934 12601 1 18 . 1 1 84 84 ILE H H 84 8.930 8.930 8.306 0.624 17934 12602 1 18 . 1 1 85 85 ALA N N 85 118.867 118.867 119.327 -0.460 17934 12603 1 18 . 1 1 85 85 ALA C C 85 174.100 174.100 174.805 -0.705 17934 12604 1 18 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.309 -0.739 17934 12605 1 18 . 1 1 85 85 ALA H H 85 7.048 7.048 8.243 -1.195 17934 12606 1 18 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.815 0.339 17934 12607 1 18 . 1 1 87 87 HIS C C 87 174.986 174.986 174.326 0.660 17934 12608 1 18 . 1 1 87 87 HIS CB C 87 34.350 34.350 33.356 0.994 17934 12609 1 18 . 1 1 88 88 GLU N N 88 125.372 125.372 121.440 3.932 17934 12610 1 18 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.232 0.289 17934 12611 1 18 . 1 1 88 88 GLU C C 88 179.047 179.047 178.827 0.220 17934 12612 1 18 . 1 1 88 88 GLU CA C 88 56.726 56.726 57.165 -0.439 17934 12613 1 18 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.143 0.334 17934 12614 1 18 . 1 1 88 88 GLU H H 88 9.106 9.106 8.794 0.312 17934 12615 1 18 . 1 1 89 89 ILE N N 89 124.132 124.132 122.217 1.915 17934 12616 1 18 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.918 0.101 17934 12617 1 18 . 1 1 89 89 ILE C C 89 176.095 176.095 177.599 -1.504 17934 12618 1 18 . 1 1 89 89 ILE CA C 89 62.351 62.351 64.856 -2.505 17934 12619 1 18 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.293 0.621 17934 12620 1 18 . 1 1 89 89 ILE H H 89 8.055 8.055 8.643 -0.588 17934 12621 1 18 . 1 1 90 90 ARG N N 90 116.949 116.949 118.765 -1.816 17934 12622 1 18 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.230 0.108 17934 12623 1 18 . 1 1 90 90 ARG C C 90 176.578 176.578 176.676 -0.098 17934 12624 1 18 . 1 1 90 90 ARG CA C 90 57.664 57.664 58.222 -0.558 17934 12625 1 18 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.535 -0.465 17934 12626 1 18 . 1 1 90 90 ARG H H 90 8.045 8.045 8.626 -0.581 17934 12627 1 18 . 1 1 91 91 ASN N N 91 116.320 116.320 116.407 -0.087 17934 12628 1 18 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.594 0.559 17934 12629 1 18 . 1 1 91 91 ASN C C 91 174.595 174.595 175.756 -1.161 17934 12630 1 18 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.736 -2.228 17934 12631 1 18 . 1 1 91 91 ASN CB C 91 39.852 39.852 38.725 1.127 17934 12632 1 18 . 1 1 91 91 ASN H H 91 8.067 8.067 7.968 0.099 17934 12633 1 18 . 1 1 92 92 ILE N N 92 122.441 122.441 121.017 1.424 17934 12634 1 18 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.798 1.275 17934 12635 1 18 . 1 1 92 92 ILE C C 92 175.229 175.229 174.937 0.292 17934 12636 1 18 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.485 -0.605 17934 12637 1 18 . 1 1 92 92 ILE CB C 92 39.850 39.850 36.658 3.192 17934 12638 1 18 . 1 1 92 92 ILE H H 92 7.483 7.483 7.756 -0.273 17934 12639 1 18 . 1 1 93 93 SER N N 93 120.329 120.329 121.955 -1.626 17934 12640 1 18 . 1 1 93 93 SER HA H 93 4.684 4.684 4.285 0.399 17934 12641 1 18 . 1 1 93 93 SER C C 93 180.744 180.744 174.032 6.712 17934 12642 1 18 . 1 1 93 93 SER CA C 93 57.664 57.664 59.780 -2.116 17934 12643 1 18 . 1 1 93 93 SER CB C 93 66.570 66.570 64.528 2.042 17934 12644 1 18 . 1 1 93 93 SER H H 93 9.545 9.545 8.330 1.215 17934 12645 1 18 . 1 1 94 94 CYS N N 94 110.900 110.900 117.673 -6.773 17934 12646 1 18 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.788 -0.976 17934 12647 1 18 . 1 1 94 94 CYS C C 94 173.973 173.973 172.390 1.583 17934 12648 1 18 . 1 1 94 94 CYS CA C 94 59.539 59.539 58.553 0.986 17934 12649 1 18 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.083 -3.825 17934 12650 1 18 . 1 1 94 94 CYS H H 94 8.858 8.858 7.886 0.972 17934 12651 1 18 . 1 1 95 95 ALA N N 95 121.379 121.379 123.984 -2.605 17934 12652 1 18 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.618 -0.188 17934 12653 1 18 . 1 1 95 95 ALA C C 95 178.098 178.098 174.913 3.185 17934 12654 1 18 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.943 0.707 17934 12655 1 18 . 1 1 95 95 ALA CB C 95 19.300 19.300 22.017 -2.717 17934 12656 1 18 . 1 1 95 95 ALA H H 95 8.360 8.360 8.387 -0.027 17934 12657 1 18 . 1 1 96 96 ALA N N 96 122.576 122.576 125.120 -2.544 17934 12658 1 18 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.820 -0.140 17934 12659 1 18 . 1 1 96 96 ALA C C 96 175.716 175.716 174.806 0.910 17934 12660 1 18 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.476 0.964 17934 12661 1 18 . 1 1 96 96 ALA CB C 96 22.700 22.700 22.334 0.366 17934 12662 1 18 . 1 1 96 96 ALA H H 96 9.080 9.080 9.017 0.063 17934 12663 1 18 . 1 1 97 97 GLN N N 97 116.903 116.903 119.454 -2.551 17934 12664 1 18 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.608 0.322 17934 12665 1 18 . 1 1 97 97 GLN C C 97 175.270 175.270 174.019 1.251 17934 12666 1 18 . 1 1 97 97 GLN CA C 97 54.851 54.851 54.219 0.632 17934 12667 1 18 . 1 1 97 97 GLN CB C 97 33.758 33.758 32.075 1.683 17934 12668 1 18 . 1 1 97 97 GLN H H 97 8.369 8.369 8.354 0.015 17934 12669 1 18 . 1 1 98 98 ASP N N 98 124.971 124.971 121.708 3.263 17934 12670 1 18 . 1 1 98 98 ASP C C 98 175.217 175.217 175.622 -0.405 17934 12671 1 18 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.884 -0.845 17934 12672 1 18 . 1 1 98 98 ASP CB C 98 42.195 42.195 43.361 -1.166 17934 12673 1 18 . 1 1 98 98 ASP H H 98 8.395 8.395 8.495 -0.100 17934 12674 1 18 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.372 -0.138 17934 12675 1 18 . 1 1 99 99 PRO C C 99 178.433 178.433 177.788 0.645 17934 12676 1 18 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.772 -0.077 17934 12677 1 18 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.096 0.256 17934 12678 1 18 . 1 1 100 100 GLU N N 100 116.223 116.223 119.038 -2.815 17934 12679 1 18 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.124 0.096 17934 12680 1 18 . 1 1 100 100 GLU C C 100 176.678 176.678 175.711 0.967 17934 12681 1 18 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.035 -1.309 17934 12682 1 18 . 1 1 100 100 GLU CB C 100 30.945 30.945 29.163 1.782 17934 12683 1 18 . 1 1 100 100 GLU H H 100 8.643 8.643 8.873 -0.230 17934 12684 1 18 . 1 1 101 101 ASP N N 101 119.053 119.053 118.479 0.574 17934 12685 1 18 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.824 -0.281 17934 12686 1 18 . 1 1 101 101 ASP C C 101 174.771 174.771 176.495 -1.724 17934 12687 1 18 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.074 0.840 17934 12688 1 18 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.543 0.246 17934 12689 1 18 . 1 1 101 101 ASP H H 101 7.597 7.597 8.179 -0.582 17934 12690 1 18 . 1 1 102 102 LEU N N 102 123.986 123.986 122.699 1.287 17934 12691 1 18 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.318 0.072 17934 12692 1 18 . 1 1 102 102 LEU C C 102 177.141 177.141 177.599 -0.458 17934 12693 1 18 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.007 0.653 17934 12694 1 18 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.881 0.779 17934 12695 1 18 . 1 1 102 102 LEU H H 102 8.534 8.534 7.554 0.980 17934 12696 1 18 . 1 1 103 103 SER N N 103 112.339 112.339 112.598 -0.259 17934 12697 1 18 . 1 1 103 103 SER HA H 103 4.290 4.290 4.351 -0.061 17934 12698 1 18 . 1 1 103 103 SER C C 103 174.106 174.106 174.639 -0.533 17934 12699 1 18 . 1 1 103 103 SER CA C 103 60.945 60.945 60.756 0.189 17934 12700 1 18 . 1 1 103 103 SER CB C 103 63.757 63.757 63.147 0.610 17934 12701 1 18 . 1 1 103 103 SER H H 103 7.867 7.867 8.413 -0.546 17934 12702 1 18 . 1 1 104 104 THR N N 104 123.070 123.070 115.635 7.435 17934 12703 1 18 . 1 1 104 104 THR HA H 104 5.373 5.373 4.695 0.678 17934 12704 1 18 . 1 1 104 104 THR C C 104 180.693 180.693 172.798 7.895 17934 12705 1 18 . 1 1 104 104 THR CA C 104 63.289 63.289 62.533 0.756 17934 12706 1 18 . 1 1 104 104 THR CB C 104 69.382 69.382 71.032 -1.650 17934 12707 1 18 . 1 1 104 104 THR H H 104 8.830 8.830 8.005 0.825 17934 12708 1 18 . 1 1 105 105 PHE N N 105 122.582 122.582 119.082 3.500 17934 12709 1 18 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.848 0.622 17934 12710 1 18 . 1 1 105 105 PHE C C 105 179.211 179.211 172.163 7.048 17934 12711 1 18 . 1 1 105 105 PHE CA C 105 55.320 55.320 56.585 -1.265 17934 12712 1 18 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.667 0.123 17934 12713 1 18 . 1 1 105 105 PHE H H 105 9.170 9.170 8.708 0.462 17934 12714 1 18 . 1 1 106 106 ALA N N 106 119.567 119.567 122.471 -2.904 17934 12715 1 18 . 1 1 106 106 ALA C C 106 175.603 175.603 175.079 0.524 17934 12716 1 18 . 1 1 106 106 ALA H H 106 8.770 8.770 8.731 0.039 17934 12717 1 18 . 1 1 107 107 TYR N N 107 109.933 109.933 119.119 -9.186 17934 12718 1 18 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.399 -0.479 17934 12719 1 18 . 1 1 107 107 TYR C C 107 180.426 180.426 172.823 7.603 17934 12720 1 18 . 1 1 107 107 TYR CA C 107 57.080 57.080 54.747 2.333 17934 12721 1 18 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.526 -0.737 17934 12722 1 18 . 1 1 107 107 TYR H H 107 7.950 7.950 9.298 -1.348 17934 12723 1 18 . 1 1 108 108 ILE N N 108 120.613 120.613 120.173 0.440 17934 12724 1 18 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.295 1.075 17934 12725 1 18 . 1 1 108 108 ILE C C 108 176.212 176.212 175.779 0.433 17934 12726 1 18 . 1 1 108 108 ILE CA C 108 59.540 59.540 60.608 -1.068 17934 12727 1 18 . 1 1 108 108 ILE CB C 108 39.380 39.380 40.694 -1.314 17934 12728 1 18 . 1 1 108 108 ILE H H 108 8.869 8.869 8.641 0.228 17934 12729 1 18 . 1 1 109 109 THR N N 109 116.505 116.505 119.315 -2.810 17934 12730 1 18 . 1 1 109 109 THR HA H 109 5.669 5.669 5.023 0.646 17934 12731 1 18 . 1 1 109 109 THR C C 109 173.505 173.505 172.822 0.683 17934 12732 1 18 . 1 1 109 109 THR CA C 109 59.070 59.070 60.750 -1.680 17934 12733 1 18 . 1 1 109 109 THR H H 109 9.489 9.489 8.039 1.450 17934 12734 1 18 . 1 1 110 110 LYS N N 110 122.960 122.960 121.245 1.715 17934 12735 1 18 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.397 0.063 17934 12736 1 18 . 1 1 110 110 LYS C C 110 175.937 175.937 175.547 0.390 17934 12737 1 18 . 1 1 110 110 LYS CA C 110 55.789 55.789 55.673 0.116 17934 12738 1 18 . 1 1 110 110 LYS CB C 110 34.227 34.227 33.039 1.188 17934 12739 1 18 . 1 1 110 110 LYS H H 110 7.831 7.831 8.189 -0.358 17934 12740 1 18 . 1 1 111 111 ASP N N 111 127.409 127.409 123.013 4.396 17934 12741 1 18 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.690 0.091 17934 12742 1 18 . 1 1 111 111 ASP C C 111 176.396 176.396 177.165 -0.769 17934 12743 1 18 . 1 1 111 111 ASP CA C 111 53.914 53.914 52.884 1.030 17934 12744 1 18 . 1 1 111 111 ASP CB C 111 43.133 43.133 42.181 0.952 17934 12745 1 18 . 1 1 111 111 ASP H H 111 8.769 8.769 8.378 0.391 17934 12746 1 18 . 1 1 112 112 LEU N N 112 125.913 125.913 124.006 1.907 17934 12747 1 18 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.172 -0.022 17934 12748 1 18 . 1 1 112 112 LEU C C 112 178.553 178.553 177.953 0.600 17934 12749 1 18 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.403 -0.213 17934 12750 1 18 . 1 1 112 112 LEU CB C 112 41.790 41.790 42.317 -0.527 17934 12751 1 18 . 1 1 112 112 LEU H H 112 8.593 8.593 8.563 0.030 17934 12752 1 18 . 1 1 113 113 LYS N N 113 117.189 117.189 115.863 1.326 17934 12753 1 18 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.152 0.110 17934 12754 1 18 . 1 1 113 113 LYS C C 113 177.180 177.180 176.516 0.664 17934 12755 1 18 . 1 1 113 113 LYS CA C 113 58.133 58.133 56.620 1.513 17934 12756 1 18 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.637 0.183 17934 12757 1 18 . 1 1 113 113 LYS H H 113 8.207 8.207 7.955 0.252 17934 12758 1 18 . 1 1 114 114 SER N N 114 112.492 112.492 110.498 1.994 17934 12759 1 18 . 1 1 114 114 SER CA C 114 58.601 58.601 58.726 -0.125 17934 12760 1 18 . 1 1 114 114 SER CB C 114 65.164 65.164 61.383 3.781 17934 12761 1 18 . 1 1 114 114 SER H H 114 7.755 7.755 7.725 0.030 17934 12762 1 18 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.798 -0.409 17934 12763 1 18 . 1 1 115 115 ASN C C 115 174.203 174.203 174.915 -0.712 17934 12764 1 18 . 1 1 115 115 ASN CA C 115 54.383 54.383 54.243 0.140 17934 12765 1 18 . 1 1 115 115 ASN CB C 115 37.977 37.977 40.140 -2.163 17934 12766 1 18 . 1 1 116 116 HIS N N 116 116.822 116.822 116.539 0.283 17934 12767 1 18 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.565 0.365 17934 12768 1 18 . 1 1 116 116 HIS C C 116 173.898 173.898 173.265 0.633 17934 12769 1 18 . 1 1 116 116 HIS CA C 116 54.910 54.910 55.736 -0.827 17934 12770 1 18 . 1 1 116 116 HIS CB C 116 32.650 32.650 32.541 0.109 17934 12771 1 18 . 1 1 116 116 HIS H H 116 7.690 7.690 7.602 0.088 17934 12772 1 18 . 1 1 117 117 HIS N N 117 118.253 118.253 118.103 0.150 17934 12773 1 18 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.847 0.473 17934 12774 1 18 . 1 1 117 117 HIS C C 117 173.695 173.695 174.459 -0.764 17934 12775 1 18 . 1 1 117 117 HIS CA C 117 56.350 56.350 55.961 0.389 17934 12776 1 18 . 1 1 117 117 HIS CB C 117 32.350 32.350 30.028 2.322 17934 12777 1 18 . 1 1 117 117 HIS H H 117 8.340 8.340 8.658 -0.318 17934 12778 1 18 . 1 1 118 118 TYR N N 118 118.301 118.301 122.883 -4.582 17934 12779 1 18 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.842 0.168 17934 12780 1 18 . 1 1 118 118 TYR C C 118 173.530 173.530 174.637 -1.107 17934 12781 1 18 . 1 1 118 118 TYR CA C 118 56.730 56.730 56.958 -0.228 17934 12782 1 18 . 1 1 118 118 TYR CB C 118 43.240 43.240 40.851 2.389 17934 12783 1 18 . 1 1 118 118 TYR H H 118 9.080 9.080 8.349 0.731 17934 12784 1 18 . 1 1 119 119 CYS N N 119 121.015 121.015 122.296 -1.281 17934 12785 1 18 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.162 0.901 17934 12786 1 18 . 1 1 119 119 CYS C C 119 180.664 180.664 173.495 7.169 17934 12787 1 18 . 1 1 119 119 CYS CA C 119 56.726 56.726 59.127 -2.401 17934 12788 1 18 . 1 1 119 119 CYS CB C 119 29.539 29.539 27.796 1.743 17934 12789 1 18 . 1 1 119 119 CYS H H 119 9.120 9.120 8.778 0.342 17934 12790 1 18 . 1 1 120 120 HIS N N 120 110.134 110.134 125.428 -15.294 17934 12791 1 18 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.454 0.245 17934 12792 1 18 . 1 1 120 120 HIS C C 120 180.776 180.776 172.960 7.816 17934 12793 1 18 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.648 0.672 17934 12794 1 18 . 1 1 120 120 HIS CB C 120 32.352 32.352 29.677 2.675 17934 12795 1 18 . 1 1 120 120 HIS H H 120 8.482 8.482 8.588 -0.106 17934 12796 1 18 . 1 1 121 121 VAL N N 121 120.855 120.855 123.219 -2.364 17934 12797 1 18 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.076 0.274 17934 12798 1 18 . 1 1 121 121 VAL C C 121 173.419 173.419 172.848 0.571 17934 12799 1 18 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.249 1.161 17934 12800 1 18 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.322 -0.042 17934 12801 1 18 . 1 1 121 121 VAL H H 121 7.929 7.929 8.383 -0.454 17934 12802 1 18 . 1 1 122 122 PHE N N 122 124.384 124.384 127.487 -3.103 17934 12803 1 18 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.243 0.177 17934 12804 1 18 . 1 1 122 122 PHE C C 122 174.876 174.876 174.444 0.432 17934 12805 1 18 . 1 1 122 122 PHE CA C 122 55.320 55.320 54.077 1.243 17934 12806 1 18 . 1 1 122 122 PHE CB C 122 44.540 44.540 42.507 2.034 17934 12807 1 18 . 1 1 122 122 PHE H H 122 8.910 8.910 8.819 0.091 17934 12808 1 18 . 1 1 123 123 THR N N 123 112.451 112.451 113.564 -1.113 17934 12809 1 18 . 1 1 123 123 THR HA H 123 5.147 5.147 4.562 0.585 17934 12810 1 18 . 1 1 123 123 THR C C 123 174.096 174.096 172.522 1.574 17934 12811 1 18 . 1 1 123 123 THR CA C 123 61.843 61.843 59.667 2.176 17934 12812 1 18 . 1 1 123 123 THR CB C 123 71.218 71.218 71.231 -0.013 17934 12813 1 18 . 1 1 123 123 THR H H 123 8.668 8.668 8.957 -0.289 17934 12814 1 18 . 1 1 124 124 ALA N N 124 128.922 128.922 126.610 2.312 17934 12815 1 18 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.824 -0.104 17934 12816 1 18 . 1 1 124 124 ALA C C 124 177.168 177.168 175.623 1.545 17934 12817 1 18 . 1 1 124 124 ALA CA C 124 50.890 50.890 49.985 0.905 17934 12818 1 18 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.507 -0.407 17934 12819 1 18 . 1 1 124 124 ALA H H 124 9.180 9.180 8.672 0.508 17934 12820 1 18 . 1 1 125 125 PHE N N 125 115.427 115.427 116.239 -0.812 17934 12821 1 18 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.463 -0.173 17934 12822 1 18 . 1 1 125 125 PHE C C 125 174.703 174.703 175.632 -0.929 17934 12823 1 18 . 1 1 125 125 PHE CA C 125 60.470 60.470 59.694 0.776 17934 12824 1 18 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.746 -1.686 17934 12825 1 18 . 1 1 125 125 PHE H H 125 8.560 8.560 9.103 -0.543 17934 12826 1 18 . 1 1 126 126 ASP N N 126 115.745 115.745 118.856 -3.111 17934 12827 1 18 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.869 -0.026 17934 12828 1 18 . 1 1 126 126 ASP C C 126 176.532 176.532 175.925 0.607 17934 12829 1 18 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.304 0.141 17934 12830 1 18 . 1 1 126 126 ASP CB C 126 44.070 44.070 44.356 -0.286 17934 12831 1 18 . 1 1 126 126 ASP H H 126 7.417 7.417 7.686 -0.269 17934 12832 1 18 . 1 1 127 127 VAL N N 127 121.923 121.923 124.002 -2.079 17934 12833 1 18 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.840 -0.250 17934 12834 1 18 . 1 1 127 127 VAL C C 127 176.863 176.863 177.254 -0.391 17934 12835 1 18 . 1 1 127 127 VAL CA C 127 65.630 65.630 65.039 0.591 17934 12836 1 18 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.315 -0.485 17934 12837 1 18 . 1 1 127 127 VAL H H 127 8.508 8.508 8.465 0.043 17934 12838 1 18 . 1 1 128 128 ASN N N 128 118.851 118.851 118.198 0.653 17934 12839 1 18 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.585 -0.109 17934 12840 1 18 . 1 1 128 128 ASN C C 128 178.251 178.251 177.607 0.644 17934 12841 1 18 . 1 1 128 128 ASN CA C 128 56.258 56.258 55.813 0.445 17934 12842 1 18 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.297 -0.320 17934 12843 1 18 . 1 1 128 128 ASN H H 128 8.207 8.207 8.562 -0.355 17934 12844 1 18 . 1 1 129 129 LEU N N 129 122.549 122.549 121.982 0.567 17934 12845 1 18 . 1 1 129 129 LEU HA H 129 4.210 4.210 4.314 -0.104 17934 12846 1 18 . 1 1 129 129 LEU C C 129 178.003 178.003 178.394 -0.391 17934 12847 1 18 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.024 0.166 17934 12848 1 18 . 1 1 129 129 LEU CB C 129 41.790 41.790 40.841 0.949 17934 12849 1 18 . 1 1 129 129 LEU H H 129 8.223 8.223 7.853 0.370 17934 12850 1 18 . 1 1 130 130 ALA N N 130 120.036 120.036 122.100 -2.064 17934 12851 1 18 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.772 -0.462 17934 12852 1 18 . 1 1 130 130 ALA C C 130 178.172 178.172 178.939 -0.767 17934 12853 1 18 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.470 0.310 17934 12854 1 18 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.243 0.827 17934 12855 1 18 . 1 1 130 130 ALA H H 130 7.360 7.360 8.382 -1.022 17934 12856 1 18 . 1 1 131 131 ALA N N 131 116.989 116.989 120.142 -3.153 17934 12857 1 18 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.960 -0.250 17934 12858 1 18 . 1 1 131 131 ALA C C 131 180.163 180.163 179.919 0.244 17934 12859 1 18 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.529 1.251 17934 12860 1 18 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.304 -0.474 17934 12861 1 18 . 1 1 131 131 ALA H H 131 7.360 7.360 8.112 -0.752 17934 12862 1 18 . 1 1 132 132 GLU N N 132 119.462 119.462 119.687 -0.225 17934 12863 1 18 . 1 1 132 132 GLU HA H 132 3.888 3.888 3.898 -0.010 17934 12864 1 18 . 1 1 132 132 GLU C C 132 179.243 179.243 178.756 0.487 17934 12865 1 18 . 1 1 132 132 GLU CA C 132 59.539 59.539 59.570 -0.031 17934 12866 1 18 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.484 0.055 17934 12867 1 18 . 1 1 132 132 GLU H H 132 7.673 7.673 7.908 -0.235 17934 12868 1 18 . 1 1 133 133 ILE N N 133 123.218 123.218 120.882 2.336 17934 12869 1 18 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.486 -0.706 17934 12870 1 18 . 1 1 133 133 ILE C C 133 177.421 177.421 178.107 -0.686 17934 12871 1 18 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.456 1.034 17934 12872 1 18 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.540 -0.890 17934 12873 1 18 . 1 1 133 133 ILE H H 133 8.154 8.154 8.084 0.070 17934 12874 1 18 . 1 1 134 134 ILE N N 134 118.244 118.244 118.515 -0.271 17934 12875 1 18 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.428 0.112 17934 12876 1 18 . 1 1 134 134 ILE C C 134 179.385 179.385 178.078 1.307 17934 12877 1 18 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.652 -1.372 17934 12878 1 18 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.683 -0.583 17934 12879 1 18 . 1 1 134 134 ILE H H 134 7.376 7.376 7.702 -0.326 17934 12880 1 18 . 1 1 135 135 LEU N N 135 123.061 123.061 119.784 3.277 17934 12881 1 18 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.881 0.309 17934 12882 1 18 . 1 1 135 135 LEU C C 135 179.858 179.858 179.221 0.637 17934 12883 1 18 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.483 -0.292 17934 12884 1 18 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.910 -0.050 17934 12885 1 18 . 1 1 135 135 LEU H H 135 8.036 8.036 8.117 -0.081 17934 12886 1 18 . 1 1 136 136 THR N N 136 119.647 119.647 114.982 4.665 17934 12887 1 18 . 1 1 136 136 THR HA H 136 3.725 3.725 4.055 -0.330 17934 12888 1 18 . 1 1 136 136 THR C C 136 176.088 176.088 176.541 -0.453 17934 12889 1 18 . 1 1 136 136 THR CA C 136 58.601 58.601 66.325 -7.724 17934 12890 1 18 . 1 1 136 136 THR CB C 136 67.976 67.976 68.671 -0.695 17934 12891 1 18 . 1 1 136 136 THR H H 136 8.508 8.508 8.422 0.086 17934 12892 1 18 . 1 1 137 137 LEU N N 137 123.182 123.182 121.689 1.493 17934 12893 1 18 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.918 -0.178 17934 12894 1 18 . 1 1 137 137 LEU C C 137 178.341 178.341 178.410 -0.069 17934 12895 1 18 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.211 0.049 17934 12896 1 18 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.542 0.008 17934 12897 1 18 . 1 1 137 137 LEU H H 137 8.520 8.520 8.727 -0.207 17934 12898 1 18 . 1 1 138 138 GLY N N 138 105.266 105.266 104.969 0.297 17934 12899 1 18 . 1 1 138 138 GLY C C 138 176.973 176.973 175.670 1.303 17934 12900 1 18 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.005 0.346 17934 12901 1 18 . 1 1 138 138 GLY H H 138 7.858 7.858 7.874 -0.016 17934 12902 1 18 . 1 1 139 139 GLN N N 139 123.485 123.485 123.152 0.333 17934 12903 1 18 . 1 1 139 139 GLN C C 139 177.891 177.891 178.294 -0.403 17934 12904 1 18 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.457 0.144 17934 12905 1 18 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.270 -0.138 17934 12906 1 18 . 1 1 139 139 GLN H H 139 8.195 8.195 8.247 -0.052 17934 12907 1 18 . 1 1 140 140 ALA N N 140 122.754 122.754 122.983 -0.229 17934 12908 1 18 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.160 -0.451 17934 12909 1 18 . 1 1 140 140 ALA C C 140 178.987 178.987 179.190 -0.203 17934 12910 1 18 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.882 0.898 17934 12911 1 18 . 1 1 140 140 ALA CB C 140 17.410 17.410 17.998 -0.588 17934 12912 1 18 . 1 1 140 140 ALA H H 140 8.530 8.530 8.412 0.118 17934 12913 1 18 . 1 1 141 141 PHE N N 141 116.275 116.275 120.657 -4.382 17934 12914 1 18 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.248 -0.158 17934 12915 1 18 . 1 1 141 141 PHE C C 141 178.129 178.129 177.431 0.698 17934 12916 1 18 . 1 1 141 141 PHE CA C 141 61.240 61.240 59.485 1.755 17934 12917 1 18 . 1 1 141 141 PHE CB C 141 39.383 39.383 38.785 0.598 17934 12918 1 18 . 1 1 141 141 PHE H H 141 7.920 7.920 8.331 -0.411 17934 12919 1 18 . 1 1 142 142 GLU N N 142 119.967 119.967 119.246 0.721 17934 12920 1 18 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.690 0.537 17934 12921 1 18 . 1 1 142 142 GLU C C 142 179.250 179.250 179.112 0.138 17934 12922 1 18 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.970 0.569 17934 12923 1 18 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.932 -0.393 17934 12924 1 18 . 1 1 142 142 GLU H H 142 7.713 7.713 8.097 -0.384 17934 12925 1 18 . 1 1 143 143 VAL N N 143 120.189 120.189 120.810 -0.621 17934 12926 1 18 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.713 -0.030 17934 12927 1 18 . 1 1 143 143 VAL C C 143 178.066 178.066 177.136 0.930 17934 12928 1 18 . 1 1 143 143 VAL CA C 143 66.570 66.570 65.195 1.375 17934 12929 1 18 . 1 1 143 143 VAL CB C 143 31.883 31.883 31.023 0.860 17934 12930 1 18 . 1 1 143 143 VAL H H 143 8.608 8.608 8.023 0.585 17934 12931 1 18 . 1 1 144 144 ALA N N 144 121.753 121.753 121.575 0.178 17934 12932 1 18 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.160 -0.160 17934 12933 1 18 . 1 1 144 144 ALA C C 144 180.776 180.776 178.005 2.771 17934 12934 1 18 . 1 1 144 144 ALA CA C 144 55.780 55.780 54.236 1.544 17934 12935 1 18 . 1 1 144 144 ALA CB C 144 18.770 18.770 19.233 -0.463 17934 12936 1 18 . 1 1 144 144 ALA H H 144 8.399 8.399 7.581 0.818 17934 12937 1 18 . 1 1 145 145 TYR N N 145 119.962 119.962 118.468 1.494 17934 12938 1 18 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.738 -0.548 17934 12939 1 18 . 1 1 145 145 TYR C C 145 177.645 177.645 174.385 3.260 17934 12940 1 18 . 1 1 145 145 TYR CA C 145 60.880 60.880 56.492 4.388 17934 12941 1 18 . 1 1 145 145 TYR CB C 145 37.980 37.980 40.603 -2.623 17934 12942 1 18 . 1 1 145 145 TYR H H 145 8.190 8.190 8.009 0.181 17934 12943 1 19 . 1 1 13 13 LYS N N 13 120.778 120.778 122.980 -2.202 17934 12944 1 19 . 1 1 13 13 LYS C C 13 176.476 176.476 174.559 1.917 17934 12945 1 19 . 1 1 13 13 LYS CA C 13 58.601 58.601 55.213 3.388 17934 12946 1 19 . 1 1 13 13 LYS CB C 13 32.820 32.820 33.856 -1.036 17934 12947 1 19 . 1 1 13 13 LYS H H 13 7.984 7.984 8.373 -0.389 17934 12948 1 19 . 1 1 15 15 ILE HA H 15 3.820 3.820 4.243 -0.423 17934 12949 1 19 . 1 1 15 15 ILE C C 15 176.376 176.376 175.926 0.450 17934 12950 1 19 . 1 1 15 15 ILE CA C 15 63.570 63.570 62.659 0.911 17934 12951 1 19 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.928 1.452 17934 12952 1 19 . 1 1 16 16 ALA N N 16 121.364 121.364 120.666 0.698 17934 12953 1 19 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.421 0.017 17934 12954 1 19 . 1 1 16 16 ALA C C 16 177.494 177.494 177.397 0.097 17934 12955 1 19 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.550 0.426 17934 12956 1 19 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.547 0.786 17934 12957 1 19 . 1 1 16 16 ALA H H 16 8.081 8.081 7.772 0.309 17934 12958 1 19 . 1 1 17 17 GLN N N 17 118.109 118.109 116.687 1.422 17934 12959 1 19 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.448 0.125 17934 12960 1 19 . 1 1 17 17 GLN C C 17 173.632 173.632 174.601 -0.969 17934 12961 1 19 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.238 -0.387 17934 12962 1 19 . 1 1 17 17 GLN CB C 17 30.477 30.477 29.697 0.780 17934 12963 1 19 . 1 1 17 17 GLN H H 17 7.550 7.550 8.325 -0.775 17934 12964 1 19 . 1 1 18 18 SER N N 18 112.384 112.384 113.882 -1.498 17934 12965 1 19 . 1 1 18 18 SER HA H 18 4.388 4.388 5.071 -0.683 17934 12966 1 19 . 1 1 18 18 SER C C 18 173.780 173.780 172.321 1.459 17934 12967 1 19 . 1 1 18 18 SER CA C 18 57.664 57.664 58.137 -0.473 17934 12968 1 19 . 1 1 18 18 SER CB C 18 65.164 65.164 64.991 0.173 17934 12969 1 19 . 1 1 18 18 SER H H 18 7.666 7.666 8.079 -0.413 17934 12970 1 19 . 1 1 19 19 CYS N N 19 120.116 120.116 123.453 -3.337 17934 12971 1 19 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.505 -0.175 17934 12972 1 19 . 1 1 19 19 CYS C C 19 180.387 180.387 172.971 7.416 17934 12973 1 19 . 1 1 19 19 CYS CA C 19 58.601 58.601 58.735 -0.134 17934 12974 1 19 . 1 1 19 19 CYS CB C 19 30.008 30.008 31.321 -1.313 17934 12975 1 19 . 1 1 19 19 CYS H H 19 8.835 8.835 9.018 -0.183 17934 12976 1 19 . 1 1 20 20 ASP N N 20 124.416 124.416 122.144 2.272 17934 12977 1 19 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.002 -0.026 17934 12978 1 19 . 1 1 20 20 ASP CB C 20 42.195 42.195 44.455 -2.260 17934 12979 1 19 . 1 1 20 20 ASP H H 20 7.847 7.847 8.001 -0.154 17934 12980 1 19 . 1 1 21 21 TYR N N 21 121.296 121.296 119.887 1.409 17934 12981 1 19 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.687 0.043 17934 12982 1 19 . 1 1 21 21 TYR C C 21 175.793 175.793 174.183 1.610 17934 12983 1 19 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.741 0.459 17934 12984 1 19 . 1 1 21 21 TYR CB C 21 43.240 43.240 43.405 -0.165 17934 12985 1 19 . 1 1 21 21 TYR H H 21 9.070 9.070 8.955 0.115 17934 12986 1 19 . 1 1 22 22 LYS N N 22 122.820 122.820 124.041 -1.221 17934 12987 1 19 . 1 1 22 22 LYS HA H 22 5.192 5.192 4.946 0.246 17934 12988 1 19 . 1 1 22 22 LYS C C 22 175.793 175.793 175.383 0.410 17934 12989 1 19 . 1 1 22 22 LYS CA C 22 56.258 56.258 56.161 0.097 17934 12990 1 19 . 1 1 22 22 LYS CB C 22 33.758 33.758 32.752 1.006 17934 12991 1 19 . 1 1 22 22 LYS H H 22 8.711 8.711 8.832 -0.121 17934 12992 1 19 . 1 1 23 23 ALA N N 23 123.073 123.073 127.963 -4.890 17934 12993 1 19 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.508 0.222 17934 12994 1 19 . 1 1 23 23 ALA C C 23 174.515 174.515 175.712 -1.197 17934 12995 1 19 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.326 1.244 17934 12996 1 19 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.569 -0.941 17934 12997 1 19 . 1 1 23 23 ALA H H 23 8.727 8.727 8.830 -0.103 17934 12998 1 19 . 1 1 24 24 ALA N N 24 122.486 122.486 126.328 -3.842 17934 12999 1 19 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.824 0.357 17934 13000 1 19 . 1 1 24 24 ALA C C 24 176.835 176.835 176.115 0.720 17934 13001 1 19 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.173 0.397 17934 13002 1 19 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.073 0.047 17934 13003 1 19 . 1 1 24 24 ALA H H 24 8.675 8.675 8.646 0.029 17934 13004 1 19 . 1 1 25 25 TYR N N 25 122.698 122.698 124.337 -1.639 17934 13005 1 19 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.410 0.600 17934 13006 1 19 . 1 1 25 25 TYR CA C 25 54.340 54.340 58.494 -4.154 17934 13007 1 19 . 1 1 25 25 TYR CB C 25 39.850 39.850 39.308 0.542 17934 13008 1 19 . 1 1 25 25 TYR H H 25 8.270 8.270 8.496 -0.226 17934 13009 1 19 . 1 1 26 26 LEU N N 26 127.997 127.997 128.322 -0.325 17934 13010 1 19 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.429 -0.509 17934 13011 1 19 . 1 1 26 26 LEU C C 26 175.983 175.983 176.919 -0.936 17934 13012 1 19 . 1 1 26 26 LEU CA C 26 56.726 56.726 55.362 1.364 17934 13013 1 19 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.358 -2.288 17934 13014 1 19 . 1 1 26 26 LEU H H 26 8.700 8.700 8.692 0.008 17934 13015 1 19 . 1 1 27 27 GLY N N 27 102.901 102.901 103.255 -0.354 17934 13016 1 19 . 1 1 27 27 GLY C C 27 176.219 176.219 171.525 4.694 17934 13017 1 19 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.035 -1.435 17934 13018 1 19 . 1 1 27 27 GLY H H 27 5.891 5.891 8.042 -2.151 17934 13019 1 19 . 1 1 28 28 SER N N 28 111.551 111.551 115.260 -3.709 17934 13020 1 19 . 1 1 28 28 SER HA H 28 5.785 5.785 5.507 0.278 17934 13021 1 19 . 1 1 28 28 SER CA C 28 56.258 56.258 56.671 -0.413 17934 13022 1 19 . 1 1 28 28 SER CB C 28 65.632 65.632 64.987 0.645 17934 13023 1 19 . 1 1 28 28 SER H H 28 7.981 7.981 8.400 -0.419 17934 13024 1 19 . 1 1 29 29 MET N N 29 119.493 119.493 123.116 -3.623 17934 13025 1 19 . 1 1 29 29 MET HA H 29 4.725 4.725 4.778 -0.053 17934 13026 1 19 . 1 1 29 29 MET C C 29 174.143 174.143 174.092 0.051 17934 13027 1 19 . 1 1 29 29 MET CA C 29 54.036 54.036 54.459 -0.423 17934 13028 1 19 . 1 1 29 29 MET CB C 29 37.268 37.268 37.089 0.179 17934 13029 1 19 . 1 1 29 29 MET H H 29 8.704 8.704 8.401 0.303 17934 13030 1 19 . 1 1 30 30 LEU N N 30 128.150 128.150 118.833 9.317 17934 13031 1 19 . 1 1 30 30 LEU HA H 30 3.785 3.785 5.213 -1.428 17934 13032 1 19 . 1 1 30 30 LEU C C 30 175.857 175.857 176.276 -0.419 17934 13033 1 19 . 1 1 30 30 LEU CA C 30 56.250 56.250 54.206 2.044 17934 13034 1 19 . 1 1 30 30 LEU CB C 30 42.660 42.660 43.597 -0.937 17934 13035 1 19 . 1 1 30 30 LEU H H 30 8.630 8.630 8.309 0.321 17934 13036 1 19 . 1 1 31 31 ILE N N 31 127.723 127.723 122.608 5.115 17934 13037 1 19 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.399 -0.209 17934 13038 1 19 . 1 1 31 31 ILE C C 31 174.881 174.881 175.014 -0.133 17934 13039 1 19 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.814 -2.154 17934 13040 1 19 . 1 1 31 31 ILE CB C 31 37.110 37.110 37.245 -0.135 17934 13041 1 19 . 1 1 31 31 ILE H H 31 8.560 8.560 8.675 -0.115 17934 13042 1 19 . 1 1 32 32 LYS HA H 32 4.055 4.055 4.245 -0.190 17934 13043 1 19 . 1 1 32 32 LYS C C 32 176.272 176.272 176.138 0.134 17934 13044 1 19 . 1 1 32 32 LYS CA C 32 58.601 58.601 56.835 1.766 17934 13045 1 19 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.829 -0.009 17934 13046 1 19 . 1 1 33 33 GLU N N 33 118.638 118.638 115.467 3.171 17934 13047 1 19 . 1 1 33 33 GLU HA H 33 4.388 4.388 3.881 0.507 17934 13048 1 19 . 1 1 33 33 GLU C C 33 173.962 173.962 175.005 -1.043 17934 13049 1 19 . 1 1 33 33 GLU CA C 33 54.851 54.851 56.937 -2.086 17934 13050 1 19 . 1 1 33 33 GLU CB C 33 30.945 30.945 27.882 3.063 17934 13051 1 19 . 1 1 33 33 GLU H H 33 7.723 7.723 8.630 -0.907 17934 13052 1 19 . 1 1 34 34 LEU N N 34 126.535 126.535 120.046 6.489 17934 13053 1 19 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.442 -0.497 17934 13054 1 19 . 1 1 34 34 LEU C C 34 176.870 176.870 176.235 0.635 17934 13055 1 19 . 1 1 34 34 LEU CA C 34 54.850 54.850 54.522 0.328 17934 13056 1 19 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.885 -1.165 17934 13057 1 19 . 1 1 34 34 LEU H H 34 8.446 8.446 7.587 0.859 17934 13058 1 19 . 1 1 35 35 ARG N N 35 128.447 128.447 125.114 3.333 17934 13059 1 19 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.593 -0.038 17934 13060 1 19 . 1 1 35 35 ARG C C 35 176.110 176.110 175.489 0.621 17934 13061 1 19 . 1 1 35 35 ARG CA C 35 54.851 54.851 55.416 -0.565 17934 13062 1 19 . 1 1 35 35 ARG CB C 35 30.477 30.477 30.793 -0.316 17934 13063 1 19 . 1 1 35 35 ARG H H 35 8.680 8.680 8.507 0.173 17934 13064 1 19 . 1 1 36 36 GLY N N 36 107.406 107.406 112.822 -5.416 17934 13065 1 19 . 1 1 36 36 GLY CA C 36 45.906 45.906 44.546 1.360 17934 13066 1 19 . 1 1 36 36 GLY H H 36 7.182 7.182 8.134 -0.952 17934 13067 1 19 . 1 1 37 37 THR HA H 37 4.060 4.060 4.071 -0.011 17934 13068 1 19 . 1 1 37 37 THR C C 37 176.634 176.634 175.394 1.240 17934 13069 1 19 . 1 1 37 37 THR CA C 37 65.632 65.632 63.520 2.112 17934 13070 1 19 . 1 1 37 37 THR CB C 37 68.445 68.445 68.737 -0.293 17934 13071 1 19 . 1 1 38 38 GLU N N 38 122.251 122.251 121.184 1.067 17934 13072 1 19 . 1 1 38 38 GLU HA H 38 4.126 4.126 4.003 0.123 17934 13073 1 19 . 1 1 38 38 GLU C C 38 179.981 179.981 178.088 1.893 17934 13074 1 19 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.349 0.659 17934 13075 1 19 . 1 1 38 38 GLU CB C 38 29.539 29.539 28.752 0.787 17934 13076 1 19 . 1 1 38 38 GLU H H 38 8.450 8.450 8.641 -0.191 17934 13077 1 19 . 1 1 39 39 SER N N 39 115.966 115.966 113.269 2.697 17934 13078 1 19 . 1 1 39 39 SER C C 39 175.991 175.991 176.323 -0.332 17934 13079 1 19 . 1 1 39 39 SER CA C 39 62.820 62.820 61.997 0.823 17934 13080 1 19 . 1 1 39 39 SER H H 39 7.522 7.522 7.657 -0.135 17934 13081 1 19 . 1 1 40 40 THR HA H 40 4.049 4.049 3.900 0.149 17934 13082 1 19 . 1 1 40 40 THR C C 40 175.972 175.972 177.129 -1.157 17934 13083 1 19 . 1 1 40 40 THR CA C 40 66.101 66.101 65.061 1.040 17934 13084 1 19 . 1 1 40 40 THR CB C 40 67.976 67.976 68.254 -0.278 17934 13085 1 19 . 1 1 41 41 GLN N N 41 120.354 120.354 118.722 1.632 17934 13086 1 19 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.230 -0.471 17934 13087 1 19 . 1 1 41 41 GLN C C 41 178.483 178.483 178.245 0.238 17934 13088 1 19 . 1 1 41 41 GLN CA C 41 60.476 60.476 58.123 2.353 17934 13089 1 19 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.108 0.025 17934 13090 1 19 . 1 1 41 41 GLN H H 41 8.271 8.271 8.235 0.036 17934 13091 1 19 . 1 1 42 42 ASP N N 42 120.757 120.757 122.058 -1.301 17934 13092 1 19 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.370 -0.011 17934 13093 1 19 . 1 1 42 42 ASP C C 42 177.480 177.480 177.756 -0.276 17934 13094 1 19 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.420 0.244 17934 13095 1 19 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.743 1.452 17934 13096 1 19 . 1 1 42 42 ASP H H 42 7.954 7.954 8.201 -0.247 17934 13097 1 19 . 1 1 43 43 ALA N N 43 120.587 120.587 121.896 -1.309 17934 13098 1 19 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.197 -0.207 17934 13099 1 19 . 1 1 43 43 ALA C C 43 179.767 179.767 179.221 0.546 17934 13100 1 19 . 1 1 43 43 ALA CA C 43 55.320 55.320 55.385 -0.065 17934 13101 1 19 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.319 0.911 17934 13102 1 19 . 1 1 43 43 ALA H H 43 7.842 7.842 8.407 -0.565 17934 13103 1 19 . 1 1 44 44 CYS N N 44 115.428 115.428 117.527 -2.099 17934 13104 1 19 . 1 1 44 44 CYS HA H 44 3.895 3.895 3.950 -0.055 17934 13105 1 19 . 1 1 44 44 CYS C C 44 176.076 176.076 176.556 -0.480 17934 13106 1 19 . 1 1 44 44 CYS CA C 44 64.695 64.695 63.094 1.601 17934 13107 1 19 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.624 0.040 17934 13108 1 19 . 1 1 44 44 CYS H H 44 7.900 7.900 8.038 -0.138 17934 13109 1 19 . 1 1 45 45 ALA N N 45 120.487 120.487 123.230 -2.743 17934 13110 1 19 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.957 0.043 17934 13111 1 19 . 1 1 45 45 ALA C C 45 173.506 173.506 178.527 -5.021 17934 13112 1 19 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.118 0.202 17934 13113 1 19 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.038 -0.098 17934 13114 1 19 . 1 1 45 45 ALA H H 45 7.250 7.250 8.282 -1.032 17934 13115 1 19 . 1 1 46 46 LYS N N 46 119.267 119.267 119.685 -0.418 17934 13116 1 19 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.873 0.074 17934 13117 1 19 . 1 1 46 46 LYS C C 46 179.561 179.561 178.802 0.759 17934 13118 1 19 . 1 1 46 46 LYS H H 46 8.102 8.102 8.082 0.020 17934 13119 1 19 . 1 1 47 47 MET N N 47 118.009 118.009 118.027 -0.018 17934 13120 1 19 . 1 1 47 47 MET HA H 47 4.214 4.214 4.111 0.103 17934 13121 1 19 . 1 1 47 47 MET C C 47 179.526 179.526 178.058 1.468 17934 13122 1 19 . 1 1 47 47 MET CA C 47 57.195 57.195 59.036 -1.841 17934 13123 1 19 . 1 1 47 47 MET CB C 47 30.945 30.945 32.704 -1.759 17934 13124 1 19 . 1 1 47 47 MET H H 47 8.585 8.585 8.502 0.083 17934 13125 1 19 . 1 1 48 48 ARG N N 48 119.962 119.962 119.893 0.069 17934 13126 1 19 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.956 -0.100 17934 13127 1 19 . 1 1 48 48 ARG C C 48 178.875 178.875 178.350 0.525 17934 13128 1 19 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.440 1.505 17934 13129 1 19 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.790 0.687 17934 13130 1 19 . 1 1 48 48 ARG H H 48 8.190 8.190 8.360 -0.170 17934 13131 1 19 . 1 1 49 49 ALA N N 49 120.640 120.640 121.581 -0.941 17934 13132 1 19 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.130 -0.387 17934 13133 1 19 . 1 1 49 49 ALA C C 49 180.169 180.169 179.719 0.450 17934 13134 1 19 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.778 0.073 17934 13135 1 19 . 1 1 49 49 ALA CB C 49 17.821 17.821 18.456 -0.635 17934 13136 1 19 . 1 1 49 49 ALA H H 49 7.671 7.671 8.422 -0.751 17934 13137 1 19 . 1 1 50 50 ASN N N 50 116.063 116.063 117.666 -1.603 17934 13138 1 19 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.441 0.033 17934 13139 1 19 . 1 1 50 50 ASN C C 50 177.084 177.084 177.264 -0.180 17934 13140 1 19 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.441 0.348 17934 13141 1 19 . 1 1 50 50 ASN CB C 50 38.914 38.914 37.968 0.946 17934 13142 1 19 . 1 1 50 50 ASN H H 50 7.893 7.893 8.092 -0.199 17934 13143 1 19 . 1 1 51 51 CYS N N 51 116.884 116.884 118.765 -1.881 17934 13144 1 19 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.073 0.233 17934 13145 1 19 . 1 1 51 51 CYS C C 51 175.002 175.002 176.773 -1.771 17934 13146 1 19 . 1 1 51 51 CYS CA C 51 61.414 61.414 63.302 -1.888 17934 13147 1 19 . 1 1 51 51 CYS CB C 51 27.664 27.664 27.939 -0.275 17934 13148 1 19 . 1 1 51 51 CYS H H 51 7.770 7.770 8.424 -0.654 17934 13149 1 19 . 1 1 52 52 GLN N N 52 117.831 117.831 117.931 -0.100 17934 13150 1 19 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.022 0.206 17934 13151 1 19 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.095 -1.369 17934 13152 1 19 . 1 1 52 52 GLN CB C 52 29.070 29.070 28.302 0.768 17934 13153 1 19 . 1 1 52 52 GLN H H 52 7.796 7.796 7.988 -0.192 17934 13154 1 19 . 1 1 53 53 LYS N N 53 118.841 118.841 119.307 -0.466 17934 13155 1 19 . 1 1 53 53 LYS CA C 53 57.195 57.195 57.917 -0.722 17934 13156 1 19 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.987 0.302 17934 13157 1 19 . 1 1 53 53 LYS H H 53 7.686 7.686 7.656 0.030 17934 13158 1 19 . 1 1 55 55 THR HA H 55 4.304 4.304 4.285 0.019 17934 13159 1 19 . 1 1 55 55 THR CA C 55 63.757 63.757 63.709 0.048 17934 13160 1 19 . 1 1 55 55 THR CB C 55 68.914 68.914 68.925 -0.011 17934 13161 1 19 . 1 1 56 56 GLU N N 56 120.861 120.861 120.977 -0.116 17934 13162 1 19 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.201 -0.054 17934 13163 1 19 . 1 1 56 56 GLU C C 56 177.656 177.656 178.607 -0.951 17934 13164 1 19 . 1 1 56 56 GLU CA C 56 58.133 58.133 59.099 -0.966 17934 13165 1 19 . 1 1 56 56 GLU CB C 56 30.008 30.008 28.237 1.771 17934 13166 1 19 . 1 1 56 56 GLU H H 56 8.311 8.311 8.782 -0.471 17934 13167 1 19 . 1 1 57 57 GLN N N 57 118.397 118.397 119.640 -1.243 17934 13168 1 19 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.260 -0.118 17934 13169 1 19 . 1 1 57 57 GLN C C 57 177.275 177.275 177.521 -0.246 17934 13170 1 19 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.580 0.084 17934 13171 1 19 . 1 1 57 57 GLN CB C 57 29.070 29.070 28.406 0.664 17934 13172 1 19 . 1 1 57 57 GLN H H 57 7.899 7.899 7.666 0.233 17934 13173 1 19 . 1 1 58 58 MET N N 58 118.897 118.897 117.446 1.451 17934 13174 1 19 . 1 1 58 58 MET HA H 58 4.350 4.350 4.368 -0.018 17934 13175 1 19 . 1 1 58 58 MET C C 58 177.172 177.172 176.950 0.222 17934 13176 1 19 . 1 1 58 58 MET CA C 58 56.726 56.726 56.533 0.193 17934 13177 1 19 . 1 1 58 58 MET CB C 58 32.196 32.196 32.637 -0.441 17934 13178 1 19 . 1 1 58 58 MET H H 58 8.036 8.036 7.478 0.558 17934 13179 1 19 . 1 1 59 59 LYS N N 59 119.779 119.779 118.172 1.607 17934 13180 1 19 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.406 -0.175 17934 13181 1 19 . 1 1 59 59 LYS C C 59 176.676 176.676 176.667 0.009 17934 13182 1 19 . 1 1 59 59 LYS CA C 59 57.195 57.195 57.008 0.187 17934 13183 1 19 . 1 1 59 59 LYS CB C 59 32.820 32.820 31.853 0.967 17934 13184 1 19 . 1 1 59 59 LYS H H 59 7.901 7.901 7.450 0.451 17934 13185 1 19 . 1 1 60 60 LYS N N 60 119.993 119.993 119.550 0.443 17934 13186 1 19 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.350 -0.015 17934 13187 1 19 . 1 1 60 60 LYS C C 60 176.336 176.336 175.517 0.819 17934 13188 1 19 . 1 1 60 60 LYS CA C 60 56.258 56.258 56.135 0.123 17934 13189 1 19 . 1 1 60 60 LYS CB C 60 32.820 32.820 33.783 -0.963 17934 13190 1 19 . 1 1 60 60 LYS H H 60 7.877 7.877 7.793 0.084 17934 13191 1 19 . 1 1 61 61 VAL N N 61 122.649 122.649 121.503 1.146 17934 13192 1 19 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.493 -0.113 17934 13193 1 19 . 1 1 61 61 VAL C C 61 174.210 174.210 174.179 0.031 17934 13194 1 19 . 1 1 61 61 VAL CA C 61 60.000 60.000 58.477 1.524 17934 13195 1 19 . 1 1 61 61 VAL CB C 61 32.350 32.350 32.029 0.321 17934 13196 1 19 . 1 1 61 61 VAL H H 61 7.708 7.708 7.526 0.182 17934 13197 1 19 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.683 -0.020 17934 13198 1 19 . 1 1 62 62 PRO C C 62 176.656 176.656 176.306 0.350 17934 13199 1 19 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.211 0.609 17934 13200 1 19 . 1 1 62 62 PRO CB C 62 31.883 31.883 33.309 -1.426 17934 13201 1 19 . 1 1 63 63 THR N N 63 117.155 117.155 114.836 2.319 17934 13202 1 19 . 1 1 63 63 THR HA H 63 4.830 4.830 4.504 0.326 17934 13203 1 19 . 1 1 63 63 THR C C 63 174.682 174.682 173.418 1.264 17934 13204 1 19 . 1 1 63 63 THR CA C 63 62.820 62.820 63.016 -0.196 17934 13205 1 19 . 1 1 63 63 THR CB C 63 69.382 69.382 69.508 -0.126 17934 13206 1 19 . 1 1 63 63 THR H H 63 8.303 8.303 8.310 -0.007 17934 13207 1 19 . 1 1 64 64 ILE N N 64 121.004 121.004 127.503 -6.499 17934 13208 1 19 . 1 1 64 64 ILE CA C 64 58.600 58.600 58.383 0.217 17934 13209 1 19 . 1 1 64 64 ILE CB C 64 42.690 42.690 41.038 1.652 17934 13210 1 19 . 1 1 64 64 ILE H H 64 9.348 9.348 9.080 0.268 17934 13211 1 19 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.159 0.581 17934 13212 1 19 . 1 1 65 65 ILE C C 65 175.378 175.378 174.956 0.422 17934 13213 1 19 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.144 -1.064 17934 13214 1 19 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.065 1.685 17934 13215 1 19 . 1 1 66 66 LEU N N 66 110.343 110.343 130.015 -19.672 17934 13216 1 19 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.806 0.044 17934 13217 1 19 . 1 1 66 66 LEU C C 66 174.982 174.982 175.920 -0.938 17934 13218 1 19 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.314 -0.404 17934 13219 1 19 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.392 1.838 17934 13220 1 19 . 1 1 66 66 LEU H H 66 9.610 9.610 9.239 0.371 17934 13221 1 19 . 1 1 67 67 SER N N 67 120.990 120.990 120.249 0.741 17934 13222 1 19 . 1 1 67 67 SER HA H 67 5.405 5.405 5.069 0.336 17934 13223 1 19 . 1 1 67 67 SER C C 67 174.405 174.405 173.174 1.231 17934 13224 1 19 . 1 1 67 67 SER CA C 67 57.195 57.195 56.941 0.254 17934 13225 1 19 . 1 1 67 67 SER CB C 67 64.695 64.695 64.064 0.631 17934 13226 1 19 . 1 1 67 67 SER H H 67 9.260 9.260 8.914 0.346 17934 13227 1 19 . 1 1 68 68 VAL N N 68 128.176 128.176 126.254 1.922 17934 13228 1 19 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.358 0.135 17934 13229 1 19 . 1 1 68 68 VAL C C 68 173.891 173.891 173.151 0.740 17934 13230 1 19 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.389 1.961 17934 13231 1 19 . 1 1 68 68 VAL CB C 68 33.750 33.750 33.418 0.332 17934 13232 1 19 . 1 1 68 68 VAL H H 68 9.225 9.225 9.053 0.172 17934 13233 1 19 . 1 1 69 69 SER N N 69 121.697 121.697 123.751 -2.054 17934 13234 1 19 . 1 1 69 69 SER HA H 69 4.837 4.837 5.028 -0.191 17934 13235 1 19 . 1 1 69 69 SER C C 69 173.188 173.188 174.737 -1.549 17934 13236 1 19 . 1 1 69 69 SER CA C 69 57.195 57.195 55.974 1.221 17934 13237 1 19 . 1 1 69 69 SER CB C 69 67.976 67.976 66.474 1.502 17934 13238 1 19 . 1 1 69 69 SER H H 69 8.869 8.869 8.843 0.026 17934 13239 1 19 . 1 1 70 70 ALA N N 70 118.689 118.689 123.888 -5.199 17934 13240 1 19 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.270 -0.120 17934 13241 1 19 . 1 1 70 70 ALA C C 70 176.714 176.714 177.395 -0.681 17934 13242 1 19 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.118 -0.208 17934 13243 1 19 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.774 -0.174 17934 13244 1 19 . 1 1 70 70 ALA H H 70 8.810 8.810 8.776 0.034 17934 13245 1 19 . 1 1 71 71 LYS N N 71 112.633 112.633 116.618 -3.985 17934 13246 1 19 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.307 -0.032 17934 13247 1 19 . 1 1 71 71 LYS C C 71 177.033 177.033 175.519 1.514 17934 13248 1 19 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.223 1.972 17934 13249 1 19 . 1 1 71 71 LYS CB C 71 33.289 33.289 33.021 0.268 17934 13250 1 19 . 1 1 71 71 LYS H H 71 7.830 7.830 7.584 0.246 17934 13251 1 19 . 1 1 72 72 GLY N N 72 108.432 108.432 106.408 2.024 17934 13252 1 19 . 1 1 72 72 GLY CA C 72 45.476 45.476 44.852 0.624 17934 13253 1 19 . 1 1 72 72 GLY H H 72 7.685 7.685 7.573 0.112 17934 13254 1 19 . 1 1 73 73 VAL N N 73 120.414 120.414 115.862 4.552 17934 13255 1 19 . 1 1 73 73 VAL HA H 73 5.000 5.000 5.179 -0.179 17934 13256 1 19 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.275 1.195 17934 13257 1 19 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.032 0.598 17934 13258 1 19 . 1 1 73 73 VAL H H 73 8.620 8.620 7.988 0.632 17934 13259 1 19 . 1 1 74 74 LYS N N 74 125.257 125.257 123.718 1.539 17934 13260 1 19 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.263 0.753 17934 13261 1 19 . 1 1 74 74 LYS CA C 74 54.383 54.383 53.693 0.690 17934 13262 1 19 . 1 1 74 74 LYS CB C 74 36.570 36.570 35.898 0.672 17934 13263 1 19 . 1 1 74 74 LYS H H 74 8.783 8.783 8.471 0.312 17934 13264 1 19 . 1 1 75 75 PHE N N 75 119.414 119.414 117.317 2.097 17934 13265 1 19 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.597 0.103 17934 13266 1 19 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.328 -2.408 17934 13267 1 19 . 1 1 75 75 PHE CB C 75 40.610 40.610 42.021 -1.411 17934 13268 1 19 . 1 1 75 75 PHE H H 75 8.432 8.432 9.077 -0.645 17934 13269 1 19 . 1 1 76 76 ILE N N 76 121.430 121.430 119.986 1.444 17934 13270 1 19 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.571 0.269 17934 13271 1 19 . 1 1 76 76 ILE C C 76 175.249 175.249 174.259 0.990 17934 13272 1 19 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.969 -0.899 17934 13273 1 19 . 1 1 76 76 ILE CB C 76 41.220 41.220 42.274 -1.054 17934 13274 1 19 . 1 1 76 76 ILE H H 76 8.960 8.960 8.646 0.314 17934 13275 1 19 . 1 1 77 77 ASP N N 77 125.744 125.744 124.035 1.709 17934 13276 1 19 . 1 1 77 77 ASP HA H 77 4.563 4.563 4.913 -0.350 17934 13277 1 19 . 1 1 77 77 ASP C C 77 177.569 177.569 176.221 1.348 17934 13278 1 19 . 1 1 77 77 ASP CA C 77 55.789 55.789 53.903 1.886 17934 13279 1 19 . 1 1 77 77 ASP CB C 77 43.601 43.601 42.483 1.118 17934 13280 1 19 . 1 1 77 77 ASP H H 77 8.750 8.750 8.470 0.280 17934 13281 1 19 . 1 1 78 78 ALA N N 78 128.632 128.632 128.644 -0.012 17934 13282 1 19 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.229 -0.259 17934 13283 1 19 . 1 1 78 78 ALA C C 78 178.052 178.052 178.307 -0.255 17934 13284 1 19 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.054 0.776 17934 13285 1 19 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.829 -0.037 17934 13286 1 19 . 1 1 78 78 ALA H H 78 8.700 8.700 8.378 0.322 17934 13287 1 19 . 1 1 79 79 THR N N 79 113.087 113.087 114.001 -0.914 17934 13288 1 19 . 1 1 79 79 THR HA H 79 4.194 4.194 4.110 0.084 17934 13289 1 19 . 1 1 79 79 THR C C 79 175.587 175.587 175.477 0.110 17934 13290 1 19 . 1 1 79 79 THR CA C 79 64.695 64.695 65.361 -0.666 17934 13291 1 19 . 1 1 79 79 THR CB C 79 69.382 69.382 69.103 0.279 17934 13292 1 19 . 1 1 79 79 THR H H 79 8.779 8.779 8.233 0.546 17934 13293 1 19 . 1 1 80 80 ASN N N 80 118.434 118.434 116.083 2.351 17934 13294 1 19 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.894 -0.157 17934 13295 1 19 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.561 0.884 17934 13296 1 19 . 1 1 80 80 ASN CB C 80 39.383 39.383 38.879 0.504 17934 13297 1 19 . 1 1 80 80 ASN H H 80 8.584 8.584 7.978 0.606 17934 13298 1 19 . 1 1 81 81 LYS N N 81 112.429 112.429 117.914 -5.485 17934 13299 1 19 . 1 1 81 81 LYS C C 81 174.909 174.909 174.939 -0.030 17934 13300 1 19 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.442 0.222 17934 13301 1 19 . 1 1 81 81 LYS CB C 81 28.602 28.602 30.165 -1.563 17934 13302 1 19 . 1 1 81 81 LYS H H 81 7.966 7.966 8.038 -0.072 17934 13303 1 19 . 1 1 82 82 ASN N N 82 116.806 116.806 116.367 0.439 17934 13304 1 19 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.764 -0.174 17934 13305 1 19 . 1 1 82 82 ASN C C 82 174.999 174.999 175.109 -0.110 17934 13306 1 19 . 1 1 82 82 ASN CA C 82 52.976 52.976 52.489 0.487 17934 13307 1 19 . 1 1 82 82 ASN CB C 82 38.445 38.445 40.037 -1.592 17934 13308 1 19 . 1 1 82 82 ASN H H 82 8.455 8.455 7.600 0.855 17934 13309 1 19 . 1 1 83 83 ILE N N 83 122.447 122.447 121.673 0.774 17934 13310 1 19 . 1 1 83 83 ILE HA H 83 4.030 4.030 3.886 0.144 17934 13311 1 19 . 1 1 83 83 ILE C C 83 176.572 176.572 175.340 1.232 17934 13312 1 19 . 1 1 83 83 ILE CA C 83 62.350 62.350 62.452 -0.102 17934 13313 1 19 . 1 1 83 83 ILE CB C 83 37.970 37.970 37.901 0.069 17934 13314 1 19 . 1 1 83 83 ILE H H 83 8.650 8.650 8.635 0.015 17934 13315 1 19 . 1 1 84 84 ILE N N 84 129.339 129.339 124.395 4.944 17934 13316 1 19 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.284 -0.364 17934 13317 1 19 . 1 1 84 84 ILE C C 84 175.873 175.873 175.456 0.417 17934 13318 1 19 . 1 1 84 84 ILE CA C 84 62.810 62.810 61.443 1.367 17934 13319 1 19 . 1 1 84 84 ILE CB C 84 38.840 38.840 40.298 -1.458 17934 13320 1 19 . 1 1 84 84 ILE H H 84 8.930 8.930 8.892 0.038 17934 13321 1 19 . 1 1 85 85 ALA N N 85 118.867 118.867 118.179 0.688 17934 13322 1 19 . 1 1 85 85 ALA C C 85 174.100 174.100 174.498 -0.398 17934 13323 1 19 . 1 1 85 85 ALA CA C 85 51.570 51.570 51.989 -0.419 17934 13324 1 19 . 1 1 85 85 ALA H H 85 7.048 7.048 8.065 -1.017 17934 13325 1 19 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.885 0.269 17934 13326 1 19 . 1 1 87 87 HIS C C 87 174.986 174.986 173.928 1.058 17934 13327 1 19 . 1 1 87 87 HIS CB C 87 34.350 34.350 31.731 2.619 17934 13328 1 19 . 1 1 88 88 GLU N N 88 125.372 125.372 120.176 5.196 17934 13329 1 19 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.346 0.175 17934 13330 1 19 . 1 1 88 88 GLU C C 88 179.047 179.047 178.351 0.696 17934 13331 1 19 . 1 1 88 88 GLU CA C 88 56.726 56.726 57.230 -0.504 17934 13332 1 19 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.258 0.219 17934 13333 1 19 . 1 1 88 88 GLU H H 88 9.106 9.106 8.917 0.189 17934 13334 1 19 . 1 1 89 89 ILE N N 89 124.132 124.132 126.988 -2.856 17934 13335 1 19 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.898 0.121 17934 13336 1 19 . 1 1 89 89 ILE C C 89 176.095 176.095 177.542 -1.447 17934 13337 1 19 . 1 1 89 89 ILE CA C 89 62.351 62.351 64.500 -2.149 17934 13338 1 19 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.335 0.579 17934 13339 1 19 . 1 1 89 89 ILE H H 89 8.055 8.055 8.975 -0.920 17934 13340 1 19 . 1 1 90 90 ARG N N 90 116.949 116.949 117.038 -0.089 17934 13341 1 19 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.103 0.235 17934 13342 1 19 . 1 1 90 90 ARG C C 90 176.578 176.578 176.630 -0.052 17934 13343 1 19 . 1 1 90 90 ARG CA C 90 57.664 57.664 57.867 -0.203 17934 13344 1 19 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.773 -0.703 17934 13345 1 19 . 1 1 90 90 ARG H H 90 8.045 8.045 8.010 0.035 17934 13346 1 19 . 1 1 91 91 ASN N N 91 116.320 116.320 116.666 -0.346 17934 13347 1 19 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.767 0.386 17934 13348 1 19 . 1 1 91 91 ASN C C 91 174.595 174.595 176.002 -1.407 17934 13349 1 19 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.362 -1.854 17934 13350 1 19 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.989 -0.137 17934 13351 1 19 . 1 1 91 91 ASN H H 91 8.067 8.067 8.011 0.056 17934 13352 1 19 . 1 1 92 92 ILE N N 92 122.441 122.441 121.792 0.649 17934 13353 1 19 . 1 1 92 92 ILE HA H 92 5.073 5.073 4.071 1.002 17934 13354 1 19 . 1 1 92 92 ILE C C 92 175.229 175.229 176.213 -0.984 17934 13355 1 19 . 1 1 92 92 ILE CA C 92 61.880 61.880 63.083 -1.203 17934 13356 1 19 . 1 1 92 92 ILE CB C 92 39.850 39.850 38.076 1.774 17934 13357 1 19 . 1 1 92 92 ILE H H 92 7.483 7.483 7.996 -0.513 17934 13358 1 19 . 1 1 93 93 SER N N 93 120.329 120.329 123.781 -3.452 17934 13359 1 19 . 1 1 93 93 SER HA H 93 4.684 4.684 4.353 0.331 17934 13360 1 19 . 1 1 93 93 SER C C 93 180.744 180.744 174.377 6.367 17934 13361 1 19 . 1 1 93 93 SER CA C 93 57.664 57.664 60.732 -3.068 17934 13362 1 19 . 1 1 93 93 SER CB C 93 66.570 66.570 64.054 2.516 17934 13363 1 19 . 1 1 93 93 SER H H 93 9.545 9.545 8.463 1.082 17934 13364 1 19 . 1 1 94 94 CYS N N 94 110.900 110.900 115.077 -4.177 17934 13365 1 19 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.452 -0.640 17934 13366 1 19 . 1 1 94 94 CYS C C 94 173.973 173.973 172.868 1.105 17934 13367 1 19 . 1 1 94 94 CYS CA C 94 59.539 59.539 57.785 1.754 17934 13368 1 19 . 1 1 94 94 CYS CB C 94 26.258 26.258 31.174 -4.916 17934 13369 1 19 . 1 1 94 94 CYS H H 94 8.858 8.858 7.787 1.071 17934 13370 1 19 . 1 1 95 95 ALA N N 95 121.379 121.379 122.477 -1.098 17934 13371 1 19 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.625 -0.196 17934 13372 1 19 . 1 1 95 95 ALA C C 95 178.098 178.098 175.255 2.843 17934 13373 1 19 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.526 1.123 17934 13374 1 19 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.020 -1.720 17934 13375 1 19 . 1 1 95 95 ALA H H 95 8.360 8.360 8.321 0.039 17934 13376 1 19 . 1 1 96 96 ALA N N 96 122.576 122.576 124.989 -2.413 17934 13377 1 19 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.642 0.038 17934 13378 1 19 . 1 1 96 96 ALA C C 96 175.716 175.716 174.935 0.781 17934 13379 1 19 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.325 1.115 17934 13380 1 19 . 1 1 96 96 ALA CB C 96 22.700 22.700 21.947 0.753 17934 13381 1 19 . 1 1 96 96 ALA H H 96 9.080 9.080 8.511 0.569 17934 13382 1 19 . 1 1 97 97 GLN N N 97 116.903 116.903 119.639 -2.736 17934 13383 1 19 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.605 0.325 17934 13384 1 19 . 1 1 97 97 GLN C C 97 175.270 175.270 173.704 1.566 17934 13385 1 19 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.425 1.425 17934 13386 1 19 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.973 1.785 17934 13387 1 19 . 1 1 97 97 GLN H H 97 8.369 8.369 8.191 0.178 17934 13388 1 19 . 1 1 98 98 ASP N N 98 124.971 124.971 121.375 3.596 17934 13389 1 19 . 1 1 98 98 ASP C C 98 175.217 175.217 176.269 -1.052 17934 13390 1 19 . 1 1 98 98 ASP CA C 98 52.039 52.039 51.631 0.408 17934 13391 1 19 . 1 1 98 98 ASP CB C 98 42.195 42.195 41.626 0.569 17934 13392 1 19 . 1 1 98 98 ASP H H 98 8.395 8.395 8.366 0.029 17934 13393 1 19 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.384 -0.150 17934 13394 1 19 . 1 1 99 99 PRO C C 99 178.433 178.433 177.831 0.602 17934 13395 1 19 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.804 -0.109 17934 13396 1 19 . 1 1 99 99 PRO CB C 99 32.352 32.352 31.974 0.378 17934 13397 1 19 . 1 1 100 100 GLU N N 100 116.223 116.223 118.724 -2.501 17934 13398 1 19 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.108 0.112 17934 13399 1 19 . 1 1 100 100 GLU C C 100 176.678 176.678 176.008 0.670 17934 13400 1 19 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.500 -1.774 17934 13401 1 19 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.591 2.354 17934 13402 1 19 . 1 1 100 100 GLU H H 100 8.643 8.643 8.706 -0.063 17934 13403 1 19 . 1 1 101 101 ASP N N 101 119.053 119.053 119.031 0.022 17934 13404 1 19 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.906 -0.363 17934 13405 1 19 . 1 1 101 101 ASP C C 101 174.771 174.771 176.477 -1.706 17934 13406 1 19 . 1 1 101 101 ASP CA C 101 53.914 53.914 52.883 1.031 17934 13407 1 19 . 1 1 101 101 ASP CB C 101 40.789 40.789 39.886 0.903 17934 13408 1 19 . 1 1 101 101 ASP H H 101 7.597 7.597 8.189 -0.592 17934 13409 1 19 . 1 1 102 102 LEU N N 102 123.986 123.986 119.782 4.204 17934 13410 1 19 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.197 0.193 17934 13411 1 19 . 1 1 102 102 LEU C C 102 177.141 177.141 178.057 -0.916 17934 13412 1 19 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.436 0.224 17934 13413 1 19 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.636 1.024 17934 13414 1 19 . 1 1 102 102 LEU H H 102 8.534 8.534 7.790 0.744 17934 13415 1 19 . 1 1 103 103 SER N N 103 112.339 112.339 111.022 1.317 17934 13416 1 19 . 1 1 103 103 SER HA H 103 4.290 4.290 4.189 0.101 17934 13417 1 19 . 1 1 103 103 SER C C 103 174.106 174.106 175.140 -1.034 17934 13418 1 19 . 1 1 103 103 SER CA C 103 60.945 60.945 60.091 0.854 17934 13419 1 19 . 1 1 103 103 SER CB C 103 63.757 63.757 63.372 0.385 17934 13420 1 19 . 1 1 103 103 SER H H 103 7.867 7.867 8.000 -0.133 17934 13421 1 19 . 1 1 104 104 THR N N 104 123.070 123.070 118.508 4.562 17934 13422 1 19 . 1 1 104 104 THR HA H 104 5.373 5.373 4.851 0.522 17934 13423 1 19 . 1 1 104 104 THR C C 104 180.693 180.693 172.566 8.127 17934 13424 1 19 . 1 1 104 104 THR CA C 104 63.289 63.289 62.009 1.280 17934 13425 1 19 . 1 1 104 104 THR CB C 104 69.382 69.382 70.273 -0.891 17934 13426 1 19 . 1 1 104 104 THR H H 104 8.830 8.830 7.944 0.886 17934 13427 1 19 . 1 1 105 105 PHE N N 105 122.582 122.582 126.036 -3.454 17934 13428 1 19 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.973 0.497 17934 13429 1 19 . 1 1 105 105 PHE C C 105 179.211 179.211 172.070 7.141 17934 13430 1 19 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.358 -0.038 17934 13431 1 19 . 1 1 105 105 PHE CB C 105 41.790 41.790 42.337 -0.547 17934 13432 1 19 . 1 1 105 105 PHE H H 105 9.170 9.170 8.761 0.409 17934 13433 1 19 . 1 1 106 106 ALA N N 106 119.567 119.567 125.873 -6.306 17934 13434 1 19 . 1 1 106 106 ALA C C 106 175.603 175.603 175.411 0.192 17934 13435 1 19 . 1 1 106 106 ALA H H 106 8.770 8.770 8.961 -0.191 17934 13436 1 19 . 1 1 107 107 TYR N N 107 109.933 109.933 119.321 -9.388 17934 13437 1 19 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.276 -0.356 17934 13438 1 19 . 1 1 107 107 TYR C C 107 180.426 180.426 173.437 6.989 17934 13439 1 19 . 1 1 107 107 TYR CA C 107 57.080 57.080 54.598 2.482 17934 13440 1 19 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.286 -0.497 17934 13441 1 19 . 1 1 107 107 TYR H H 107 7.950 7.950 8.047 -0.097 17934 13442 1 19 . 1 1 108 108 ILE N N 108 120.613 120.613 120.498 0.115 17934 13443 1 19 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.453 0.917 17934 13444 1 19 . 1 1 108 108 ILE C C 108 176.212 176.212 176.084 0.128 17934 13445 1 19 . 1 1 108 108 ILE CA C 108 59.540 59.540 60.990 -1.450 17934 13446 1 19 . 1 1 108 108 ILE CB C 108 39.380 39.380 38.175 1.205 17934 13447 1 19 . 1 1 108 108 ILE H H 108 8.869 8.869 8.252 0.617 17934 13448 1 19 . 1 1 109 109 THR N N 109 116.505 116.505 117.895 -1.390 17934 13449 1 19 . 1 1 109 109 THR HA H 109 5.669 5.669 4.776 0.893 17934 13450 1 19 . 1 1 109 109 THR C C 109 173.505 173.505 173.259 0.246 17934 13451 1 19 . 1 1 109 109 THR CA C 109 59.070 59.070 60.349 -1.279 17934 13452 1 19 . 1 1 109 109 THR H H 109 9.489 9.489 8.265 1.224 17934 13453 1 19 . 1 1 110 110 LYS N N 110 122.960 122.960 121.042 1.918 17934 13454 1 19 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.299 0.161 17934 13455 1 19 . 1 1 110 110 LYS C C 110 175.937 175.937 175.593 0.344 17934 13456 1 19 . 1 1 110 110 LYS CA C 110 55.789 55.789 55.766 0.023 17934 13457 1 19 . 1 1 110 110 LYS CB C 110 34.227 34.227 32.934 1.293 17934 13458 1 19 . 1 1 110 110 LYS H H 110 7.831 7.831 8.251 -0.420 17934 13459 1 19 . 1 1 111 111 ASP N N 111 127.409 127.409 122.842 4.567 17934 13460 1 19 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.868 -0.087 17934 13461 1 19 . 1 1 111 111 ASP C C 111 176.396 176.396 177.748 -1.352 17934 13462 1 19 . 1 1 111 111 ASP CA C 111 53.914 53.914 53.175 0.739 17934 13463 1 19 . 1 1 111 111 ASP CB C 111 43.133 43.133 42.761 0.372 17934 13464 1 19 . 1 1 111 111 ASP H H 111 8.769 8.769 8.420 0.349 17934 13465 1 19 . 1 1 112 112 LEU N N 112 125.913 125.913 120.570 5.343 17934 13466 1 19 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.160 -0.010 17934 13467 1 19 . 1 1 112 112 LEU C C 112 178.553 178.553 178.280 0.273 17934 13468 1 19 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.537 -0.347 17934 13469 1 19 . 1 1 112 112 LEU CB C 112 41.790 41.790 41.717 0.074 17934 13470 1 19 . 1 1 112 112 LEU H H 112 8.593 8.593 8.852 -0.259 17934 13471 1 19 . 1 1 113 113 LYS N N 113 117.189 117.189 116.393 0.796 17934 13472 1 19 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.364 -0.102 17934 13473 1 19 . 1 1 113 113 LYS C C 113 177.180 177.180 176.325 0.855 17934 13474 1 19 . 1 1 113 113 LYS CA C 113 58.133 58.133 56.184 1.949 17934 13475 1 19 . 1 1 113 113 LYS CB C 113 32.820 32.820 33.559 -0.739 17934 13476 1 19 . 1 1 113 113 LYS H H 113 8.207 8.207 7.865 0.342 17934 13477 1 19 . 1 1 114 114 SER N N 114 112.492 112.492 112.473 0.019 17934 13478 1 19 . 1 1 114 114 SER CA C 114 58.601 58.601 58.798 -0.197 17934 13479 1 19 . 1 1 114 114 SER CB C 114 65.164 65.164 61.414 3.750 17934 13480 1 19 . 1 1 114 114 SER H H 114 7.755 7.755 8.119 -0.364 17934 13481 1 19 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.665 -0.276 17934 13482 1 19 . 1 1 115 115 ASN C C 115 174.203 174.203 175.462 -1.259 17934 13483 1 19 . 1 1 115 115 ASN CA C 115 54.383 54.383 54.328 0.055 17934 13484 1 19 . 1 1 115 115 ASN CB C 115 37.977 37.977 39.605 -1.628 17934 13485 1 19 . 1 1 116 116 HIS N N 116 116.822 116.822 116.181 0.641 17934 13486 1 19 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.580 0.350 17934 13487 1 19 . 1 1 116 116 HIS C C 116 173.898 173.898 173.124 0.774 17934 13488 1 19 . 1 1 116 116 HIS CA C 116 54.910 54.910 54.630 0.279 17934 13489 1 19 . 1 1 116 116 HIS CB C 116 32.650 32.650 32.237 0.413 17934 13490 1 19 . 1 1 116 116 HIS H H 116 7.690 7.690 7.924 -0.234 17934 13491 1 19 . 1 1 117 117 HIS N N 117 118.253 118.253 120.275 -2.022 17934 13492 1 19 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.089 1.231 17934 13493 1 19 . 1 1 117 117 HIS C C 117 173.695 173.695 174.093 -0.398 17934 13494 1 19 . 1 1 117 117 HIS CA C 117 56.350 56.350 56.820 -0.470 17934 13495 1 19 . 1 1 117 117 HIS CB C 117 32.350 32.350 29.099 3.251 17934 13496 1 19 . 1 1 117 117 HIS H H 117 8.340 8.340 8.793 -0.453 17934 13497 1 19 . 1 1 118 118 TYR N N 118 118.301 118.301 119.738 -1.437 17934 13498 1 19 . 1 1 118 118 TYR HA H 118 5.010 5.010 5.353 -0.343 17934 13499 1 19 . 1 1 118 118 TYR C C 118 173.530 173.530 173.628 -0.098 17934 13500 1 19 . 1 1 118 118 TYR CA C 118 56.730 56.730 53.845 2.885 17934 13501 1 19 . 1 1 118 118 TYR CB C 118 43.240 43.240 40.614 2.626 17934 13502 1 19 . 1 1 118 118 TYR H H 118 9.080 9.080 7.949 1.131 17934 13503 1 19 . 1 1 119 119 CYS N N 119 121.015 121.015 117.648 3.367 17934 13504 1 19 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.921 0.142 17934 13505 1 19 . 1 1 119 119 CYS C C 119 180.664 180.664 173.674 6.990 17934 13506 1 19 . 1 1 119 119 CYS CA C 119 56.726 56.726 55.693 1.033 17934 13507 1 19 . 1 1 119 119 CYS CB C 119 29.539 29.539 30.928 -1.389 17934 13508 1 19 . 1 1 119 119 CYS H H 119 9.120 9.120 8.668 0.452 17934 13509 1 19 . 1 1 120 120 HIS N N 120 110.134 110.134 120.298 -10.164 17934 13510 1 19 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.907 -0.208 17934 13511 1 19 . 1 1 120 120 HIS C C 120 180.776 180.776 173.615 7.161 17934 13512 1 19 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.101 1.219 17934 13513 1 19 . 1 1 120 120 HIS CB C 120 32.352 32.352 30.799 1.553 17934 13514 1 19 . 1 1 120 120 HIS H H 120 8.482 8.482 8.345 0.137 17934 13515 1 19 . 1 1 121 121 VAL N N 121 120.855 120.855 124.914 -4.059 17934 13516 1 19 . 1 1 121 121 VAL HA H 121 4.350 4.350 3.921 0.429 17934 13517 1 19 . 1 1 121 121 VAL C C 121 173.419 173.419 173.151 0.268 17934 13518 1 19 . 1 1 121 121 VAL CA C 121 61.410 61.410 59.529 1.881 17934 13519 1 19 . 1 1 121 121 VAL CB C 121 33.280 33.280 32.847 0.432 17934 13520 1 19 . 1 1 121 121 VAL H H 121 7.929 7.929 8.656 -0.727 17934 13521 1 19 . 1 1 122 122 PHE N N 122 124.384 124.384 128.215 -3.831 17934 13522 1 19 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.086 0.334 17934 13523 1 19 . 1 1 122 122 PHE C C 122 174.876 174.876 174.855 0.021 17934 13524 1 19 . 1 1 122 122 PHE CA C 122 55.320 55.320 54.120 1.200 17934 13525 1 19 . 1 1 122 122 PHE CB C 122 44.540 44.540 42.296 2.244 17934 13526 1 19 . 1 1 122 122 PHE H H 122 8.910 8.910 8.675 0.235 17934 13527 1 19 . 1 1 123 123 THR N N 123 112.451 112.451 114.411 -1.960 17934 13528 1 19 . 1 1 123 123 THR HA H 123 5.147 5.147 4.431 0.716 17934 13529 1 19 . 1 1 123 123 THR C C 123 174.096 174.096 173.125 0.971 17934 13530 1 19 . 1 1 123 123 THR CA C 123 61.843 61.843 60.551 1.292 17934 13531 1 19 . 1 1 123 123 THR CB C 123 71.218 71.218 69.582 1.636 17934 13532 1 19 . 1 1 123 123 THR H H 123 8.668 8.668 9.008 -0.340 17934 13533 1 19 . 1 1 124 124 ALA N N 124 128.922 128.922 127.552 1.370 17934 13534 1 19 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.396 0.324 17934 13535 1 19 . 1 1 124 124 ALA C C 124 177.168 177.168 176.397 0.771 17934 13536 1 19 . 1 1 124 124 ALA CA C 124 50.890 50.890 50.527 0.363 17934 13537 1 19 . 1 1 124 124 ALA CB C 124 21.100 21.100 20.973 0.127 17934 13538 1 19 . 1 1 124 124 ALA H H 124 9.180 9.180 7.930 1.250 17934 13539 1 19 . 1 1 125 125 PHE N N 125 115.427 115.427 117.923 -2.496 17934 13540 1 19 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.404 -0.114 17934 13541 1 19 . 1 1 125 125 PHE C C 125 174.703 174.703 175.536 -0.833 17934 13542 1 19 . 1 1 125 125 PHE CA C 125 60.470 60.470 58.518 1.952 17934 13543 1 19 . 1 1 125 125 PHE CB C 125 38.060 38.060 38.931 -0.871 17934 13544 1 19 . 1 1 125 125 PHE H H 125 8.560 8.560 7.460 1.100 17934 13545 1 19 . 1 1 126 126 ASP N N 126 115.745 115.745 121.515 -5.770 17934 13546 1 19 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.922 -0.079 17934 13547 1 19 . 1 1 126 126 ASP C C 126 176.532 176.532 176.039 0.493 17934 13548 1 19 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.089 0.356 17934 13549 1 19 . 1 1 126 126 ASP CB C 126 44.070 44.070 41.519 2.551 17934 13550 1 19 . 1 1 126 126 ASP H H 126 7.417 7.417 7.433 -0.016 17934 13551 1 19 . 1 1 127 127 VAL N N 127 121.923 121.923 124.800 -2.877 17934 13552 1 19 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.534 0.056 17934 13553 1 19 . 1 1 127 127 VAL C C 127 176.863 176.863 177.200 -0.337 17934 13554 1 19 . 1 1 127 127 VAL CA C 127 65.630 65.630 67.203 -1.573 17934 13555 1 19 . 1 1 127 127 VAL CB C 127 31.830 31.830 31.877 -0.047 17934 13556 1 19 . 1 1 127 127 VAL H H 127 8.508 8.508 8.428 0.080 17934 13557 1 19 . 1 1 128 128 ASN N N 128 118.851 118.851 117.732 1.119 17934 13558 1 19 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.337 0.139 17934 13559 1 19 . 1 1 128 128 ASN C C 128 178.251 178.251 177.501 0.750 17934 13560 1 19 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.152 0.106 17934 13561 1 19 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.126 -0.149 17934 13562 1 19 . 1 1 128 128 ASN H H 128 8.207 8.207 8.543 -0.336 17934 13563 1 19 . 1 1 129 129 LEU N N 129 122.549 122.549 120.522 2.027 17934 13564 1 19 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.593 0.617 17934 13565 1 19 . 1 1 129 129 LEU C C 129 178.003 178.003 178.484 -0.481 17934 13566 1 19 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.165 0.025 17934 13567 1 19 . 1 1 129 129 LEU CB C 129 41.790 41.790 41.537 0.253 17934 13568 1 19 . 1 1 129 129 LEU H H 129 8.223 8.223 7.854 0.369 17934 13569 1 19 . 1 1 130 130 ALA N N 130 120.036 120.036 121.550 -1.514 17934 13570 1 19 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.706 -0.396 17934 13571 1 19 . 1 1 130 130 ALA C C 130 178.172 178.172 179.043 -0.871 17934 13572 1 19 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.255 0.525 17934 13573 1 19 . 1 1 130 130 ALA CB C 130 19.070 19.070 17.889 1.181 17934 13574 1 19 . 1 1 130 130 ALA H H 130 7.360 7.360 8.342 -0.982 17934 13575 1 19 . 1 1 131 131 ALA N N 131 116.989 116.989 119.188 -2.199 17934 13576 1 19 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.841 -0.131 17934 13577 1 19 . 1 1 131 131 ALA C C 131 180.163 180.163 179.538 0.625 17934 13578 1 19 . 1 1 131 131 ALA CA C 131 55.780 55.780 55.037 0.743 17934 13579 1 19 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.010 -0.180 17934 13580 1 19 . 1 1 131 131 ALA H H 131 7.360 7.360 8.254 -0.894 17934 13581 1 19 . 1 1 132 132 GLU N N 132 119.462 119.462 119.240 0.222 17934 13582 1 19 . 1 1 132 132 GLU HA H 132 3.888 3.888 4.083 -0.195 17934 13583 1 19 . 1 1 132 132 GLU C C 132 179.243 179.243 178.823 0.420 17934 13584 1 19 . 1 1 132 132 GLU CA C 132 59.539 59.539 58.787 0.752 17934 13585 1 19 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.605 -0.066 17934 13586 1 19 . 1 1 132 132 GLU H H 132 7.673 7.673 7.876 -0.203 17934 13587 1 19 . 1 1 133 133 ILE N N 133 123.218 123.218 121.016 2.202 17934 13588 1 19 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.625 -0.845 17934 13589 1 19 . 1 1 133 133 ILE C C 133 177.421 177.421 178.196 -0.775 17934 13590 1 19 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.359 1.131 17934 13591 1 19 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.470 -0.820 17934 13592 1 19 . 1 1 133 133 ILE H H 133 8.154 8.154 8.192 -0.038 17934 13593 1 19 . 1 1 134 134 ILE N N 134 118.244 118.244 119.750 -1.506 17934 13594 1 19 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.442 0.098 17934 13595 1 19 . 1 1 134 134 ILE C C 134 179.385 179.385 177.799 1.586 17934 13596 1 19 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.615 -1.335 17934 13597 1 19 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.975 -0.875 17934 13598 1 19 . 1 1 134 134 ILE H H 134 7.376 7.376 8.107 -0.731 17934 13599 1 19 . 1 1 135 135 LEU N N 135 123.061 123.061 120.603 2.458 17934 13600 1 19 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.765 0.425 17934 13601 1 19 . 1 1 135 135 LEU C C 135 179.858 179.858 178.944 0.914 17934 13602 1 19 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.541 -0.351 17934 13603 1 19 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.819 0.041 17934 13604 1 19 . 1 1 135 135 LEU H H 135 8.036 8.036 8.038 -0.002 17934 13605 1 19 . 1 1 136 136 THR N N 136 119.647 119.647 114.492 5.155 17934 13606 1 19 . 1 1 136 136 THR HA H 136 3.725 3.725 3.998 -0.273 17934 13607 1 19 . 1 1 136 136 THR C C 136 176.088 176.088 176.965 -0.877 17934 13608 1 19 . 1 1 136 136 THR CA C 136 58.601 58.601 66.359 -7.758 17934 13609 1 19 . 1 1 136 136 THR CB C 136 67.976 67.976 68.777 -0.801 17934 13610 1 19 . 1 1 136 136 THR H H 136 8.508 8.508 8.215 0.293 17934 13611 1 19 . 1 1 137 137 LEU N N 137 123.182 123.182 121.248 1.934 17934 13612 1 19 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.826 -0.086 17934 13613 1 19 . 1 1 137 137 LEU C C 137 178.341 178.341 178.831 -0.490 17934 13614 1 19 . 1 1 137 137 LEU CA C 137 58.260 58.260 57.833 0.427 17934 13615 1 19 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.507 0.043 17934 13616 1 19 . 1 1 137 137 LEU H H 137 8.520 8.520 8.283 0.237 17934 13617 1 19 . 1 1 138 138 GLY N N 138 105.266 105.266 105.498 -0.232 17934 13618 1 19 . 1 1 138 138 GLY C C 138 176.973 176.973 176.085 0.888 17934 13619 1 19 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.013 0.338 17934 13620 1 19 . 1 1 138 138 GLY H H 138 7.858 7.858 8.127 -0.269 17934 13621 1 19 . 1 1 139 139 GLN N N 139 123.485 123.485 122.409 1.076 17934 13622 1 19 . 1 1 139 139 GLN C C 139 177.891 177.891 178.269 -0.378 17934 13623 1 19 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.874 -0.273 17934 13624 1 19 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.619 -0.486 17934 13625 1 19 . 1 1 139 139 GLN H H 139 8.195 8.195 8.570 -0.375 17934 13626 1 19 . 1 1 140 140 ALA N N 140 122.754 122.754 120.604 2.150 17934 13627 1 19 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.203 -0.494 17934 13628 1 19 . 1 1 140 140 ALA C C 140 178.987 178.987 178.993 -0.006 17934 13629 1 19 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.551 1.229 17934 13630 1 19 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.492 -1.082 17934 13631 1 19 . 1 1 140 140 ALA H H 140 8.530 8.530 8.561 -0.031 17934 13632 1 19 . 1 1 141 141 PHE N N 141 116.275 116.275 119.696 -3.421 17934 13633 1 19 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.436 -0.346 17934 13634 1 19 . 1 1 141 141 PHE C C 141 178.129 178.129 176.949 1.180 17934 13635 1 19 . 1 1 141 141 PHE CA C 141 61.240 61.240 60.649 0.591 17934 13636 1 19 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.513 -0.130 17934 13637 1 19 . 1 1 141 141 PHE H H 141 7.920 7.920 8.269 -0.349 17934 13638 1 19 . 1 1 142 142 GLU N N 142 119.967 119.967 120.184 -0.217 17934 13639 1 19 . 1 1 142 142 GLU HA H 142 4.227 4.227 4.091 0.136 17934 13640 1 19 . 1 1 142 142 GLU C C 142 179.250 179.250 177.965 1.285 17934 13641 1 19 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.490 1.049 17934 13642 1 19 . 1 1 142 142 GLU CB C 142 29.539 29.539 30.262 -0.723 17934 13643 1 19 . 1 1 142 142 GLU H H 142 7.713 7.713 8.465 -0.752 17934 13644 1 19 . 1 1 143 143 VAL N N 143 120.189 120.189 119.544 0.645 17934 13645 1 19 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.748 -0.065 17934 13646 1 19 . 1 1 143 143 VAL C C 143 178.066 178.066 176.205 1.861 17934 13647 1 19 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.628 1.942 17934 13648 1 19 . 1 1 143 143 VAL CB C 143 31.883 31.883 32.375 -0.492 17934 13649 1 19 . 1 1 143 143 VAL H H 143 8.608 8.608 7.947 0.661 17934 13650 1 19 . 1 1 144 144 ALA N N 144 121.753 121.753 119.065 2.688 17934 13651 1 19 . 1 1 144 144 ALA HA H 144 4.000 4.000 3.963 0.037 17934 13652 1 19 . 1 1 144 144 ALA C C 144 180.776 180.776 177.546 3.230 17934 13653 1 19 . 1 1 144 144 ALA CA C 144 55.780 55.780 52.759 3.021 17934 13654 1 19 . 1 1 144 144 ALA CB C 144 18.770 18.770 16.690 2.080 17934 13655 1 19 . 1 1 144 144 ALA H H 144 8.399 8.399 7.510 0.889 17934 13656 1 19 . 1 1 145 145 TYR N N 145 119.962 119.962 118.924 1.038 17934 13657 1 19 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.081 0.109 17934 13658 1 19 . 1 1 145 145 TYR C C 145 177.645 177.645 177.027 0.618 17934 13659 1 19 . 1 1 145 145 TYR CA C 145 60.880 60.880 60.221 0.659 17934 13660 1 19 . 1 1 145 145 TYR CB C 145 37.980 37.980 38.585 -0.605 17934 13661 1 19 . 1 1 145 145 TYR H H 145 8.190 8.190 8.319 -0.129 17934 13662 1 20 . 1 1 13 13 LYS N N 13 120.778 120.778 120.717 0.061 17934 13663 1 20 . 1 1 13 13 LYS C C 13 176.476 176.476 178.065 -1.589 17934 13664 1 20 . 1 1 13 13 LYS CA C 13 58.601 58.601 56.900 1.701 17934 13665 1 20 . 1 1 13 13 LYS CB C 13 32.820 32.820 32.785 0.035 17934 13666 1 20 . 1 1 13 13 LYS H H 13 7.984 7.984 8.058 -0.074 17934 13667 1 20 . 1 1 15 15 ILE HA H 15 3.820 3.820 3.876 -0.056 17934 13668 1 20 . 1 1 15 15 ILE C C 15 176.376 176.376 176.051 0.325 17934 13669 1 20 . 1 1 15 15 ILE CA C 15 63.570 63.570 62.330 1.240 17934 13670 1 20 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.571 1.809 17934 13671 1 20 . 1 1 16 16 ALA N N 16 121.364 121.364 120.069 1.295 17934 13672 1 20 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.443 -0.005 17934 13673 1 20 . 1 1 16 16 ALA C C 16 177.494 177.494 177.715 -0.221 17934 13674 1 20 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.616 0.360 17934 13675 1 20 . 1 1 16 16 ALA CB C 16 20.333 20.333 20.383 -0.050 17934 13676 1 20 . 1 1 16 16 ALA H H 16 8.081 8.081 7.898 0.183 17934 13677 1 20 . 1 1 17 17 GLN N N 17 118.109 118.109 116.273 1.836 17934 13678 1 20 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.566 0.007 17934 13679 1 20 . 1 1 17 17 GLN C C 17 173.632 173.632 174.724 -1.092 17934 13680 1 20 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.021 -0.170 17934 13681 1 20 . 1 1 17 17 GLN CB C 17 30.477 30.477 31.261 -0.784 17934 13682 1 20 . 1 1 17 17 GLN H H 17 7.550 7.550 8.227 -0.677 17934 13683 1 20 . 1 1 18 18 SER N N 18 112.384 112.384 114.682 -2.298 17934 13684 1 20 . 1 1 18 18 SER HA H 18 4.388 4.388 4.778 -0.390 17934 13685 1 20 . 1 1 18 18 SER C C 18 173.780 173.780 173.291 0.489 17934 13686 1 20 . 1 1 18 18 SER CA C 18 57.664 57.664 56.943 0.721 17934 13687 1 20 . 1 1 18 18 SER CB C 18 65.164 65.164 65.225 -0.061 17934 13688 1 20 . 1 1 18 18 SER H H 18 7.666 7.666 7.888 -0.222 17934 13689 1 20 . 1 1 19 19 CYS N N 19 120.116 120.116 122.478 -2.362 17934 13690 1 20 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.393 -0.063 17934 13691 1 20 . 1 1 19 19 CYS C C 19 180.387 180.387 172.646 7.741 17934 13692 1 20 . 1 1 19 19 CYS CA C 19 58.601 58.601 59.242 -0.641 17934 13693 1 20 . 1 1 19 19 CYS CB C 19 30.008 30.008 31.255 -1.247 17934 13694 1 20 . 1 1 19 19 CYS H H 19 8.835 8.835 8.805 0.030 17934 13695 1 20 . 1 1 20 20 ASP N N 20 124.416 124.416 122.013 2.403 17934 13696 1 20 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.297 -0.321 17934 13697 1 20 . 1 1 20 20 ASP CB C 20 42.195 42.195 44.408 -2.213 17934 13698 1 20 . 1 1 20 20 ASP H H 20 7.847 7.847 7.937 -0.090 17934 13699 1 20 . 1 1 21 21 TYR N N 21 121.296 121.296 119.126 2.170 17934 13700 1 20 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.834 -0.104 17934 13701 1 20 . 1 1 21 21 TYR C C 21 175.793 175.793 173.842 1.951 17934 13702 1 20 . 1 1 21 21 TYR CA C 21 57.200 57.200 55.216 1.984 17934 13703 1 20 . 1 1 21 21 TYR CB C 21 43.240 43.240 41.084 2.156 17934 13704 1 20 . 1 1 21 21 TYR H H 21 9.070 9.070 9.003 0.067 17934 13705 1 20 . 1 1 22 22 LYS N N 22 122.820 122.820 121.469 1.351 17934 13706 1 20 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.147 0.045 17934 13707 1 20 . 1 1 22 22 LYS C C 22 175.793 175.793 175.333 0.460 17934 13708 1 20 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.593 0.665 17934 13709 1 20 . 1 1 22 22 LYS CB C 22 33.758 33.758 34.163 -0.405 17934 13710 1 20 . 1 1 22 22 LYS H H 22 8.711 8.711 8.676 0.035 17934 13711 1 20 . 1 1 23 23 ALA N N 23 123.073 123.073 126.607 -3.534 17934 13712 1 20 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.819 -0.089 17934 13713 1 20 . 1 1 23 23 ALA C C 23 174.515 174.515 175.557 -1.042 17934 13714 1 20 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.293 1.277 17934 13715 1 20 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.956 -1.327 17934 13716 1 20 . 1 1 23 23 ALA H H 23 8.727 8.727 8.717 0.010 17934 13717 1 20 . 1 1 24 24 ALA N N 24 122.486 122.486 124.757 -2.271 17934 13718 1 20 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.782 0.399 17934 13719 1 20 . 1 1 24 24 ALA C C 24 176.835 176.835 176.352 0.483 17934 13720 1 20 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.286 0.284 17934 13721 1 20 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.216 -0.096 17934 13722 1 20 . 1 1 24 24 ALA H H 24 8.675 8.675 9.042 -0.367 17934 13723 1 20 . 1 1 25 25 TYR N N 25 122.698 122.698 126.396 -3.698 17934 13724 1 20 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.544 0.466 17934 13725 1 20 . 1 1 25 25 TYR CA C 25 54.340 54.340 55.393 -1.053 17934 13726 1 20 . 1 1 25 25 TYR CB C 25 39.850 39.850 37.480 2.370 17934 13727 1 20 . 1 1 25 25 TYR H H 25 8.270 8.270 8.557 -0.287 17934 13728 1 20 . 1 1 26 26 LEU N N 26 127.997 127.997 128.924 -0.927 17934 13729 1 20 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.132 -0.212 17934 13730 1 20 . 1 1 26 26 LEU C C 26 175.983 175.983 176.638 -0.655 17934 13731 1 20 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.625 0.101 17934 13732 1 20 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.024 -1.954 17934 13733 1 20 . 1 1 26 26 LEU H H 26 8.700 8.700 8.307 0.393 17934 13734 1 20 . 1 1 27 27 GLY N N 27 102.901 102.901 101.631 1.270 17934 13735 1 20 . 1 1 27 27 GLY C C 27 176.219 176.219 171.490 4.729 17934 13736 1 20 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.188 -1.587 17934 13737 1 20 . 1 1 27 27 GLY H H 27 5.891 5.891 8.170 -2.279 17934 13738 1 20 . 1 1 28 28 SER N N 28 111.551 111.551 113.583 -2.032 17934 13739 1 20 . 1 1 28 28 SER HA H 28 5.785 5.785 5.447 0.338 17934 13740 1 20 . 1 1 28 28 SER CA C 28 56.258 56.258 57.593 -1.335 17934 13741 1 20 . 1 1 28 28 SER CB C 28 65.632 65.632 66.589 -0.957 17934 13742 1 20 . 1 1 28 28 SER H H 28 7.981 7.981 8.450 -0.469 17934 13743 1 20 . 1 1 29 29 MET N N 29 119.493 119.493 121.503 -2.010 17934 13744 1 20 . 1 1 29 29 MET HA H 29 4.725 4.725 4.743 -0.018 17934 13745 1 20 . 1 1 29 29 MET C C 29 174.143 174.143 174.331 -0.188 17934 13746 1 20 . 1 1 29 29 MET CA C 29 54.036 54.036 54.047 -0.011 17934 13747 1 20 . 1 1 29 29 MET CB C 29 37.268 37.268 36.396 0.872 17934 13748 1 20 . 1 1 29 29 MET H H 29 8.704 8.704 8.825 -0.121 17934 13749 1 20 . 1 1 30 30 LEU N N 30 128.150 128.150 124.609 3.541 17934 13750 1 20 . 1 1 30 30 LEU HA H 30 3.785 3.785 4.041 -0.256 17934 13751 1 20 . 1 1 30 30 LEU C C 30 175.857 175.857 175.298 0.559 17934 13752 1 20 . 1 1 30 30 LEU CA C 30 56.250 56.250 54.766 1.484 17934 13753 1 20 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.816 0.844 17934 13754 1 20 . 1 1 30 30 LEU H H 30 8.630 8.630 8.435 0.195 17934 13755 1 20 . 1 1 31 31 ILE N N 31 127.723 127.723 128.393 -0.670 17934 13756 1 20 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.295 -0.105 17934 13757 1 20 . 1 1 31 31 ILE C C 31 174.881 174.881 174.809 0.072 17934 13758 1 20 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.062 -1.401 17934 13759 1 20 . 1 1 31 31 ILE CB C 31 37.110 37.110 37.087 0.023 17934 13760 1 20 . 1 1 31 31 ILE H H 31 8.560 8.560 8.651 -0.091 17934 13761 1 20 . 1 1 32 32 LYS HA H 32 4.055 4.055 4.399 -0.344 17934 13762 1 20 . 1 1 32 32 LYS C C 32 176.272 176.272 176.816 -0.544 17934 13763 1 20 . 1 1 32 32 LYS CA C 32 58.601 58.601 56.285 2.316 17934 13764 1 20 . 1 1 32 32 LYS CB C 32 32.820 32.820 33.041 -0.221 17934 13765 1 20 . 1 1 33 33 GLU N N 33 118.638 118.638 116.044 2.594 17934 13766 1 20 . 1 1 33 33 GLU HA H 33 4.388 4.388 3.935 0.453 17934 13767 1 20 . 1 1 33 33 GLU C C 33 173.962 173.962 175.638 -1.676 17934 13768 1 20 . 1 1 33 33 GLU CA C 33 54.851 54.851 57.058 -2.207 17934 13769 1 20 . 1 1 33 33 GLU CB C 33 30.945 30.945 27.782 3.163 17934 13770 1 20 . 1 1 33 33 GLU H H 33 7.723 7.723 8.746 -1.023 17934 13771 1 20 . 1 1 34 34 LEU N N 34 126.535 126.535 118.556 7.979 17934 13772 1 20 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.287 -0.342 17934 13773 1 20 . 1 1 34 34 LEU C C 34 176.870 176.870 176.487 0.383 17934 13774 1 20 . 1 1 34 34 LEU CA C 34 54.850 54.850 55.669 -0.819 17934 13775 1 20 . 1 1 34 34 LEU CB C 34 41.720 41.720 41.791 -0.071 17934 13776 1 20 . 1 1 34 34 LEU H H 34 8.446 8.446 7.332 1.114 17934 13777 1 20 . 1 1 35 35 ARG N N 35 128.447 128.447 124.722 3.725 17934 13778 1 20 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.581 -0.026 17934 13779 1 20 . 1 1 35 35 ARG C C 35 176.110 176.110 175.498 0.612 17934 13780 1 20 . 1 1 35 35 ARG CA C 35 54.851 54.851 55.104 -0.253 17934 13781 1 20 . 1 1 35 35 ARG CB C 35 30.477 30.477 30.242 0.235 17934 13782 1 20 . 1 1 35 35 ARG H H 35 8.680 8.680 8.345 0.335 17934 13783 1 20 . 1 1 36 36 GLY N N 36 107.406 107.406 112.769 -5.363 17934 13784 1 20 . 1 1 36 36 GLY CA C 36 45.906 45.906 44.624 1.282 17934 13785 1 20 . 1 1 36 36 GLY H H 36 7.182 7.182 8.057 -0.875 17934 13786 1 20 . 1 1 37 37 THR HA H 37 4.060 4.060 4.049 0.011 17934 13787 1 20 . 1 1 37 37 THR C C 37 176.634 176.634 175.616 1.018 17934 13788 1 20 . 1 1 37 37 THR CA C 37 65.632 65.632 63.224 2.408 17934 13789 1 20 . 1 1 37 37 THR CB C 37 68.445 68.445 69.066 -0.621 17934 13790 1 20 . 1 1 38 38 GLU N N 38 122.251 122.251 122.536 -0.285 17934 13791 1 20 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.957 0.169 17934 13792 1 20 . 1 1 38 38 GLU C C 38 179.981 179.981 178.148 1.833 17934 13793 1 20 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.477 0.530 17934 13794 1 20 . 1 1 38 38 GLU CB C 38 29.539 29.539 28.831 0.708 17934 13795 1 20 . 1 1 38 38 GLU H H 38 8.450 8.450 8.698 -0.248 17934 13796 1 20 . 1 1 39 39 SER N N 39 115.966 115.966 113.154 2.812 17934 13797 1 20 . 1 1 39 39 SER C C 39 175.991 175.991 176.515 -0.524 17934 13798 1 20 . 1 1 39 39 SER CA C 39 62.820 62.820 61.574 1.246 17934 13799 1 20 . 1 1 39 39 SER H H 39 7.522 7.522 7.818 -0.296 17934 13800 1 20 . 1 1 40 40 THR HA H 40 4.049 4.049 3.870 0.179 17934 13801 1 20 . 1 1 40 40 THR C C 40 175.972 175.972 176.890 -0.918 17934 13802 1 20 . 1 1 40 40 THR CA C 40 66.101 66.101 65.049 1.052 17934 13803 1 20 . 1 1 40 40 THR CB C 40 67.976 67.976 68.367 -0.391 17934 13804 1 20 . 1 1 41 41 GLN N N 41 120.354 120.354 120.257 0.097 17934 13805 1 20 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.089 -0.330 17934 13806 1 20 . 1 1 41 41 GLN C C 41 178.483 178.483 177.922 0.561 17934 13807 1 20 . 1 1 41 41 GLN CA C 41 60.476 60.476 58.271 2.205 17934 13808 1 20 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.139 -0.006 17934 13809 1 20 . 1 1 41 41 GLN H H 41 8.271 8.271 8.555 -0.284 17934 13810 1 20 . 1 1 42 42 ASP N N 42 120.757 120.757 121.239 -0.482 17934 13811 1 20 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.385 -0.026 17934 13812 1 20 . 1 1 42 42 ASP C C 42 177.480 177.480 177.702 -0.222 17934 13813 1 20 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.652 0.012 17934 13814 1 20 . 1 1 42 42 ASP CB C 42 42.195 42.195 41.141 1.054 17934 13815 1 20 . 1 1 42 42 ASP H H 42 7.954 7.954 8.195 -0.241 17934 13816 1 20 . 1 1 43 43 ALA N N 43 120.587 120.587 122.334 -1.747 17934 13817 1 20 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.217 -0.227 17934 13818 1 20 . 1 1 43 43 ALA C C 43 179.767 179.767 179.649 0.118 17934 13819 1 20 . 1 1 43 43 ALA CA C 43 55.320 55.320 55.111 0.209 17934 13820 1 20 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.352 0.878 17934 13821 1 20 . 1 1 43 43 ALA H H 43 7.842 7.842 8.433 -0.591 17934 13822 1 20 . 1 1 44 44 CYS N N 44 115.428 115.428 117.148 -1.720 17934 13823 1 20 . 1 1 44 44 CYS HA H 44 3.895 3.895 4.072 -0.177 17934 13824 1 20 . 1 1 44 44 CYS C C 44 176.076 176.076 176.557 -0.481 17934 13825 1 20 . 1 1 44 44 CYS CA C 44 64.695 64.695 62.259 2.436 17934 13826 1 20 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.286 0.378 17934 13827 1 20 . 1 1 44 44 CYS H H 44 7.900 7.900 8.563 -0.663 17934 13828 1 20 . 1 1 45 45 ALA N N 45 120.487 120.487 123.608 -3.121 17934 13829 1 20 . 1 1 45 45 ALA HA H 45 4.000 4.000 4.007 -0.007 17934 13830 1 20 . 1 1 45 45 ALA C C 45 173.506 173.506 178.712 -5.206 17934 13831 1 20 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.233 0.087 17934 13832 1 20 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.548 -0.608 17934 13833 1 20 . 1 1 45 45 ALA H H 45 7.250 7.250 8.085 -0.835 17934 13834 1 20 . 1 1 46 46 LYS N N 46 119.267 119.267 119.430 -0.163 17934 13835 1 20 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.924 0.023 17934 13836 1 20 . 1 1 46 46 LYS C C 46 179.561 179.561 178.730 0.831 17934 13837 1 20 . 1 1 46 46 LYS H H 46 8.102 8.102 8.235 -0.133 17934 13838 1 20 . 1 1 47 47 MET N N 47 118.009 118.009 119.563 -1.554 17934 13839 1 20 . 1 1 47 47 MET HA H 47 4.214 4.214 4.109 0.105 17934 13840 1 20 . 1 1 47 47 MET C C 47 179.526 179.526 178.078 1.448 17934 13841 1 20 . 1 1 47 47 MET CA C 47 57.195 57.195 58.718 -1.524 17934 13842 1 20 . 1 1 47 47 MET CB C 47 30.945 30.945 32.855 -1.910 17934 13843 1 20 . 1 1 47 47 MET H H 47 8.585 8.585 8.410 0.175 17934 13844 1 20 . 1 1 48 48 ARG N N 48 119.962 119.962 119.503 0.459 17934 13845 1 20 . 1 1 48 48 ARG HA H 48 3.856 3.856 4.047 -0.191 17934 13846 1 20 . 1 1 48 48 ARG C C 48 178.875 178.875 178.532 0.343 17934 13847 1 20 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.018 1.927 17934 13848 1 20 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.927 0.550 17934 13849 1 20 . 1 1 48 48 ARG H H 48 8.190 8.190 8.387 -0.197 17934 13850 1 20 . 1 1 49 49 ALA N N 49 120.640 120.640 121.044 -0.404 17934 13851 1 20 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.463 -0.720 17934 13852 1 20 . 1 1 49 49 ALA C C 49 180.169 180.169 178.894 1.275 17934 13853 1 20 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.390 0.461 17934 13854 1 20 . 1 1 49 49 ALA CB C 49 17.821 17.821 18.516 -0.695 17934 13855 1 20 . 1 1 49 49 ALA H H 49 7.671 7.671 8.410 -0.739 17934 13856 1 20 . 1 1 50 50 ASN N N 50 116.063 116.063 116.175 -0.112 17934 13857 1 20 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.721 -0.247 17934 13858 1 20 . 1 1 50 50 ASN C C 50 177.084 177.084 176.641 0.443 17934 13859 1 20 . 1 1 50 50 ASN CA C 50 55.789 55.789 54.654 1.135 17934 13860 1 20 . 1 1 50 50 ASN CB C 50 38.914 38.914 39.225 -0.311 17934 13861 1 20 . 1 1 50 50 ASN H H 50 7.893 7.893 7.931 -0.038 17934 13862 1 20 . 1 1 51 51 CYS N N 51 116.884 116.884 118.797 -1.913 17934 13863 1 20 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.337 -0.031 17934 13864 1 20 . 1 1 51 51 CYS C C 51 175.002 175.002 176.386 -1.384 17934 13865 1 20 . 1 1 51 51 CYS CA C 51 61.414 61.414 61.294 0.120 17934 13866 1 20 . 1 1 51 51 CYS CB C 51 27.664 27.664 28.814 -1.150 17934 13867 1 20 . 1 1 51 51 CYS H H 51 7.770 7.770 8.450 -0.680 17934 13868 1 20 . 1 1 52 52 GLN N N 52 117.831 117.831 120.622 -2.791 17934 13869 1 20 . 1 1 52 52 GLN HA H 52 4.228 4.228 3.947 0.281 17934 13870 1 20 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.398 -1.672 17934 13871 1 20 . 1 1 52 52 GLN CB C 52 29.070 29.070 27.826 1.244 17934 13872 1 20 . 1 1 52 52 GLN H H 52 7.796 7.796 8.075 -0.279 17934 13873 1 20 . 1 1 53 53 LYS N N 53 118.841 118.841 117.987 0.854 17934 13874 1 20 . 1 1 53 53 LYS CA C 53 57.195 57.195 58.191 -0.996 17934 13875 1 20 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.418 0.871 17934 13876 1 20 . 1 1 53 53 LYS H H 53 7.686 7.686 8.068 -0.382 17934 13877 1 20 . 1 1 55 55 THR HA H 55 4.304 4.304 4.232 0.072 17934 13878 1 20 . 1 1 55 55 THR CA C 55 63.757 63.757 63.267 0.490 17934 13879 1 20 . 1 1 55 55 THR CB C 55 68.914 68.914 68.408 0.506 17934 13880 1 20 . 1 1 56 56 GLU N N 56 120.861 120.861 120.956 -0.095 17934 13881 1 20 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.101 0.046 17934 13882 1 20 . 1 1 56 56 GLU C C 56 177.656 177.656 177.324 0.332 17934 13883 1 20 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.746 -0.613 17934 13884 1 20 . 1 1 56 56 GLU CB C 56 30.008 30.008 29.316 0.692 17934 13885 1 20 . 1 1 56 56 GLU H H 56 8.311 8.311 8.555 -0.244 17934 13886 1 20 . 1 1 57 57 GLN N N 57 118.397 118.397 118.292 0.105 17934 13887 1 20 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.155 -0.013 17934 13888 1 20 . 1 1 57 57 GLN C C 57 177.275 177.275 177.305 -0.030 17934 13889 1 20 . 1 1 57 57 GLN CA C 57 57.664 57.664 58.130 -0.466 17934 13890 1 20 . 1 1 57 57 GLN CB C 57 29.070 29.070 29.226 -0.155 17934 13891 1 20 . 1 1 57 57 GLN H H 57 7.899 7.899 7.783 0.116 17934 13892 1 20 . 1 1 58 58 MET N N 58 118.897 118.897 114.785 4.112 17934 13893 1 20 . 1 1 58 58 MET HA H 58 4.350 4.350 4.433 -0.083 17934 13894 1 20 . 1 1 58 58 MET C C 58 177.172 177.172 176.760 0.412 17934 13895 1 20 . 1 1 58 58 MET CA C 58 56.726 56.726 56.634 0.092 17934 13896 1 20 . 1 1 58 58 MET CB C 58 32.196 32.196 33.483 -1.287 17934 13897 1 20 . 1 1 58 58 MET H H 58 8.036 8.036 7.631 0.405 17934 13898 1 20 . 1 1 59 59 LYS N N 59 119.779 119.779 119.033 0.746 17934 13899 1 20 . 1 1 59 59 LYS HA H 59 4.231 4.231 3.955 0.276 17934 13900 1 20 . 1 1 59 59 LYS C C 59 176.676 176.676 174.822 1.854 17934 13901 1 20 . 1 1 59 59 LYS CA C 59 57.195 57.195 57.753 -0.558 17934 13902 1 20 . 1 1 59 59 LYS CB C 59 32.820 32.820 29.865 2.955 17934 13903 1 20 . 1 1 59 59 LYS H H 59 7.901 7.901 8.301 -0.400 17934 13904 1 20 . 1 1 60 60 LYS N N 60 119.993 119.993 114.714 5.279 17934 13905 1 20 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.379 -0.044 17934 13906 1 20 . 1 1 60 60 LYS C C 60 176.336 176.336 173.589 2.747 17934 13907 1 20 . 1 1 60 60 LYS CA C 60 56.258 56.258 55.730 0.528 17934 13908 1 20 . 1 1 60 60 LYS CB C 60 32.820 32.820 35.093 -2.273 17934 13909 1 20 . 1 1 60 60 LYS H H 60 7.877 7.877 7.380 0.497 17934 13910 1 20 . 1 1 61 61 VAL N N 61 122.649 122.649 117.950 4.699 17934 13911 1 20 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.659 -0.279 17934 13912 1 20 . 1 1 61 61 VAL C C 61 174.210 174.210 174.256 -0.046 17934 13913 1 20 . 1 1 61 61 VAL CA C 61 60.000 60.000 59.319 0.681 17934 13914 1 20 . 1 1 61 61 VAL CB C 61 32.350 32.350 33.094 -0.744 17934 13915 1 20 . 1 1 61 61 VAL H H 61 7.708 7.708 8.450 -0.742 17934 13916 1 20 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.725 -0.062 17934 13917 1 20 . 1 1 62 62 PRO C C 62 176.656 176.656 175.864 0.792 17934 13918 1 20 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.650 0.170 17934 13919 1 20 . 1 1 62 62 PRO CB C 62 31.883 31.883 33.140 -1.257 17934 13920 1 20 . 1 1 63 63 THR N N 63 117.155 117.155 115.932 1.223 17934 13921 1 20 . 1 1 63 63 THR HA H 63 4.830 4.830 4.864 -0.034 17934 13922 1 20 . 1 1 63 63 THR C C 63 174.682 174.682 173.273 1.409 17934 13923 1 20 . 1 1 63 63 THR CA C 63 62.820 62.820 61.301 1.519 17934 13924 1 20 . 1 1 63 63 THR CB C 63 69.382 69.382 71.002 -1.621 17934 13925 1 20 . 1 1 63 63 THR H H 63 8.303 8.303 8.604 -0.301 17934 13926 1 20 . 1 1 64 64 ILE N N 64 121.004 121.004 120.923 0.081 17934 13927 1 20 . 1 1 64 64 ILE CA C 64 58.600 58.600 59.102 -0.502 17934 13928 1 20 . 1 1 64 64 ILE CB C 64 42.690 42.690 42.051 0.639 17934 13929 1 20 . 1 1 64 64 ILE H H 64 9.348 9.348 8.644 0.704 17934 13930 1 20 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.092 0.648 17934 13931 1 20 . 1 1 65 65 ILE C C 65 175.378 175.378 174.706 0.672 17934 13932 1 20 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.359 -1.279 17934 13933 1 20 . 1 1 65 65 ILE CB C 65 38.750 38.750 38.191 0.559 17934 13934 1 20 . 1 1 66 66 LEU N N 66 110.343 110.343 129.398 -19.055 17934 13935 1 20 . 1 1 66 66 LEU HA H 66 4.850 4.850 5.002 -0.152 17934 13936 1 20 . 1 1 66 66 LEU C C 66 174.982 174.982 175.586 -0.604 17934 13937 1 20 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.352 -0.443 17934 13938 1 20 . 1 1 66 66 LEU CB C 66 44.230 44.230 44.555 -0.325 17934 13939 1 20 . 1 1 66 66 LEU H H 66 9.610 9.610 9.256 0.354 17934 13940 1 20 . 1 1 67 67 SER N N 67 120.990 120.990 119.939 1.051 17934 13941 1 20 . 1 1 67 67 SER HA H 67 5.405 5.405 4.996 0.409 17934 13942 1 20 . 1 1 67 67 SER C C 67 174.405 174.405 172.940 1.465 17934 13943 1 20 . 1 1 67 67 SER CA C 67 57.195 57.195 56.975 0.220 17934 13944 1 20 . 1 1 67 67 SER CB C 67 64.695 64.695 64.373 0.322 17934 13945 1 20 . 1 1 67 67 SER H H 67 9.260 9.260 9.235 0.025 17934 13946 1 20 . 1 1 68 68 VAL N N 68 128.176 128.176 125.971 2.205 17934 13947 1 20 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.397 0.096 17934 13948 1 20 . 1 1 68 68 VAL C C 68 173.891 173.891 173.617 0.274 17934 13949 1 20 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.937 1.413 17934 13950 1 20 . 1 1 68 68 VAL CB C 68 33.750 33.750 34.774 -1.024 17934 13951 1 20 . 1 1 68 68 VAL H H 68 9.225 9.225 8.661 0.564 17934 13952 1 20 . 1 1 69 69 SER N N 69 121.697 121.697 123.471 -1.774 17934 13953 1 20 . 1 1 69 69 SER HA H 69 4.837 4.837 4.876 -0.039 17934 13954 1 20 . 1 1 69 69 SER C C 69 173.188 173.188 174.782 -1.594 17934 13955 1 20 . 1 1 69 69 SER CA C 69 57.195 57.195 56.193 1.002 17934 13956 1 20 . 1 1 69 69 SER CB C 69 67.976 67.976 65.382 2.594 17934 13957 1 20 . 1 1 69 69 SER H H 69 8.869 8.869 8.117 0.752 17934 13958 1 20 . 1 1 70 70 ALA N N 70 118.689 118.689 129.341 -10.652 17934 13959 1 20 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.287 -0.137 17934 13960 1 20 . 1 1 70 70 ALA C C 70 176.714 176.714 177.037 -0.323 17934 13961 1 20 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.242 -0.333 17934 13962 1 20 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.907 -0.307 17934 13963 1 20 . 1 1 70 70 ALA H H 70 8.810 8.810 9.078 -0.268 17934 13964 1 20 . 1 1 71 71 LYS N N 71 112.633 112.633 116.141 -3.508 17934 13965 1 20 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.350 -0.075 17934 13966 1 20 . 1 1 71 71 LYS C C 71 177.033 177.033 176.153 0.880 17934 13967 1 20 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.533 1.662 17934 13968 1 20 . 1 1 71 71 LYS CB C 71 33.289 33.289 32.929 0.360 17934 13969 1 20 . 1 1 71 71 LYS H H 71 7.830 7.830 7.605 0.225 17934 13970 1 20 . 1 1 72 72 GLY N N 72 108.432 108.432 107.578 0.854 17934 13971 1 20 . 1 1 72 72 GLY CA C 72 45.476 45.476 44.991 0.485 17934 13972 1 20 . 1 1 72 72 GLY H H 72 7.685 7.685 7.696 -0.011 17934 13973 1 20 . 1 1 73 73 VAL N N 73 120.414 120.414 116.704 3.710 17934 13974 1 20 . 1 1 73 73 VAL HA H 73 5.000 5.000 5.099 -0.099 17934 13975 1 20 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.488 0.982 17934 13976 1 20 . 1 1 73 73 VAL CB C 73 35.630 35.630 34.790 0.840 17934 13977 1 20 . 1 1 73 73 VAL H H 73 8.620 8.620 8.067 0.553 17934 13978 1 20 . 1 1 74 74 LYS N N 74 125.257 125.257 126.621 -1.364 17934 13979 1 20 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.716 0.300 17934 13980 1 20 . 1 1 74 74 LYS CA C 74 54.383 54.383 54.187 0.196 17934 13981 1 20 . 1 1 74 74 LYS CB C 74 36.570 36.570 36.372 0.198 17934 13982 1 20 . 1 1 74 74 LYS H H 74 8.783 8.783 8.018 0.765 17934 13983 1 20 . 1 1 75 75 PHE N N 75 119.414 119.414 118.691 0.723 17934 13984 1 20 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.332 0.368 17934 13985 1 20 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.623 -2.703 17934 13986 1 20 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.346 -0.736 17934 13987 1 20 . 1 1 75 75 PHE H H 75 8.432 8.432 8.978 -0.546 17934 13988 1 20 . 1 1 76 76 ILE N N 76 121.430 121.430 121.097 0.333 17934 13989 1 20 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.561 0.279 17934 13990 1 20 . 1 1 76 76 ILE C C 76 175.249 175.249 174.123 1.126 17934 13991 1 20 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.553 -0.483 17934 13992 1 20 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.828 -0.608 17934 13993 1 20 . 1 1 76 76 ILE H H 76 8.960 8.960 8.387 0.573 17934 13994 1 20 . 1 1 77 77 ASP N N 77 125.744 125.744 123.339 2.405 17934 13995 1 20 . 1 1 77 77 ASP HA H 77 4.563 4.563 4.913 -0.350 17934 13996 1 20 . 1 1 77 77 ASP C C 77 177.569 177.569 176.091 1.478 17934 13997 1 20 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.136 3.653 17934 13998 1 20 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.778 -0.177 17934 13999 1 20 . 1 1 77 77 ASP H H 77 8.750 8.750 8.025 0.725 17934 14000 1 20 . 1 1 78 78 ALA N N 78 128.632 128.632 127.841 0.791 17934 14001 1 20 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.307 -0.337 17934 14002 1 20 . 1 1 78 78 ALA C C 78 178.052 178.052 178.236 -0.184 17934 14003 1 20 . 1 1 78 78 ALA CA C 78 54.830 54.830 53.922 0.908 17934 14004 1 20 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.470 0.323 17934 14005 1 20 . 1 1 78 78 ALA H H 78 8.700 8.700 8.760 -0.060 17934 14006 1 20 . 1 1 79 79 THR N N 79 113.087 113.087 115.480 -2.393 17934 14007 1 20 . 1 1 79 79 THR HA H 79 4.194 4.194 4.201 -0.007 17934 14008 1 20 . 1 1 79 79 THR C C 79 175.587 175.587 176.048 -0.461 17934 14009 1 20 . 1 1 79 79 THR CA C 79 64.695 64.695 65.273 -0.578 17934 14010 1 20 . 1 1 79 79 THR CB C 79 69.382 69.382 69.009 0.373 17934 14011 1 20 . 1 1 79 79 THR H H 79 8.779 8.779 8.466 0.313 17934 14012 1 20 . 1 1 80 80 ASN N N 80 118.434 118.434 116.193 2.241 17934 14013 1 20 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.776 -0.039 17934 14014 1 20 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.432 1.013 17934 14015 1 20 . 1 1 80 80 ASN CB C 80 39.383 39.383 39.441 -0.058 17934 14016 1 20 . 1 1 80 80 ASN H H 80 8.584 8.584 7.892 0.692 17934 14017 1 20 . 1 1 81 81 LYS N N 81 112.429 112.429 117.222 -4.793 17934 14018 1 20 . 1 1 81 81 LYS C C 81 174.909 174.909 175.296 -0.387 17934 14019 1 20 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.575 0.089 17934 14020 1 20 . 1 1 81 81 LYS CB C 81 28.602 28.602 30.686 -2.084 17934 14021 1 20 . 1 1 81 81 LYS H H 81 7.966 7.966 8.212 -0.246 17934 14022 1 20 . 1 1 82 82 ASN N N 82 116.806 116.806 115.236 1.570 17934 14023 1 20 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.678 -0.088 17934 14024 1 20 . 1 1 82 82 ASN C C 82 174.999 174.999 174.183 0.816 17934 14025 1 20 . 1 1 82 82 ASN CA C 82 52.976 52.976 52.468 0.508 17934 14026 1 20 . 1 1 82 82 ASN CB C 82 38.445 38.445 39.464 -1.018 17934 14027 1 20 . 1 1 82 82 ASN H H 82 8.455 8.455 8.032 0.423 17934 14028 1 20 . 1 1 83 83 ILE N N 83 122.447 122.447 116.846 5.601 17934 14029 1 20 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.356 -0.326 17934 14030 1 20 . 1 1 83 83 ILE C C 83 176.572 176.572 175.689 0.883 17934 14031 1 20 . 1 1 83 83 ILE CA C 83 62.350 62.350 60.423 1.927 17934 14032 1 20 . 1 1 83 83 ILE CB C 83 37.970 37.970 37.203 0.767 17934 14033 1 20 . 1 1 83 83 ILE H H 83 8.650 8.650 8.449 0.201 17934 14034 1 20 . 1 1 84 84 ILE N N 84 129.339 129.339 128.313 1.026 17934 14035 1 20 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.090 -0.170 17934 14036 1 20 . 1 1 84 84 ILE C C 84 175.873 175.873 175.833 0.040 17934 14037 1 20 . 1 1 84 84 ILE CA C 84 62.810 62.810 62.464 0.346 17934 14038 1 20 . 1 1 84 84 ILE CB C 84 38.840 38.840 38.687 0.153 17934 14039 1 20 . 1 1 84 84 ILE H H 84 8.930 8.930 8.290 0.640 17934 14040 1 20 . 1 1 85 85 ALA N N 85 118.867 118.867 118.733 0.134 17934 14041 1 20 . 1 1 85 85 ALA C C 85 174.100 174.100 174.347 -0.247 17934 14042 1 20 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.275 -0.705 17934 14043 1 20 . 1 1 85 85 ALA H H 85 7.048 7.048 8.003 -0.955 17934 14044 1 20 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.894 0.261 17934 14045 1 20 . 1 1 87 87 HIS C C 87 174.986 174.986 173.715 1.271 17934 14046 1 20 . 1 1 87 87 HIS CB C 87 34.350 34.350 32.502 1.848 17934 14047 1 20 . 1 1 88 88 GLU N N 88 125.372 125.372 120.242 5.130 17934 14048 1 20 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.254 0.267 17934 14049 1 20 . 1 1 88 88 GLU C C 88 179.047 179.047 177.332 1.715 17934 14050 1 20 . 1 1 88 88 GLU CA C 88 56.726 56.726 56.789 -0.063 17934 14051 1 20 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.415 0.062 17934 14052 1 20 . 1 1 88 88 GLU H H 88 9.106 9.106 8.785 0.321 17934 14053 1 20 . 1 1 89 89 ILE N N 89 124.132 124.132 121.373 2.759 17934 14054 1 20 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.984 0.035 17934 14055 1 20 . 1 1 89 89 ILE C C 89 176.095 176.095 177.452 -1.357 17934 14056 1 20 . 1 1 89 89 ILE CA C 89 62.351 62.351 63.876 -1.525 17934 14057 1 20 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.238 0.676 17934 14058 1 20 . 1 1 89 89 ILE H H 89 8.055 8.055 8.886 -0.831 17934 14059 1 20 . 1 1 90 90 ARG N N 90 116.949 116.949 116.287 0.662 17934 14060 1 20 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.369 -0.031 17934 14061 1 20 . 1 1 90 90 ARG C C 90 176.578 176.578 176.329 0.249 17934 14062 1 20 . 1 1 90 90 ARG CA C 90 57.664 57.664 58.095 -0.431 17934 14063 1 20 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.549 -0.479 17934 14064 1 20 . 1 1 90 90 ARG H H 90 8.045 8.045 8.471 -0.426 17934 14065 1 20 . 1 1 91 91 ASN N N 91 116.320 116.320 116.522 -0.202 17934 14066 1 20 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.753 0.400 17934 14067 1 20 . 1 1 91 91 ASN C C 91 174.595 174.595 174.901 -0.306 17934 14068 1 20 . 1 1 91 91 ASN CA C 91 52.508 52.508 53.703 -1.195 17934 14069 1 20 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.976 -0.124 17934 14070 1 20 . 1 1 91 91 ASN H H 91 8.067 8.067 7.774 0.293 17934 14071 1 20 . 1 1 92 92 ILE N N 92 122.441 122.441 121.579 0.862 17934 14072 1 20 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.829 1.244 17934 14073 1 20 . 1 1 92 92 ILE C C 92 175.229 175.229 175.910 -0.681 17934 14074 1 20 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.896 -1.016 17934 14075 1 20 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.043 2.807 17934 14076 1 20 . 1 1 92 92 ILE H H 92 7.483 7.483 7.781 -0.298 17934 14077 1 20 . 1 1 93 93 SER N N 93 120.329 120.329 124.137 -3.808 17934 14078 1 20 . 1 1 93 93 SER HA H 93 4.684 4.684 4.108 0.576 17934 14079 1 20 . 1 1 93 93 SER C C 93 180.744 180.744 174.562 6.182 17934 14080 1 20 . 1 1 93 93 SER CA C 93 57.664 57.664 60.482 -2.818 17934 14081 1 20 . 1 1 93 93 SER CB C 93 66.570 66.570 63.523 3.046 17934 14082 1 20 . 1 1 93 93 SER H H 93 9.545 9.545 8.303 1.242 17934 14083 1 20 . 1 1 94 94 CYS N N 94 110.900 110.900 116.365 -5.465 17934 14084 1 20 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.444 -0.632 17934 14085 1 20 . 1 1 94 94 CYS C C 94 173.973 173.973 172.892 1.081 17934 14086 1 20 . 1 1 94 94 CYS CA C 94 59.539 59.539 58.031 1.508 17934 14087 1 20 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.526 -4.268 17934 14088 1 20 . 1 1 94 94 CYS H H 94 8.858 8.858 7.974 0.884 17934 14089 1 20 . 1 1 95 95 ALA N N 95 121.379 121.379 121.889 -0.510 17934 14090 1 20 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.604 -0.174 17934 14091 1 20 . 1 1 95 95 ALA C C 95 178.098 178.098 174.921 3.177 17934 14092 1 20 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.204 1.446 17934 14093 1 20 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.923 -2.623 17934 14094 1 20 . 1 1 95 95 ALA H H 95 8.360 8.360 8.165 0.195 17934 14095 1 20 . 1 1 96 96 ALA N N 96 122.576 122.576 121.988 0.588 17934 14096 1 20 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.755 -0.075 17934 14097 1 20 . 1 1 96 96 ALA C C 96 175.716 175.716 174.512 1.204 17934 14098 1 20 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.968 0.472 17934 14099 1 20 . 1 1 96 96 ALA CB C 96 22.700 22.700 22.041 0.659 17934 14100 1 20 . 1 1 96 96 ALA H H 96 9.080 9.080 8.693 0.387 17934 14101 1 20 . 1 1 97 97 GLN N N 97 116.903 116.903 119.582 -2.679 17934 14102 1 20 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.711 0.219 17934 14103 1 20 . 1 1 97 97 GLN C C 97 175.270 175.270 174.306 0.964 17934 14104 1 20 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.695 1.156 17934 14105 1 20 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.808 1.950 17934 14106 1 20 . 1 1 97 97 GLN H H 97 8.369 8.369 8.424 -0.055 17934 14107 1 20 . 1 1 98 98 ASP N N 98 124.971 124.971 121.522 3.449 17934 14108 1 20 . 1 1 98 98 ASP C C 98 175.217 175.217 175.824 -0.607 17934 14109 1 20 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.453 -0.414 17934 14110 1 20 . 1 1 98 98 ASP CB C 98 42.195 42.195 41.717 0.478 17934 14111 1 20 . 1 1 98 98 ASP H H 98 8.395 8.395 8.247 0.148 17934 14112 1 20 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.355 -0.121 17934 14113 1 20 . 1 1 99 99 PRO C C 99 178.433 178.433 177.335 1.098 17934 14114 1 20 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.728 -0.033 17934 14115 1 20 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.207 0.145 17934 14116 1 20 . 1 1 100 100 GLU N N 100 116.223 116.223 118.331 -2.108 17934 14117 1 20 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.140 0.080 17934 14118 1 20 . 1 1 100 100 GLU C C 100 176.678 176.678 175.839 0.839 17934 14119 1 20 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.281 -1.555 17934 14120 1 20 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.873 2.072 17934 14121 1 20 . 1 1 100 100 GLU H H 100 8.643 8.643 8.655 -0.012 17934 14122 1 20 . 1 1 101 101 ASP N N 101 119.053 119.053 118.811 0.242 17934 14123 1 20 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.874 -0.331 17934 14124 1 20 . 1 1 101 101 ASP C C 101 174.771 174.771 176.247 -1.476 17934 14125 1 20 . 1 1 101 101 ASP CA C 101 53.914 53.914 52.976 0.938 17934 14126 1 20 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.712 0.077 17934 14127 1 20 . 1 1 101 101 ASP H H 101 7.597 7.597 8.172 -0.575 17934 14128 1 20 . 1 1 102 102 LEU N N 102 123.986 123.986 120.927 3.059 17934 14129 1 20 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.310 0.080 17934 14130 1 20 . 1 1 102 102 LEU C C 102 177.141 177.141 178.305 -1.164 17934 14131 1 20 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.171 0.489 17934 14132 1 20 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.761 0.899 17934 14133 1 20 . 1 1 102 102 LEU H H 102 8.534 8.534 7.954 0.580 17934 14134 1 20 . 1 1 103 103 SER N N 103 112.339 112.339 112.916 -0.577 17934 14135 1 20 . 1 1 103 103 SER HA H 103 4.290 4.290 4.293 -0.003 17934 14136 1 20 . 1 1 103 103 SER C C 103 174.106 174.106 174.485 -0.379 17934 14137 1 20 . 1 1 103 103 SER CA C 103 60.945 60.945 60.724 0.221 17934 14138 1 20 . 1 1 103 103 SER CB C 103 63.757 63.757 63.811 -0.054 17934 14139 1 20 . 1 1 103 103 SER H H 103 7.867 7.867 8.376 -0.509 17934 14140 1 20 . 1 1 104 104 THR N N 104 123.070 123.070 116.863 6.207 17934 14141 1 20 . 1 1 104 104 THR HA H 104 5.373 5.373 4.554 0.819 17934 14142 1 20 . 1 1 104 104 THR C C 104 180.693 180.693 172.872 7.821 17934 14143 1 20 . 1 1 104 104 THR CA C 104 63.289 63.289 62.402 0.887 17934 14144 1 20 . 1 1 104 104 THR CB C 104 69.382 69.382 70.625 -1.243 17934 14145 1 20 . 1 1 104 104 THR H H 104 8.830 8.830 7.961 0.869 17934 14146 1 20 . 1 1 105 105 PHE N N 105 122.582 122.582 120.668 1.914 17934 14147 1 20 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.828 0.642 17934 14148 1 20 . 1 1 105 105 PHE C C 105 179.211 179.211 172.069 7.142 17934 14149 1 20 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.915 -0.595 17934 14150 1 20 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.595 0.195 17934 14151 1 20 . 1 1 105 105 PHE H H 105 9.170 9.170 8.662 0.508 17934 14152 1 20 . 1 1 106 106 ALA N N 106 119.567 119.567 121.166 -1.599 17934 14153 1 20 . 1 1 106 106 ALA C C 106 175.603 175.603 175.056 0.547 17934 14154 1 20 . 1 1 106 106 ALA H H 106 8.770 8.770 9.047 -0.277 17934 14155 1 20 . 1 1 107 107 TYR N N 107 109.933 109.933 117.967 -8.034 17934 14156 1 20 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.316 -0.396 17934 14157 1 20 . 1 1 107 107 TYR C C 107 180.426 180.426 173.102 7.324 17934 14158 1 20 . 1 1 107 107 TYR CA C 107 57.080 57.080 54.678 2.401 17934 14159 1 20 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.286 -0.497 17934 14160 1 20 . 1 1 107 107 TYR H H 107 7.950 7.950 8.630 -0.680 17934 14161 1 20 . 1 1 108 108 ILE N N 108 120.613 120.613 118.624 1.989 17934 14162 1 20 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.827 0.543 17934 14163 1 20 . 1 1 108 108 ILE C C 108 176.212 176.212 175.924 0.288 17934 14164 1 20 . 1 1 108 108 ILE CA C 108 59.540 59.540 59.019 0.521 17934 14165 1 20 . 1 1 108 108 ILE CB C 108 39.380 39.380 38.234 1.146 17934 14166 1 20 . 1 1 108 108 ILE H H 108 8.869 8.869 8.563 0.306 17934 14167 1 20 . 1 1 109 109 THR N N 109 116.505 116.505 118.963 -2.458 17934 14168 1 20 . 1 1 109 109 THR HA H 109 5.669 5.669 4.753 0.916 17934 14169 1 20 . 1 1 109 109 THR C C 109 173.505 173.505 173.848 -0.343 17934 14170 1 20 . 1 1 109 109 THR CA C 109 59.070 59.070 60.279 -1.209 17934 14171 1 20 . 1 1 109 109 THR H H 109 9.489 9.489 8.562 0.927 17934 14172 1 20 . 1 1 110 110 LYS N N 110 122.960 122.960 120.121 2.839 17934 14173 1 20 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.335 0.125 17934 14174 1 20 . 1 1 110 110 LYS C C 110 175.937 175.937 176.466 -0.529 17934 14175 1 20 . 1 1 110 110 LYS CA C 110 55.789 55.789 56.529 -0.740 17934 14176 1 20 . 1 1 110 110 LYS CB C 110 34.227 34.227 33.052 1.175 17934 14177 1 20 . 1 1 110 110 LYS H H 110 7.831 7.831 7.977 -0.146 17934 14178 1 20 . 1 1 111 111 ASP N N 111 127.409 127.409 122.254 5.155 17934 14179 1 20 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.671 0.110 17934 14180 1 20 . 1 1 111 111 ASP C C 111 176.396 176.396 177.462 -1.066 17934 14181 1 20 . 1 1 111 111 ASP CA C 111 53.914 53.914 52.687 1.227 17934 14182 1 20 . 1 1 111 111 ASP CB C 111 43.133 43.133 42.019 1.114 17934 14183 1 20 . 1 1 111 111 ASP H H 111 8.769 8.769 8.344 0.425 17934 14184 1 20 . 1 1 112 112 LEU N N 112 125.913 125.913 123.006 2.907 17934 14185 1 20 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.115 0.035 17934 14186 1 20 . 1 1 112 112 LEU C C 112 178.553 178.553 178.114 0.439 17934 14187 1 20 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.805 -0.615 17934 14188 1 20 . 1 1 112 112 LEU CB C 112 41.790 41.790 41.791 -0.001 17934 14189 1 20 . 1 1 112 112 LEU H H 112 8.593 8.593 8.693 -0.100 17934 14190 1 20 . 1 1 113 113 LYS N N 113 117.189 117.189 116.831 0.358 17934 14191 1 20 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.265 -0.003 17934 14192 1 20 . 1 1 113 113 LYS C C 113 177.180 177.180 176.380 0.800 17934 14193 1 20 . 1 1 113 113 LYS CA C 113 58.133 58.133 55.242 2.891 17934 14194 1 20 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.939 -0.119 17934 14195 1 20 . 1 1 113 113 LYS H H 113 8.207 8.207 7.671 0.536 17934 14196 1 20 . 1 1 114 114 SER N N 114 112.492 112.492 111.302 1.190 17934 14197 1 20 . 1 1 114 114 SER CA C 114 58.601 58.601 58.861 -0.260 17934 14198 1 20 . 1 1 114 114 SER CB C 114 65.164 65.164 61.857 3.307 17934 14199 1 20 . 1 1 114 114 SER H H 114 7.755 7.755 8.410 -0.655 17934 14200 1 20 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.795 -0.406 17934 14201 1 20 . 1 1 115 115 ASN C C 115 174.203 174.203 174.667 -0.464 17934 14202 1 20 . 1 1 115 115 ASN CA C 115 54.383 54.383 53.824 0.559 17934 14203 1 20 . 1 1 115 115 ASN CB C 115 37.977 37.977 39.209 -1.232 17934 14204 1 20 . 1 1 116 116 HIS N N 116 116.822 116.822 116.280 0.542 17934 14205 1 20 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.682 0.248 17934 14206 1 20 . 1 1 116 116 HIS C C 116 173.898 173.898 173.922 -0.024 17934 14207 1 20 . 1 1 116 116 HIS CA C 116 54.910 54.910 53.877 1.033 17934 14208 1 20 . 1 1 116 116 HIS CB C 116 32.650 32.650 31.663 0.987 17934 14209 1 20 . 1 1 116 116 HIS H H 116 7.690 7.690 7.382 0.308 17934 14210 1 20 . 1 1 117 117 HIS N N 117 118.253 118.253 120.137 -1.884 17934 14211 1 20 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.716 0.604 17934 14212 1 20 . 1 1 117 117 HIS C C 117 173.695 173.695 174.271 -0.576 17934 14213 1 20 . 1 1 117 117 HIS CA C 117 56.350 56.350 55.998 0.352 17934 14214 1 20 . 1 1 117 117 HIS CB C 117 32.350 32.350 29.544 2.806 17934 14215 1 20 . 1 1 117 117 HIS H H 117 8.340 8.340 8.598 -0.258 17934 14216 1 20 . 1 1 118 118 TYR N N 118 118.301 118.301 123.995 -5.694 17934 14217 1 20 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.571 0.439 17934 14218 1 20 . 1 1 118 118 TYR C C 118 173.530 173.530 174.555 -1.025 17934 14219 1 20 . 1 1 118 118 TYR CA C 118 56.730 56.730 57.448 -0.718 17934 14220 1 20 . 1 1 118 118 TYR CB C 118 43.240 43.240 39.714 3.526 17934 14221 1 20 . 1 1 118 118 TYR H H 118 9.080 9.080 8.366 0.714 17934 14222 1 20 . 1 1 119 119 CYS N N 119 121.015 121.015 121.406 -0.391 17934 14223 1 20 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.796 0.267 17934 14224 1 20 . 1 1 119 119 CYS C C 119 180.664 180.664 173.527 7.137 17934 14225 1 20 . 1 1 119 119 CYS CA C 119 56.726 56.726 56.279 0.447 17934 14226 1 20 . 1 1 119 119 CYS CB C 119 29.539 29.539 29.341 0.198 17934 14227 1 20 . 1 1 119 119 CYS H H 119 9.120 9.120 8.906 0.214 17934 14228 1 20 . 1 1 120 120 HIS N N 120 110.134 110.134 124.287 -14.153 17934 14229 1 20 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.883 -0.184 17934 14230 1 20 . 1 1 120 120 HIS C C 120 180.776 180.776 173.529 7.247 17934 14231 1 20 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.229 1.091 17934 14232 1 20 . 1 1 120 120 HIS CB C 120 32.352 32.352 30.349 2.003 17934 14233 1 20 . 1 1 120 120 HIS H H 120 8.482 8.482 8.615 -0.133 17934 14234 1 20 . 1 1 121 121 VAL N N 121 120.855 120.855 122.760 -1.905 17934 14235 1 20 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.148 0.202 17934 14236 1 20 . 1 1 121 121 VAL C C 121 173.419 173.419 173.151 0.268 17934 14237 1 20 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.283 1.127 17934 14238 1 20 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.312 -0.032 17934 14239 1 20 . 1 1 121 121 VAL H H 121 7.929 7.929 8.770 -0.841 17934 14240 1 20 . 1 1 122 122 PHE N N 122 124.384 124.384 127.636 -3.252 17934 14241 1 20 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.487 -0.067 17934 14242 1 20 . 1 1 122 122 PHE C C 122 174.876 174.876 174.641 0.235 17934 14243 1 20 . 1 1 122 122 PHE CA C 122 55.320 55.320 54.048 1.272 17934 14244 1 20 . 1 1 122 122 PHE CB C 122 44.540 44.540 42.651 1.889 17934 14245 1 20 . 1 1 122 122 PHE H H 122 8.910 8.910 8.834 0.076 17934 14246 1 20 . 1 1 123 123 THR N N 123 112.451 112.451 112.642 -0.191 17934 14247 1 20 . 1 1 123 123 THR HA H 123 5.147 5.147 4.536 0.611 17934 14248 1 20 . 1 1 123 123 THR C C 123 174.096 174.096 173.030 1.066 17934 14249 1 20 . 1 1 123 123 THR CA C 123 61.843 61.843 59.495 2.348 17934 14250 1 20 . 1 1 123 123 THR CB C 123 71.218 71.218 70.780 0.438 17934 14251 1 20 . 1 1 123 123 THR H H 123 8.668 8.668 9.010 -0.342 17934 14252 1 20 . 1 1 124 124 ALA N N 124 128.922 128.922 125.250 3.672 17934 14253 1 20 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.783 -0.063 17934 14254 1 20 . 1 1 124 124 ALA C C 124 177.168 177.168 176.600 0.568 17934 14255 1 20 . 1 1 124 124 ALA CA C 124 50.890 50.890 49.784 1.106 17934 14256 1 20 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.553 -0.453 17934 14257 1 20 . 1 1 124 124 ALA H H 124 9.180 9.180 8.677 0.503 17934 14258 1 20 . 1 1 125 125 PHE N N 125 115.427 115.427 117.816 -2.389 17934 14259 1 20 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.547 -0.257 17934 14260 1 20 . 1 1 125 125 PHE C C 125 174.703 174.703 175.522 -0.819 17934 14261 1 20 . 1 1 125 125 PHE CA C 125 60.470 60.470 58.901 1.569 17934 14262 1 20 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.690 -1.630 17934 14263 1 20 . 1 1 125 125 PHE H H 125 8.560 8.560 9.164 -0.604 17934 14264 1 20 . 1 1 126 126 ASP N N 126 115.745 115.745 118.542 -2.797 17934 14265 1 20 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.968 -0.125 17934 14266 1 20 . 1 1 126 126 ASP C C 126 176.532 176.532 176.038 0.494 17934 14267 1 20 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.416 0.029 17934 14268 1 20 . 1 1 126 126 ASP CB C 126 44.070 44.070 44.064 0.006 17934 14269 1 20 . 1 1 126 126 ASP H H 126 7.417 7.417 7.803 -0.386 17934 14270 1 20 . 1 1 127 127 VAL N N 127 121.923 121.923 124.353 -2.430 17934 14271 1 20 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.642 -0.052 17934 14272 1 20 . 1 1 127 127 VAL C C 127 176.863 176.863 177.009 -0.146 17934 14273 1 20 . 1 1 127 127 VAL CA C 127 65.630 65.630 67.237 -1.607 17934 14274 1 20 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.367 -0.537 17934 14275 1 20 . 1 1 127 127 VAL H H 127 8.508 8.508 8.672 -0.164 17934 14276 1 20 . 1 1 128 128 ASN N N 128 118.851 118.851 117.991 0.860 17934 14277 1 20 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.372 0.104 17934 14278 1 20 . 1 1 128 128 ASN C C 128 178.251 178.251 177.296 0.955 17934 14279 1 20 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.360 -0.102 17934 14280 1 20 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.065 -0.088 17934 14281 1 20 . 1 1 128 128 ASN H H 128 8.207 8.207 8.341 -0.134 17934 14282 1 20 . 1 1 129 129 LEU N N 129 122.549 122.549 119.911 2.638 17934 14283 1 20 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.972 0.238 17934 14284 1 20 . 1 1 129 129 LEU C C 129 178.003 178.003 178.229 -0.226 17934 14285 1 20 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.676 -0.486 17934 14286 1 20 . 1 1 129 129 LEU CB C 129 41.790 41.790 40.889 0.901 17934 14287 1 20 . 1 1 129 129 LEU H H 129 8.223 8.223 8.049 0.174 17934 14288 1 20 . 1 1 130 130 ALA N N 130 120.036 120.036 122.269 -2.233 17934 14289 1 20 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.932 -0.622 17934 14290 1 20 . 1 1 130 130 ALA C C 130 178.172 178.172 179.221 -1.049 17934 14291 1 20 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.364 0.416 17934 14292 1 20 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.213 0.857 17934 14293 1 20 . 1 1 130 130 ALA H H 130 7.360 7.360 8.463 -1.103 17934 14294 1 20 . 1 1 131 131 ALA N N 131 116.989 116.989 118.850 -1.861 17934 14295 1 20 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.950 -0.240 17934 14296 1 20 . 1 1 131 131 ALA C C 131 180.163 180.163 179.607 0.556 17934 14297 1 20 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.799 0.981 17934 14298 1 20 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.141 -0.311 17934 14299 1 20 . 1 1 131 131 ALA H H 131 7.360 7.360 8.583 -1.223 17934 14300 1 20 . 1 1 132 132 GLU N N 132 119.462 119.462 119.476 -0.014 17934 14301 1 20 . 1 1 132 132 GLU HA H 132 3.888 3.888 4.150 -0.262 17934 14302 1 20 . 1 1 132 132 GLU C C 132 179.243 179.243 178.883 0.360 17934 14303 1 20 . 1 1 132 132 GLU CA C 132 59.539 59.539 58.512 1.027 17934 14304 1 20 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.230 0.309 17934 14305 1 20 . 1 1 132 132 GLU H H 132 7.673 7.673 7.968 -0.295 17934 14306 1 20 . 1 1 133 133 ILE N N 133 123.218 123.218 121.087 2.131 17934 14307 1 20 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.589 -0.809 17934 14308 1 20 . 1 1 133 133 ILE C C 133 177.421 177.421 178.268 -0.847 17934 14309 1 20 . 1 1 133 133 ILE CA C 133 66.490 66.490 64.870 1.620 17934 14310 1 20 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.478 -0.828 17934 14311 1 20 . 1 1 133 133 ILE H H 133 8.154 8.154 8.268 -0.114 17934 14312 1 20 . 1 1 134 134 ILE N N 134 118.244 118.244 119.319 -1.075 17934 14313 1 20 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.380 0.160 17934 14314 1 20 . 1 1 134 134 ILE C C 134 179.385 179.385 177.624 1.761 17934 14315 1 20 . 1 1 134 134 ILE CA C 134 63.280 63.280 63.858 -0.578 17934 14316 1 20 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.651 -0.551 17934 14317 1 20 . 1 1 134 134 ILE H H 134 7.376 7.376 8.027 -0.651 17934 14318 1 20 . 1 1 135 135 LEU N N 135 123.061 123.061 121.174 1.887 17934 14319 1 20 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.876 0.314 17934 14320 1 20 . 1 1 135 135 LEU C C 135 179.858 179.858 179.014 0.844 17934 14321 1 20 . 1 1 135 135 LEU CA C 135 58.190 58.190 59.094 -0.904 17934 14322 1 20 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.170 0.690 17934 14323 1 20 . 1 1 135 135 LEU H H 135 8.036 8.036 8.428 -0.392 17934 14324 1 20 . 1 1 136 136 THR N N 136 119.647 119.647 115.743 3.904 17934 14325 1 20 . 1 1 136 136 THR HA H 136 3.725 3.725 3.957 -0.232 17934 14326 1 20 . 1 1 136 136 THR C C 136 176.088 176.088 176.685 -0.597 17934 14327 1 20 . 1 1 136 136 THR CA C 136 58.601 58.601 66.862 -8.261 17934 14328 1 20 . 1 1 136 136 THR CB C 136 67.976 67.976 68.984 -1.008 17934 14329 1 20 . 1 1 136 136 THR H H 136 8.508 8.508 8.284 0.224 17934 14330 1 20 . 1 1 137 137 LEU N N 137 123.182 123.182 121.851 1.331 17934 14331 1 20 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.804 -0.064 17934 14332 1 20 . 1 1 137 137 LEU C C 137 178.341 178.341 179.057 -0.716 17934 14333 1 20 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.046 0.214 17934 14334 1 20 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.517 0.033 17934 14335 1 20 . 1 1 137 137 LEU H H 137 8.520 8.520 8.263 0.257 17934 14336 1 20 . 1 1 138 138 GLY N N 138 105.266 105.266 105.462 -0.196 17934 14337 1 20 . 1 1 138 138 GLY C C 138 176.973 176.973 176.219 0.754 17934 14338 1 20 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.264 0.087 17934 14339 1 20 . 1 1 138 138 GLY H H 138 7.858 7.858 8.137 -0.279 17934 14340 1 20 . 1 1 139 139 GLN N N 139 123.485 123.485 122.266 1.219 17934 14341 1 20 . 1 1 139 139 GLN C C 139 177.891 177.891 178.436 -0.545 17934 14342 1 20 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.631 -0.030 17934 14343 1 20 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.298 -0.165 17934 14344 1 20 . 1 1 139 139 GLN H H 139 8.195 8.195 8.585 -0.390 17934 14345 1 20 . 1 1 140 140 ALA N N 140 122.754 122.754 120.195 2.559 17934 14346 1 20 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.214 -0.505 17934 14347 1 20 . 1 1 140 140 ALA C C 140 178.987 178.987 178.914 0.073 17934 14348 1 20 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.424 1.356 17934 14349 1 20 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.534 -1.124 17934 14350 1 20 . 1 1 140 140 ALA H H 140 8.530 8.530 8.530 -0.000 17934 14351 1 20 . 1 1 141 141 PHE N N 141 116.275 116.275 120.014 -3.739 17934 14352 1 20 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.557 -0.467 17934 14353 1 20 . 1 1 141 141 PHE C C 141 178.129 178.129 177.044 1.085 17934 14354 1 20 . 1 1 141 141 PHE CA C 141 61.240 61.240 60.046 1.194 17934 14355 1 20 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.728 -0.346 17934 14356 1 20 . 1 1 141 141 PHE H H 141 7.920 7.920 8.281 -0.361 17934 14357 1 20 . 1 1 142 142 GLU N N 142 119.967 119.967 119.709 0.258 17934 14358 1 20 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.874 0.353 17934 14359 1 20 . 1 1 142 142 GLU C C 142 179.250 179.250 178.070 1.180 17934 14360 1 20 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.152 1.387 17934 14361 1 20 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.465 0.074 17934 14362 1 20 . 1 1 142 142 GLU H H 142 7.713 7.713 8.366 -0.653 17934 14363 1 20 . 1 1 143 143 VAL N N 143 120.189 120.189 120.390 -0.201 17934 14364 1 20 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.703 -0.020 17934 14365 1 20 . 1 1 143 143 VAL C C 143 178.066 178.066 176.356 1.710 17934 14366 1 20 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.398 2.172 17934 14367 1 20 . 1 1 143 143 VAL CB C 143 31.883 31.883 32.319 -0.436 17934 14368 1 20 . 1 1 143 143 VAL H H 143 8.608 8.608 7.724 0.884 17934 14369 1 20 . 1 1 144 144 ALA N N 144 121.753 121.753 119.115 2.638 17934 14370 1 20 . 1 1 144 144 ALA HA H 144 4.000 4.000 3.940 0.060 17934 14371 1 20 . 1 1 144 144 ALA C C 144 180.776 180.776 175.837 4.939 17934 14372 1 20 . 1 1 144 144 ALA CA C 144 55.780 55.780 53.185 2.595 17934 14373 1 20 . 1 1 144 144 ALA CB C 144 18.770 18.770 17.283 1.487 17934 14374 1 20 . 1 1 144 144 ALA H H 144 8.399 8.399 7.551 0.848 17934 14375 1 20 . 1 1 145 145 TYR N N 145 119.962 119.962 119.788 0.174 17934 14376 1 20 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.626 -0.436 17934 14377 1 20 . 1 1 145 145 TYR C C 145 177.645 177.645 174.829 2.816 17934 14378 1 20 . 1 1 145 145 TYR CA C 145 60.880 60.880 56.764 4.116 17934 14379 1 20 . 1 1 145 145 TYR CB C 145 37.980 37.980 41.056 -3.076 17934 14380 1 20 . 1 1 145 145 TYR H H 145 8.190 8.190 7.939 0.251 17934 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 120 3.629 0.454 3.615 17934 2 1 1 "Average Difference" HA 121 0.396 -0.090 0.387 17934 3 1 1 "Average Difference" C 116 2.198 -0.713 2.088 17934 4 1 1 "Average Difference" CA 127 1.478 -0.154 1.476 17934 5 1 1 "Average Difference" CB 121 1.208 -0.157 1.202 17934 6 1 1 "Average Difference" HN 120 0.544 -0.011 0.547 17934 7 1 2 "Average Difference" N 120 3.394 0.280 3.397 17934 8 1 2 "Average Difference" HA 121 0.380 -0.057 0.377 17934 9 1 2 "Average Difference" C 116 2.199 -0.760 2.072 17934 10 1 2 "Average Difference" CA 127 1.562 -0.216 1.553 17934 11 1 2 "Average Difference" CB 121 1.237 -0.097 1.239 17934 12 1 2 "Average Difference" HN 120 0.541 0.029 0.542 17934 13 1 3 "Average Difference" N 120 3.691 0.497 3.673 17934 14 1 3 "Average Difference" HA 121 0.384 -0.043 0.383 17934 15 1 3 "Average Difference" C 116 2.143 -0.665 2.046 17934 16 1 3 "Average Difference" CA 127 1.371 -0.205 1.360 17934 17 1 3 "Average Difference" CB 121 1.246 -0.132 1.244 17934 18 1 3 "Average Difference" HN 120 0.572 0.031 0.573 17934 19 1 4 "Average Difference" N 120 3.506 0.273 3.510 17934 20 1 4 "Average Difference" HA 121 0.380 -0.047 0.379 17934 21 1 4 "Average Difference" C 116 2.191 -0.720 2.078 17934 22 1 4 "Average Difference" CA 127 1.419 -0.201 1.410 17934 23 1 4 "Average Difference" CB 121 1.305 -0.142 1.303 17934 24 1 4 "Average Difference" HN 120 0.519 0.060 0.518 17934 25 1 5 "Average Difference" N 120 3.770 0.598 3.738 17934 26 1 5 "Average Difference" HA 121 0.384 -0.043 0.383 17934 27 1 5 "Average Difference" C 116 2.119 -0.651 2.025 17934 28 1 5 "Average Difference" CA 127 1.437 -0.191 1.429 17934 29 1 5 "Average Difference" CB 121 1.134 -0.175 1.125 17934 30 1 5 "Average Difference" HN 120 0.519 0.018 0.521 17934 31 1 6 "Average Difference" N 120 3.662 0.472 3.647 17934 32 1 6 "Average Difference" HA 121 0.414 -0.044 0.413 17934 33 1 6 "Average Difference" C 116 2.127 -0.611 2.046 17934 34 1 6 "Average Difference" CA 127 1.484 -0.092 1.487 17934 35 1 6 "Average Difference" CB 121 1.211 -0.187 1.202 17934 36 1 6 "Average Difference" HN 120 0.523 0.044 0.524 17934 37 1 7 "Average Difference" N 120 3.614 0.583 3.582 17934 38 1 7 "Average Difference" HA 121 0.399 -0.052 0.397 17934 39 1 7 "Average Difference" C 116 2.174 -0.676 2.075 17934 40 1 7 "Average Difference" CA 127 1.442 -0.154 1.439 17934 41 1 7 "Average Difference" CB 121 1.305 -0.165 1.300 17934 42 1 7 "Average Difference" HN 120 0.566 0.015 0.568 17934 43 1 8 "Average Difference" N 120 3.628 0.393 3.622 17934 44 1 8 "Average Difference" HA 121 0.390 -0.055 0.388 17934 45 1 8 "Average Difference" C 116 2.257 -0.722 2.147 17934 46 1 8 "Average Difference" CA 127 1.505 -0.208 1.496 17934 47 1 8 "Average Difference" CB 121 1.163 -0.099 1.164 17934 48 1 8 "Average Difference" HN 120 0.549 0.025 0.551 17934 49 1 9 "Average Difference" N 120 3.806 0.487 3.791 17934 50 1 9 "Average Difference" HA 121 0.375 -0.044 0.374 17934 51 1 9 "Average Difference" C 116 2.143 -0.620 2.061 17934 52 1 9 "Average Difference" CA 127 1.502 -0.267 1.484 17934 53 1 9 "Average Difference" CB 121 1.292 -0.308 1.260 17934 54 1 9 "Average Difference" HN 120 0.534 0.010 0.536 17934 55 1 10 "Average Difference" N 120 3.612 0.380 3.607 17934 56 1 10 "Average Difference" HA 121 0.384 -0.041 0.383 17934 57 1 10 "Average Difference" C 116 2.221 -0.709 2.114 17934 58 1 10 "Average Difference" CA 127 1.463 -0.138 1.462 17934 59 1 10 "Average Difference" CB 121 1.225 -0.171 1.218 17934 60 1 10 "Average Difference" HN 120 0.540 0.066 0.538 17934 61 1 11 "Average Difference" N 120 3.521 0.348 3.518 17934 62 1 11 "Average Difference" HA 121 0.357 -0.037 0.356 17934 63 1 11 "Average Difference" C 116 2.225 -0.705 2.120 17934 64 1 11 "Average Difference" CA 127 1.564 -0.111 1.566 17934 65 1 11 "Average Difference" CB 121 1.274 -0.156 1.269 17934 66 1 11 "Average Difference" HN 120 0.534 0.046 0.535 17934 67 1 12 "Average Difference" N 120 3.636 0.421 3.626 17934 68 1 12 "Average Difference" HA 121 0.369 -0.062 0.366 17934 69 1 12 "Average Difference" C 116 2.067 -0.532 2.006 17934 70 1 12 "Average Difference" CA 127 1.462 -0.097 1.465 17934 71 1 12 "Average Difference" CB 121 1.314 -0.197 1.305 17934 72 1 12 "Average Difference" HN 120 0.523 0.023 0.524 17934 73 1 13 "Average Difference" N 120 3.489 0.578 3.456 17934 74 1 13 "Average Difference" HA 121 0.391 -0.046 0.390 17934 75 1 13 "Average Difference" C 116 2.096 -0.630 2.008 17934 76 1 13 "Average Difference" CA 127 1.400 -0.272 1.379 17934 77 1 13 "Average Difference" CB 121 1.284 -0.292 1.256 17934 78 1 13 "Average Difference" HN 120 0.519 0.060 0.518 17934 79 1 14 "Average Difference" N 120 3.487 0.291 3.489 17934 80 1 14 "Average Difference" HA 121 0.372 -0.036 0.372 17934 81 1 14 "Average Difference" C 116 2.147 -0.646 2.057 17934 82 1 14 "Average Difference" CA 127 1.608 -0.170 1.606 17934 83 1 14 "Average Difference" CB 121 1.224 -0.201 1.213 17934 84 1 14 "Average Difference" HN 120 0.523 0.017 0.525 17934 85 1 15 "Average Difference" N 120 3.496 0.494 3.476 17934 86 1 15 "Average Difference" HA 121 0.391 -0.076 0.385 17934 87 1 15 "Average Difference" C 116 2.128 -0.615 2.045 17934 88 1 15 "Average Difference" CA 127 1.432 -0.187 1.426 17934 89 1 15 "Average Difference" CB 121 1.270 -0.297 1.239 17934 90 1 15 "Average Difference" HN 120 0.513 0.040 0.514 17934 91 1 16 "Average Difference" N 120 3.682 0.479 3.666 17934 92 1 16 "Average Difference" HA 121 0.371 -0.051 0.369 17934 93 1 16 "Average Difference" C 116 2.085 -0.700 1.972 17934 94 1 16 "Average Difference" CA 127 1.457 -0.250 1.441 17934 95 1 16 "Average Difference" CB 121 1.228 -0.163 1.222 17934 96 1 16 "Average Difference" HN 120 0.510 0.020 0.512 17934 97 1 17 "Average Difference" N 120 3.687 0.547 3.662 17934 98 1 17 "Average Difference" HA 121 0.391 -0.028 0.392 17934 99 1 17 "Average Difference" C 116 2.220 -0.683 2.121 17934 100 1 17 "Average Difference" CA 127 1.510 -0.238 1.497 17934 101 1 17 "Average Difference" CB 121 1.179 -0.129 1.177 17934 102 1 17 "Average Difference" HN 120 0.515 0.010 0.517 17934 103 1 18 "Average Difference" N 120 3.564 0.558 3.535 17934 104 1 18 "Average Difference" HA 121 0.388 -0.031 0.388 17934 105 1 18 "Average Difference" C 116 2.135 -0.676 2.034 17934 106 1 18 "Average Difference" CA 127 1.408 -0.164 1.404 17934 107 1 18 "Average Difference" CB 121 1.247 -0.152 1.242 17934 108 1 18 "Average Difference" HN 120 0.538 0.062 0.536 17934 109 1 19 "Average Difference" N 120 3.597 0.356 3.594 17934 110 1 19 "Average Difference" HA 121 0.401 -0.034 0.401 17934 111 1 19 "Average Difference" C 116 2.102 -0.629 2.014 17934 112 1 19 "Average Difference" CA 127 1.448 -0.231 1.435 17934 113 1 19 "Average Difference" CB 121 1.280 -0.213 1.267 17934 114 1 19 "Average Difference" HN 120 0.537 -0.001 0.539 17934 115 1 20 "Average Difference" N 120 3.567 0.171 3.578 17934 116 1 20 "Average Difference" HA 121 0.364 -0.017 0.365 17934 117 1 20 "Average Difference" C 116 2.176 -0.711 2.065 17934 118 1 20 "Average Difference" CA 127 1.469 -0.312 1.442 17934 119 1 20 "Average Difference" CB 121 1.325 -0.135 1.323 17934 120 1 20 "Average Difference" HN 120 0.549 0.048 0.549 17934 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 17934 _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 13 13 LYS N N 13 120.778 120.778 122.146 -1.368 17934 2 1 . 1 1 13 13 LYS C C 13 176.476 176.476 176.012 0.464 17934 3 1 . 1 1 13 13 LYS CA C 13 58.601 58.601 56.175 2.425 17934 4 1 . 1 1 13 13 LYS CB C 13 32.820 32.820 33.211 -0.391 17934 5 1 . 1 1 13 13 LYS H H 13 7.984 7.984 8.269 -0.285 17934 6 1 . 1 1 15 15 ILE HA H 15 3.820 3.820 3.979 -0.159 17934 7 1 . 1 1 15 15 ILE C C 15 176.376 176.376 176.181 0.195 17934 8 1 . 1 1 15 15 ILE CA C 15 63.570 63.570 62.563 1.007 17934 9 1 . 1 1 15 15 ILE CB C 15 39.380 39.380 37.632 1.748 17934 10 1 . 1 1 16 16 ALA N N 16 121.364 121.364 120.314 1.050 17934 11 1 . 1 1 16 16 ALA HA H 16 4.438 4.438 4.449 -0.011 17934 12 1 . 1 1 16 16 ALA C C 16 177.494 177.494 177.439 0.055 17934 13 1 . 1 1 16 16 ALA CA C 16 52.976 52.976 52.549 0.427 17934 14 1 . 1 1 16 16 ALA CB C 16 20.333 20.333 19.599 0.734 17934 15 1 . 1 1 16 16 ALA H H 16 8.081 8.081 7.805 0.276 17934 16 1 . 1 1 17 17 GLN N N 17 118.109 118.109 116.066 2.043 17934 17 1 . 1 1 17 17 GLN HA H 17 4.573 4.573 4.442 0.131 17934 18 1 . 1 1 17 17 GLN C C 17 173.632 173.632 174.649 -1.017 17934 19 1 . 1 1 17 17 GLN CA C 17 54.851 54.851 55.326 -0.475 17934 20 1 . 1 1 17 17 GLN CB C 17 30.477 30.477 29.897 0.580 17934 21 1 . 1 1 17 17 GLN H H 17 7.550 7.550 8.105 -0.555 17934 22 1 . 1 1 18 18 SER N N 18 112.384 112.384 114.159 -1.775 17934 23 1 . 1 1 18 18 SER HA H 18 4.388 4.388 4.864 -0.476 17934 24 1 . 1 1 18 18 SER C C 18 173.780 173.780 172.775 1.005 17934 25 1 . 1 1 18 18 SER CA C 18 57.664 57.664 57.584 0.080 17934 26 1 . 1 1 18 18 SER CB C 18 65.164 65.164 65.302 -0.138 17934 27 1 . 1 1 18 18 SER H H 18 7.666 7.666 7.991 -0.325 17934 28 1 . 1 1 19 19 CYS N N 19 120.116 120.116 121.785 -1.669 17934 29 1 . 1 1 19 19 CYS HA H 19 4.330 4.330 4.530 -0.200 17934 30 1 . 1 1 19 19 CYS C C 19 180.387 180.387 173.181 7.206 17934 31 1 . 1 1 19 19 CYS CA C 19 58.601 58.601 58.245 0.356 17934 32 1 . 1 1 19 19 CYS CB C 19 30.008 30.008 30.067 -0.059 17934 33 1 . 1 1 19 19 CYS H H 19 8.835 8.835 8.790 0.045 17934 34 1 . 1 1 20 20 ASP N N 20 124.416 124.416 123.160 1.256 17934 35 1 . 1 1 20 20 ASP CA C 20 52.976 52.976 53.252 -0.276 17934 36 1 . 1 1 20 20 ASP CB C 20 42.195 42.195 44.286 -2.091 17934 37 1 . 1 1 20 20 ASP H H 20 7.847 7.847 8.034 -0.187 17934 38 1 . 1 1 21 21 TYR N N 21 121.296 121.296 120.899 0.397 17934 39 1 . 1 1 21 21 TYR HA H 21 4.730 4.730 4.735 -0.005 17934 40 1 . 1 1 21 21 TYR C C 21 175.793 175.793 174.295 1.498 17934 41 1 . 1 1 21 21 TYR CA C 21 57.200 57.200 56.442 0.758 17934 42 1 . 1 1 21 21 TYR CB C 21 43.240 43.240 42.934 0.306 17934 43 1 . 1 1 21 21 TYR H H 21 9.070 9.070 8.800 0.270 17934 44 1 . 1 1 22 22 LYS N N 22 122.820 122.820 121.786 1.034 17934 45 1 . 1 1 22 22 LYS HA H 22 5.192 5.192 5.136 0.056 17934 46 1 . 1 1 22 22 LYS C C 22 175.793 175.793 175.407 0.386 17934 47 1 . 1 1 22 22 LYS CA C 22 56.258 56.258 55.609 0.649 17934 48 1 . 1 1 22 22 LYS CB C 22 33.758 33.758 33.222 0.536 17934 49 1 . 1 1 22 22 LYS H H 22 8.711 8.711 8.657 0.054 17934 50 1 . 1 1 23 23 ALA N N 23 123.073 123.073 126.674 -3.601 17934 51 1 . 1 1 23 23 ALA HA H 23 4.730 4.730 4.509 0.221 17934 52 1 . 1 1 23 23 ALA C C 23 174.515 174.515 175.474 -0.959 17934 53 1 . 1 1 23 23 ALA CA C 23 51.570 51.570 50.230 1.340 17934 54 1 . 1 1 23 23 ALA CB C 23 21.628 21.628 22.702 -1.074 17934 55 1 . 1 1 23 23 ALA H H 23 8.727 8.727 8.709 0.018 17934 56 1 . 1 1 24 24 ALA N N 24 122.486 122.486 124.499 -2.013 17934 57 1 . 1 1 24 24 ALA HA H 24 5.181 5.181 4.735 0.446 17934 58 1 . 1 1 24 24 ALA C C 24 176.835 176.835 176.157 0.678 17934 59 1 . 1 1 24 24 ALA CA C 24 51.570 51.570 51.193 0.377 17934 60 1 . 1 1 24 24 ALA CB C 24 20.120 20.120 20.270 -0.149 17934 61 1 . 1 1 24 24 ALA H H 24 8.675 8.675 8.754 -0.079 17934 62 1 . 1 1 25 25 TYR N N 25 122.698 122.698 125.588 -2.890 17934 63 1 . 1 1 25 25 TYR HA H 25 5.010 5.010 4.353 0.657 17934 64 1 . 1 1 25 25 TYR CA C 25 54.340 54.340 57.332 -2.992 17934 65 1 . 1 1 25 25 TYR CB C 25 39.850 39.850 38.126 1.724 17934 66 1 . 1 1 25 25 TYR H H 25 8.270 8.270 8.491 -0.221 17934 67 1 . 1 1 26 26 LEU N N 26 127.997 127.997 128.949 -0.952 17934 68 1 . 1 1 26 26 LEU HA H 26 3.920 3.920 4.173 -0.253 17934 69 1 . 1 1 26 26 LEU C C 26 175.983 175.983 176.733 -0.750 17934 70 1 . 1 1 26 26 LEU CA C 26 56.726 56.726 56.212 0.515 17934 71 1 . 1 1 26 26 LEU CB C 26 41.070 41.070 43.107 -2.037 17934 72 1 . 1 1 26 26 LEU H H 26 8.700 8.700 8.164 0.536 17934 73 1 . 1 1 27 27 GLY N N 27 102.901 102.901 101.803 1.098 17934 74 1 . 1 1 27 27 GLY C C 27 176.219 176.219 171.527 4.692 17934 75 1 . 1 1 27 27 GLY CA C 27 43.601 43.601 45.057 -1.456 17934 76 1 . 1 1 27 27 GLY H H 27 5.891 5.891 7.882 -1.991 17934 77 1 . 1 1 28 28 SER N N 28 111.551 111.551 114.583 -3.032 17934 78 1 . 1 1 28 28 SER HA H 28 5.785 5.785 5.340 0.445 17934 79 1 . 1 1 28 28 SER CA C 28 56.258 56.258 57.436 -1.178 17934 80 1 . 1 1 28 28 SER CB C 28 65.632 65.632 66.006 -0.374 17934 81 1 . 1 1 28 28 SER H H 28 7.981 7.981 8.369 -0.388 17934 82 1 . 1 1 29 29 MET N N 29 119.493 119.493 122.568 -3.075 17934 83 1 . 1 1 29 29 MET HA H 29 4.725 4.725 4.726 -0.001 17934 84 1 . 1 1 29 29 MET C C 29 174.143 174.143 174.383 -0.240 17934 85 1 . 1 1 29 29 MET CA C 29 54.036 54.036 53.896 0.140 17934 86 1 . 1 1 29 29 MET CB C 29 37.268 37.268 36.371 0.897 17934 87 1 . 1 1 29 29 MET H H 29 8.704 8.704 8.833 -0.129 17934 88 1 . 1 1 30 30 LEU N N 30 128.150 128.150 124.151 3.999 17934 89 1 . 1 1 30 30 LEU HA H 30 3.785 3.785 3.995 -0.210 17934 90 1 . 1 1 30 30 LEU C C 30 175.857 175.857 175.335 0.522 17934 91 1 . 1 1 30 30 LEU CA C 30 56.250 56.250 54.384 1.866 17934 92 1 . 1 1 30 30 LEU CB C 30 42.660 42.660 41.836 0.824 17934 93 1 . 1 1 30 30 LEU H H 30 8.630 8.630 8.386 0.244 17934 94 1 . 1 1 31 31 ILE N N 31 127.723 127.723 127.334 0.389 17934 95 1 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.210 -0.020 17934 96 1 . 1 1 31 31 ILE C C 31 174.881 174.881 174.931 -0.050 17934 97 1 . 1 1 31 31 ILE CA C 31 57.660 57.660 59.276 -1.616 17934 98 1 . 1 1 31 31 ILE CB C 31 37.110 37.110 37.475 -0.365 17934 99 1 . 1 1 31 31 ILE H H 31 8.560 8.560 8.480 0.080 17934 100 1 . 1 1 32 32 LYS HA H 32 4.055 4.055 4.035 0.020 17934 101 1 . 1 1 32 32 LYS C C 32 176.272 176.272 176.625 -0.353 17934 102 1 . 1 1 32 32 LYS CA C 32 58.601 58.601 57.605 0.997 17934 103 1 . 1 1 32 32 LYS CB C 32 32.820 32.820 32.902 -0.082 17934 104 1 . 1 1 33 33 GLU N N 33 118.638 118.638 119.054 -0.416 17934 105 1 . 1 1 33 33 GLU HA H 33 4.388 4.388 4.132 0.256 17934 106 1 . 1 1 33 33 GLU C C 33 173.962 173.962 175.175 -1.213 17934 107 1 . 1 1 33 33 GLU CA C 33 54.851 54.851 56.213 -1.362 17934 108 1 . 1 1 33 33 GLU CB C 33 30.945 30.945 28.853 2.092 17934 109 1 . 1 1 33 33 GLU H H 33 7.723 7.723 8.343 -0.620 17934 110 1 . 1 1 34 34 LEU N N 34 126.535 126.535 122.453 4.082 17934 111 1 . 1 1 34 34 LEU HA H 34 3.945 3.945 4.373 -0.428 17934 112 1 . 1 1 34 34 LEU C C 34 176.870 176.870 176.526 0.344 17934 113 1 . 1 1 34 34 LEU CA C 34 54.850 54.850 54.614 0.236 17934 114 1 . 1 1 34 34 LEU CB C 34 41.720 41.720 42.307 -0.587 17934 115 1 . 1 1 34 34 LEU H H 34 8.446 8.446 8.016 0.430 17934 116 1 . 1 1 35 35 ARG N N 35 128.447 128.447 124.377 4.070 17934 117 1 . 1 1 35 35 ARG HA H 35 4.555 4.555 4.544 0.011 17934 118 1 . 1 1 35 35 ARG C C 35 176.110 176.110 175.797 0.313 17934 119 1 . 1 1 35 35 ARG CA C 35 54.851 54.851 55.050 -0.199 17934 120 1 . 1 1 35 35 ARG CB C 35 30.477 30.477 30.770 -0.293 17934 121 1 . 1 1 35 35 ARG H H 35 8.680 8.680 8.508 0.172 17934 122 1 . 1 1 36 36 GLY N N 36 107.406 107.406 113.174 -5.768 17934 123 1 . 1 1 36 36 GLY CA C 36 45.906 45.906 45.150 0.756 17934 124 1 . 1 1 36 36 GLY H H 36 7.182 7.182 8.336 -1.154 17934 125 1 . 1 1 37 37 THR HA H 37 4.060 4.060 4.098 -0.039 17934 126 1 . 1 1 37 37 THR C C 37 176.634 176.634 175.912 0.722 17934 127 1 . 1 1 37 37 THR CA C 37 65.632 65.632 63.706 1.926 17934 128 1 . 1 1 37 37 THR CB C 37 68.445 68.445 68.805 -0.360 17934 129 1 . 1 1 38 38 GLU N N 38 122.251 122.251 122.097 0.154 17934 130 1 . 1 1 38 38 GLU HA H 38 4.126 4.126 3.933 0.193 17934 131 1 . 1 1 38 38 GLU C C 38 179.981 179.981 178.373 1.608 17934 132 1 . 1 1 38 38 GLU CA C 38 60.008 60.008 59.685 0.323 17934 133 1 . 1 1 38 38 GLU CB C 38 29.539 29.539 29.055 0.485 17934 134 1 . 1 1 38 38 GLU H H 38 8.450 8.450 8.582 -0.132 17934 135 1 . 1 1 39 39 SER N N 39 115.966 115.966 113.659 2.307 17934 136 1 . 1 1 39 39 SER C C 39 175.991 175.991 176.465 -0.474 17934 137 1 . 1 1 39 39 SER CA C 39 62.820 62.820 61.946 0.874 17934 138 1 . 1 1 39 39 SER H H 39 7.522 7.522 7.783 -0.261 17934 139 1 . 1 1 40 40 THR HA H 40 4.049 4.049 3.918 0.131 17934 140 1 . 1 1 40 40 THR C C 40 175.972 175.972 176.886 -0.914 17934 141 1 . 1 1 40 40 THR CA C 40 66.101 66.101 65.540 0.561 17934 142 1 . 1 1 40 40 THR CB C 40 67.976 67.976 68.290 -0.314 17934 143 1 . 1 1 41 41 GLN N N 41 120.354 120.354 119.663 0.691 17934 144 1 . 1 1 41 41 GLN HA H 41 3.759 3.759 4.075 -0.316 17934 145 1 . 1 1 41 41 GLN C C 41 178.483 178.483 178.137 0.346 17934 146 1 . 1 1 41 41 GLN CA C 41 60.476 60.476 58.775 1.701 17934 147 1 . 1 1 41 41 GLN CB C 41 28.133 28.133 28.241 -0.108 17934 148 1 . 1 1 41 41 GLN H H 41 8.271 8.271 8.427 -0.156 17934 149 1 . 1 1 42 42 ASP N N 42 120.757 120.757 121.336 -0.579 17934 150 1 . 1 1 42 42 ASP HA H 42 4.359 4.359 4.402 -0.043 17934 151 1 . 1 1 42 42 ASP C C 42 177.480 177.480 177.915 -0.434 17934 152 1 . 1 1 42 42 ASP CA C 42 57.664 57.664 57.323 0.341 17934 153 1 . 1 1 42 42 ASP CB C 42 42.195 42.195 40.837 1.358 17934 154 1 . 1 1 42 42 ASP H H 42 7.954 7.954 8.091 -0.137 17934 155 1 . 1 1 43 43 ALA N N 43 120.587 120.587 122.100 -1.513 17934 156 1 . 1 1 43 43 ALA HA H 43 3.990 3.990 4.154 -0.164 17934 157 1 . 1 1 43 43 ALA C C 43 179.767 179.767 179.659 0.108 17934 158 1 . 1 1 43 43 ALA CA C 43 55.320 55.320 55.086 0.234 17934 159 1 . 1 1 43 43 ALA CB C 43 19.230 19.230 18.260 0.970 17934 160 1 . 1 1 43 43 ALA H H 43 7.842 7.842 8.286 -0.444 17934 161 1 . 1 1 44 44 CYS N N 44 115.428 115.428 117.997 -2.569 17934 162 1 . 1 1 44 44 CYS HA H 44 3.895 3.895 3.980 -0.085 17934 163 1 . 1 1 44 44 CYS C C 44 176.076 176.076 176.455 -0.379 17934 164 1 . 1 1 44 44 CYS CA C 44 64.695 64.695 63.121 1.574 17934 165 1 . 1 1 44 44 CYS CB C 44 27.664 27.664 27.260 0.404 17934 166 1 . 1 1 44 44 CYS H H 44 7.900 7.900 8.363 -0.463 17934 167 1 . 1 1 45 45 ALA N N 45 120.487 120.487 122.432 -1.945 17934 168 1 . 1 1 45 45 ALA HA H 45 4.000 4.000 3.955 0.045 17934 169 1 . 1 1 45 45 ALA C C 45 173.506 173.506 179.008 -5.502 17934 170 1 . 1 1 45 45 ALA CA C 45 55.320 55.320 55.279 0.041 17934 171 1 . 1 1 45 45 ALA CB C 45 17.940 17.940 18.191 -0.251 17934 172 1 . 1 1 45 45 ALA H H 45 7.250 7.250 8.131 -0.881 17934 173 1 . 1 1 46 46 LYS N N 46 119.267 119.267 119.242 0.025 17934 174 1 . 1 1 46 46 LYS HA H 46 3.947 3.947 3.916 0.032 17934 175 1 . 1 1 46 46 LYS C C 46 179.561 179.561 178.777 0.784 17934 176 1 . 1 1 46 46 LYS H H 46 8.102 8.102 8.157 -0.055 17934 177 1 . 1 1 47 47 MET N N 47 118.009 118.009 118.428 -0.419 17934 178 1 . 1 1 47 47 MET HA H 47 4.214 4.214 4.111 0.103 17934 179 1 . 1 1 47 47 MET C C 47 179.526 179.526 178.080 1.446 17934 180 1 . 1 1 47 47 MET CA C 47 57.195 57.195 58.831 -1.636 17934 181 1 . 1 1 47 47 MET CB C 47 30.945 30.945 32.666 -1.721 17934 182 1 . 1 1 47 47 MET H H 47 8.585 8.585 8.129 0.456 17934 183 1 . 1 1 48 48 ARG N N 48 119.962 119.962 119.654 0.308 17934 184 1 . 1 1 48 48 ARG HA H 48 3.856 3.856 3.959 -0.103 17934 185 1 . 1 1 48 48 ARG C C 48 178.875 178.875 178.042 0.832 17934 186 1 . 1 1 48 48 ARG CA C 48 60.945 60.945 59.167 1.778 17934 187 1 . 1 1 48 48 ARG CB C 48 30.477 30.477 29.834 0.643 17934 188 1 . 1 1 48 48 ARG H H 48 8.190 8.190 8.423 -0.233 17934 189 1 . 1 1 49 49 ALA N N 49 120.640 120.640 120.319 0.321 17934 190 1 . 1 1 49 49 ALA HA H 49 3.743 3.743 4.217 -0.474 17934 191 1 . 1 1 49 49 ALA C C 49 180.169 180.169 179.285 0.884 17934 192 1 . 1 1 49 49 ALA CA C 49 54.851 54.851 54.372 0.479 17934 193 1 . 1 1 49 49 ALA CB C 49 17.821 17.821 18.866 -1.045 17934 194 1 . 1 1 49 49 ALA H H 49 7.671 7.671 8.253 -0.582 17934 195 1 . 1 1 50 50 ASN N N 50 116.063 116.063 117.727 -1.664 17934 196 1 . 1 1 50 50 ASN HA H 50 4.474 4.474 4.516 -0.042 17934 197 1 . 1 1 50 50 ASN C C 50 177.084 177.084 177.152 -0.068 17934 198 1 . 1 1 50 50 ASN CA C 50 55.789 55.789 55.558 0.231 17934 199 1 . 1 1 50 50 ASN CB C 50 38.914 38.914 38.580 0.334 17934 200 1 . 1 1 50 50 ASN H H 50 7.893 7.893 8.239 -0.346 17934 201 1 . 1 1 51 51 CYS N N 51 116.884 116.884 118.103 -1.219 17934 202 1 . 1 1 51 51 CYS HA H 51 4.306 4.306 4.289 0.017 17934 203 1 . 1 1 51 51 CYS C C 51 175.002 175.002 175.990 -0.988 17934 204 1 . 1 1 51 51 CYS CA C 51 61.414 61.414 60.355 1.059 17934 205 1 . 1 1 51 51 CYS CB C 51 27.664 27.664 27.634 0.030 17934 206 1 . 1 1 51 51 CYS H H 51 7.770 7.770 8.402 -0.632 17934 207 1 . 1 1 52 52 GLN N N 52 117.831 117.831 119.759 -1.928 17934 208 1 . 1 1 52 52 GLN HA H 52 4.228 4.228 4.071 0.157 17934 209 1 . 1 1 52 52 GLN CA C 52 56.726 56.726 58.109 -1.383 17934 210 1 . 1 1 52 52 GLN CB C 52 29.070 29.070 28.146 0.924 17934 211 1 . 1 1 52 52 GLN H H 52 7.796 7.796 8.060 -0.264 17934 212 1 . 1 1 53 53 LYS N N 53 118.841 118.841 118.728 0.113 17934 213 1 . 1 1 53 53 LYS CA C 53 57.195 57.195 57.769 -0.574 17934 214 1 . 1 1 53 53 LYS CB C 53 33.289 33.289 32.756 0.533 17934 215 1 . 1 1 53 53 LYS H H 53 7.686 7.686 7.811 -0.125 17934 216 1 . 1 1 55 55 THR HA H 55 4.304 4.304 4.107 0.197 17934 217 1 . 1 1 55 55 THR CA C 55 63.757 63.757 64.807 -1.050 17934 218 1 . 1 1 55 55 THR CB C 55 68.914 68.914 68.851 0.063 17934 219 1 . 1 1 56 56 GLU N N 56 120.861 120.861 120.114 0.747 17934 220 1 . 1 1 56 56 GLU HA H 56 4.147 4.147 4.078 0.069 17934 221 1 . 1 1 56 56 GLU C C 56 177.656 177.656 178.238 -0.582 17934 222 1 . 1 1 56 56 GLU CA C 56 58.133 58.133 58.918 -0.785 17934 223 1 . 1 1 56 56 GLU CB C 56 30.008 30.008 28.883 1.125 17934 224 1 . 1 1 56 56 GLU H H 56 8.311 8.311 8.486 -0.175 17934 225 1 . 1 1 57 57 GLN N N 57 118.397 118.397 118.124 0.273 17934 226 1 . 1 1 57 57 GLN HA H 57 4.142 4.142 4.189 -0.047 17934 227 1 . 1 1 57 57 GLN C C 57 177.275 177.275 177.651 -0.376 17934 228 1 . 1 1 57 57 GLN CA C 57 57.664 57.664 57.727 -0.063 17934 229 1 . 1 1 57 57 GLN CB C 57 29.070 29.070 28.876 0.194 17934 230 1 . 1 1 57 57 GLN H H 57 7.899 7.899 7.867 0.032 17934 231 1 . 1 1 58 58 MET N N 58 118.897 118.897 117.112 1.785 17934 232 1 . 1 1 58 58 MET HA H 58 4.350 4.350 4.320 0.030 17934 233 1 . 1 1 58 58 MET C C 58 177.172 177.172 176.900 0.272 17934 234 1 . 1 1 58 58 MET CA C 58 56.726 56.726 57.284 -0.558 17934 235 1 . 1 1 58 58 MET CB C 58 32.196 32.196 33.030 -0.834 17934 236 1 . 1 1 58 58 MET H H 58 8.036 8.036 7.746 0.290 17934 237 1 . 1 1 59 59 LYS N N 59 119.779 119.779 118.106 1.673 17934 238 1 . 1 1 59 59 LYS HA H 59 4.231 4.231 4.186 0.045 17934 239 1 . 1 1 59 59 LYS C C 59 176.676 176.676 176.058 0.618 17934 240 1 . 1 1 59 59 LYS CA C 59 57.195 57.195 57.121 0.073 17934 241 1 . 1 1 59 59 LYS CB C 59 32.820 32.820 32.194 0.626 17934 242 1 . 1 1 59 59 LYS H H 59 7.901 7.901 7.818 0.083 17934 243 1 . 1 1 60 60 LYS N N 60 119.993 119.993 118.407 1.586 17934 244 1 . 1 1 60 60 LYS HA H 60 4.335 4.335 4.319 0.016 17934 245 1 . 1 1 60 60 LYS C C 60 176.336 176.336 174.975 1.361 17934 246 1 . 1 1 60 60 LYS CA C 60 56.258 56.258 56.033 0.225 17934 247 1 . 1 1 60 60 LYS CB C 60 32.820 32.820 33.287 -0.467 17934 248 1 . 1 1 60 60 LYS H H 60 7.877 7.877 7.870 0.007 17934 249 1 . 1 1 61 61 VAL N N 61 122.649 122.649 120.391 2.258 17934 250 1 . 1 1 61 61 VAL HA H 61 4.380 4.380 4.525 -0.145 17934 251 1 . 1 1 61 61 VAL C C 61 174.210 174.210 174.224 -0.014 17934 252 1 . 1 1 61 61 VAL CA C 61 60.000 60.000 58.962 1.038 17934 253 1 . 1 1 61 61 VAL CB C 61 32.350 32.350 32.850 -0.500 17934 254 1 . 1 1 61 61 VAL H H 61 7.708 7.708 8.084 -0.376 17934 255 1 . 1 1 62 62 PRO HA H 62 4.663 4.663 4.684 -0.021 17934 256 1 . 1 1 62 62 PRO C C 62 176.656 176.656 176.247 0.409 17934 257 1 . 1 1 62 62 PRO CA C 62 62.820 62.820 62.546 0.274 17934 258 1 . 1 1 62 62 PRO CB C 62 31.883 31.883 32.685 -0.802 17934 259 1 . 1 1 63 63 THR N N 63 117.155 117.155 117.016 0.139 17934 260 1 . 1 1 63 63 THR HA H 63 4.830 4.830 4.731 0.099 17934 261 1 . 1 1 63 63 THR C C 63 174.682 174.682 173.619 1.063 17934 262 1 . 1 1 63 63 THR CA C 63 62.820 62.820 62.702 0.118 17934 263 1 . 1 1 63 63 THR CB C 63 69.382 69.382 70.159 -0.777 17934 264 1 . 1 1 63 63 THR H H 63 8.303 8.303 8.468 -0.165 17934 265 1 . 1 1 64 64 ILE N N 64 121.004 121.004 122.589 -1.585 17934 266 1 . 1 1 64 64 ILE CA C 64 58.600 58.600 58.953 -0.353 17934 267 1 . 1 1 64 64 ILE CB C 64 42.690 42.690 41.887 0.802 17934 268 1 . 1 1 64 64 ILE H H 64 9.348 9.348 8.856 0.492 17934 269 1 . 1 1 65 65 ILE HA H 65 4.740 4.740 4.276 0.464 17934 270 1 . 1 1 65 65 ILE C C 65 175.378 175.378 174.762 0.616 17934 271 1 . 1 1 65 65 ILE CA C 65 60.080 60.080 61.029 -0.949 17934 272 1 . 1 1 65 65 ILE CB C 65 38.750 38.750 37.716 1.034 17934 273 1 . 1 1 66 66 LEU N N 66 110.343 110.343 129.872 -19.529 17934 274 1 . 1 1 66 66 LEU HA H 66 4.850 4.850 4.822 0.028 17934 275 1 . 1 1 66 66 LEU C C 66 174.982 174.982 175.594 -0.612 17934 276 1 . 1 1 66 66 LEU CA C 66 53.910 53.910 54.326 -0.416 17934 277 1 . 1 1 66 66 LEU CB C 66 44.230 44.230 42.779 1.452 17934 278 1 . 1 1 66 66 LEU H H 66 9.610 9.610 9.247 0.363 17934 279 1 . 1 1 67 67 SER N N 67 120.990 120.990 120.096 0.894 17934 280 1 . 1 1 67 67 SER HA H 67 5.405 5.405 5.040 0.365 17934 281 1 . 1 1 67 67 SER C C 67 174.405 174.405 173.028 1.377 17934 282 1 . 1 1 67 67 SER CA C 67 57.195 57.195 56.834 0.361 17934 283 1 . 1 1 67 67 SER CB C 67 64.695 64.695 64.372 0.323 17934 284 1 . 1 1 67 67 SER H H 67 9.260 9.260 8.882 0.378 17934 285 1 . 1 1 68 68 VAL N N 68 128.176 128.176 126.293 1.883 17934 286 1 . 1 1 68 68 VAL HA H 68 4.493 4.493 4.356 0.137 17934 287 1 . 1 1 68 68 VAL C C 68 173.891 173.891 173.330 0.561 17934 288 1 . 1 1 68 68 VAL CA C 68 62.350 62.350 60.669 1.681 17934 289 1 . 1 1 68 68 VAL CB C 68 33.750 33.750 33.963 -0.213 17934 290 1 . 1 1 68 68 VAL H H 68 9.225 9.225 8.856 0.369 17934 291 1 . 1 1 69 69 SER N N 69 121.697 121.697 123.669 -1.972 17934 292 1 . 1 1 69 69 SER HA H 69 4.837 4.837 4.958 -0.121 17934 293 1 . 1 1 69 69 SER C C 69 173.188 173.188 174.805 -1.617 17934 294 1 . 1 1 69 69 SER CA C 69 57.195 57.195 56.017 1.178 17934 295 1 . 1 1 69 69 SER CB C 69 67.976 67.976 65.771 2.205 17934 296 1 . 1 1 69 69 SER H H 69 8.869 8.869 8.739 0.130 17934 297 1 . 1 1 70 70 ALA N N 70 118.689 118.689 126.772 -8.083 17934 298 1 . 1 1 70 70 ALA HA H 70 4.150 4.150 4.229 -0.079 17934 299 1 . 1 1 70 70 ALA C C 70 176.714 176.714 177.333 -0.619 17934 300 1 . 1 1 70 70 ALA CA C 70 53.910 53.910 54.081 -0.171 17934 301 1 . 1 1 70 70 ALA CB C 70 18.600 18.600 18.774 -0.174 17934 302 1 . 1 1 70 70 ALA H H 70 8.810 8.810 8.851 -0.041 17934 303 1 . 1 1 71 71 LYS N N 71 112.633 112.633 115.602 -2.969 17934 304 1 . 1 1 71 71 LYS HA H 71 4.275 4.275 4.411 -0.136 17934 305 1 . 1 1 71 71 LYS C C 71 177.033 177.033 175.938 1.095 17934 306 1 . 1 1 71 71 LYS CA C 71 57.195 57.195 55.381 1.814 17934 307 1 . 1 1 71 71 LYS CB C 71 33.289 33.289 32.944 0.345 17934 308 1 . 1 1 71 71 LYS H H 71 7.830 7.830 7.856 -0.026 17934 309 1 . 1 1 72 72 GLY N N 72 108.432 108.432 106.775 1.657 17934 310 1 . 1 1 72 72 GLY CA C 72 45.476 45.476 45.125 0.351 17934 311 1 . 1 1 72 72 GLY H H 72 7.685 7.685 7.683 0.002 17934 312 1 . 1 1 73 73 VAL N N 73 120.414 120.414 118.398 2.016 17934 313 1 . 1 1 73 73 VAL HA H 73 5.000 5.000 4.802 0.198 17934 314 1 . 1 1 73 73 VAL CA C 73 60.470 60.470 59.841 0.629 17934 315 1 . 1 1 73 73 VAL CB C 73 35.630 35.630 35.139 0.491 17934 316 1 . 1 1 73 73 VAL H H 73 8.620 8.620 8.120 0.501 17934 317 1 . 1 1 74 74 LYS N N 74 125.257 125.257 125.033 0.224 17934 318 1 . 1 1 74 74 LYS HA H 74 5.016 5.016 4.465 0.551 17934 319 1 . 1 1 74 74 LYS CA C 74 54.383 54.383 54.208 0.175 17934 320 1 . 1 1 74 74 LYS CB C 74 36.570 36.570 35.899 0.671 17934 321 1 . 1 1 74 74 LYS H H 74 8.783 8.783 8.285 0.497 17934 322 1 . 1 1 75 75 PHE N N 75 119.414 119.414 118.414 1.000 17934 323 1 . 1 1 75 75 PHE HA H 75 5.700 5.700 5.449 0.251 17934 324 1 . 1 1 75 75 PHE CA C 75 53.920 53.920 56.448 -2.528 17934 325 1 . 1 1 75 75 PHE CB C 75 40.610 40.610 41.645 -1.035 17934 326 1 . 1 1 75 75 PHE H H 75 8.432 8.432 8.953 -0.521 17934 327 1 . 1 1 76 76 ILE N N 76 121.430 121.430 120.994 0.436 17934 328 1 . 1 1 76 76 ILE HA H 76 4.840 4.840 4.680 0.160 17934 329 1 . 1 1 76 76 ILE C C 76 175.249 175.249 174.278 0.971 17934 330 1 . 1 1 76 76 ILE CA C 76 59.070 59.070 59.744 -0.674 17934 331 1 . 1 1 76 76 ILE CB C 76 41.220 41.220 41.793 -0.573 17934 332 1 . 1 1 76 76 ILE H H 76 8.960 8.960 8.527 0.433 17934 333 1 . 1 1 77 77 ASP N N 77 125.744 125.744 123.534 2.210 17934 334 1 . 1 1 77 77 ASP HA H 77 4.563 4.563 4.975 -0.412 17934 335 1 . 1 1 77 77 ASP C C 77 177.569 177.569 175.900 1.669 17934 336 1 . 1 1 77 77 ASP CA C 77 55.789 55.789 52.821 2.968 17934 337 1 . 1 1 77 77 ASP CB C 77 43.601 43.601 43.161 0.440 17934 338 1 . 1 1 77 77 ASP H H 77 8.750 8.750 8.442 0.308 17934 339 1 . 1 1 78 78 ALA N N 78 128.632 128.632 128.109 0.523 17934 340 1 . 1 1 78 78 ALA HA H 78 3.970 3.970 4.289 -0.319 17934 341 1 . 1 1 78 78 ALA C C 78 178.052 178.052 178.164 -0.112 17934 342 1 . 1 1 78 78 ALA CA C 78 54.830 54.830 54.103 0.727 17934 343 1 . 1 1 78 78 ALA CB C 78 18.793 18.793 18.598 0.195 17934 344 1 . 1 1 78 78 ALA H H 78 8.700 8.700 8.777 -0.077 17934 345 1 . 1 1 79 79 THR N N 79 113.087 113.087 113.919 -0.832 17934 346 1 . 1 1 79 79 THR HA H 79 4.194 4.194 4.220 -0.026 17934 347 1 . 1 1 79 79 THR C C 79 175.587 175.587 175.737 -0.150 17934 348 1 . 1 1 79 79 THR CA C 79 64.695 64.695 65.043 -0.348 17934 349 1 . 1 1 79 79 THR CB C 79 69.382 69.382 69.220 0.162 17934 350 1 . 1 1 79 79 THR H H 79 8.779 8.779 8.358 0.421 17934 351 1 . 1 1 80 80 ASN N N 80 118.434 118.434 116.791 1.643 17934 352 1 . 1 1 80 80 ASN HA H 80 4.737 4.737 4.799 -0.062 17934 353 1 . 1 1 80 80 ASN CA C 80 53.445 53.445 52.842 0.603 17934 354 1 . 1 1 80 80 ASN CB C 80 39.383 39.383 39.129 0.254 17934 355 1 . 1 1 80 80 ASN H H 80 8.584 8.584 8.091 0.493 17934 356 1 . 1 1 81 81 LYS N N 81 112.429 112.429 115.826 -3.397 17934 357 1 . 1 1 81 81 LYS C C 81 174.909 174.909 175.344 -0.435 17934 358 1 . 1 1 81 81 LYS CA C 81 57.664 57.664 57.613 0.051 17934 359 1 . 1 1 81 81 LYS CB C 81 28.602 28.602 30.141 -1.539 17934 360 1 . 1 1 81 81 LYS H H 81 7.966 7.966 8.356 -0.390 17934 361 1 . 1 1 82 82 ASN N N 82 116.806 116.806 116.270 0.536 17934 362 1 . 1 1 82 82 ASN HA H 82 4.590 4.590 4.741 -0.151 17934 363 1 . 1 1 82 82 ASN C C 82 174.999 174.999 174.156 0.843 17934 364 1 . 1 1 82 82 ASN CA C 82 52.976 52.976 52.243 0.733 17934 365 1 . 1 1 82 82 ASN CB C 82 38.445 38.445 40.316 -1.871 17934 366 1 . 1 1 82 82 ASN H H 82 8.455 8.455 7.880 0.575 17934 367 1 . 1 1 83 83 ILE N N 83 122.447 122.447 119.902 2.545 17934 368 1 . 1 1 83 83 ILE HA H 83 4.030 4.030 4.285 -0.255 17934 369 1 . 1 1 83 83 ILE C C 83 176.572 176.572 175.638 0.934 17934 370 1 . 1 1 83 83 ILE CA C 83 62.350 62.350 60.759 1.591 17934 371 1 . 1 1 83 83 ILE CB C 83 37.970 37.970 37.421 0.549 17934 372 1 . 1 1 83 83 ILE H H 83 8.650 8.650 8.439 0.211 17934 373 1 . 1 1 84 84 ILE N N 84 129.339 129.339 127.011 2.328 17934 374 1 . 1 1 84 84 ILE HA H 84 3.920 3.920 4.168 -0.248 17934 375 1 . 1 1 84 84 ILE C C 84 175.873 175.873 176.021 -0.148 17934 376 1 . 1 1 84 84 ILE CA C 84 62.810 62.810 61.703 1.107 17934 377 1 . 1 1 84 84 ILE CB C 84 38.840 38.840 38.501 0.339 17934 378 1 . 1 1 84 84 ILE H H 84 8.930 8.930 8.573 0.357 17934 379 1 . 1 1 85 85 ALA N N 85 118.867 118.867 118.813 0.054 17934 380 1 . 1 1 85 85 ALA C C 85 174.100 174.100 174.738 -0.638 17934 381 1 . 1 1 85 85 ALA CA C 85 51.570 51.570 52.183 -0.613 17934 382 1 . 1 1 85 85 ALA H H 85 7.048 7.048 8.103 -1.055 17934 383 1 . 1 1 87 87 HIS HA H 87 5.154 5.154 4.921 0.233 17934 384 1 . 1 1 87 87 HIS C C 87 174.986 174.986 173.934 1.052 17934 385 1 . 1 1 87 87 HIS CB C 87 34.350 34.350 32.709 1.641 17934 386 1 . 1 1 88 88 GLU N N 88 125.372 125.372 121.057 4.315 17934 387 1 . 1 1 88 88 GLU HA H 88 4.521 4.521 4.275 0.246 17934 388 1 . 1 1 88 88 GLU C C 88 179.047 179.047 177.908 1.139 17934 389 1 . 1 1 88 88 GLU CA C 88 56.726 56.726 56.882 -0.157 17934 390 1 . 1 1 88 88 GLU CB C 88 30.477 30.477 30.295 0.182 17934 391 1 . 1 1 88 88 GLU H H 88 9.106 9.106 8.812 0.294 17934 392 1 . 1 1 89 89 ILE N N 89 124.132 124.132 123.768 0.364 17934 393 1 . 1 1 89 89 ILE HA H 89 4.019 4.019 3.880 0.139 17934 394 1 . 1 1 89 89 ILE C C 89 176.095 176.095 177.472 -1.377 17934 395 1 . 1 1 89 89 ILE CA C 89 62.351 62.351 65.002 -2.651 17934 396 1 . 1 1 89 89 ILE CB C 89 38.914 38.914 38.247 0.667 17934 397 1 . 1 1 89 89 ILE H H 89 8.055 8.055 8.868 -0.813 17934 398 1 . 1 1 90 90 ARG N N 90 116.949 116.949 116.263 0.686 17934 399 1 . 1 1 90 90 ARG HA H 90 4.338 4.338 4.232 0.106 17934 400 1 . 1 1 90 90 ARG C C 90 176.578 176.578 176.422 0.156 17934 401 1 . 1 1 90 90 ARG CA C 90 57.664 57.664 57.966 -0.302 17934 402 1 . 1 1 90 90 ARG CB C 90 29.070 29.070 29.231 -0.161 17934 403 1 . 1 1 90 90 ARG H H 90 8.045 8.045 8.510 -0.465 17934 404 1 . 1 1 91 91 ASN N N 91 116.320 116.320 116.762 -0.442 17934 405 1 . 1 1 91 91 ASN HA H 91 5.153 5.153 4.706 0.447 17934 406 1 . 1 1 91 91 ASN C C 91 174.595 174.595 175.585 -0.990 17934 407 1 . 1 1 91 91 ASN CA C 91 52.508 52.508 54.047 -1.539 17934 408 1 . 1 1 91 91 ASN CB C 91 39.852 39.852 39.756 0.096 17934 409 1 . 1 1 91 91 ASN H H 91 8.067 8.067 7.895 0.172 17934 410 1 . 1 1 92 92 ILE N N 92 122.441 122.441 121.899 0.542 17934 411 1 . 1 1 92 92 ILE HA H 92 5.073 5.073 3.830 1.243 17934 412 1 . 1 1 92 92 ILE C C 92 175.229 175.229 175.914 -0.685 17934 413 1 . 1 1 92 92 ILE CA C 92 61.880 61.880 62.779 -0.899 17934 414 1 . 1 1 92 92 ILE CB C 92 39.850 39.850 37.338 2.512 17934 415 1 . 1 1 92 92 ILE H H 92 7.483 7.483 7.820 -0.337 17934 416 1 . 1 1 93 93 SER N N 93 120.329 120.329 123.353 -3.024 17934 417 1 . 1 1 93 93 SER HA H 93 4.684 4.684 4.212 0.472 17934 418 1 . 1 1 93 93 SER C C 93 180.744 180.744 174.286 6.458 17934 419 1 . 1 1 93 93 SER CA C 93 57.664 57.664 60.826 -3.162 17934 420 1 . 1 1 93 93 SER CB C 93 66.570 66.570 63.969 2.600 17934 421 1 . 1 1 93 93 SER H H 93 9.545 9.545 8.402 1.143 17934 422 1 . 1 1 94 94 CYS N N 94 110.900 110.900 115.450 -4.550 17934 423 1 . 1 1 94 94 CYS HA H 94 3.812 3.812 4.524 -0.712 17934 424 1 . 1 1 94 94 CYS C C 94 173.973 173.973 172.673 1.300 17934 425 1 . 1 1 94 94 CYS CA C 94 59.539 59.539 58.111 1.428 17934 426 1 . 1 1 94 94 CYS CB C 94 26.258 26.258 30.474 -4.216 17934 427 1 . 1 1 94 94 CYS H H 94 8.858 8.858 7.927 0.931 17934 428 1 . 1 1 95 95 ALA N N 95 121.379 121.379 123.141 -1.762 17934 429 1 . 1 1 95 95 ALA HA H 95 4.430 4.430 4.624 -0.194 17934 430 1 . 1 1 95 95 ALA C C 95 178.098 178.098 175.092 3.006 17934 431 1 . 1 1 95 95 ALA CA C 95 52.650 52.650 51.771 0.879 17934 432 1 . 1 1 95 95 ALA CB C 95 19.300 19.300 21.660 -2.360 17934 433 1 . 1 1 95 95 ALA H H 95 8.360 8.360 8.344 0.016 17934 434 1 . 1 1 96 96 ALA N N 96 122.576 122.576 123.215 -0.639 17934 435 1 . 1 1 96 96 ALA HA H 96 4.680 4.680 4.724 -0.044 17934 436 1 . 1 1 96 96 ALA C C 96 175.716 175.716 174.714 1.002 17934 437 1 . 1 1 96 96 ALA CA C 96 52.440 52.440 51.788 0.652 17934 438 1 . 1 1 96 96 ALA CB C 96 22.700 22.700 22.044 0.656 17934 439 1 . 1 1 96 96 ALA H H 96 9.080 9.080 8.747 0.333 17934 440 1 . 1 1 97 97 GLN N N 97 116.903 116.903 119.890 -2.987 17934 441 1 . 1 1 97 97 GLN HA H 97 4.930 4.930 4.679 0.251 17934 442 1 . 1 1 97 97 GLN C C 97 175.270 175.270 174.100 1.170 17934 443 1 . 1 1 97 97 GLN CA C 97 54.851 54.851 53.788 1.063 17934 444 1 . 1 1 97 97 GLN CB C 97 33.758 33.758 31.762 1.997 17934 445 1 . 1 1 97 97 GLN H H 97 8.369 8.369 8.313 0.056 17934 446 1 . 1 1 98 98 ASP N N 98 124.971 124.971 121.560 3.411 17934 447 1 . 1 1 98 98 ASP C C 98 175.217 175.217 175.990 -0.773 17934 448 1 . 1 1 98 98 ASP CA C 98 52.039 52.039 52.258 -0.219 17934 449 1 . 1 1 98 98 ASP CB C 98 42.195 42.195 41.898 0.297 17934 450 1 . 1 1 98 98 ASP H H 98 8.395 8.395 8.335 0.060 17934 451 1 . 1 1 99 99 PRO HA H 99 4.234 4.234 4.375 -0.141 17934 452 1 . 1 1 99 99 PRO C C 99 178.433 178.433 177.676 0.757 17934 453 1 . 1 1 99 99 PRO CA C 99 64.695 64.695 64.837 -0.142 17934 454 1 . 1 1 99 99 PRO CB C 99 32.352 32.352 32.107 0.245 17934 455 1 . 1 1 100 100 GLU N N 100 116.223 116.223 118.630 -2.406 17934 456 1 . 1 1 100 100 GLU HA H 100 4.220 4.220 4.130 0.090 17934 457 1 . 1 1 100 100 GLU C C 100 176.678 176.678 175.945 0.733 17934 458 1 . 1 1 100 100 GLU CA C 100 56.726 56.726 58.310 -1.584 17934 459 1 . 1 1 100 100 GLU CB C 100 30.945 30.945 28.754 2.191 17934 460 1 . 1 1 100 100 GLU H H 100 8.643 8.643 8.762 -0.119 17934 461 1 . 1 1 101 101 ASP N N 101 119.053 119.053 119.033 0.020 17934 462 1 . 1 1 101 101 ASP HA H 101 4.543 4.543 4.866 -0.323 17934 463 1 . 1 1 101 101 ASP C C 101 174.771 174.771 176.409 -1.638 17934 464 1 . 1 1 101 101 ASP CA C 101 53.914 53.914 53.039 0.875 17934 465 1 . 1 1 101 101 ASP CB C 101 40.789 40.789 40.721 0.069 17934 466 1 . 1 1 101 101 ASP H H 101 7.597 7.597 8.082 -0.485 17934 467 1 . 1 1 102 102 LEU N N 102 123.986 123.986 121.075 2.911 17934 468 1 . 1 1 102 102 LEU HA H 102 4.390 4.390 4.286 0.104 17934 469 1 . 1 1 102 102 LEU C C 102 177.141 177.141 177.770 -0.629 17934 470 1 . 1 1 102 102 LEU CA C 102 57.660 57.660 57.321 0.339 17934 471 1 . 1 1 102 102 LEU CB C 102 42.660 42.660 41.742 0.918 17934 472 1 . 1 1 102 102 LEU H H 102 8.534 8.534 7.648 0.886 17934 473 1 . 1 1 103 103 SER N N 103 112.339 112.339 112.336 0.003 17934 474 1 . 1 1 103 103 SER HA H 103 4.290 4.290 4.324 -0.034 17934 475 1 . 1 1 103 103 SER C C 103 174.106 174.106 174.817 -0.711 17934 476 1 . 1 1 103 103 SER CA C 103 60.945 60.945 60.734 0.210 17934 477 1 . 1 1 103 103 SER CB C 103 63.757 63.757 63.415 0.342 17934 478 1 . 1 1 103 103 SER H H 103 7.867 7.867 8.270 -0.403 17934 479 1 . 1 1 104 104 THR N N 104 123.070 123.070 117.589 5.481 17934 480 1 . 1 1 104 104 THR HA H 104 5.373 5.373 4.585 0.788 17934 481 1 . 1 1 104 104 THR C C 104 180.693 180.693 172.877 7.816 17934 482 1 . 1 1 104 104 THR CA C 104 63.289 63.289 62.839 0.450 17934 483 1 . 1 1 104 104 THR CB C 104 69.382 69.382 70.249 -0.867 17934 484 1 . 1 1 104 104 THR H H 104 8.830 8.830 7.985 0.845 17934 485 1 . 1 1 105 105 PHE N N 105 122.582 122.582 122.109 0.473 17934 486 1 . 1 1 105 105 PHE HA H 105 5.470 5.470 4.972 0.498 17934 487 1 . 1 1 105 105 PHE C C 105 179.211 179.211 172.305 6.906 17934 488 1 . 1 1 105 105 PHE CA C 105 55.320 55.320 55.739 -0.419 17934 489 1 . 1 1 105 105 PHE CB C 105 41.790 41.790 41.673 0.117 17934 490 1 . 1 1 105 105 PHE H H 105 9.170 9.170 8.648 0.522 17934 491 1 . 1 1 106 106 ALA N N 106 119.567 119.567 122.892 -3.325 17934 492 1 . 1 1 106 106 ALA C C 106 175.603 175.603 175.169 0.434 17934 493 1 . 1 1 106 106 ALA H H 106 8.770 8.770 9.011 -0.241 17934 494 1 . 1 1 107 107 TYR N N 107 109.933 109.933 118.316 -8.383 17934 495 1 . 1 1 107 107 TYR HA H 107 4.920 4.920 5.194 -0.274 17934 496 1 . 1 1 107 107 TYR C C 107 180.426 180.426 172.901 7.525 17934 497 1 . 1 1 107 107 TYR CA C 107 57.080 57.080 55.132 1.948 17934 498 1 . 1 1 107 107 TYR CB C 107 40.789 40.789 41.164 -0.375 17934 499 1 . 1 1 107 107 TYR H H 107 7.950 7.950 8.820 -0.870 17934 500 1 . 1 1 108 108 ILE N N 108 120.613 120.613 119.651 0.962 17934 501 1 . 1 1 108 108 ILE HA H 108 5.370 5.370 4.665 0.705 17934 502 1 . 1 1 108 108 ILE C C 108 176.212 176.212 175.809 0.403 17934 503 1 . 1 1 108 108 ILE CA C 108 59.540 59.540 59.736 -0.196 17934 504 1 . 1 1 108 108 ILE CB C 108 39.380 39.380 39.005 0.375 17934 505 1 . 1 1 108 108 ILE H H 108 8.869 8.869 8.502 0.367 17934 506 1 . 1 1 109 109 THR N N 109 116.505 116.505 117.211 -0.706 17934 507 1 . 1 1 109 109 THR HA H 109 5.669 5.669 4.669 1.000 17934 508 1 . 1 1 109 109 THR C C 109 173.505 173.505 173.250 0.255 17934 509 1 . 1 1 109 109 THR CA C 109 59.070 59.070 60.466 -1.396 17934 510 1 . 1 1 109 109 THR H H 109 9.489 9.489 8.209 1.280 17934 511 1 . 1 1 110 110 LYS N N 110 122.960 122.960 121.230 1.730 17934 512 1 . 1 1 110 110 LYS HA H 110 4.460 4.460 4.303 0.158 17934 513 1 . 1 1 110 110 LYS C C 110 175.937 175.937 175.873 0.064 17934 514 1 . 1 1 110 110 LYS CA C 110 55.789 55.789 56.248 -0.459 17934 515 1 . 1 1 110 110 LYS CB C 110 34.227 34.227 33.067 1.160 17934 516 1 . 1 1 110 110 LYS H H 110 7.831 7.831 8.295 -0.464 17934 517 1 . 1 1 111 111 ASP N N 111 127.409 127.409 121.602 5.807 17934 518 1 . 1 1 111 111 ASP HA H 111 4.781 4.781 4.756 0.025 17934 519 1 . 1 1 111 111 ASP C C 111 176.396 176.396 177.393 -0.997 17934 520 1 . 1 1 111 111 ASP CA C 111 53.914 53.914 52.903 1.011 17934 521 1 . 1 1 111 111 ASP CB C 111 43.133 43.133 42.230 0.903 17934 522 1 . 1 1 111 111 ASP H H 111 8.769 8.769 8.258 0.511 17934 523 1 . 1 1 112 112 LEU N N 112 125.913 125.913 121.355 4.558 17934 524 1 . 1 1 112 112 LEU HA H 112 4.150 4.150 4.150 0.000 17934 525 1 . 1 1 112 112 LEU C C 112 178.553 178.553 177.637 0.916 17934 526 1 . 1 1 112 112 LEU CA C 112 57.190 57.190 57.517 -0.327 17934 527 1 . 1 1 112 112 LEU CB C 112 41.790 41.790 41.987 -0.197 17934 528 1 . 1 1 112 112 LEU H H 112 8.593 8.593 8.628 -0.035 17934 529 1 . 1 1 113 113 LYS N N 113 117.189 117.189 116.716 0.473 17934 530 1 . 1 1 113 113 LYS HA H 113 4.262 4.262 4.254 0.008 17934 531 1 . 1 1 113 113 LYS C C 113 177.180 177.180 176.010 1.171 17934 532 1 . 1 1 113 113 LYS CA C 113 58.133 58.133 56.396 1.737 17934 533 1 . 1 1 113 113 LYS CB C 113 32.820 32.820 32.663 0.157 17934 534 1 . 1 1 113 113 LYS H H 113 8.207 8.207 7.954 0.253 17934 535 1 . 1 1 114 114 SER N N 114 112.492 112.492 112.384 0.108 17934 536 1 . 1 1 114 114 SER CA C 114 58.601 58.601 58.342 0.259 17934 537 1 . 1 1 114 114 SER CB C 114 65.164 65.164 62.803 2.361 17934 538 1 . 1 1 114 114 SER H H 114 7.755 7.755 7.918 -0.163 17934 539 1 . 1 1 115 115 ASN HA H 115 4.389 4.389 4.681 -0.292 17934 540 1 . 1 1 115 115 ASN C C 115 174.203 174.203 175.022 -0.819 17934 541 1 . 1 1 115 115 ASN CA C 115 54.383 54.383 54.019 0.364 17934 542 1 . 1 1 115 115 ASN CB C 115 37.977 37.977 39.349 -1.372 17934 543 1 . 1 1 116 116 HIS N N 116 116.822 116.822 116.669 0.153 17934 544 1 . 1 1 116 116 HIS HA H 116 4.930 4.930 4.607 0.323 17934 545 1 . 1 1 116 116 HIS C C 116 173.898 173.898 173.972 -0.074 17934 546 1 . 1 1 116 116 HIS CA C 116 54.910 54.910 55.397 -0.487 17934 547 1 . 1 1 116 116 HIS CB C 116 32.650 32.650 31.897 0.753 17934 548 1 . 1 1 116 116 HIS H H 116 7.690 7.690 7.809 -0.119 17934 549 1 . 1 1 117 117 HIS N N 117 118.253 118.253 120.051 -1.798 17934 550 1 . 1 1 117 117 HIS HA H 117 5.320 5.320 4.575 0.745 17934 551 1 . 1 1 117 117 HIS C C 117 173.695 173.695 174.149 -0.454 17934 552 1 . 1 1 117 117 HIS CA C 117 56.350 56.350 56.376 -0.026 17934 553 1 . 1 1 117 117 HIS CB C 117 32.350 32.350 29.088 3.262 17934 554 1 . 1 1 117 117 HIS H H 117 8.340 8.340 8.579 -0.239 17934 555 1 . 1 1 118 118 TYR N N 118 118.301 118.301 123.934 -5.633 17934 556 1 . 1 1 118 118 TYR HA H 118 5.010 5.010 4.752 0.258 17934 557 1 . 1 1 118 118 TYR C C 118 173.530 173.530 174.509 -0.979 17934 558 1 . 1 1 118 118 TYR CA C 118 56.730 56.730 57.096 -0.366 17934 559 1 . 1 1 118 118 TYR CB C 118 43.240 43.240 40.815 2.425 17934 560 1 . 1 1 118 118 TYR H H 118 9.080 9.080 8.379 0.701 17934 561 1 . 1 1 119 119 CYS N N 119 121.015 121.015 122.335 -1.320 17934 562 1 . 1 1 119 119 CYS HA H 119 5.063 5.063 4.542 0.521 17934 563 1 . 1 1 119 119 CYS C C 119 180.664 180.664 173.492 7.172 17934 564 1 . 1 1 119 119 CYS CA C 119 56.726 56.726 57.123 -0.397 17934 565 1 . 1 1 119 119 CYS CB C 119 29.539 29.539 28.752 0.787 17934 566 1 . 1 1 119 119 CYS H H 119 9.120 9.120 8.918 0.202 17934 567 1 . 1 1 120 120 HIS N N 120 110.134 110.134 126.270 -16.136 17934 568 1 . 1 1 120 120 HIS HA H 120 4.699 4.699 4.700 -0.001 17934 569 1 . 1 1 120 120 HIS C C 120 180.776 180.776 173.398 7.378 17934 570 1 . 1 1 120 120 HIS CA C 120 55.320 55.320 54.618 0.702 17934 571 1 . 1 1 120 120 HIS CB C 120 32.352 32.352 31.084 1.268 17934 572 1 . 1 1 120 120 HIS H H 120 8.482 8.482 8.690 -0.208 17934 573 1 . 1 1 121 121 VAL N N 121 120.855 120.855 123.874 -3.019 17934 574 1 . 1 1 121 121 VAL HA H 121 4.350 4.350 4.226 0.124 17934 575 1 . 1 1 121 121 VAL C C 121 173.419 173.419 172.961 0.458 17934 576 1 . 1 1 121 121 VAL CA C 121 61.410 61.410 60.291 1.119 17934 577 1 . 1 1 121 121 VAL CB C 121 33.280 33.280 33.462 -0.182 17934 578 1 . 1 1 121 121 VAL H H 121 7.929 7.929 8.586 -0.657 17934 579 1 . 1 1 122 122 PHE N N 122 124.384 124.384 127.732 -3.348 17934 580 1 . 1 1 122 122 PHE HA H 122 5.420 5.420 5.188 0.232 17934 581 1 . 1 1 122 122 PHE C C 122 174.876 174.876 174.341 0.535 17934 582 1 . 1 1 122 122 PHE CA C 122 55.320 55.320 54.965 0.355 17934 583 1 . 1 1 122 122 PHE CB C 122 44.540 44.540 42.926 1.614 17934 584 1 . 1 1 122 122 PHE H H 122 8.910 8.910 8.982 -0.072 17934 585 1 . 1 1 123 123 THR N N 123 112.451 112.451 113.683 -1.232 17934 586 1 . 1 1 123 123 THR HA H 123 5.147 5.147 4.571 0.576 17934 587 1 . 1 1 123 123 THR C C 123 174.096 174.096 173.050 1.046 17934 588 1 . 1 1 123 123 THR CA C 123 61.843 61.843 59.759 2.084 17934 589 1 . 1 1 123 123 THR CB C 123 71.218 71.218 70.555 0.663 17934 590 1 . 1 1 123 123 THR H H 123 8.668 8.668 8.875 -0.207 17934 591 1 . 1 1 124 124 ALA N N 124 128.922 128.922 126.292 2.630 17934 592 1 . 1 1 124 124 ALA HA H 124 4.720 4.720 4.568 0.152 17934 593 1 . 1 1 124 124 ALA C C 124 177.168 177.168 176.666 0.502 17934 594 1 . 1 1 124 124 ALA CA C 124 50.890 50.890 50.249 0.641 17934 595 1 . 1 1 124 124 ALA CB C 124 21.100 21.100 21.269 -0.169 17934 596 1 . 1 1 124 124 ALA H H 124 9.180 9.180 8.377 0.803 17934 597 1 . 1 1 125 125 PHE N N 125 115.427 115.427 117.793 -2.366 17934 598 1 . 1 1 125 125 PHE HA H 125 4.290 4.290 4.472 -0.182 17934 599 1 . 1 1 125 125 PHE C C 125 174.703 174.703 175.687 -0.984 17934 600 1 . 1 1 125 125 PHE CA C 125 60.470 60.470 58.420 2.050 17934 601 1 . 1 1 125 125 PHE CB C 125 38.060 38.060 39.311 -1.251 17934 602 1 . 1 1 125 125 PHE H H 125 8.560 8.560 8.574 -0.014 17934 603 1 . 1 1 126 126 ASP N N 126 115.745 115.745 119.161 -3.416 17934 604 1 . 1 1 126 126 ASP HA H 126 4.843 4.843 4.909 -0.066 17934 605 1 . 1 1 126 126 ASP C C 126 176.532 176.532 176.188 0.344 17934 606 1 . 1 1 126 126 ASP CA C 126 53.445 53.445 53.328 0.117 17934 607 1 . 1 1 126 126 ASP CB C 126 44.070 44.070 43.835 0.235 17934 608 1 . 1 1 126 126 ASP H H 126 7.417 7.417 7.679 -0.262 17934 609 1 . 1 1 127 127 VAL N N 127 121.923 121.923 124.187 -2.264 17934 610 1 . 1 1 127 127 VAL HA H 127 3.590 3.590 3.695 -0.105 17934 611 1 . 1 1 127 127 VAL C C 127 176.863 176.863 177.207 -0.344 17934 612 1 . 1 1 127 127 VAL CA C 127 65.630 65.630 66.558 -0.928 17934 613 1 . 1 1 127 127 VAL CB C 127 31.830 31.830 32.130 -0.300 17934 614 1 . 1 1 127 127 VAL H H 127 8.508 8.508 8.655 -0.147 17934 615 1 . 1 1 128 128 ASN N N 128 118.851 118.851 118.224 0.627 17934 616 1 . 1 1 128 128 ASN HA H 128 4.476 4.476 4.441 0.035 17934 617 1 . 1 1 128 128 ASN C C 128 178.251 178.251 177.461 0.790 17934 618 1 . 1 1 128 128 ASN CA C 128 56.258 56.258 56.145 0.113 17934 619 1 . 1 1 128 128 ASN CB C 128 37.977 37.977 38.100 -0.123 17934 620 1 . 1 1 128 128 ASN H H 128 8.207 8.207 8.415 -0.208 17934 621 1 . 1 1 129 129 LEU N N 129 122.549 122.549 120.358 2.191 17934 622 1 . 1 1 129 129 LEU HA H 129 4.210 4.210 3.840 0.370 17934 623 1 . 1 1 129 129 LEU C C 129 178.003 178.003 178.187 -0.184 17934 624 1 . 1 1 129 129 LEU CA C 129 57.190 57.190 57.470 -0.280 17934 625 1 . 1 1 129 129 LEU CB C 129 41.790 41.790 41.028 0.762 17934 626 1 . 1 1 129 129 LEU H H 129 8.223 8.223 7.923 0.300 17934 627 1 . 1 1 130 130 ALA N N 130 120.036 120.036 121.964 -1.928 17934 628 1 . 1 1 130 130 ALA HA H 130 3.310 3.310 3.887 -0.577 17934 629 1 . 1 1 130 130 ALA C C 130 178.172 178.172 179.085 -0.913 17934 630 1 . 1 1 130 130 ALA CA C 130 55.780 55.780 55.310 0.470 17934 631 1 . 1 1 130 130 ALA CB C 130 19.070 19.070 18.167 0.903 17934 632 1 . 1 1 130 130 ALA H H 130 7.360 7.360 8.221 -0.861 17934 633 1 . 1 1 131 131 ALA N N 131 116.989 116.989 119.707 -2.718 17934 634 1 . 1 1 131 131 ALA HA H 131 3.710 3.710 3.978 -0.268 17934 635 1 . 1 1 131 131 ALA C C 131 180.163 180.163 179.759 0.404 17934 636 1 . 1 1 131 131 ALA CA C 131 55.780 55.780 54.683 1.097 17934 637 1 . 1 1 131 131 ALA CB C 131 17.830 17.830 18.122 -0.291 17934 638 1 . 1 1 131 131 ALA H H 131 7.360 7.360 8.254 -0.894 17934 639 1 . 1 1 132 132 GLU N N 132 119.462 119.462 119.629 -0.167 17934 640 1 . 1 1 132 132 GLU HA H 132 3.888 3.888 4.027 -0.139 17934 641 1 . 1 1 132 132 GLU C C 132 179.243 179.243 178.758 0.485 17934 642 1 . 1 1 132 132 GLU CA C 132 59.539 59.539 59.112 0.427 17934 643 1 . 1 1 132 132 GLU CB C 132 29.539 29.539 29.478 0.061 17934 644 1 . 1 1 132 132 GLU H H 132 7.673 7.673 8.033 -0.360 17934 645 1 . 1 1 133 133 ILE N N 133 123.218 123.218 120.858 2.360 17934 646 1 . 1 1 133 133 ILE HA H 133 2.780 2.780 3.559 -0.779 17934 647 1 . 1 1 133 133 ILE C C 133 177.421 177.421 178.133 -0.712 17934 648 1 . 1 1 133 133 ILE CA C 133 66.490 66.490 65.302 1.188 17934 649 1 . 1 1 133 133 ILE CB C 133 36.650 36.650 37.654 -1.004 17934 650 1 . 1 1 133 133 ILE H H 133 8.154 8.154 8.072 0.082 17934 651 1 . 1 1 134 134 ILE N N 134 118.244 118.244 119.333 -1.089 17934 652 1 . 1 1 134 134 ILE HA H 134 3.540 3.540 3.464 0.076 17934 653 1 . 1 1 134 134 ILE C C 134 179.385 179.385 177.880 1.505 17934 654 1 . 1 1 134 134 ILE CA C 134 63.280 63.280 64.456 -1.176 17934 655 1 . 1 1 134 134 ILE CB C 134 36.100 36.100 36.789 -0.689 17934 656 1 . 1 1 134 134 ILE H H 134 7.376 7.376 8.012 -0.636 17934 657 1 . 1 1 135 135 LEU N N 135 123.061 123.061 120.954 2.107 17934 658 1 . 1 1 135 135 LEU HA H 135 4.190 4.190 3.863 0.327 17934 659 1 . 1 1 135 135 LEU C C 135 179.858 179.858 178.850 1.008 17934 660 1 . 1 1 135 135 LEU CA C 135 58.190 58.190 58.723 -0.533 17934 661 1 . 1 1 135 135 LEU CB C 135 41.860 41.860 41.657 0.203 17934 662 1 . 1 1 135 135 LEU H H 135 8.036 8.036 8.190 -0.154 17934 663 1 . 1 1 136 136 THR N N 136 119.647 119.647 115.169 4.478 17934 664 1 . 1 1 136 136 THR HA H 136 3.725 3.725 3.960 -0.235 17934 665 1 . 1 1 136 136 THR C C 136 176.088 176.088 176.654 -0.566 17934 666 1 . 1 1 136 136 THR CA C 136 58.601 58.601 66.750 -8.149 17934 667 1 . 1 1 136 136 THR CB C 136 67.976 67.976 68.833 -0.857 17934 668 1 . 1 1 136 136 THR H H 136 8.508 8.508 8.279 0.229 17934 669 1 . 1 1 137 137 LEU N N 137 123.182 123.182 121.697 1.485 17934 670 1 . 1 1 137 137 LEU HA H 137 3.740 3.740 3.851 -0.111 17934 671 1 . 1 1 137 137 LEU C C 137 178.341 178.341 178.811 -0.470 17934 672 1 . 1 1 137 137 LEU CA C 137 58.260 58.260 58.260 -0.000 17934 673 1 . 1 1 137 137 LEU CB C 137 41.550 41.550 41.427 0.123 17934 674 1 . 1 1 137 137 LEU H H 137 8.520 8.520 8.427 0.093 17934 675 1 . 1 1 138 138 GLY N N 138 105.266 105.266 105.356 -0.090 17934 676 1 . 1 1 138 138 GLY C C 138 176.973 176.973 175.953 1.020 17934 677 1 . 1 1 138 138 GLY CA C 138 47.351 47.351 47.034 0.317 17934 678 1 . 1 1 138 138 GLY H H 138 7.858 7.858 8.078 -0.220 17934 679 1 . 1 1 139 139 GLN N N 139 123.485 123.485 122.489 0.996 17934 680 1 . 1 1 139 139 GLN C C 139 177.891 177.891 178.400 -0.509 17934 681 1 . 1 1 139 139 GLN CA C 139 58.601 58.601 58.590 0.011 17934 682 1 . 1 1 139 139 GLN CB C 139 28.133 28.133 28.358 -0.225 17934 683 1 . 1 1 139 139 GLN H H 139 8.195 8.195 8.465 -0.270 17934 684 1 . 1 1 140 140 ALA N N 140 122.754 122.754 121.886 0.868 17934 685 1 . 1 1 140 140 ALA HA H 140 3.709 3.709 4.171 -0.462 17934 686 1 . 1 1 140 140 ALA C C 140 178.987 178.987 179.203 -0.216 17934 687 1 . 1 1 140 140 ALA CA C 140 55.780 55.780 54.738 1.042 17934 688 1 . 1 1 140 140 ALA CB C 140 17.410 17.410 18.265 -0.855 17934 689 1 . 1 1 140 140 ALA H H 140 8.530 8.530 8.439 0.091 17934 690 1 . 1 1 141 141 PHE N N 141 116.275 116.275 119.465 -3.190 17934 691 1 . 1 1 141 141 PHE HA H 141 4.090 4.090 4.383 -0.293 17934 692 1 . 1 1 141 141 PHE C C 141 178.129 178.129 177.090 1.039 17934 693 1 . 1 1 141 141 PHE CA C 141 61.240 61.240 59.996 1.244 17934 694 1 . 1 1 141 141 PHE CB C 141 39.383 39.383 39.186 0.197 17934 695 1 . 1 1 141 141 PHE H H 141 7.920 7.920 8.198 -0.278 17934 696 1 . 1 1 142 142 GLU N N 142 119.967 119.967 119.466 0.501 17934 697 1 . 1 1 142 142 GLU HA H 142 4.227 4.227 3.782 0.445 17934 698 1 . 1 1 142 142 GLU C C 142 179.250 179.250 178.063 1.187 17934 699 1 . 1 1 142 142 GLU CA C 142 59.539 59.539 58.201 1.338 17934 700 1 . 1 1 142 142 GLU CB C 142 29.539 29.539 29.934 -0.395 17934 701 1 . 1 1 142 142 GLU H H 142 7.713 7.713 8.217 -0.504 17934 702 1 . 1 1 143 143 VAL N N 143 120.189 120.189 119.538 0.651 17934 703 1 . 1 1 143 143 VAL HA H 143 3.683 3.683 3.710 -0.027 17934 704 1 . 1 1 143 143 VAL C C 143 178.066 178.066 176.033 2.033 17934 705 1 . 1 1 143 143 VAL CA C 143 66.570 66.570 64.543 2.027 17934 706 1 . 1 1 143 143 VAL CB C 143 31.883 31.883 31.969 -0.086 17934 707 1 . 1 1 143 143 VAL H H 143 8.608 8.608 7.690 0.918 17934 708 1 . 1 1 144 144 ALA N N 144 121.753 121.753 120.279 1.474 17934 709 1 . 1 1 144 144 ALA HA H 144 4.000 4.000 4.139 -0.139 17934 710 1 . 1 1 144 144 ALA C C 144 180.776 180.776 176.639 4.137 17934 711 1 . 1 1 144 144 ALA CA C 144 55.780 55.780 52.611 3.169 17934 712 1 . 1 1 144 144 ALA CB C 144 18.770 18.770 18.529 0.241 17934 713 1 . 1 1 144 144 ALA H H 144 8.399 8.399 7.402 0.997 17934 714 1 . 1 1 145 145 TYR N N 145 119.962 119.962 119.347 0.615 17934 715 1 . 1 1 145 145 TYR HA H 145 4.190 4.190 4.417 -0.227 17934 716 1 . 1 1 145 145 TYR C C 145 177.645 177.645 175.585 2.060 17934 717 1 . 1 1 145 145 TYR CA C 145 60.880 60.880 58.420 2.459 17934 718 1 . 1 1 145 145 TYR CB C 145 37.980 37.980 39.559 -1.579 17934 719 1 . 1 1 145 145 TYR H H 145 8.190 8.190 8.267 -0.077 17934 stop_ save_