data_17927 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17927 _Entry.PDB_ID 2LJA 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 17927 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 SER HA H 2 4.121 4.121 4.284 -0.163 17927 2 1 1 . 1 1 2 2 SER CA C 2 57.293 57.293 59.620 -2.327 17927 3 1 1 . 1 1 2 2 SER CB C 2 63.545 63.545 63.561 -0.016 17927 4 1 1 . 1 1 3 3 LEU HA H 3 4.432 4.432 3.956 0.476 17927 5 1 1 . 1 1 3 3 LEU C C 3 177.383 177.383 176.185 1.198 17927 6 1 1 . 1 1 3 3 LEU CA C 3 55.575 55.575 57.798 -2.223 17927 7 1 1 . 1 1 3 3 LEU CB C 3 42.584 42.584 41.170 1.414 17927 8 1 1 . 1 1 4 4 ARG N N 4 122.080 122.080 115.748 6.332 17927 9 1 1 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.298 0.086 17927 10 1 1 . 1 1 4 4 ARG C C 4 176.410 176.410 176.724 -0.314 17927 11 1 1 . 1 1 4 4 ARG CA C 4 56.269 56.269 55.821 0.449 17927 12 1 1 . 1 1 4 4 ARG CB C 4 30.842 30.842 30.714 0.128 17927 13 1 1 . 1 1 4 4 ARG H H 4 8.410 8.410 8.364 0.046 17927 14 1 1 . 1 1 5 5 SER N N 5 117.023 117.023 117.735 -0.712 17927 15 1 1 . 1 1 5 5 SER HA H 5 4.423 4.423 4.444 -0.021 17927 16 1 1 . 1 1 5 5 SER C C 5 175.039 175.039 175.446 -0.407 17927 17 1 1 . 1 1 5 5 SER CA C 5 58.605 58.605 59.670 -1.065 17927 18 1 1 . 1 1 5 5 SER CB C 5 64.044 64.044 63.867 0.177 17927 19 1 1 . 1 1 5 5 SER H H 5 8.292 8.292 8.268 0.024 17927 20 1 1 . 1 1 6 6 GLY N N 6 110.718 110.718 109.571 1.147 17927 21 1 1 . 1 1 6 6 GLY C C 6 173.654 173.654 172.839 0.815 17927 22 1 1 . 1 1 6 6 GLY CA C 6 45.273 45.273 45.340 -0.067 17927 23 1 1 . 1 1 6 6 GLY H H 6 8.446 8.446 8.276 0.170 17927 24 1 1 . 1 1 7 7 ASN N N 7 119.287 119.287 120.180 -0.893 17927 25 1 1 . 1 1 7 7 ASN HA H 7 5.024 5.024 5.195 -0.171 17927 26 1 1 . 1 1 7 7 ASN C C 7 173.672 173.672 173.171 0.501 17927 27 1 1 . 1 1 7 7 ASN CA C 7 51.357 51.357 50.439 0.918 17927 28 1 1 . 1 1 7 7 ASN CB C 7 38.927 38.927 40.007 -1.080 17927 29 1 1 . 1 1 7 7 ASN H H 7 8.273 8.273 7.850 0.423 17927 30 1 1 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.620 -0.173 17927 31 1 1 . 1 1 8 8 PRO C C 8 176.899 176.899 175.807 1.092 17927 32 1 1 . 1 1 8 8 PRO CA C 8 63.429 63.429 62.994 0.435 17927 33 1 1 . 1 1 8 8 PRO CB C 8 32.216 32.216 31.899 0.317 17927 34 1 1 . 1 1 9 9 SER N N 9 115.642 115.642 120.943 -5.301 17927 35 1 1 . 1 1 9 9 SER HA H 9 4.415 4.415 4.550 -0.135 17927 36 1 1 . 1 1 9 9 SER C C 9 174.714 174.714 174.571 0.143 17927 37 1 1 . 1 1 9 9 SER CA C 9 58.488 58.488 57.586 0.902 17927 38 1 1 . 1 1 9 9 SER CB C 9 64.048 64.048 65.595 -1.547 17927 39 1 1 . 1 1 9 9 SER H H 9 8.336 8.336 7.992 0.344 17927 40 1 1 . 1 1 10 10 ALA N N 10 126.808 126.808 123.038 3.770 17927 41 1 1 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.552 -0.290 17927 42 1 1 . 1 1 10 10 ALA C C 10 177.233 177.233 177.004 0.229 17927 43 1 1 . 1 1 10 10 ALA CA C 10 53.230 53.230 54.396 -1.166 17927 44 1 1 . 1 1 10 10 ALA CB C 10 19.187 19.187 17.991 1.196 17927 45 1 1 . 1 1 10 10 ALA H H 10 8.137 8.137 8.988 -0.851 17927 46 1 1 . 1 1 11 11 ALA N N 11 120.449 120.449 123.361 -2.912 17927 47 1 1 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.356 -0.095 17927 48 1 1 . 1 1 11 11 ALA C C 11 177.469 177.469 176.811 0.658 17927 49 1 1 . 1 1 11 11 ALA CA C 11 52.475 52.475 51.620 0.855 17927 50 1 1 . 1 1 11 11 ALA CB C 11 19.485 19.485 17.937 1.548 17927 51 1 1 . 1 1 11 11 ALA H H 11 7.851 7.851 7.749 0.102 17927 52 1 1 . 1 1 12 12 SER N N 12 114.186 114.186 115.820 -1.634 17927 53 1 1 . 1 1 12 12 SER HA H 12 4.312 4.312 4.005 0.307 17927 54 1 1 . 1 1 12 12 SER C C 12 173.593 173.593 173.442 0.151 17927 55 1 1 . 1 1 12 12 SER CA C 12 58.099 58.099 59.200 -1.101 17927 56 1 1 . 1 1 12 12 SER CB C 12 63.320 63.320 62.175 1.145 17927 57 1 1 . 1 1 12 12 SER H H 12 7.990 7.990 8.184 -0.194 17927 58 1 1 . 1 1 13 13 PHE N N 13 118.092 118.092 121.073 -2.981 17927 59 1 1 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.720 0.060 17927 60 1 1 . 1 1 13 13 PHE C C 13 174.220 174.220 173.994 0.226 17927 61 1 1 . 1 1 13 13 PHE CA C 13 56.717 56.717 55.790 0.927 17927 62 1 1 . 1 1 13 13 PHE CB C 13 41.151 41.151 41.342 -0.191 17927 63 1 1 . 1 1 13 13 PHE H H 13 7.147 7.147 7.392 -0.245 17927 64 1 1 . 1 1 14 14 SER N N 14 116.456 116.456 114.897 1.559 17927 65 1 1 . 1 1 14 14 SER HA H 14 5.162 5.162 5.091 0.071 17927 66 1 1 . 1 1 14 14 SER C C 14 172.626 172.626 173.093 -0.467 17927 67 1 1 . 1 1 14 14 SER CA C 14 57.390 57.390 57.622 -0.232 17927 68 1 1 . 1 1 14 14 SER CB C 14 64.518 64.518 64.621 -0.103 17927 69 1 1 . 1 1 14 14 SER H H 14 7.616 7.616 8.295 -0.679 17927 70 1 1 . 1 1 15 15 TYR N N 15 122.384 122.384 123.890 -1.506 17927 71 1 1 . 1 1 15 15 TYR HA H 15 5.206 5.206 5.048 0.158 17927 72 1 1 . 1 1 15 15 TYR C C 15 172.543 172.543 173.381 -0.838 17927 73 1 1 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.119 -0.173 17927 74 1 1 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.219 1.008 17927 75 1 1 . 1 1 15 15 TYR H H 15 8.558 8.558 9.344 -0.786 17927 76 1 1 . 1 1 16 16 PRO HA H 16 5.109 5.109 5.076 0.033 17927 77 1 1 . 1 1 16 16 PRO C C 16 176.475 176.475 176.306 0.169 17927 78 1 1 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.057 -0.076 17927 79 1 1 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.044 0.618 17927 80 1 1 . 1 1 17 17 ASP N N 17 119.834 119.834 125.450 -5.616 17927 81 1 1 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.823 0.916 17927 82 1 1 . 1 1 17 17 ASP C C 17 180.740 180.740 178.183 2.557 17927 83 1 1 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.575 -1.858 17927 84 1 1 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.248 -0.687 17927 85 1 1 . 1 1 17 17 ASP H H 17 8.643 8.643 8.880 -0.237 17927 86 1 1 . 1 1 18 18 ILE N N 18 118.340 118.340 123.143 -4.803 17927 87 1 1 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.701 0.750 17927 88 1 1 . 1 1 18 18 ILE C C 18 175.742 175.742 177.867 -2.125 17927 89 1 1 . 1 1 18 18 ILE CA C 18 61.894 61.894 63.949 -2.055 17927 90 1 1 . 1 1 18 18 ILE CB C 18 39.240 39.240 37.260 1.980 17927 91 1 1 . 1 1 18 18 ILE H H 18 8.450 8.450 8.937 -0.487 17927 92 1 1 . 1 1 19 19 ASN N N 19 119.377 119.377 116.901 2.476 17927 93 1 1 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.539 0.476 17927 94 1 1 . 1 1 19 19 ASN C C 19 175.892 175.892 176.216 -0.324 17927 95 1 1 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.599 -1.292 17927 96 1 1 . 1 1 19 19 ASN CB C 19 39.825 39.825 39.006 0.819 17927 97 1 1 . 1 1 19 19 ASN H H 19 8.376 8.376 8.658 -0.282 17927 98 1 1 . 1 1 20 20 GLY N N 20 109.535 109.535 107.333 2.202 17927 99 1 1 . 1 1 20 20 GLY C C 20 174.285 174.285 173.049 1.236 17927 100 1 1 . 1 1 20 20 GLY CA C 20 45.793 45.793 44.660 1.133 17927 101 1 1 . 1 1 20 20 GLY H H 20 8.539 8.539 8.458 0.081 17927 102 1 1 . 1 1 21 21 LYS N N 21 124.675 124.675 121.245 3.430 17927 103 1 1 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.549 -0.106 17927 104 1 1 . 1 1 21 21 LYS C C 21 176.537 176.537 176.098 0.439 17927 105 1 1 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.993 0.451 17927 106 1 1 . 1 1 21 21 LYS CB C 21 32.754 32.754 33.791 -1.037 17927 107 1 1 . 1 1 21 21 LYS H H 21 8.608 8.608 7.563 1.045 17927 108 1 1 . 1 1 22 22 THR N N 22 120.666 120.666 123.636 -2.970 17927 109 1 1 . 1 1 22 22 THR HA H 22 4.087 4.087 4.352 -0.265 17927 110 1 1 . 1 1 22 22 THR C C 22 174.431 174.431 174.172 0.259 17927 111 1 1 . 1 1 22 22 THR CA C 22 64.292 64.292 64.006 0.286 17927 112 1 1 . 1 1 22 22 THR CB C 22 69.069 69.069 68.061 1.008 17927 113 1 1 . 1 1 22 22 THR H H 22 8.595 8.595 8.871 -0.276 17927 114 1 1 . 1 1 23 23 VAL N N 23 131.207 131.207 130.081 1.126 17927 115 1 1 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.374 -0.182 17927 116 1 1 . 1 1 23 23 VAL C C 23 174.244 174.244 174.985 -0.741 17927 117 1 1 . 1 1 23 23 VAL CA C 23 62.456 62.456 61.404 1.052 17927 118 1 1 . 1 1 23 23 VAL CB C 23 33.791 33.791 32.648 1.143 17927 119 1 1 . 1 1 23 23 VAL H H 23 8.937 8.937 9.246 -0.309 17927 120 1 1 . 1 1 24 24 SER N N 24 120.787 120.787 122.757 -1.970 17927 121 1 1 . 1 1 24 24 SER HA H 24 5.407 5.407 5.236 0.171 17927 122 1 1 . 1 1 24 24 SER C C 24 176.169 176.169 174.316 1.853 17927 123 1 1 . 1 1 24 24 SER CA C 24 55.135 55.135 56.301 -1.166 17927 124 1 1 . 1 1 24 24 SER CB C 24 65.646 65.646 65.775 -0.128 17927 125 1 1 . 1 1 24 24 SER H H 24 8.554 8.554 9.514 -0.960 17927 126 1 1 . 1 1 25 25 LEU N N 25 124.332 124.332 120.253 4.079 17927 127 1 1 . 1 1 25 25 LEU HA H 25 3.687 3.687 4.062 -0.375 17927 128 1 1 . 1 1 25 25 LEU C C 25 179.364 179.364 176.558 2.806 17927 129 1 1 . 1 1 25 25 LEU CA C 25 58.217 58.217 54.977 3.240 17927 130 1 1 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.106 -0.569 17927 131 1 1 . 1 1 25 25 LEU H H 25 7.811 7.811 8.068 -0.257 17927 132 1 1 . 1 1 26 26 ALA N N 26 119.799 119.799 120.528 -0.729 17927 133 1 1 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.238 -0.245 17927 134 1 1 . 1 1 26 26 ALA C C 26 179.719 179.719 178.258 1.461 17927 135 1 1 . 1 1 26 26 ALA CA C 26 54.663 54.663 52.984 1.679 17927 136 1 1 . 1 1 26 26 ALA CB C 26 18.323 18.323 19.717 -1.394 17927 137 1 1 . 1 1 26 26 ALA H H 26 8.099 8.099 7.358 0.741 17927 138 1 1 . 1 1 27 27 ASP N N 27 116.553 116.553 119.050 -2.497 17927 139 1 1 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.380 0.093 17927 140 1 1 . 1 1 27 27 ASP C C 27 176.915 176.915 177.292 -0.377 17927 141 1 1 . 1 1 27 27 ASP CA C 27 56.251 56.251 56.573 -0.322 17927 142 1 1 . 1 1 27 27 ASP CB C 27 40.788 40.788 40.973 -0.185 17927 143 1 1 . 1 1 27 27 ASP H H 27 7.572 7.572 7.629 -0.057 17927 144 1 1 . 1 1 28 28 LEU N N 28 118.950 118.950 115.634 3.316 17927 145 1 1 . 1 1 28 28 LEU HA H 28 4.233 4.233 3.800 0.433 17927 146 1 1 . 1 1 28 28 LEU C C 28 175.542 175.542 176.186 -0.644 17927 147 1 1 . 1 1 28 28 LEU CA C 28 53.706 53.706 54.627 -0.921 17927 148 1 1 . 1 1 28 28 LEU CB C 28 41.049 41.049 42.143 -1.094 17927 149 1 1 . 1 1 28 28 LEU H H 28 7.363 7.363 7.400 -0.037 17927 150 1 1 . 1 1 29 29 LYS N N 29 118.429 118.429 120.364 -1.935 17927 151 1 1 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.144 0.208 17927 152 1 1 . 1 1 29 29 LYS C C 29 178.063 178.063 177.393 0.670 17927 153 1 1 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.792 -0.015 17927 154 1 1 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.398 1.042 17927 155 1 1 . 1 1 29 29 LYS H H 29 6.780 6.780 7.213 -0.433 17927 156 1 1 . 1 1 30 30 GLY N N 30 112.426 112.426 114.557 -2.131 17927 157 1 1 . 1 1 30 30 GLY C C 30 173.801 173.801 172.860 0.941 17927 158 1 1 . 1 1 30 30 GLY CA C 30 44.611 44.611 44.961 -0.350 17927 159 1 1 . 1 1 30 30 GLY H H 30 9.398 9.398 9.083 0.315 17927 160 1 1 . 1 1 31 31 LYS N N 31 119.295 119.295 120.660 -1.365 17927 161 1 1 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.855 -0.703 17927 162 1 1 . 1 1 31 31 LYS C C 31 173.862 173.862 174.941 -1.079 17927 163 1 1 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.832 0.356 17927 164 1 1 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.655 1.313 17927 165 1 1 . 1 1 31 31 LYS H H 31 7.496 7.496 7.315 0.181 17927 166 1 1 . 1 1 32 32 TYR N N 32 116.984 116.984 122.245 -5.261 17927 167 1 1 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.524 -0.367 17927 168 1 1 . 1 1 32 32 TYR C C 32 175.226 175.226 176.159 -0.933 17927 169 1 1 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.436 0.154 17927 170 1 1 . 1 1 32 32 TYR CB C 32 39.121 39.121 38.565 0.556 17927 171 1 1 . 1 1 32 32 TYR H H 32 7.521 7.521 8.400 -0.879 17927 172 1 1 . 1 1 33 33 ILE N N 33 118.052 118.052 122.113 -4.061 17927 173 1 1 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.385 0.522 17927 174 1 1 . 1 1 33 33 ILE C C 33 174.308 174.308 174.390 -0.082 17927 175 1 1 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.544 0.158 17927 176 1 1 . 1 1 33 33 ILE CB C 33 41.616 41.616 40.010 1.606 17927 177 1 1 . 1 1 33 33 ILE H H 33 8.467 8.467 8.710 -0.243 17927 178 1 1 . 1 1 34 34 TYR N N 34 130.242 130.242 128.936 1.306 17927 179 1 1 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.302 0.224 17927 180 1 1 . 1 1 34 34 TYR C C 34 174.245 174.245 173.662 0.583 17927 181 1 1 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.831 0.327 17927 182 1 1 . 1 1 34 34 TYR CB C 34 40.133 40.133 41.136 -1.002 17927 183 1 1 . 1 1 34 34 TYR H H 34 8.905 8.905 9.362 -0.457 17927 184 1 1 . 1 1 35 35 ILE N N 35 128.697 128.697 129.825 -1.128 17927 185 1 1 . 1 1 35 35 ILE HA H 35 5.342 5.342 4.850 0.492 17927 186 1 1 . 1 1 35 35 ILE C C 35 174.520 174.520 174.457 0.063 17927 187 1 1 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.987 -0.238 17927 188 1 1 . 1 1 35 35 ILE CB C 35 40.899 40.899 38.412 2.487 17927 189 1 1 . 1 1 35 35 ILE H H 35 9.445 9.445 8.330 1.115 17927 190 1 1 . 1 1 36 36 ASP N N 36 123.675 123.675 126.687 -3.012 17927 191 1 1 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.883 -1.035 17927 192 1 1 . 1 1 36 36 ASP C C 36 174.385 174.385 175.757 -1.372 17927 193 1 1 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.460 -0.166 17927 194 1 1 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.065 -2.287 17927 195 1 1 . 1 1 36 36 ASP H H 36 8.875 8.875 8.470 0.405 17927 196 1 1 . 1 1 37 37 VAL N N 37 127.159 127.159 118.791 8.368 17927 197 1 1 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.856 0.103 17927 198 1 1 . 1 1 37 37 VAL C C 37 175.046 175.046 176.025 -0.979 17927 199 1 1 . 1 1 37 37 VAL CA C 37 62.245 62.245 60.961 1.284 17927 200 1 1 . 1 1 37 37 VAL CB C 37 31.807 31.807 32.728 -0.921 17927 201 1 1 . 1 1 37 37 VAL H H 37 8.603 8.603 8.046 0.557 17927 202 1 1 . 1 1 38 38 TRP N N 38 124.161 124.161 124.713 -0.552 17927 203 1 1 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.113 0.124 17927 204 1 1 . 1 1 38 38 TRP C C 38 171.995 171.995 173.139 -1.144 17927 205 1 1 . 1 1 38 38 TRP CA C 38 55.207 55.207 54.085 1.122 17927 206 1 1 . 1 1 38 38 TRP CB C 38 33.187 33.187 31.580 1.607 17927 207 1 1 . 1 1 38 38 TRP H H 38 8.562 8.562 8.775 -0.213 17927 208 1 1 . 1 1 39 39 ALA N N 39 116.252 116.252 123.380 -7.128 17927 209 1 1 . 1 1 39 39 ALA HA H 39 3.678 3.678 4.205 -0.527 17927 210 1 1 . 1 1 39 39 ALA C C 39 178.664 178.664 176.305 2.359 17927 211 1 1 . 1 1 39 39 ALA CA C 39 51.466 51.466 49.895 1.571 17927 212 1 1 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.270 1.071 17927 213 1 1 . 1 1 39 39 ALA H H 39 6.757 6.757 7.994 -1.237 17927 214 1 1 . 1 1 40 40 THR N N 40 114.321 114.321 116.504 -2.183 17927 215 1 1 . 1 1 40 40 THR HA H 40 3.907 3.907 3.882 0.025 17927 216 1 1 . 1 1 40 40 THR C C 40 175.885 175.885 176.164 -0.279 17927 217 1 1 . 1 1 40 40 THR CA C 40 65.447 65.447 66.307 -0.860 17927 218 1 1 . 1 1 40 40 THR CB C 40 70.106 70.106 68.965 1.141 17927 219 1 1 . 1 1 40 40 THR H H 40 9.639 9.639 8.696 0.943 17927 220 1 1 . 1 1 41 41 TRP N N 41 114.483 114.483 120.236 -5.753 17927 221 1 1 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.634 -0.071 17927 222 1 1 . 1 1 41 41 TRP C C 41 176.189 176.189 175.435 0.754 17927 223 1 1 . 1 1 41 41 TRP CA C 41 54.698 54.698 55.766 -1.068 17927 224 1 1 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.460 1.517 17927 225 1 1 . 1 1 41 41 TRP H H 41 6.401 6.401 6.934 -0.533 17927 226 1 1 . 1 1 42 42 CYS N N 42 123.536 123.536 120.979 2.557 17927 227 1 1 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.531 0.037 17927 228 1 1 . 1 1 42 42 CYS C C 42 175.726 175.726 175.525 0.201 17927 229 1 1 . 1 1 42 42 CYS CA C 42 58.700 58.700 58.426 0.274 17927 230 1 1 . 1 1 42 42 CYS CB C 42 27.121 27.121 28.298 -1.177 17927 231 1 1 . 1 1 42 42 CYS H H 42 6.883 6.883 7.017 -0.134 17927 232 1 1 . 1 1 43 43 GLY N N 43 120.977 120.977 114.539 6.438 17927 233 1 1 . 1 1 43 43 GLY CA C 43 49.204 49.204 46.481 2.723 17927 234 1 1 . 1 1 43 43 GLY H H 43 9.653 9.653 8.868 0.785 17927 235 1 1 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.303 0.184 17927 236 1 1 . 1 1 44 44 PRO C C 44 179.956 179.956 178.703 1.253 17927 237 1 1 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.031 0.611 17927 238 1 1 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.263 1.315 17927 239 1 1 . 1 1 45 45 CYS N N 45 113.925 113.925 113.931 -0.006 17927 240 1 1 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.204 0.109 17927 241 1 1 . 1 1 45 45 CYS C C 45 178.325 178.325 176.351 1.974 17927 242 1 1 . 1 1 45 45 CYS CA C 45 63.392 63.392 60.940 2.452 17927 243 1 1 . 1 1 45 45 CYS CB C 45 28.505 28.505 26.811 1.694 17927 244 1 1 . 1 1 45 45 CYS H H 45 7.676 7.676 7.680 -0.004 17927 245 1 1 . 1 1 46 46 ARG N N 46 120.336 120.336 120.770 -0.434 17927 246 1 1 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.175 -0.106 17927 247 1 1 . 1 1 46 46 ARG C C 46 180.446 180.446 177.975 2.471 17927 248 1 1 . 1 1 46 46 ARG CA C 46 59.785 59.785 57.853 1.932 17927 249 1 1 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.752 0.116 17927 250 1 1 . 1 1 46 46 ARG H H 46 8.109 8.109 7.985 0.124 17927 251 1 1 . 1 1 47 47 GLY N N 47 105.408 105.408 107.167 -1.759 17927 252 1 1 . 1 1 47 47 GLY C C 47 175.258 175.258 174.957 0.301 17927 253 1 1 . 1 1 47 47 GLY CA C 47 46.594 46.594 45.935 0.659 17927 254 1 1 . 1 1 47 47 GLY H H 47 8.466 8.466 7.964 0.502 17927 255 1 1 . 1 1 48 48 GLU N N 48 116.343 116.343 119.063 -2.720 17927 256 1 1 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.543 -0.018 17927 257 1 1 . 1 1 48 48 GLU C C 48 176.535 176.535 178.104 -1.569 17927 258 1 1 . 1 1 48 48 GLU CA C 48 55.792 55.792 55.822 -0.030 17927 259 1 1 . 1 1 48 48 GLU CB C 48 30.982 30.982 30.396 0.586 17927 260 1 1 . 1 1 48 48 GLU H H 48 7.050 7.050 7.803 -0.753 17927 261 1 1 . 1 1 49 49 LEU N N 49 118.652 118.652 122.923 -4.271 17927 262 1 1 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.122 0.030 17927 263 1 1 . 1 1 49 49 LEU C C 49 176.832 176.832 176.216 0.616 17927 264 1 1 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.080 -0.735 17927 265 1 1 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.346 -0.850 17927 266 1 1 . 1 1 49 49 LEU H H 49 7.385 7.385 8.315 -0.930 17927 267 1 1 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.083 0.170 17927 268 1 1 . 1 1 50 50 PRO C C 50 179.744 179.744 178.237 1.507 17927 269 1 1 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.212 0.347 17927 270 1 1 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.932 -0.170 17927 271 1 1 . 1 1 51 51 ALA N N 51 120.418 120.418 119.231 1.187 17927 272 1 1 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.201 -0.056 17927 273 1 1 . 1 1 51 51 ALA C C 51 180.329 180.329 179.587 0.742 17927 274 1 1 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.393 0.041 17927 275 1 1 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.294 0.076 17927 276 1 1 . 1 1 51 51 ALA H H 51 7.731 7.731 7.851 -0.120 17927 277 1 1 . 1 1 52 52 LEU N N 52 121.506 121.506 120.103 1.403 17927 278 1 1 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.710 0.278 17927 279 1 1 . 1 1 52 52 LEU C C 52 177.944 177.944 178.271 -0.327 17927 280 1 1 . 1 1 52 52 LEU CA C 52 58.327 58.327 57.851 0.476 17927 281 1 1 . 1 1 52 52 LEU CB C 52 42.382 42.382 41.925 0.457 17927 282 1 1 . 1 1 52 52 LEU H H 52 8.355 8.355 8.348 0.007 17927 283 1 1 . 1 1 53 53 LYS N N 53 119.732 119.732 118.901 0.831 17927 284 1 1 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.884 0.019 17927 285 1 1 . 1 1 53 53 LYS C C 53 179.030 179.030 179.126 -0.096 17927 286 1 1 . 1 1 53 53 LYS CA C 53 59.846 59.846 58.697 1.149 17927 287 1 1 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.352 0.858 17927 288 1 1 . 1 1 53 53 LYS H H 53 8.148 8.148 7.877 0.271 17927 289 1 1 . 1 1 54 54 GLU N N 54 117.779 117.779 119.905 -2.126 17927 290 1 1 . 1 1 54 54 GLU HA H 54 4.059 4.059 4.027 0.032 17927 291 1 1 . 1 1 54 54 GLU C C 54 179.646 179.646 179.178 0.468 17927 292 1 1 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.499 0.126 17927 293 1 1 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.452 0.115 17927 294 1 1 . 1 1 54 54 GLU H H 54 7.585 7.585 7.814 -0.229 17927 295 1 1 . 1 1 55 55 LEU N N 55 120.581 120.581 120.151 0.430 17927 296 1 1 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.072 0.121 17927 297 1 1 . 1 1 55 55 LEU C C 55 178.557 178.557 178.907 -0.350 17927 298 1 1 . 1 1 55 55 LEU CA C 55 58.235 58.235 58.024 0.211 17927 299 1 1 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.748 1.263 17927 300 1 1 . 1 1 55 55 LEU H H 55 8.096 8.096 8.130 -0.034 17927 301 1 1 . 1 1 56 56 GLU N N 56 118.023 118.023 119.764 -1.741 17927 302 1 1 . 1 1 56 56 GLU HA H 56 3.177 3.177 4.283 -1.106 17927 303 1 1 . 1 1 56 56 GLU C C 56 179.650 179.650 179.108 0.542 17927 304 1 1 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.163 -0.292 17927 305 1 1 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.411 -2.426 17927 306 1 1 . 1 1 56 56 GLU H H 56 8.181 8.181 7.854 0.327 17927 307 1 1 . 1 1 57 57 GLU N N 57 117.828 117.828 118.474 -0.646 17927 308 1 1 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.181 -0.077 17927 309 1 1 . 1 1 57 57 GLU C C 57 179.700 179.700 178.593 1.107 17927 310 1 1 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.112 0.915 17927 311 1 1 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.765 -0.099 17927 312 1 1 . 1 1 57 57 GLU H H 57 7.762 7.762 8.340 -0.578 17927 313 1 1 . 1 1 58 58 LYS N N 58 120.896 120.896 118.361 2.535 17927 314 1 1 . 1 1 58 58 LYS HA H 58 3.979 3.979 4.222 -0.243 17927 315 1 1 . 1 1 58 58 LYS C C 58 178.715 178.715 177.785 0.930 17927 316 1 1 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.360 0.718 17927 317 1 1 . 1 1 58 58 LYS CB C 58 32.980 32.980 33.238 -0.258 17927 318 1 1 . 1 1 58 58 LYS H H 58 8.410 8.410 8.290 0.120 17927 319 1 1 . 1 1 59 59 TYR N N 59 113.713 113.713 117.033 -3.320 17927 320 1 1 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.565 -0.253 17927 321 1 1 . 1 1 59 59 TYR C C 59 175.025 175.025 174.559 0.466 17927 322 1 1 . 1 1 59 59 TYR CA C 59 58.973 58.973 57.023 1.950 17927 323 1 1 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.378 -0.944 17927 324 1 1 . 1 1 59 59 TYR H H 59 8.102 8.102 7.832 0.270 17927 325 1 1 . 1 1 60 60 ALA N N 60 126.637 126.637 122.389 4.248 17927 326 1 1 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.194 0.224 17927 327 1 1 . 1 1 60 60 ALA C C 60 179.208 179.208 178.325 0.883 17927 328 1 1 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.836 0.698 17927 329 1 1 . 1 1 60 60 ALA CB C 60 18.589 18.589 17.946 0.643 17927 330 1 1 . 1 1 60 60 ALA H H 60 7.201 7.201 7.425 -0.224 17927 331 1 1 . 1 1 61 61 GLY N N 61 111.816 111.816 111.838 -0.022 17927 332 1 1 . 1 1 61 61 GLY C C 61 174.698 174.698 174.783 -0.085 17927 333 1 1 . 1 1 61 61 GLY CA C 61 45.904 45.904 44.676 1.228 17927 334 1 1 . 1 1 61 61 GLY H H 61 9.184 9.184 8.843 0.341 17927 335 1 1 . 1 1 62 62 LYS N N 62 118.497 118.497 122.027 -3.530 17927 336 1 1 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.344 0.535 17927 337 1 1 . 1 1 62 62 LYS C C 62 179.019 179.019 176.214 2.805 17927 338 1 1 . 1 1 62 62 LYS CA C 62 53.988 53.988 55.532 -1.544 17927 339 1 1 . 1 1 62 62 LYS CB C 62 33.840 33.840 32.834 1.006 17927 340 1 1 . 1 1 62 62 LYS H H 62 8.019 8.019 7.899 0.120 17927 341 1 1 . 1 1 63 63 ASP N N 63 122.982 122.982 120.876 2.106 17927 342 1 1 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.677 -0.150 17927 343 1 1 . 1 1 63 63 ASP C C 63 174.065 174.065 174.466 -0.401 17927 344 1 1 . 1 1 63 63 ASP CA C 63 55.055 55.055 54.071 0.984 17927 345 1 1 . 1 1 63 63 ASP CB C 63 38.582 38.582 39.970 -1.388 17927 346 1 1 . 1 1 63 63 ASP H H 63 8.709 8.709 8.718 -0.009 17927 347 1 1 . 1 1 64 64 ILE N N 64 122.219 122.219 118.824 3.395 17927 348 1 1 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.464 0.143 17927 349 1 1 . 1 1 64 64 ILE C C 64 174.627 174.627 173.650 0.977 17927 350 1 1 . 1 1 64 64 ILE CA C 64 59.712 59.712 60.066 -0.353 17927 351 1 1 . 1 1 64 64 ILE CB C 64 42.133 42.133 42.039 0.094 17927 352 1 1 . 1 1 64 64 ILE H H 64 8.678 8.678 7.219 1.459 17927 353 1 1 . 1 1 65 65 HIS N N 65 125.584 125.584 123.793 1.791 17927 354 1 1 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.805 0.238 17927 355 1 1 . 1 1 65 65 HIS C C 65 174.153 174.153 174.169 -0.016 17927 356 1 1 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.453 0.506 17927 357 1 1 . 1 1 65 65 HIS CB C 65 34.156 34.156 31.485 2.671 17927 358 1 1 . 1 1 65 65 HIS H H 65 9.204 9.204 8.809 0.395 17927 359 1 1 . 1 1 66 66 PHE N N 66 123.244 123.244 124.983 -1.739 17927 360 1 1 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.836 0.374 17927 361 1 1 . 1 1 66 66 PHE C C 66 175.463 175.463 174.829 0.634 17927 362 1 1 . 1 1 66 66 PHE CA C 66 58.088 58.088 57.918 0.170 17927 363 1 1 . 1 1 66 66 PHE CB C 66 39.637 39.637 38.580 1.057 17927 364 1 1 . 1 1 66 66 PHE H H 66 9.262 9.262 8.926 0.336 17927 365 1 1 . 1 1 67 67 VAL N N 67 126.201 126.201 125.575 0.626 17927 366 1 1 . 1 1 67 67 VAL HA H 67 4.834 4.834 4.804 0.030 17927 367 1 1 . 1 1 67 67 VAL C C 67 174.364 174.364 175.527 -1.163 17927 368 1 1 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.934 -0.210 17927 369 1 1 . 1 1 67 67 VAL CB C 67 34.893 34.893 32.920 1.972 17927 370 1 1 . 1 1 67 67 VAL H H 67 8.843 8.843 9.326 -0.483 17927 371 1 1 . 1 1 68 68 SER N N 68 124.528 124.528 124.079 0.449 17927 372 1 1 . 1 1 68 68 SER HA H 68 5.585 5.585 5.170 0.415 17927 373 1 1 . 1 1 68 68 SER C C 68 172.858 172.858 172.837 0.021 17927 374 1 1 . 1 1 68 68 SER CA C 68 57.282 57.282 57.819 -0.536 17927 375 1 1 . 1 1 68 68 SER CB C 68 65.032 65.032 63.298 1.734 17927 376 1 1 . 1 1 68 68 SER H H 68 9.243 9.243 8.299 0.944 17927 377 1 1 . 1 1 69 69 LEU N N 69 126.695 126.695 128.447 -1.752 17927 378 1 1 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.294 -0.777 17927 379 1 1 . 1 1 69 69 LEU C C 69 174.652 174.652 175.504 -0.852 17927 380 1 1 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.461 -0.634 17927 381 1 1 . 1 1 69 69 LEU CB C 69 43.895 43.895 45.718 -1.823 17927 382 1 1 . 1 1 69 69 LEU H H 69 9.360 9.360 9.040 0.320 17927 383 1 1 . 1 1 70 70 SER N N 70 116.379 116.379 121.950 -5.571 17927 384 1 1 . 1 1 70 70 SER HA H 70 4.905 4.905 5.162 -0.257 17927 385 1 1 . 1 1 70 70 SER C C 70 176.307 176.307 174.666 1.641 17927 386 1 1 . 1 1 70 70 SER CA C 70 55.213 55.213 56.475 -1.262 17927 387 1 1 . 1 1 70 70 SER CB C 70 63.519 63.519 64.619 -1.100 17927 388 1 1 . 1 1 70 70 SER H H 70 7.981 7.981 8.678 -0.697 17927 389 1 1 . 1 1 71 71 CYS N N 71 124.670 124.670 127.605 -2.935 17927 390 1 1 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.511 0.447 17927 391 1 1 . 1 1 71 71 CYS C C 71 173.996 173.996 174.286 -0.290 17927 392 1 1 . 1 1 71 71 CYS CA C 71 55.483 55.483 57.186 -1.703 17927 393 1 1 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.473 0.639 17927 394 1 1 . 1 1 71 71 CYS H H 71 8.609 8.609 9.097 -0.488 17927 395 1 1 . 1 1 72 72 ASP N N 72 122.398 122.398 121.364 1.034 17927 396 1 1 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.832 -0.540 17927 397 1 1 . 1 1 72 72 ASP C C 72 176.653 176.653 176.685 -0.032 17927 398 1 1 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.855 0.927 17927 399 1 1 . 1 1 72 72 ASP CB C 72 41.526 41.526 41.480 0.046 17927 400 1 1 . 1 1 72 72 ASP H H 72 8.557 8.557 7.460 1.097 17927 401 1 1 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.253 -0.188 17927 402 1 1 . 1 1 73 73 LYS C C 73 176.545 176.545 176.497 0.048 17927 403 1 1 . 1 1 73 73 LYS CA C 73 58.458 58.458 58.185 0.273 17927 404 1 1 . 1 1 73 73 LYS CB C 73 32.641 32.641 33.140 -0.499 17927 405 1 1 . 1 1 74 74 ASN N N 74 117.616 117.616 118.567 -0.951 17927 406 1 1 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.780 0.125 17927 407 1 1 . 1 1 74 74 ASN C C 74 174.894 174.894 175.484 -0.590 17927 408 1 1 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.982 -1.461 17927 409 1 1 . 1 1 74 74 ASN CB C 74 38.109 38.109 37.441 0.668 17927 410 1 1 . 1 1 74 74 ASN H H 74 8.625 8.625 8.450 0.175 17927 411 1 1 . 1 1 75 75 LYS N N 75 126.797 126.797 125.468 1.329 17927 412 1 1 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.617 -0.194 17927 413 1 1 . 1 1 75 75 LYS C C 75 178.058 178.058 177.943 0.115 17927 414 1 1 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.288 -0.115 17927 415 1 1 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.407 0.884 17927 416 1 1 . 1 1 75 75 LYS H H 75 8.588 8.588 7.896 0.692 17927 417 1 1 . 1 1 76 76 LYS N N 76 117.875 117.875 119.621 -1.746 17927 418 1 1 . 1 1 76 76 LYS HA H 76 4.200 4.200 4.176 0.024 17927 419 1 1 . 1 1 76 76 LYS C C 76 178.791 178.791 178.579 0.212 17927 420 1 1 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.381 -0.773 17927 421 1 1 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.149 0.341 17927 422 1 1 . 1 1 76 76 LYS H H 76 8.041 8.041 8.753 -0.712 17927 423 1 1 . 1 1 77 77 ALA N N 77 121.567 121.567 120.869 0.698 17927 424 1 1 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.210 -0.087 17927 425 1 1 . 1 1 77 77 ALA C C 77 181.191 181.191 179.490 1.701 17927 426 1 1 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.392 0.565 17927 427 1 1 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.228 -0.469 17927 428 1 1 . 1 1 77 77 ALA H H 77 7.366 7.366 8.147 -0.781 17927 429 1 1 . 1 1 78 78 TRP N N 78 119.497 119.497 120.672 -1.175 17927 430 1 1 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.230 -0.153 17927 431 1 1 . 1 1 78 78 TRP C C 78 175.942 175.942 177.034 -1.092 17927 432 1 1 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.086 2.675 17927 433 1 1 . 1 1 78 78 TRP CB C 78 27.272 27.272 30.167 -2.895 17927 434 1 1 . 1 1 78 78 TRP H H 78 7.187 7.187 7.884 -0.697 17927 435 1 1 . 1 1 79 79 GLU N N 79 118.771 118.771 119.718 -0.947 17927 436 1 1 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.483 -0.469 17927 437 1 1 . 1 1 79 79 GLU C C 79 179.863 179.863 178.101 1.762 17927 438 1 1 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.797 -0.687 17927 439 1 1 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.963 1.257 17927 440 1 1 . 1 1 79 79 GLU H H 79 8.813 8.813 8.989 -0.176 17927 441 1 1 . 1 1 80 80 ASN N N 80 115.964 115.964 117.437 -1.473 17927 442 1 1 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.493 -0.154 17927 443 1 1 . 1 1 80 80 ASN C C 80 176.749 176.749 177.466 -0.717 17927 444 1 1 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.340 0.695 17927 445 1 1 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.170 0.319 17927 446 1 1 . 1 1 80 80 ASN H H 80 8.491 8.491 7.946 0.545 17927 447 1 1 . 1 1 81 81 MET N N 81 119.670 119.670 120.269 -0.599 17927 448 1 1 . 1 1 81 81 MET HA H 81 4.149 4.149 4.228 -0.079 17927 449 1 1 . 1 1 81 81 MET C C 81 177.933 177.933 177.806 0.127 17927 450 1 1 . 1 1 81 81 MET CA C 81 60.276 60.276 57.892 2.384 17927 451 1 1 . 1 1 81 81 MET CB C 81 32.518 32.518 32.309 0.209 17927 452 1 1 . 1 1 81 81 MET H H 81 7.667 7.667 7.623 0.044 17927 453 1 1 . 1 1 82 82 VAL N N 82 117.634 117.634 118.441 -0.807 17927 454 1 1 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.484 -0.181 17927 455 1 1 . 1 1 82 82 VAL C C 82 179.005 179.005 177.578 1.427 17927 456 1 1 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.121 0.916 17927 457 1 1 . 1 1 82 82 VAL CB C 82 31.765 31.765 30.779 0.986 17927 458 1 1 . 1 1 82 82 VAL H H 82 8.338 8.338 8.208 0.130 17927 459 1 1 . 1 1 83 83 THR N N 83 110.519 110.519 115.330 -4.811 17927 460 1 1 . 1 1 83 83 THR HA H 83 3.983 3.983 3.928 0.055 17927 461 1 1 . 1 1 83 83 THR C C 83 177.591 177.591 176.074 1.517 17927 462 1 1 . 1 1 83 83 THR CA C 83 65.431 65.431 66.481 -1.050 17927 463 1 1 . 1 1 83 83 THR CB C 83 69.156 69.156 68.530 0.626 17927 464 1 1 . 1 1 83 83 THR H H 83 7.659 7.659 7.453 0.206 17927 465 1 1 . 1 1 84 84 LYS N N 84 123.927 123.927 120.474 3.453 17927 466 1 1 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.141 -0.072 17927 467 1 1 . 1 1 84 84 LYS C C 84 178.582 178.582 177.868 0.714 17927 468 1 1 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.476 1.401 17927 469 1 1 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.691 -0.368 17927 470 1 1 . 1 1 84 84 LYS H H 84 8.665 8.665 7.490 1.175 17927 471 1 1 . 1 1 85 85 ASP N N 85 116.280 116.280 117.333 -1.053 17927 472 1 1 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.558 0.192 17927 473 1 1 . 1 1 85 85 ASP C C 85 175.086 175.086 175.859 -0.773 17927 474 1 1 . 1 1 85 85 ASP CA C 85 54.693 54.693 56.169 -1.476 17927 475 1 1 . 1 1 85 85 ASP CB C 85 39.685 39.685 41.318 -1.633 17927 476 1 1 . 1 1 85 85 ASP H H 85 8.179 8.179 8.480 -0.301 17927 477 1 1 . 1 1 86 86 GLN N N 86 116.258 116.258 114.370 1.888 17927 478 1 1 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.981 -0.073 17927 479 1 1 . 1 1 86 86 GLN C C 86 175.659 175.659 175.456 0.203 17927 480 1 1 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.422 -0.251 17927 481 1 1 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.128 0.162 17927 482 1 1 . 1 1 86 86 GLN H H 86 7.431 7.431 7.861 -0.430 17927 483 1 1 . 1 1 87 87 LEU N N 87 117.031 117.031 118.534 -1.503 17927 484 1 1 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.276 -0.186 17927 485 1 1 . 1 1 87 87 LEU C C 87 178.225 178.225 175.782 2.443 17927 486 1 1 . 1 1 87 87 LEU CA C 87 55.932 55.932 54.239 1.693 17927 487 1 1 . 1 1 87 87 LEU CB C 87 41.202 41.202 39.574 1.628 17927 488 1 1 . 1 1 87 87 LEU H H 87 7.736 7.736 7.539 0.197 17927 489 1 1 . 1 1 88 88 LYS N N 88 122.367 122.367 118.954 3.413 17927 490 1 1 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.370 0.266 17927 491 1 1 . 1 1 88 88 LYS C C 88 177.538 177.538 176.900 0.638 17927 492 1 1 . 1 1 88 88 LYS CA C 88 54.930 54.930 55.733 -0.803 17927 493 1 1 . 1 1 88 88 LYS CB C 88 33.316 33.316 32.865 0.451 17927 494 1 1 . 1 1 88 88 LYS H H 88 8.496 8.496 7.476 1.020 17927 495 1 1 . 1 1 89 89 GLY N N 89 108.452 108.452 107.384 1.068 17927 496 1 1 . 1 1 89 89 GLY C C 89 173.781 173.781 173.334 0.447 17927 497 1 1 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.582 0.776 17927 498 1 1 . 1 1 89 89 GLY H H 89 8.497 8.497 7.954 0.543 17927 499 1 1 . 1 1 90 90 ILE N N 90 123.295 123.295 124.664 -1.369 17927 500 1 1 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.478 -0.107 17927 501 1 1 . 1 1 90 90 ILE C C 90 175.606 175.606 173.771 1.835 17927 502 1 1 . 1 1 90 90 ILE CA C 90 62.001 62.001 59.532 2.469 17927 503 1 1 . 1 1 90 90 ILE CB C 90 38.036 38.036 36.859 1.177 17927 504 1 1 . 1 1 90 90 ILE H H 90 8.728 8.728 8.027 0.701 17927 505 1 1 . 1 1 91 91 GLN N N 91 128.632 128.632 124.353 4.279 17927 506 1 1 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.805 -0.039 17927 507 1 1 . 1 1 91 91 GLN C C 91 174.618 174.618 173.748 0.870 17927 508 1 1 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.998 0.852 17927 509 1 1 . 1 1 91 91 GLN CB C 91 28.341 28.341 32.639 -4.298 17927 510 1 1 . 1 1 91 91 GLN H H 91 8.762 8.762 8.417 0.345 17927 511 1 1 . 1 1 92 92 LEU N N 92 120.830 120.830 120.185 0.645 17927 512 1 1 . 1 1 92 92 LEU HA H 92 5.580 5.580 4.934 0.646 17927 513 1 1 . 1 1 92 92 LEU C C 92 176.828 176.828 174.799 2.029 17927 514 1 1 . 1 1 92 92 LEU CA C 92 52.801 52.801 54.008 -1.207 17927 515 1 1 . 1 1 92 92 LEU CB C 92 44.210 44.210 46.713 -2.503 17927 516 1 1 . 1 1 92 92 LEU H H 92 9.011 9.011 9.101 -0.090 17927 517 1 1 . 1 1 93 93 HIS N N 93 121.481 121.481 121.711 -0.230 17927 518 1 1 . 1 1 93 93 HIS HA H 93 3.931 3.931 5.084 -1.153 17927 519 1 1 . 1 1 93 93 HIS C C 93 173.590 173.590 173.778 -0.188 17927 520 1 1 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.395 1.188 17927 521 1 1 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.315 -1.065 17927 522 1 1 . 1 1 93 93 HIS H H 93 8.038 8.038 8.412 -0.374 17927 523 1 1 . 1 1 94 94 MET N N 94 121.881 121.881 125.712 -3.831 17927 524 1 1 . 1 1 94 94 MET HA H 94 3.866 3.866 4.508 -0.641 17927 525 1 1 . 1 1 94 94 MET C C 94 177.035 177.035 176.039 0.996 17927 526 1 1 . 1 1 94 94 MET CA C 94 55.189 55.189 57.821 -2.632 17927 527 1 1 . 1 1 94 94 MET CB C 94 33.993 33.993 33.768 0.225 17927 528 1 1 . 1 1 94 94 MET H H 94 8.039 8.039 8.781 -0.742 17927 529 1 1 . 1 1 95 95 GLY N N 95 104.041 104.041 105.225 -1.184 17927 530 1 1 . 1 1 95 95 GLY C C 95 174.251 174.251 174.361 -0.110 17927 531 1 1 . 1 1 95 95 GLY CA C 95 46.580 46.580 45.696 0.884 17927 532 1 1 . 1 1 95 95 GLY H H 95 5.666 5.666 7.979 -2.313 17927 533 1 1 . 1 1 96 96 THR N N 96 114.114 114.114 117.856 -3.742 17927 534 1 1 . 1 1 96 96 THR HA H 96 4.211 4.211 4.480 -0.269 17927 535 1 1 . 1 1 96 96 THR C C 96 175.122 175.122 174.004 1.118 17927 536 1 1 . 1 1 96 96 THR CA C 96 61.339 61.339 62.658 -1.319 17927 537 1 1 . 1 1 96 96 THR CB C 96 68.615 68.615 70.208 -1.593 17927 538 1 1 . 1 1 96 96 THR H H 96 8.517 8.517 8.094 0.423 17927 539 1 1 . 1 1 97 97 ASP N N 97 121.892 121.892 122.282 -0.390 17927 540 1 1 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.733 -0.148 17927 541 1 1 . 1 1 97 97 ASP C C 97 178.241 178.241 175.915 2.326 17927 542 1 1 . 1 1 97 97 ASP CA C 97 55.800 55.800 53.496 2.304 17927 543 1 1 . 1 1 97 97 ASP CB C 97 43.129 43.129 38.992 4.137 17927 544 1 1 . 1 1 97 97 ASP H H 97 7.563 7.563 8.530 -0.967 17927 545 1 1 . 1 1 98 98 ARG N N 98 127.508 127.508 119.161 8.347 17927 546 1 1 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.493 -0.101 17927 547 1 1 . 1 1 98 98 ARG C C 98 176.724 176.724 177.330 -0.606 17927 548 1 1 . 1 1 98 98 ARG CA C 98 55.939 55.939 56.713 -0.774 17927 549 1 1 . 1 1 98 98 ARG CB C 98 30.291 30.291 28.855 1.436 17927 550 1 1 . 1 1 98 98 ARG H H 98 9.225 9.225 7.855 1.370 17927 551 1 1 . 1 1 99 99 THR N N 99 116.384 116.384 117.004 -0.620 17927 552 1 1 . 1 1 99 99 THR HA H 99 3.987 3.987 4.203 -0.216 17927 553 1 1 . 1 1 99 99 THR C C 99 176.969 176.969 175.513 1.456 17927 554 1 1 . 1 1 99 99 THR CA C 99 67.714 67.714 66.340 1.374 17927 555 1 1 . 1 1 99 99 THR CB C 99 68.777 68.777 68.463 0.313 17927 556 1 1 . 1 1 99 99 THR H H 99 8.382 8.382 8.129 0.253 17927 557 1 1 . 1 1 100 100 PHE N N 100 123.232 123.232 122.340 0.892 17927 558 1 1 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.403 -0.230 17927 559 1 1 . 1 1 100 100 PHE C C 100 177.010 177.010 176.784 0.226 17927 560 1 1 . 1 1 100 100 PHE CA C 100 61.923 61.923 60.346 1.577 17927 561 1 1 . 1 1 100 100 PHE CB C 100 40.762 40.762 38.959 1.803 17927 562 1 1 . 1 1 100 100 PHE H H 100 7.998 7.998 7.827 0.171 17927 563 1 1 . 1 1 101 101 MET N N 101 115.968 115.968 119.373 -3.405 17927 564 1 1 . 1 1 101 101 MET HA H 101 3.975 3.975 4.039 -0.064 17927 565 1 1 . 1 1 101 101 MET C C 101 178.763 178.763 177.638 1.125 17927 566 1 1 . 1 1 101 101 MET CA C 101 58.552 58.552 58.520 0.032 17927 567 1 1 . 1 1 101 101 MET CB C 101 32.593 32.593 32.248 0.345 17927 568 1 1 . 1 1 101 101 MET H H 101 7.828 7.828 8.056 -0.228 17927 569 1 1 . 1 1 102 102 ASP N N 102 117.553 117.553 118.722 -1.169 17927 570 1 1 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.506 0.016 17927 571 1 1 . 1 1 102 102 ASP C C 102 179.503 179.503 178.987 0.516 17927 572 1 1 . 1 1 102 102 ASP CA C 102 56.890 56.890 56.820 0.070 17927 573 1 1 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.359 -0.433 17927 574 1 1 . 1 1 102 102 ASP H H 102 8.828 8.828 7.781 1.047 17927 575 1 1 . 1 1 103 103 ALA N N 103 122.984 122.984 122.815 0.169 17927 576 1 1 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.088 -0.102 17927 577 1 1 . 1 1 103 103 ALA C C 103 178.782 178.782 177.889 0.893 17927 578 1 1 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.295 0.799 17927 579 1 1 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.470 0.093 17927 580 1 1 . 1 1 103 103 ALA H H 103 7.567 7.567 7.689 -0.122 17927 581 1 1 . 1 1 104 104 TYR N N 104 112.159 112.159 113.201 -1.042 17927 582 1 1 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.524 -0.300 17927 583 1 1 . 1 1 104 104 TYR C C 104 173.821 173.821 175.009 -1.188 17927 584 1 1 . 1 1 104 104 TYR CA C 104 58.498 58.498 57.483 1.015 17927 585 1 1 . 1 1 104 104 TYR CB C 104 38.393 38.393 39.760 -1.367 17927 586 1 1 . 1 1 104 104 TYR H H 104 7.203 7.203 7.398 -0.195 17927 587 1 1 . 1 1 105 105 LEU N N 105 119.433 119.433 117.974 1.459 17927 588 1 1 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.890 0.095 17927 589 1 1 . 1 1 105 105 LEU C C 105 176.721 176.721 175.861 0.860 17927 590 1 1 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.972 -0.188 17927 591 1 1 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.885 -1.442 17927 592 1 1 . 1 1 105 105 LEU H H 105 7.582 7.582 7.535 0.047 17927 593 1 1 . 1 1 106 106 ILE N N 106 119.575 119.575 120.151 -0.576 17927 594 1 1 . 1 1 106 106 ILE HA H 106 4.002 4.002 3.785 0.217 17927 595 1 1 . 1 1 106 106 ILE C C 106 175.459 175.459 175.102 0.357 17927 596 1 1 . 1 1 106 106 ILE CA C 106 62.043 62.043 62.562 -0.519 17927 597 1 1 . 1 1 106 106 ILE CB C 106 36.335 36.335 37.611 -1.276 17927 598 1 1 . 1 1 106 106 ILE H H 106 8.774 8.774 7.776 0.998 17927 599 1 1 . 1 1 107 107 ASN N N 107 126.514 126.514 124.306 2.208 17927 600 1 1 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.764 0.099 17927 601 1 1 . 1 1 107 107 ASN C C 107 174.584 174.584 176.161 -1.577 17927 602 1 1 . 1 1 107 107 ASN CA C 107 53.112 53.112 52.901 0.211 17927 603 1 1 . 1 1 107 107 ASN CB C 107 38.977 38.977 41.287 -2.310 17927 604 1 1 . 1 1 107 107 ASN H H 107 8.364 8.364 8.081 0.283 17927 605 1 1 . 1 1 108 108 GLY N N 108 108.469 108.469 111.178 -2.709 17927 606 1 1 . 1 1 108 108 GLY C C 108 171.245 171.245 173.737 -2.492 17927 607 1 1 . 1 1 108 108 GLY CA C 108 45.269 45.269 45.541 -0.272 17927 608 1 1 . 1 1 108 108 GLY H H 108 7.678 7.678 8.817 -1.139 17927 609 1 1 . 1 1 109 109 ILE N N 109 112.817 112.817 118.805 -5.988 17927 610 1 1 . 1 1 109 109 ILE HA H 109 4.406 4.406 3.866 0.540 17927 611 1 1 . 1 1 109 109 ILE C C 109 173.498 173.498 173.305 0.193 17927 612 1 1 . 1 1 109 109 ILE CA C 109 58.384 58.384 60.875 -2.491 17927 613 1 1 . 1 1 109 109 ILE CB C 109 40.322 40.322 37.606 2.716 17927 614 1 1 . 1 1 109 109 ILE H H 109 7.868 7.868 7.935 -0.067 17927 615 1 1 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.743 -0.001 17927 616 1 1 . 1 1 110 110 PRO C C 110 175.715 175.715 175.384 0.331 17927 617 1 1 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.096 0.180 17927 618 1 1 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.545 3.823 17927 619 1 1 . 1 1 111 111 ARG N N 111 122.358 122.358 121.477 0.881 17927 620 1 1 . 1 1 111 111 ARG HA H 111 4.469 4.469 4.157 0.312 17927 621 1 1 . 1 1 111 111 ARG C C 111 171.541 171.541 174.991 -3.450 17927 622 1 1 . 1 1 111 111 ARG CA C 111 54.356 54.356 54.422 -0.066 17927 623 1 1 . 1 1 111 111 ARG CB C 111 33.430 33.430 32.204 1.226 17927 624 1 1 . 1 1 111 111 ARG H H 111 7.732 7.732 8.518 -0.786 17927 625 1 1 . 1 1 112 112 PHE N N 112 125.103 125.103 120.153 4.950 17927 626 1 1 . 1 1 112 112 PHE HA H 112 5.773 5.773 4.799 0.974 17927 627 1 1 . 1 1 112 112 PHE C C 112 175.097 175.097 174.671 0.426 17927 628 1 1 . 1 1 112 112 PHE CA C 112 55.791 55.791 55.824 -0.033 17927 629 1 1 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.232 1.696 17927 630 1 1 . 1 1 112 112 PHE H H 112 8.929 8.929 7.511 1.418 17927 631 1 1 . 1 1 113 113 ILE N N 113 123.778 123.778 122.942 0.836 17927 632 1 1 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.961 -0.418 17927 633 1 1 . 1 1 113 113 ILE C C 113 173.197 173.197 174.201 -1.004 17927 634 1 1 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.600 0.686 17927 635 1 1 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.411 1.835 17927 636 1 1 . 1 1 113 113 ILE H H 113 8.873 8.873 8.553 0.320 17927 637 1 1 . 1 1 114 114 LEU N N 114 127.146 127.146 125.854 1.292 17927 638 1 1 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.492 0.522 17927 639 1 1 . 1 1 114 114 LEU C C 114 175.080 175.080 174.593 0.487 17927 640 1 1 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.767 -0.367 17927 641 1 1 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.927 0.443 17927 642 1 1 . 1 1 114 114 LEU H H 114 8.974 8.974 8.963 0.011 17927 643 1 1 . 1 1 115 115 LEU N N 115 128.323 128.323 123.931 4.392 17927 644 1 1 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.238 0.194 17927 645 1 1 . 1 1 115 115 LEU C C 115 176.660 176.660 175.696 0.964 17927 646 1 1 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.694 -0.617 17927 647 1 1 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.270 -1.686 17927 648 1 1 . 1 1 115 115 LEU H H 115 9.874 9.874 9.334 0.540 17927 649 1 1 . 1 1 116 116 ASP N N 116 119.834 119.834 121.299 -1.465 17927 650 1 1 . 1 1 116 116 ASP HA H 116 4.935 4.935 5.002 -0.067 17927 651 1 1 . 1 1 116 116 ASP C C 116 176.898 176.898 177.767 -0.869 17927 652 1 1 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.819 -1.514 17927 653 1 1 . 1 1 116 116 ASP CB C 116 41.028 41.028 43.006 -1.978 17927 654 1 1 . 1 1 116 116 ASP H H 116 9.357 9.357 9.016 0.341 17927 655 1 1 . 1 1 117 117 ARG N N 117 113.356 113.356 122.569 -9.213 17927 656 1 1 . 1 1 117 117 ARG HA H 117 3.717 3.717 3.876 -0.159 17927 657 1 1 . 1 1 117 117 ARG C C 117 177.105 177.105 178.389 -1.284 17927 658 1 1 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.786 -1.601 17927 659 1 1 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.740 0.697 17927 660 1 1 . 1 1 117 117 ARG H H 117 7.697 7.697 8.142 -0.445 17927 661 1 1 . 1 1 118 118 ASP N N 118 117.226 117.226 117.328 -0.102 17927 662 1 1 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.381 0.514 17927 663 1 1 . 1 1 118 118 ASP C C 118 176.657 176.657 176.823 -0.166 17927 664 1 1 . 1 1 118 118 ASP CA C 118 53.517 53.517 56.118 -2.601 17927 665 1 1 . 1 1 118 118 ASP CB C 118 42.556 42.556 41.459 1.097 17927 666 1 1 . 1 1 118 118 ASP H H 118 8.456 8.456 8.536 -0.080 17927 667 1 1 . 1 1 119 119 GLY N N 119 109.074 109.074 105.453 3.621 17927 668 1 1 . 1 1 119 119 GLY C C 119 173.355 173.355 174.055 -0.700 17927 669 1 1 . 1 1 119 119 GLY CA C 119 46.256 46.256 44.788 1.468 17927 670 1 1 . 1 1 119 119 GLY H H 119 8.183 8.183 8.243 -0.060 17927 671 1 1 . 1 1 120 120 LYS N N 120 120.744 120.744 121.567 -0.823 17927 672 1 1 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.627 -0.094 17927 673 1 1 . 1 1 120 120 LYS C C 120 177.229 177.229 176.132 1.097 17927 674 1 1 . 1 1 120 120 LYS CA C 120 55.287 55.287 54.346 0.941 17927 675 1 1 . 1 1 120 120 LYS CB C 120 32.581 32.581 32.123 0.458 17927 676 1 1 . 1 1 120 120 LYS H H 120 8.449 8.449 7.559 0.890 17927 677 1 1 . 1 1 121 121 ILE N N 121 121.221 121.221 128.069 -6.848 17927 678 1 1 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.874 0.012 17927 679 1 1 . 1 1 121 121 ILE C C 121 177.819 177.819 176.278 1.541 17927 680 1 1 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.443 0.472 17927 681 1 1 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.165 2.225 17927 682 1 1 . 1 1 121 121 ILE H H 121 8.715 8.715 8.881 -0.166 17927 683 1 1 . 1 1 122 122 ILE N N 122 127.165 127.165 128.314 -1.149 17927 684 1 1 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.274 0.067 17927 685 1 1 . 1 1 122 122 ILE C C 122 176.978 176.978 176.771 0.207 17927 686 1 1 . 1 1 122 122 ILE CA C 122 63.719 63.719 62.165 1.554 17927 687 1 1 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.524 0.128 17927 688 1 1 . 1 1 122 122 ILE H H 122 8.974 8.974 8.577 0.397 17927 689 1 1 . 1 1 123 123 SER N N 123 111.227 111.227 116.014 -4.787 17927 690 1 1 . 1 1 123 123 SER HA H 123 4.738 4.738 4.802 -0.064 17927 691 1 1 . 1 1 123 123 SER C C 123 174.184 174.184 173.830 0.354 17927 692 1 1 . 1 1 123 123 SER CA C 123 57.383 57.383 56.742 0.641 17927 693 1 1 . 1 1 123 123 SER CB C 123 65.326 65.326 65.121 0.205 17927 694 1 1 . 1 1 123 123 SER H H 123 7.850 7.850 8.287 -0.437 17927 695 1 1 . 1 1 124 124 ALA N N 124 131.373 131.373 126.964 4.409 17927 696 1 1 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.120 0.365 17927 697 1 1 . 1 1 124 124 ALA C C 124 175.147 175.147 175.776 -0.629 17927 698 1 1 . 1 1 124 124 ALA CA C 124 53.035 53.035 54.815 -1.780 17927 699 1 1 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.378 -0.716 17927 700 1 1 . 1 1 124 124 ALA H H 124 9.384 9.384 8.870 0.514 17927 701 1 1 . 1 1 125 125 ASN N N 125 119.476 119.476 113.339 6.137 17927 702 1 1 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.262 -0.206 17927 703 1 1 . 1 1 125 125 ASN C C 125 173.593 173.593 174.038 -0.445 17927 704 1 1 . 1 1 125 125 ASN CA C 125 52.352 52.352 51.494 0.858 17927 705 1 1 . 1 1 125 125 ASN CB C 125 38.304 38.304 39.920 -1.616 17927 706 1 1 . 1 1 125 125 ASN H H 125 8.191 8.191 7.631 0.560 17927 707 1 1 . 1 1 126 126 MET N N 126 122.705 122.705 123.245 -0.540 17927 708 1 1 . 1 1 126 126 MET HA H 126 4.585 4.585 4.789 -0.204 17927 709 1 1 . 1 1 126 126 MET C C 126 175.215 175.215 175.363 -0.148 17927 710 1 1 . 1 1 126 126 MET CA C 126 53.849 53.849 55.940 -2.091 17927 711 1 1 . 1 1 126 126 MET CB C 126 31.312 31.312 34.461 -3.149 17927 712 1 1 . 1 1 126 126 MET H H 126 8.376 8.376 9.147 -0.771 17927 713 1 1 . 1 1 127 127 THR N N 127 111.016 111.016 111.488 -0.472 17927 714 1 1 . 1 1 127 127 THR HA H 127 4.291 4.291 3.931 0.360 17927 715 1 1 . 1 1 127 127 THR C C 127 174.574 174.574 173.269 1.305 17927 716 1 1 . 1 1 127 127 THR CA C 127 62.085 62.085 60.760 1.325 17927 717 1 1 . 1 1 127 127 THR CB C 127 69.733 69.733 70.499 -0.766 17927 718 1 1 . 1 1 127 127 THR H H 127 7.714 7.714 8.272 -0.558 17927 719 1 1 . 1 1 128 128 ARG N N 128 118.722 118.722 126.519 -7.797 17927 720 1 1 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.490 -1.182 17927 721 1 1 . 1 1 128 128 ARG C C 128 176.978 176.978 176.261 0.717 17927 722 1 1 . 1 1 128 128 ARG CA C 128 54.727 54.727 56.477 -1.750 17927 723 1 1 . 1 1 128 128 ARG CB C 128 29.598 29.598 30.563 -0.965 17927 724 1 1 . 1 1 128 128 ARG H H 128 8.658 8.658 7.870 0.788 17927 725 1 1 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.198 -0.265 17927 726 1 1 . 1 1 129 129 PRO C C 129 175.794 175.794 177.172 -1.378 17927 727 1 1 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.388 1.161 17927 728 1 1 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.721 -0.044 17927 729 1 1 . 1 1 130 130 SER N N 130 108.696 108.696 110.962 -2.266 17927 730 1 1 . 1 1 130 130 SER HA H 130 3.988 3.988 4.334 -0.346 17927 731 1 1 . 1 1 130 130 SER C C 130 174.445 174.445 174.044 0.401 17927 732 1 1 . 1 1 130 130 SER CA C 130 58.911 58.911 58.584 0.327 17927 733 1 1 . 1 1 130 130 SER CB C 130 62.680 62.680 63.287 -0.607 17927 734 1 1 . 1 1 130 130 SER H H 130 8.375 8.375 8.131 0.244 17927 735 1 1 . 1 1 131 131 ASP N N 131 126.377 126.377 122.687 3.690 17927 736 1 1 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.891 -0.019 17927 737 1 1 . 1 1 131 131 ASP C C 131 176.879 176.879 175.145 1.734 17927 738 1 1 . 1 1 131 131 ASP CA C 131 51.195 51.195 51.400 -0.205 17927 739 1 1 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.279 0.537 17927 740 1 1 . 1 1 131 131 ASP H H 131 7.514 7.514 7.722 -0.208 17927 741 1 1 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.140 0.252 17927 742 1 1 . 1 1 132 132 PRO C C 132 178.097 178.097 177.928 0.169 17927 743 1 1 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.600 0.479 17927 744 1 1 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.090 0.319 17927 745 1 1 . 1 1 133 133 LYS N N 133 116.306 116.306 116.219 0.087 17927 746 1 1 . 1 1 133 133 LYS HA H 133 3.958 3.958 3.900 0.058 17927 747 1 1 . 1 1 133 133 LYS C C 133 179.532 179.532 178.356 1.176 17927 748 1 1 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.252 -0.731 17927 749 1 1 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.802 0.389 17927 750 1 1 . 1 1 133 133 LYS H H 133 8.842 8.842 8.528 0.314 17927 751 1 1 . 1 1 134 134 THR N N 134 120.833 120.833 115.040 5.793 17927 752 1 1 . 1 1 134 134 THR HA H 134 3.147 3.147 3.732 -0.585 17927 753 1 1 . 1 1 134 134 THR C C 134 173.356 173.356 174.667 -1.311 17927 754 1 1 . 1 1 134 134 THR CA C 134 66.383 66.383 65.230 1.153 17927 755 1 1 . 1 1 134 134 THR CB C 134 66.847 66.847 68.430 -1.583 17927 756 1 1 . 1 1 134 134 THR H H 134 8.292 8.292 7.680 0.612 17927 757 1 1 . 1 1 135 135 ALA N N 135 121.720 121.720 123.012 -1.292 17927 758 1 1 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.498 0.085 17927 759 1 1 . 1 1 135 135 ALA C C 135 178.902 178.902 179.058 -0.156 17927 760 1 1 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.892 0.107 17927 761 1 1 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.076 -0.301 17927 762 1 1 . 1 1 135 135 ALA H H 135 7.030 7.030 7.369 -0.339 17927 763 1 1 . 1 1 136 136 GLU N N 136 114.623 114.623 117.407 -2.784 17927 764 1 1 . 1 1 136 136 GLU HA H 136 3.922 3.922 3.749 0.173 17927 765 1 1 . 1 1 136 136 GLU C C 136 179.199 179.199 179.263 -0.064 17927 766 1 1 . 1 1 136 136 GLU CA C 136 59.837 59.837 59.080 0.757 17927 767 1 1 . 1 1 136 136 GLU CB C 136 29.786 29.786 28.650 1.136 17927 768 1 1 . 1 1 136 136 GLU H H 136 7.216 7.216 7.767 -0.551 17927 769 1 1 . 1 1 137 137 LYS N N 137 120.789 120.789 119.428 1.361 17927 770 1 1 . 1 1 137 137 LYS HA H 137 4.204 4.204 4.042 0.163 17927 771 1 1 . 1 1 137 137 LYS C C 137 178.834 178.834 179.068 -0.234 17927 772 1 1 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.607 -1.264 17927 773 1 1 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.846 -1.383 17927 774 1 1 . 1 1 137 137 LYS H H 137 7.681 7.681 7.303 0.378 17927 775 1 1 . 1 1 138 138 PHE N N 138 118.373 118.373 119.190 -0.817 17927 776 1 1 . 1 1 138 138 PHE HA H 138 4.033 4.033 4.086 -0.053 17927 777 1 1 . 1 1 138 138 PHE C C 138 178.027 178.027 178.181 -0.154 17927 778 1 1 . 1 1 138 138 PHE CA C 138 57.507 57.507 60.190 -2.683 17927 779 1 1 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.538 -1.649 17927 780 1 1 . 1 1 138 138 PHE H H 138 8.059 8.059 7.626 0.433 17927 781 1 1 . 1 1 139 139 ASN N N 139 117.611 117.611 117.080 0.531 17927 782 1 1 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.473 -0.069 17927 783 1 1 . 1 1 139 139 ASN C C 139 178.190 178.190 177.933 0.257 17927 784 1 1 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.243 -0.019 17927 785 1 1 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.860 -1.126 17927 786 1 1 . 1 1 139 139 ASN H H 139 8.683 8.683 8.343 0.340 17927 787 1 1 . 1 1 140 140 GLU N N 140 121.432 121.432 121.623 -0.191 17927 788 1 1 . 1 1 140 140 GLU HA H 140 4.005 4.005 3.955 0.050 17927 789 1 1 . 1 1 140 140 GLU C C 140 179.751 179.751 179.625 0.126 17927 790 1 1 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.468 -0.158 17927 791 1 1 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.831 0.224 17927 792 1 1 . 1 1 140 140 GLU H H 140 7.868 7.868 8.244 -0.376 17927 793 1 1 . 1 1 141 141 LEU N N 141 119.968 119.968 116.796 3.172 17927 794 1 1 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.203 -0.187 17927 795 1 1 . 1 1 141 141 LEU C C 141 179.293 179.293 177.935 1.358 17927 796 1 1 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.143 0.293 17927 797 1 1 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.678 -0.495 17927 798 1 1 . 1 1 141 141 LEU H H 141 8.303 8.303 8.159 0.144 17927 799 1 1 . 1 1 142 142 LEU N N 142 115.040 115.040 117.424 -2.384 17927 800 1 1 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.386 -0.002 17927 801 1 1 . 1 1 142 142 LEU C C 142 178.002 178.002 177.827 0.175 17927 802 1 1 . 1 1 142 142 LEU CA C 142 55.279 55.279 54.920 0.359 17927 803 1 1 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.490 0.156 17927 804 1 1 . 1 1 142 142 LEU H H 142 8.230 8.230 7.656 0.574 17927 805 1 1 . 1 1 143 143 GLY N N 143 108.977 108.977 107.611 1.366 17927 806 1 1 . 1 1 143 143 GLY C C 143 175.216 175.216 174.980 0.236 17927 807 1 1 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.799 0.942 17927 808 1 1 . 1 1 143 143 GLY H H 143 7.762 7.762 7.755 0.007 17927 809 1 1 . 1 1 144 144 LEU N N 144 119.660 119.660 119.628 0.032 17927 810 1 1 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.539 -0.051 17927 811 1 1 . 1 1 144 144 LEU C C 144 177.375 177.375 176.323 1.052 17927 812 1 1 . 1 1 144 144 LEU CA C 144 54.525 54.525 54.456 0.069 17927 813 1 1 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.250 0.523 17927 814 1 1 . 1 1 144 144 LEU H H 144 8.241 8.241 8.169 0.072 17927 815 1 1 . 1 1 145 145 GLU N N 145 119.959 119.959 119.509 0.450 17927 816 1 1 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.247 -0.006 17927 817 1 1 . 1 1 145 145 GLU C C 145 177.075 177.075 176.656 0.419 17927 818 1 1 . 1 1 145 145 GLU CA C 145 56.799 56.799 55.935 0.864 17927 819 1 1 . 1 1 145 145 GLU CB C 145 30.168 30.168 30.265 -0.097 17927 820 1 1 . 1 1 145 145 GLU H H 145 8.410 8.410 7.775 0.635 17927 821 1 1 . 1 1 146 146 GLY N N 146 109.412 109.412 113.085 -3.673 17927 822 1 1 . 1 1 146 146 GLY C C 146 174.276 174.276 174.114 0.162 17927 823 1 1 . 1 1 146 146 GLY CA C 146 45.445 45.445 45.330 0.116 17927 824 1 1 . 1 1 146 146 GLY H H 146 8.422 8.422 9.054 -0.632 17927 825 1 1 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.512 0.144 17927 826 1 1 . 1 1 151 151 HIS C C 151 173.990 173.990 174.483 -0.493 17927 827 1 1 . 1 1 151 151 HIS CA C 151 56.044 56.044 57.454 -1.410 17927 828 1 1 . 1 1 151 151 HIS CB C 151 30.076 30.076 29.744 0.332 17927 829 1 2 . 1 1 2 2 SER HA H 2 4.121 4.121 4.278 -0.157 17927 830 1 2 . 1 1 2 2 SER CA C 2 57.293 57.293 60.641 -3.348 17927 831 1 2 . 1 1 2 2 SER CB C 2 63.545 63.545 63.018 0.527 17927 832 1 2 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.704 -0.272 17927 833 1 2 . 1 1 3 3 LEU C C 3 177.383 177.383 176.810 0.573 17927 834 1 2 . 1 1 3 3 LEU CA C 3 55.575 55.575 53.941 1.634 17927 835 1 2 . 1 1 3 3 LEU CB C 3 42.584 42.584 41.136 1.448 17927 836 1 2 . 1 1 4 4 ARG N N 4 122.080 122.080 119.829 2.251 17927 837 1 2 . 1 1 4 4 ARG HA H 4 4.384 4.384 3.786 0.598 17927 838 1 2 . 1 1 4 4 ARG C C 4 176.410 176.410 176.497 -0.087 17927 839 1 2 . 1 1 4 4 ARG CA C 4 56.269 56.269 58.266 -1.997 17927 840 1 2 . 1 1 4 4 ARG CB C 4 30.842 30.842 28.749 2.093 17927 841 1 2 . 1 1 4 4 ARG H H 4 8.410 8.410 8.030 0.380 17927 842 1 2 . 1 1 5 5 SER N N 5 117.023 117.023 116.434 0.589 17927 843 1 2 . 1 1 5 5 SER HA H 5 4.423 4.423 4.046 0.377 17927 844 1 2 . 1 1 5 5 SER C C 5 175.039 175.039 174.992 0.047 17927 845 1 2 . 1 1 5 5 SER CA C 5 58.605 58.605 60.402 -1.797 17927 846 1 2 . 1 1 5 5 SER CB C 5 64.044 64.044 62.509 1.535 17927 847 1 2 . 1 1 5 5 SER H H 5 8.292 8.292 8.351 -0.059 17927 848 1 2 . 1 1 6 6 GLY N N 6 110.718 110.718 111.522 -0.804 17927 849 1 2 . 1 1 6 6 GLY C C 6 173.654 173.654 173.301 0.353 17927 850 1 2 . 1 1 6 6 GLY CA C 6 45.273 45.273 45.261 0.012 17927 851 1 2 . 1 1 6 6 GLY H H 6 8.446 8.446 8.342 0.104 17927 852 1 2 . 1 1 7 7 ASN N N 7 119.287 119.287 120.263 -0.976 17927 853 1 2 . 1 1 7 7 ASN HA H 7 5.024 5.024 4.865 0.159 17927 854 1 2 . 1 1 7 7 ASN C C 7 173.672 173.672 173.832 -0.160 17927 855 1 2 . 1 1 7 7 ASN CA C 7 51.357 51.357 50.983 0.374 17927 856 1 2 . 1 1 7 7 ASN CB C 7 38.927 38.927 38.356 0.571 17927 857 1 2 . 1 1 7 7 ASN H H 7 8.273 8.273 8.097 0.176 17927 858 1 2 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.631 -0.184 17927 859 1 2 . 1 1 8 8 PRO C C 8 176.899 176.899 175.861 1.038 17927 860 1 2 . 1 1 8 8 PRO CA C 8 63.429 63.429 62.794 0.635 17927 861 1 2 . 1 1 8 8 PRO CB C 8 32.216 32.216 31.945 0.271 17927 862 1 2 . 1 1 9 9 SER N N 9 115.642 115.642 121.811 -6.169 17927 863 1 2 . 1 1 9 9 SER HA H 9 4.415 4.415 4.893 -0.478 17927 864 1 2 . 1 1 9 9 SER C C 9 174.714 174.714 175.051 -0.337 17927 865 1 2 . 1 1 9 9 SER CA C 9 58.488 58.488 57.462 1.026 17927 866 1 2 . 1 1 9 9 SER CB C 9 64.048 64.048 63.303 0.745 17927 867 1 2 . 1 1 9 9 SER H H 9 8.336 8.336 8.400 -0.064 17927 868 1 2 . 1 1 10 10 ALA N N 10 126.808 126.808 129.680 -2.872 17927 869 1 2 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.612 -0.350 17927 870 1 2 . 1 1 10 10 ALA C C 10 177.233 177.233 176.962 0.271 17927 871 1 2 . 1 1 10 10 ALA CA C 10 53.230 53.230 54.734 -1.504 17927 872 1 2 . 1 1 10 10 ALA CB C 10 19.187 19.187 17.545 1.642 17927 873 1 2 . 1 1 10 10 ALA H H 10 8.137 8.137 9.469 -1.332 17927 874 1 2 . 1 1 11 11 ALA N N 11 120.449 120.449 122.904 -2.455 17927 875 1 2 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.369 -0.108 17927 876 1 2 . 1 1 11 11 ALA C C 11 177.469 177.469 176.719 0.750 17927 877 1 2 . 1 1 11 11 ALA CA C 11 52.475 52.475 51.309 1.166 17927 878 1 2 . 1 1 11 11 ALA CB C 11 19.485 19.485 18.006 1.479 17927 879 1 2 . 1 1 11 11 ALA H H 11 7.851 7.851 7.854 -0.003 17927 880 1 2 . 1 1 12 12 SER N N 12 114.186 114.186 115.430 -1.244 17927 881 1 2 . 1 1 12 12 SER HA H 12 4.312 4.312 3.965 0.347 17927 882 1 2 . 1 1 12 12 SER C C 12 173.593 173.593 173.388 0.205 17927 883 1 2 . 1 1 12 12 SER CA C 12 58.099 58.099 58.947 -0.848 17927 884 1 2 . 1 1 12 12 SER CB C 12 63.320 63.320 61.648 1.672 17927 885 1 2 . 1 1 12 12 SER H H 12 7.990 7.990 8.173 -0.183 17927 886 1 2 . 1 1 13 13 PHE N N 13 118.092 118.092 118.776 -0.684 17927 887 1 2 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.869 -0.089 17927 888 1 2 . 1 1 13 13 PHE C C 13 174.220 174.220 174.232 -0.012 17927 889 1 2 . 1 1 13 13 PHE CA C 13 56.717 56.717 55.331 1.386 17927 890 1 2 . 1 1 13 13 PHE CB C 13 41.151 41.151 40.997 0.154 17927 891 1 2 . 1 1 13 13 PHE H H 13 7.147 7.147 7.228 -0.081 17927 892 1 2 . 1 1 14 14 SER N N 14 116.456 116.456 115.051 1.405 17927 893 1 2 . 1 1 14 14 SER HA H 14 5.162 5.162 5.036 0.126 17927 894 1 2 . 1 1 14 14 SER C C 14 172.626 172.626 172.924 -0.298 17927 895 1 2 . 1 1 14 14 SER CA C 14 57.390 57.390 57.400 -0.010 17927 896 1 2 . 1 1 14 14 SER CB C 14 64.518 64.518 64.499 0.020 17927 897 1 2 . 1 1 14 14 SER H H 14 7.616 7.616 8.372 -0.756 17927 898 1 2 . 1 1 15 15 TYR N N 15 122.384 122.384 124.604 -2.220 17927 899 1 2 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.987 0.219 17927 900 1 2 . 1 1 15 15 TYR C C 15 172.543 172.543 173.387 -0.844 17927 901 1 2 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.338 -0.392 17927 902 1 2 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.707 0.520 17927 903 1 2 . 1 1 15 15 TYR H H 15 8.558 8.558 9.303 -0.745 17927 904 1 2 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.799 0.310 17927 905 1 2 . 1 1 16 16 PRO C C 16 176.475 176.475 175.848 0.627 17927 906 1 2 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.197 -0.216 17927 907 1 2 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.156 0.506 17927 908 1 2 . 1 1 17 17 ASP N N 17 119.834 119.834 124.891 -5.057 17927 909 1 2 . 1 1 17 17 ASP HA H 17 5.739 5.739 5.065 0.674 17927 910 1 2 . 1 1 17 17 ASP C C 17 180.740 180.740 178.120 2.620 17927 911 1 2 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.031 -1.314 17927 912 1 2 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.856 -1.295 17927 913 1 2 . 1 1 17 17 ASP H H 17 8.643 8.643 8.780 -0.137 17927 914 1 2 . 1 1 18 18 ILE N N 18 118.340 118.340 121.511 -3.171 17927 915 1 2 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.909 0.542 17927 916 1 2 . 1 1 18 18 ILE C C 18 175.742 175.742 176.416 -0.674 17927 917 1 2 . 1 1 18 18 ILE CA C 18 61.894 61.894 64.433 -2.539 17927 918 1 2 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.309 0.931 17927 919 1 2 . 1 1 18 18 ILE H H 18 8.450 8.450 8.676 -0.226 17927 920 1 2 . 1 1 19 19 ASN N N 19 119.377 119.377 115.892 3.485 17927 921 1 2 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.662 0.353 17927 922 1 2 . 1 1 19 19 ASN C C 19 175.892 175.892 176.103 -0.211 17927 923 1 2 . 1 1 19 19 ASN CA C 19 53.307 53.307 53.913 -0.606 17927 924 1 2 . 1 1 19 19 ASN CB C 19 39.825 39.825 38.579 1.246 17927 925 1 2 . 1 1 19 19 ASN H H 19 8.376 8.376 8.737 -0.361 17927 926 1 2 . 1 1 20 20 GLY N N 20 109.535 109.535 108.575 0.960 17927 927 1 2 . 1 1 20 20 GLY C C 20 174.285 174.285 173.554 0.731 17927 928 1 2 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.525 0.268 17927 929 1 2 . 1 1 20 20 GLY H H 20 8.539 8.539 8.339 0.200 17927 930 1 2 . 1 1 21 21 LYS N N 21 124.675 124.675 121.371 3.304 17927 931 1 2 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.526 -0.083 17927 932 1 2 . 1 1 21 21 LYS C C 21 176.537 176.537 176.036 0.501 17927 933 1 2 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.809 0.636 17927 934 1 2 . 1 1 21 21 LYS CB C 21 32.754 32.754 32.892 -0.138 17927 935 1 2 . 1 1 21 21 LYS H H 21 8.608 8.608 7.531 1.077 17927 936 1 2 . 1 1 22 22 THR N N 22 120.666 120.666 124.220 -3.554 17927 937 1 2 . 1 1 22 22 THR HA H 22 4.087 4.087 4.396 -0.309 17927 938 1 2 . 1 1 22 22 THR C C 22 174.431 174.431 174.273 0.158 17927 939 1 2 . 1 1 22 22 THR CA C 22 64.292 64.292 63.829 0.463 17927 940 1 2 . 1 1 22 22 THR CB C 22 69.069 69.069 68.403 0.666 17927 941 1 2 . 1 1 22 22 THR H H 22 8.595 8.595 8.700 -0.105 17927 942 1 2 . 1 1 23 23 VAL N N 23 131.207 131.207 129.068 2.139 17927 943 1 2 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.414 -0.222 17927 944 1 2 . 1 1 23 23 VAL C C 23 174.244 174.244 174.680 -0.436 17927 945 1 2 . 1 1 23 23 VAL CA C 23 62.456 62.456 60.654 1.802 17927 946 1 2 . 1 1 23 23 VAL CB C 23 33.791 33.791 34.379 -0.588 17927 947 1 2 . 1 1 23 23 VAL H H 23 8.937 8.937 9.221 -0.284 17927 948 1 2 . 1 1 24 24 SER N N 24 120.787 120.787 121.449 -0.662 17927 949 1 2 . 1 1 24 24 SER HA H 24 5.407 5.407 4.986 0.421 17927 950 1 2 . 1 1 24 24 SER C C 24 176.169 176.169 174.910 1.259 17927 951 1 2 . 1 1 24 24 SER CA C 24 55.135 55.135 56.861 -1.726 17927 952 1 2 . 1 1 24 24 SER CB C 24 65.646 65.646 65.490 0.156 17927 953 1 2 . 1 1 24 24 SER H H 24 8.554 8.554 8.483 0.071 17927 954 1 2 . 1 1 25 25 LEU N N 25 124.332 124.332 121.710 2.622 17927 955 1 2 . 1 1 25 25 LEU HA H 25 3.687 3.687 4.078 -0.391 17927 956 1 2 . 1 1 25 25 LEU C C 25 179.364 179.364 176.298 3.066 17927 957 1 2 . 1 1 25 25 LEU CA C 25 58.217 58.217 54.222 3.995 17927 958 1 2 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.579 -1.041 17927 959 1 2 . 1 1 25 25 LEU H H 25 7.811 7.811 8.814 -1.003 17927 960 1 2 . 1 1 26 26 ALA N N 26 119.799 119.799 118.897 0.902 17927 961 1 2 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.018 -0.025 17927 962 1 2 . 1 1 26 26 ALA C C 26 179.719 179.719 178.853 0.866 17927 963 1 2 . 1 1 26 26 ALA CA C 26 54.663 54.663 54.073 0.590 17927 964 1 2 . 1 1 26 26 ALA CB C 26 18.323 18.323 18.799 -0.476 17927 965 1 2 . 1 1 26 26 ALA H H 26 8.099 8.099 7.172 0.927 17927 966 1 2 . 1 1 27 27 ASP N N 27 116.553 116.553 119.350 -2.797 17927 967 1 2 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.387 0.086 17927 968 1 2 . 1 1 27 27 ASP C C 27 176.915 176.915 177.077 -0.162 17927 969 1 2 . 1 1 27 27 ASP CA C 27 56.251 56.251 55.903 0.348 17927 970 1 2 . 1 1 27 27 ASP CB C 27 40.788 40.788 41.121 -0.333 17927 971 1 2 . 1 1 27 27 ASP H H 27 7.572 7.572 7.616 -0.044 17927 972 1 2 . 1 1 28 28 LEU N N 28 118.950 118.950 116.016 2.934 17927 973 1 2 . 1 1 28 28 LEU HA H 28 4.233 4.233 3.442 0.791 17927 974 1 2 . 1 1 28 28 LEU C C 28 175.542 175.542 176.770 -1.228 17927 975 1 2 . 1 1 28 28 LEU CA C 28 53.706 53.706 54.363 -0.657 17927 976 1 2 . 1 1 28 28 LEU CB C 28 41.049 41.049 40.484 0.565 17927 977 1 2 . 1 1 28 28 LEU H H 28 7.363 7.363 7.041 0.322 17927 978 1 2 . 1 1 29 29 LYS N N 29 118.429 118.429 118.239 0.190 17927 979 1 2 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.705 -0.353 17927 980 1 2 . 1 1 29 29 LYS C C 29 178.063 178.063 178.370 -0.307 17927 981 1 2 . 1 1 29 29 LYS CA C 29 57.777 57.777 56.324 1.453 17927 982 1 2 . 1 1 29 29 LYS CB C 29 33.440 33.440 33.024 0.416 17927 983 1 2 . 1 1 29 29 LYS H H 29 6.780 6.780 6.966 -0.186 17927 984 1 2 . 1 1 30 30 GLY N N 30 112.426 112.426 106.764 5.662 17927 985 1 2 . 1 1 30 30 GLY C C 30 173.801 173.801 174.087 -0.286 17927 986 1 2 . 1 1 30 30 GLY CA C 30 44.611 44.611 46.143 -1.532 17927 987 1 2 . 1 1 30 30 GLY H H 30 9.398 9.398 8.572 0.826 17927 988 1 2 . 1 1 31 31 LYS N N 31 119.295 119.295 121.439 -2.144 17927 989 1 2 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.495 -0.343 17927 990 1 2 . 1 1 31 31 LYS C C 31 173.862 173.862 176.145 -2.283 17927 991 1 2 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.339 0.849 17927 992 1 2 . 1 1 31 31 LYS CB C 31 36.968 36.968 34.983 1.985 17927 993 1 2 . 1 1 31 31 LYS H H 31 7.496 7.496 7.647 -0.151 17927 994 1 2 . 1 1 32 32 TYR N N 32 116.984 116.984 119.805 -2.821 17927 995 1 2 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.413 -0.256 17927 996 1 2 . 1 1 32 32 TYR C C 32 175.226 175.226 175.625 -0.399 17927 997 1 2 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.494 0.096 17927 998 1 2 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.245 -0.124 17927 999 1 2 . 1 1 32 32 TYR H H 32 7.521 7.521 8.198 -0.677 17927 1000 1 2 . 1 1 33 33 ILE N N 33 118.052 118.052 119.394 -1.342 17927 1001 1 2 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.517 0.390 17927 1002 1 2 . 1 1 33 33 ILE C C 33 174.308 174.308 174.254 0.054 17927 1003 1 2 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.286 0.416 17927 1004 1 2 . 1 1 33 33 ILE CB C 33 41.616 41.616 40.748 0.868 17927 1005 1 2 . 1 1 33 33 ILE H H 33 8.467 8.467 8.737 -0.270 17927 1006 1 2 . 1 1 34 34 TYR N N 34 130.242 130.242 128.593 1.649 17927 1007 1 2 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.340 0.186 17927 1008 1 2 . 1 1 34 34 TYR C C 34 174.245 174.245 173.427 0.818 17927 1009 1 2 . 1 1 34 34 TYR CA C 34 56.158 56.158 56.002 0.156 17927 1010 1 2 . 1 1 34 34 TYR CB C 34 40.133 40.133 41.795 -1.662 17927 1011 1 2 . 1 1 34 34 TYR H H 34 8.905 8.905 9.273 -0.368 17927 1012 1 2 . 1 1 35 35 ILE N N 35 128.697 128.697 128.162 0.535 17927 1013 1 2 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.027 0.315 17927 1014 1 2 . 1 1 35 35 ILE C C 35 174.520 174.520 173.748 0.772 17927 1015 1 2 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.706 0.043 17927 1016 1 2 . 1 1 35 35 ILE CB C 35 40.899 40.899 41.051 -0.152 17927 1017 1 2 . 1 1 35 35 ILE H H 35 9.445 9.445 8.734 0.711 17927 1018 1 2 . 1 1 36 36 ASP N N 36 123.675 123.675 125.092 -1.417 17927 1019 1 2 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.856 -1.008 17927 1020 1 2 . 1 1 36 36 ASP C C 36 174.385 174.385 174.851 -0.466 17927 1021 1 2 . 1 1 36 36 ASP CA C 36 51.294 51.294 50.978 0.316 17927 1022 1 2 . 1 1 36 36 ASP CB C 36 41.778 41.778 45.483 -3.705 17927 1023 1 2 . 1 1 36 36 ASP H H 36 8.875 8.875 9.075 -0.200 17927 1024 1 2 . 1 1 37 37 VAL N N 37 127.159 127.159 122.268 4.891 17927 1025 1 2 . 1 1 37 37 VAL HA H 37 4.959 4.959 5.162 -0.203 17927 1026 1 2 . 1 1 37 37 VAL C C 37 175.046 175.046 175.492 -0.446 17927 1027 1 2 . 1 1 37 37 VAL CA C 37 62.245 62.245 60.737 1.508 17927 1028 1 2 . 1 1 37 37 VAL CB C 37 31.807 31.807 32.585 -0.778 17927 1029 1 2 . 1 1 37 37 VAL H H 37 8.603 8.603 7.983 0.620 17927 1030 1 2 . 1 1 38 38 TRP N N 38 124.161 124.161 127.539 -3.378 17927 1031 1 2 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.116 0.121 17927 1032 1 2 . 1 1 38 38 TRP C C 38 171.995 171.995 173.845 -1.850 17927 1033 1 2 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.092 2.115 17927 1034 1 2 . 1 1 38 38 TRP CB C 38 33.187 33.187 29.809 3.378 17927 1035 1 2 . 1 1 38 38 TRP H H 38 8.562 8.562 8.337 0.225 17927 1036 1 2 . 1 1 39 39 ALA N N 39 116.252 116.252 125.176 -8.924 17927 1037 1 2 . 1 1 39 39 ALA HA H 39 3.678 3.678 4.084 -0.406 17927 1038 1 2 . 1 1 39 39 ALA C C 39 178.664 178.664 176.131 2.533 17927 1039 1 2 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.485 0.981 17927 1040 1 2 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.529 0.812 17927 1041 1 2 . 1 1 39 39 ALA H H 39 6.757 6.757 8.079 -1.322 17927 1042 1 2 . 1 1 40 40 THR N N 40 114.321 114.321 116.366 -2.045 17927 1043 1 2 . 1 1 40 40 THR HA H 40 3.907 3.907 4.646 -0.739 17927 1044 1 2 . 1 1 40 40 THR C C 40 175.885 175.885 175.680 0.205 17927 1045 1 2 . 1 1 40 40 THR CA C 40 65.447 65.447 62.907 2.540 17927 1046 1 2 . 1 1 40 40 THR CB C 40 70.106 70.106 69.956 0.150 17927 1047 1 2 . 1 1 40 40 THR H H 40 9.639 9.639 9.019 0.620 17927 1048 1 2 . 1 1 41 41 TRP N N 41 114.483 114.483 122.005 -7.522 17927 1049 1 2 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.844 -0.281 17927 1050 1 2 . 1 1 41 41 TRP C C 41 176.189 176.189 176.125 0.064 17927 1051 1 2 . 1 1 41 41 TRP CA C 41 54.698 54.698 56.647 -1.949 17927 1052 1 2 . 1 1 41 41 TRP CB C 41 29.977 29.977 27.897 2.080 17927 1053 1 2 . 1 1 41 41 TRP H H 41 6.401 6.401 7.546 -1.145 17927 1054 1 2 . 1 1 42 42 CYS N N 42 123.536 123.536 114.712 8.824 17927 1055 1 2 . 1 1 42 42 CYS HA H 42 4.568 4.568 3.919 0.649 17927 1056 1 2 . 1 1 42 42 CYS C C 42 175.726 175.726 175.657 0.069 17927 1057 1 2 . 1 1 42 42 CYS CA C 42 58.700 58.700 59.087 -0.387 17927 1058 1 2 . 1 1 42 42 CYS CB C 42 27.121 27.121 28.192 -1.071 17927 1059 1 2 . 1 1 42 42 CYS H H 42 6.883 6.883 7.325 -0.442 17927 1060 1 2 . 1 1 43 43 GLY N N 43 120.977 120.977 109.765 11.212 17927 1061 1 2 . 1 1 43 43 GLY CA C 43 49.204 49.204 45.500 3.704 17927 1062 1 2 . 1 1 43 43 GLY H H 43 9.653 9.653 7.966 1.687 17927 1063 1 2 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.275 0.212 17927 1064 1 2 . 1 1 44 44 PRO C C 44 179.956 179.956 178.326 1.630 17927 1065 1 2 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.499 0.143 17927 1066 1 2 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.565 1.013 17927 1067 1 2 . 1 1 45 45 CYS N N 45 113.925 113.925 115.635 -1.710 17927 1068 1 2 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.162 0.151 17927 1069 1 2 . 1 1 45 45 CYS C C 45 178.325 178.325 176.547 1.778 17927 1070 1 2 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.278 2.114 17927 1071 1 2 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.245 1.260 17927 1072 1 2 . 1 1 45 45 CYS H H 45 7.676 7.676 8.438 -0.762 17927 1073 1 2 . 1 1 46 46 ARG N N 46 120.336 120.336 119.894 0.442 17927 1074 1 2 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.226 -0.157 17927 1075 1 2 . 1 1 46 46 ARG C C 46 180.446 180.446 177.832 2.614 17927 1076 1 2 . 1 1 46 46 ARG CA C 46 59.785 59.785 58.176 1.609 17927 1077 1 2 . 1 1 46 46 ARG CB C 46 29.868 29.868 30.019 -0.151 17927 1078 1 2 . 1 1 46 46 ARG H H 46 8.109 8.109 8.076 0.033 17927 1079 1 2 . 1 1 47 47 GLY N N 47 105.408 105.408 106.614 -1.206 17927 1080 1 2 . 1 1 47 47 GLY C C 47 175.258 175.258 175.137 0.121 17927 1081 1 2 . 1 1 47 47 GLY CA C 47 46.594 46.594 45.619 0.975 17927 1082 1 2 . 1 1 47 47 GLY H H 47 8.466 8.466 8.193 0.273 17927 1083 1 2 . 1 1 48 48 GLU N N 48 116.343 116.343 120.463 -4.120 17927 1084 1 2 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.440 0.085 17927 1085 1 2 . 1 1 48 48 GLU C C 48 176.535 176.535 178.494 -1.959 17927 1086 1 2 . 1 1 48 48 GLU CA C 48 55.792 55.792 56.982 -1.190 17927 1087 1 2 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.588 1.394 17927 1088 1 2 . 1 1 48 48 GLU H H 48 7.050 7.050 7.786 -0.736 17927 1089 1 2 . 1 1 49 49 LEU N N 49 118.652 118.652 121.242 -2.590 17927 1090 1 2 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.157 -0.005 17927 1091 1 2 . 1 1 49 49 LEU C C 49 176.832 176.832 176.266 0.566 17927 1092 1 2 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.706 -1.361 17927 1093 1 2 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.064 -0.568 17927 1094 1 2 . 1 1 49 49 LEU H H 49 7.385 7.385 7.607 -0.222 17927 1095 1 2 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.145 0.108 17927 1096 1 2 . 1 1 50 50 PRO C C 50 179.744 179.744 178.251 1.493 17927 1097 1 2 . 1 1 50 50 PRO CA C 50 66.559 66.559 65.944 0.615 17927 1098 1 2 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.874 -0.112 17927 1099 1 2 . 1 1 51 51 ALA N N 51 120.418 120.418 119.761 0.657 17927 1100 1 2 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.285 -0.140 17927 1101 1 2 . 1 1 51 51 ALA C C 51 180.329 180.329 179.833 0.496 17927 1102 1 2 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.432 0.002 17927 1103 1 2 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.368 0.002 17927 1104 1 2 . 1 1 51 51 ALA H H 51 7.731 7.731 7.825 -0.094 17927 1105 1 2 . 1 1 52 52 LEU N N 52 121.506 121.506 120.005 1.501 17927 1106 1 2 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.830 0.158 17927 1107 1 2 . 1 1 52 52 LEU C C 52 177.944 177.944 179.071 -1.127 17927 1108 1 2 . 1 1 52 52 LEU CA C 52 58.327 58.327 57.936 0.391 17927 1109 1 2 . 1 1 52 52 LEU CB C 52 42.382 42.382 41.603 0.778 17927 1110 1 2 . 1 1 52 52 LEU H H 52 8.355 8.355 8.213 0.142 17927 1111 1 2 . 1 1 53 53 LYS N N 53 119.732 119.732 119.472 0.260 17927 1112 1 2 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.992 -0.089 17927 1113 1 2 . 1 1 53 53 LYS C C 53 179.030 179.030 178.839 0.191 17927 1114 1 2 . 1 1 53 53 LYS CA C 53 59.846 59.846 59.782 0.064 17927 1115 1 2 . 1 1 53 53 LYS CB C 53 32.211 32.211 32.304 -0.093 17927 1116 1 2 . 1 1 53 53 LYS H H 53 8.148 8.148 7.839 0.309 17927 1117 1 2 . 1 1 54 54 GLU N N 54 117.779 117.779 120.157 -2.378 17927 1118 1 2 . 1 1 54 54 GLU HA H 54 4.059 4.059 4.014 0.045 17927 1119 1 2 . 1 1 54 54 GLU C C 54 179.646 179.646 179.161 0.485 17927 1120 1 2 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.564 0.061 17927 1121 1 2 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.347 0.220 17927 1122 1 2 . 1 1 54 54 GLU H H 54 7.585 7.585 7.765 -0.180 17927 1123 1 2 . 1 1 55 55 LEU N N 55 120.581 120.581 119.491 1.090 17927 1124 1 2 . 1 1 55 55 LEU HA H 55 4.193 4.193 3.976 0.217 17927 1125 1 2 . 1 1 55 55 LEU C C 55 178.557 178.557 178.433 0.124 17927 1126 1 2 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.700 0.535 17927 1127 1 2 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.048 1.963 17927 1128 1 2 . 1 1 55 55 LEU H H 55 8.096 8.096 8.246 -0.150 17927 1129 1 2 . 1 1 56 56 GLU N N 56 118.023 118.023 119.535 -1.512 17927 1130 1 2 . 1 1 56 56 GLU HA H 56 3.177 3.177 3.803 -0.626 17927 1131 1 2 . 1 1 56 56 GLU C C 56 179.650 179.650 179.130 0.520 17927 1132 1 2 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.771 -0.900 17927 1133 1 2 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.482 -2.497 17927 1134 1 2 . 1 1 56 56 GLU H H 56 8.181 8.181 7.591 0.590 17927 1135 1 2 . 1 1 57 57 GLU N N 57 117.828 117.828 116.937 0.891 17927 1136 1 2 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.123 -0.019 17927 1137 1 2 . 1 1 57 57 GLU C C 57 179.700 179.700 178.747 0.953 17927 1138 1 2 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.249 0.778 17927 1139 1 2 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.760 -0.095 17927 1140 1 2 . 1 1 57 57 GLU H H 57 7.762 7.762 8.280 -0.518 17927 1141 1 2 . 1 1 58 58 LYS N N 58 120.896 120.896 118.029 2.867 17927 1142 1 2 . 1 1 58 58 LYS HA H 58 3.979 3.979 4.046 -0.067 17927 1143 1 2 . 1 1 58 58 LYS C C 58 178.715 178.715 178.588 0.127 17927 1144 1 2 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.779 0.299 17927 1145 1 2 . 1 1 58 58 LYS CB C 58 32.980 32.980 33.051 -0.071 17927 1146 1 2 . 1 1 58 58 LYS H H 58 8.410 8.410 7.759 0.651 17927 1147 1 2 . 1 1 59 59 TYR N N 59 113.713 113.713 116.766 -3.053 17927 1148 1 2 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.577 -0.265 17927 1149 1 2 . 1 1 59 59 TYR C C 59 175.025 175.025 174.958 0.067 17927 1150 1 2 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.853 2.120 17927 1151 1 2 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.274 -0.840 17927 1152 1 2 . 1 1 59 59 TYR H H 59 8.102 8.102 8.611 -0.509 17927 1153 1 2 . 1 1 60 60 ALA N N 60 126.637 126.637 122.705 3.932 17927 1154 1 2 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.365 0.053 17927 1155 1 2 . 1 1 60 60 ALA C C 60 179.208 179.208 177.792 1.416 17927 1156 1 2 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.582 0.952 17927 1157 1 2 . 1 1 60 60 ALA CB C 60 18.589 18.589 18.991 -0.402 17927 1158 1 2 . 1 1 60 60 ALA H H 60 7.201 7.201 7.682 -0.481 17927 1159 1 2 . 1 1 61 61 GLY N N 61 111.816 111.816 110.637 1.179 17927 1160 1 2 . 1 1 61 61 GLY C C 61 174.698 174.698 174.913 -0.215 17927 1161 1 2 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.843 0.061 17927 1162 1 2 . 1 1 61 61 GLY H H 61 9.184 9.184 9.047 0.137 17927 1163 1 2 . 1 1 62 62 LYS N N 62 118.497 118.497 120.032 -1.535 17927 1164 1 2 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.454 0.425 17927 1165 1 2 . 1 1 62 62 LYS C C 62 179.019 179.019 175.752 3.267 17927 1166 1 2 . 1 1 62 62 LYS CA C 62 53.988 53.988 54.826 -0.838 17927 1167 1 2 . 1 1 62 62 LYS CB C 62 33.840 33.840 32.968 0.872 17927 1168 1 2 . 1 1 62 62 LYS H H 62 8.019 8.019 7.518 0.501 17927 1169 1 2 . 1 1 63 63 ASP N N 63 122.982 122.982 119.290 3.692 17927 1170 1 2 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.728 -0.201 17927 1171 1 2 . 1 1 63 63 ASP C C 63 174.065 174.065 174.323 -0.258 17927 1172 1 2 . 1 1 63 63 ASP CA C 63 55.055 55.055 53.719 1.336 17927 1173 1 2 . 1 1 63 63 ASP CB C 63 38.582 38.582 40.904 -2.322 17927 1174 1 2 . 1 1 63 63 ASP H H 63 8.709 8.709 8.479 0.230 17927 1175 1 2 . 1 1 64 64 ILE N N 64 122.219 122.219 118.392 3.827 17927 1176 1 2 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.720 -0.113 17927 1177 1 2 . 1 1 64 64 ILE C C 64 174.627 174.627 173.086 1.541 17927 1178 1 2 . 1 1 64 64 ILE CA C 64 59.712 59.712 58.763 0.949 17927 1179 1 2 . 1 1 64 64 ILE CB C 64 42.133 42.133 41.829 0.304 17927 1180 1 2 . 1 1 64 64 ILE H H 64 8.678 8.678 7.547 1.131 17927 1181 1 2 . 1 1 65 65 HIS N N 65 125.584 125.584 123.768 1.816 17927 1182 1 2 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.782 0.261 17927 1183 1 2 . 1 1 65 65 HIS C C 65 174.153 174.153 173.399 0.754 17927 1184 1 2 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.169 0.790 17927 1185 1 2 . 1 1 65 65 HIS CB C 65 34.156 34.156 32.837 1.319 17927 1186 1 2 . 1 1 65 65 HIS H H 65 9.204 9.204 8.660 0.544 17927 1187 1 2 . 1 1 66 66 PHE N N 66 123.244 123.244 122.626 0.618 17927 1188 1 2 . 1 1 66 66 PHE HA H 66 5.210 5.210 5.217 -0.007 17927 1189 1 2 . 1 1 66 66 PHE C C 66 175.463 175.463 174.840 0.623 17927 1190 1 2 . 1 1 66 66 PHE CA C 66 58.088 58.088 56.926 1.162 17927 1191 1 2 . 1 1 66 66 PHE CB C 66 39.637 39.637 39.889 -0.252 17927 1192 1 2 . 1 1 66 66 PHE H H 66 9.262 9.262 8.963 0.299 17927 1193 1 2 . 1 1 67 67 VAL N N 67 126.201 126.201 125.924 0.277 17927 1194 1 2 . 1 1 67 67 VAL HA H 67 4.834 4.834 4.814 0.020 17927 1195 1 2 . 1 1 67 67 VAL C C 67 174.364 174.364 175.553 -1.189 17927 1196 1 2 . 1 1 67 67 VAL CA C 67 60.724 60.724 61.155 -0.431 17927 1197 1 2 . 1 1 67 67 VAL CB C 67 34.893 34.893 32.591 2.302 17927 1198 1 2 . 1 1 67 67 VAL H H 67 8.843 8.843 9.373 -0.530 17927 1199 1 2 . 1 1 68 68 SER N N 68 124.528 124.528 124.584 -0.056 17927 1200 1 2 . 1 1 68 68 SER HA H 68 5.585 5.585 4.977 0.608 17927 1201 1 2 . 1 1 68 68 SER C C 68 172.858 172.858 172.694 0.164 17927 1202 1 2 . 1 1 68 68 SER CA C 68 57.282 57.282 58.146 -0.864 17927 1203 1 2 . 1 1 68 68 SER CB C 68 65.032 65.032 63.036 1.996 17927 1204 1 2 . 1 1 68 68 SER H H 68 9.243 9.243 9.018 0.225 17927 1205 1 2 . 1 1 69 69 LEU N N 69 126.695 126.695 129.492 -2.797 17927 1206 1 2 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.611 -1.094 17927 1207 1 2 . 1 1 69 69 LEU C C 69 174.652 174.652 175.025 -0.373 17927 1208 1 2 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.428 -0.601 17927 1209 1 2 . 1 1 69 69 LEU CB C 69 43.895 43.895 46.021 -2.126 17927 1210 1 2 . 1 1 69 69 LEU H H 69 9.360 9.360 9.307 0.053 17927 1211 1 2 . 1 1 70 70 SER N N 70 116.379 116.379 120.895 -4.516 17927 1212 1 2 . 1 1 70 70 SER HA H 70 4.905 4.905 5.183 -0.278 17927 1213 1 2 . 1 1 70 70 SER C C 70 176.307 176.307 174.910 1.397 17927 1214 1 2 . 1 1 70 70 SER CA C 70 55.213 55.213 56.150 -0.937 17927 1215 1 2 . 1 1 70 70 SER CB C 70 63.519 63.519 64.031 -0.512 17927 1216 1 2 . 1 1 70 70 SER H H 70 7.981 7.981 8.836 -0.855 17927 1217 1 2 . 1 1 71 71 CYS N N 71 124.670 124.670 127.837 -3.167 17927 1218 1 2 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.455 0.503 17927 1219 1 2 . 1 1 71 71 CYS C C 71 173.996 173.996 174.081 -0.085 17927 1220 1 2 . 1 1 71 71 CYS CA C 71 55.483 55.483 58.626 -3.143 17927 1221 1 2 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.345 0.767 17927 1222 1 2 . 1 1 71 71 CYS H H 71 8.609 8.609 9.091 -0.482 17927 1223 1 2 . 1 1 72 72 ASP N N 72 122.398 122.398 123.693 -1.295 17927 1224 1 2 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.830 -0.538 17927 1225 1 2 . 1 1 72 72 ASP C C 72 176.653 176.653 176.166 0.487 17927 1226 1 2 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.124 1.658 17927 1227 1 2 . 1 1 72 72 ASP CB C 72 41.526 41.526 40.520 1.006 17927 1228 1 2 . 1 1 72 72 ASP H H 72 8.557 8.557 7.762 0.795 17927 1229 1 2 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.397 -0.332 17927 1230 1 2 . 1 1 73 73 LYS C C 73 176.545 176.545 175.620 0.925 17927 1231 1 2 . 1 1 73 73 LYS CA C 73 58.458 58.458 58.134 0.324 17927 1232 1 2 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.919 -0.278 17927 1233 1 2 . 1 1 74 74 ASN N N 74 117.616 117.616 117.989 -0.373 17927 1234 1 2 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.759 0.146 17927 1235 1 2 . 1 1 74 74 ASN C C 74 174.894 174.894 175.764 -0.870 17927 1236 1 2 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.341 -0.820 17927 1237 1 2 . 1 1 74 74 ASN CB C 74 38.109 38.109 37.508 0.601 17927 1238 1 2 . 1 1 74 74 ASN H H 74 8.625 8.625 7.952 0.673 17927 1239 1 2 . 1 1 75 75 LYS N N 75 126.797 126.797 125.850 0.947 17927 1240 1 2 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.995 -0.572 17927 1241 1 2 . 1 1 75 75 LYS C C 75 178.058 178.058 177.855 0.203 17927 1242 1 2 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.084 0.089 17927 1243 1 2 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.717 0.574 17927 1244 1 2 . 1 1 75 75 LYS H H 75 8.588 8.588 7.902 0.686 17927 1245 1 2 . 1 1 76 76 LYS N N 76 117.875 117.875 119.991 -2.116 17927 1246 1 2 . 1 1 76 76 LYS HA H 76 4.200 4.200 4.030 0.170 17927 1247 1 2 . 1 1 76 76 LYS C C 76 178.791 178.791 178.586 0.205 17927 1248 1 2 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.400 -0.792 17927 1249 1 2 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.681 -0.191 17927 1250 1 2 . 1 1 76 76 LYS H H 76 8.041 8.041 8.649 -0.608 17927 1251 1 2 . 1 1 77 77 ALA N N 77 121.567 121.567 121.089 0.478 17927 1252 1 2 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.200 -0.077 17927 1253 1 2 . 1 1 77 77 ALA C C 77 181.191 181.191 179.614 1.577 17927 1254 1 2 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.802 0.155 17927 1255 1 2 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.021 -0.262 17927 1256 1 2 . 1 1 77 77 ALA H H 77 7.366 7.366 8.349 -0.983 17927 1257 1 2 . 1 1 78 78 TRP N N 78 119.497 119.497 120.203 -0.706 17927 1258 1 2 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.143 -0.066 17927 1259 1 2 . 1 1 78 78 TRP C C 78 175.942 175.942 177.283 -1.341 17927 1260 1 2 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.005 2.756 17927 1261 1 2 . 1 1 78 78 TRP CB C 78 27.272 27.272 29.805 -2.533 17927 1262 1 2 . 1 1 78 78 TRP H H 78 7.187 7.187 7.682 -0.495 17927 1263 1 2 . 1 1 79 79 GLU N N 79 118.771 118.771 117.902 0.869 17927 1264 1 2 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.532 -0.518 17927 1265 1 2 . 1 1 79 79 GLU C C 79 179.863 179.863 179.218 0.645 17927 1266 1 2 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.386 -0.276 17927 1267 1 2 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.356 1.864 17927 1268 1 2 . 1 1 79 79 GLU H H 79 8.813 8.813 8.333 0.480 17927 1269 1 2 . 1 1 80 80 ASN N N 80 115.964 115.964 118.003 -2.039 17927 1270 1 2 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.356 -0.017 17927 1271 1 2 . 1 1 80 80 ASN C C 80 176.749 176.749 177.583 -0.834 17927 1272 1 2 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.868 0.167 17927 1273 1 2 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.151 0.338 17927 1274 1 2 . 1 1 80 80 ASN H H 80 8.491 8.491 7.847 0.644 17927 1275 1 2 . 1 1 81 81 MET N N 81 119.670 119.670 121.461 -1.791 17927 1276 1 2 . 1 1 81 81 MET HA H 81 4.149 4.149 4.160 -0.011 17927 1277 1 2 . 1 1 81 81 MET C C 81 177.933 177.933 178.144 -0.211 17927 1278 1 2 . 1 1 81 81 MET CA C 81 60.276 60.276 59.039 1.237 17927 1279 1 2 . 1 1 81 81 MET CB C 81 32.518 32.518 32.903 -0.385 17927 1280 1 2 . 1 1 81 81 MET H H 81 7.667 7.667 7.640 0.027 17927 1281 1 2 . 1 1 82 82 VAL N N 82 117.634 117.634 119.089 -1.455 17927 1282 1 2 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.540 -0.237 17927 1283 1 2 . 1 1 82 82 VAL C C 82 179.005 179.005 177.560 1.445 17927 1284 1 2 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.404 0.633 17927 1285 1 2 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.018 0.747 17927 1286 1 2 . 1 1 82 82 VAL H H 82 8.338 8.338 7.898 0.440 17927 1287 1 2 . 1 1 83 83 THR N N 83 110.519 110.519 115.212 -4.693 17927 1288 1 2 . 1 1 83 83 THR HA H 83 3.983 3.983 4.063 -0.080 17927 1289 1 2 . 1 1 83 83 THR C C 83 177.591 177.591 176.188 1.403 17927 1290 1 2 . 1 1 83 83 THR CA C 83 65.431 65.431 66.231 -0.800 17927 1291 1 2 . 1 1 83 83 THR CB C 83 69.156 69.156 68.419 0.737 17927 1292 1 2 . 1 1 83 83 THR H H 83 7.659 7.659 7.657 0.002 17927 1293 1 2 . 1 1 84 84 LYS N N 84 123.927 123.927 121.544 2.383 17927 1294 1 2 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.150 -0.081 17927 1295 1 2 . 1 1 84 84 LYS C C 84 178.582 178.582 177.741 0.841 17927 1296 1 2 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.588 1.289 17927 1297 1 2 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.954 -0.631 17927 1298 1 2 . 1 1 84 84 LYS H H 84 8.665 8.665 7.893 0.772 17927 1299 1 2 . 1 1 85 85 ASP N N 85 116.280 116.280 117.224 -0.944 17927 1300 1 2 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.738 0.012 17927 1301 1 2 . 1 1 85 85 ASP C C 85 175.086 175.086 174.972 0.114 17927 1302 1 2 . 1 1 85 85 ASP CA C 85 54.693 54.693 55.045 -0.352 17927 1303 1 2 . 1 1 85 85 ASP CB C 85 39.685 39.685 40.963 -1.278 17927 1304 1 2 . 1 1 85 85 ASP H H 85 8.179 8.179 8.178 0.001 17927 1305 1 2 . 1 1 86 86 GLN N N 86 116.258 116.258 113.960 2.298 17927 1306 1 2 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.851 0.057 17927 1307 1 2 . 1 1 86 86 GLN C C 86 175.659 175.659 174.786 0.873 17927 1308 1 2 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.327 -0.156 17927 1309 1 2 . 1 1 86 86 GLN CB C 86 26.290 26.290 25.881 0.409 17927 1310 1 2 . 1 1 86 86 GLN H H 86 7.431 7.431 7.660 -0.229 17927 1311 1 2 . 1 1 87 87 LEU N N 87 117.031 117.031 119.547 -2.516 17927 1312 1 2 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.187 -0.097 17927 1313 1 2 . 1 1 87 87 LEU C C 87 178.225 178.225 176.333 1.892 17927 1314 1 2 . 1 1 87 87 LEU CA C 87 55.932 55.932 55.754 0.178 17927 1315 1 2 . 1 1 87 87 LEU CB C 87 41.202 41.202 41.128 0.074 17927 1316 1 2 . 1 1 87 87 LEU H H 87 7.736 7.736 7.728 0.008 17927 1317 1 2 . 1 1 88 88 LYS N N 88 122.367 122.367 123.024 -0.657 17927 1318 1 2 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.597 0.039 17927 1319 1 2 . 1 1 88 88 LYS C C 88 177.538 177.538 176.500 1.038 17927 1320 1 2 . 1 1 88 88 LYS CA C 88 54.930 54.930 54.001 0.929 17927 1321 1 2 . 1 1 88 88 LYS CB C 88 33.316 33.316 34.946 -1.630 17927 1322 1 2 . 1 1 88 88 LYS H H 88 8.496 8.496 8.007 0.489 17927 1323 1 2 . 1 1 89 89 GLY N N 89 108.452 108.452 106.891 1.561 17927 1324 1 2 . 1 1 89 89 GLY C C 89 173.781 173.781 173.725 0.056 17927 1325 1 2 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.452 0.906 17927 1326 1 2 . 1 1 89 89 GLY H H 89 8.497 8.497 8.878 -0.381 17927 1327 1 2 . 1 1 90 90 ILE N N 90 123.295 123.295 123.226 0.069 17927 1328 1 2 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.129 0.242 17927 1329 1 2 . 1 1 90 90 ILE C C 90 175.606 175.606 174.725 0.881 17927 1330 1 2 . 1 1 90 90 ILE CA C 90 62.001 62.001 61.465 0.536 17927 1331 1 2 . 1 1 90 90 ILE CB C 90 38.036 38.036 37.443 0.593 17927 1332 1 2 . 1 1 90 90 ILE H H 90 8.728 8.728 8.004 0.724 17927 1333 1 2 . 1 1 91 91 GLN N N 91 128.632 128.632 126.520 2.112 17927 1334 1 2 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.966 -0.200 17927 1335 1 2 . 1 1 91 91 GLN C C 91 174.618 174.618 174.406 0.212 17927 1336 1 2 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.490 1.360 17927 1337 1 2 . 1 1 91 91 GLN CB C 91 28.341 28.341 30.800 -2.459 17927 1338 1 2 . 1 1 91 91 GLN H H 91 8.762 8.762 8.481 0.281 17927 1339 1 2 . 1 1 92 92 LEU N N 92 120.830 120.830 123.663 -2.833 17927 1340 1 2 . 1 1 92 92 LEU HA H 92 5.580 5.580 5.153 0.427 17927 1341 1 2 . 1 1 92 92 LEU C C 92 176.828 176.828 175.638 1.190 17927 1342 1 2 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.676 -0.875 17927 1343 1 2 . 1 1 92 92 LEU CB C 92 44.210 44.210 45.336 -1.126 17927 1344 1 2 . 1 1 92 92 LEU H H 92 9.011 9.011 9.264 -0.253 17927 1345 1 2 . 1 1 93 93 HIS N N 93 121.481 121.481 122.384 -0.903 17927 1346 1 2 . 1 1 93 93 HIS HA H 93 3.931 3.931 5.113 -1.182 17927 1347 1 2 . 1 1 93 93 HIS C C 93 173.590 173.590 173.878 -0.288 17927 1348 1 2 . 1 1 93 93 HIS CA C 93 56.583 56.583 54.708 1.875 17927 1349 1 2 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.875 -1.625 17927 1350 1 2 . 1 1 93 93 HIS H H 93 8.038 8.038 9.339 -1.301 17927 1351 1 2 . 1 1 94 94 MET N N 94 121.881 121.881 127.848 -5.967 17927 1352 1 2 . 1 1 94 94 MET HA H 94 3.866 3.866 4.751 -0.885 17927 1353 1 2 . 1 1 94 94 MET C C 94 177.035 177.035 174.970 2.065 17927 1354 1 2 . 1 1 94 94 MET CA C 94 55.189 55.189 54.006 1.183 17927 1355 1 2 . 1 1 94 94 MET CB C 94 33.993 33.993 33.009 0.984 17927 1356 1 2 . 1 1 94 94 MET H H 94 8.039 8.039 8.669 -0.630 17927 1357 1 2 . 1 1 95 95 GLY N N 95 104.041 104.041 111.038 -6.997 17927 1358 1 2 . 1 1 95 95 GLY C C 95 174.251 174.251 174.177 0.074 17927 1359 1 2 . 1 1 95 95 GLY CA C 95 46.580 46.580 47.036 -0.456 17927 1360 1 2 . 1 1 95 95 GLY H H 95 5.666 5.666 8.091 -2.425 17927 1361 1 2 . 1 1 96 96 THR N N 96 114.114 114.114 113.299 0.815 17927 1362 1 2 . 1 1 96 96 THR HA H 96 4.211 4.211 4.431 -0.220 17927 1363 1 2 . 1 1 96 96 THR C C 96 175.122 175.122 173.882 1.240 17927 1364 1 2 . 1 1 96 96 THR CA C 96 61.339 61.339 62.097 -0.758 17927 1365 1 2 . 1 1 96 96 THR CB C 96 68.615 68.615 69.222 -0.607 17927 1366 1 2 . 1 1 96 96 THR H H 96 8.517 8.517 8.062 0.455 17927 1367 1 2 . 1 1 97 97 ASP N N 97 121.892 121.892 123.133 -1.241 17927 1368 1 2 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.710 -0.125 17927 1369 1 2 . 1 1 97 97 ASP C C 97 178.241 178.241 176.442 1.799 17927 1370 1 2 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.629 1.171 17927 1371 1 2 . 1 1 97 97 ASP CB C 97 43.129 43.129 38.903 4.226 17927 1372 1 2 . 1 1 97 97 ASP H H 97 7.563 7.563 8.646 -1.083 17927 1373 1 2 . 1 1 98 98 ARG N N 98 127.508 127.508 118.681 8.827 17927 1374 1 2 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.289 0.103 17927 1375 1 2 . 1 1 98 98 ARG C C 98 176.724 176.724 177.169 -0.445 17927 1376 1 2 . 1 1 98 98 ARG CA C 98 55.939 55.939 57.706 -1.767 17927 1377 1 2 . 1 1 98 98 ARG CB C 98 30.291 30.291 29.198 1.093 17927 1378 1 2 . 1 1 98 98 ARG H H 98 9.225 9.225 7.720 1.505 17927 1379 1 2 . 1 1 99 99 THR N N 99 116.384 116.384 117.205 -0.821 17927 1380 1 2 . 1 1 99 99 THR HA H 99 3.987 3.987 4.120 -0.134 17927 1381 1 2 . 1 1 99 99 THR C C 99 176.969 176.969 175.207 1.762 17927 1382 1 2 . 1 1 99 99 THR CA C 99 67.714 67.714 66.114 1.600 17927 1383 1 2 . 1 1 99 99 THR CB C 99 68.777 68.777 68.325 0.452 17927 1384 1 2 . 1 1 99 99 THR H H 99 8.382 8.382 8.073 0.309 17927 1385 1 2 . 1 1 100 100 PHE N N 100 123.232 123.232 122.611 0.621 17927 1386 1 2 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.470 -0.297 17927 1387 1 2 . 1 1 100 100 PHE C C 100 177.010 177.010 176.340 0.670 17927 1388 1 2 . 1 1 100 100 PHE CA C 100 61.923 61.923 60.153 1.770 17927 1389 1 2 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.161 1.601 17927 1390 1 2 . 1 1 100 100 PHE H H 100 7.998 7.998 8.255 -0.257 17927 1391 1 2 . 1 1 101 101 MET N N 101 115.968 115.968 119.116 -3.148 17927 1392 1 2 . 1 1 101 101 MET HA H 101 3.975 3.975 3.946 0.029 17927 1393 1 2 . 1 1 101 101 MET C C 101 178.763 178.763 178.103 0.660 17927 1394 1 2 . 1 1 101 101 MET CA C 101 58.552 58.552 59.592 -1.040 17927 1395 1 2 . 1 1 101 101 MET CB C 101 32.593 32.593 32.215 0.378 17927 1396 1 2 . 1 1 101 101 MET H H 101 7.828 7.828 7.487 0.341 17927 1397 1 2 . 1 1 102 102 ASP N N 102 117.553 117.553 119.145 -1.592 17927 1398 1 2 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.369 0.153 17927 1399 1 2 . 1 1 102 102 ASP C C 102 179.503 179.503 178.801 0.702 17927 1400 1 2 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.067 -0.177 17927 1401 1 2 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.106 -0.180 17927 1402 1 2 . 1 1 102 102 ASP H H 102 8.828 8.828 7.817 1.011 17927 1403 1 2 . 1 1 103 103 ALA N N 103 122.984 122.984 121.848 1.136 17927 1404 1 2 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.034 -0.048 17927 1405 1 2 . 1 1 103 103 ALA C C 103 178.782 178.782 178.289 0.493 17927 1406 1 2 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.379 0.715 17927 1407 1 2 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.356 0.207 17927 1408 1 2 . 1 1 103 103 ALA H H 103 7.567 7.567 7.518 0.049 17927 1409 1 2 . 1 1 104 104 TYR N N 104 112.159 112.159 114.515 -2.356 17927 1410 1 2 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.522 -0.298 17927 1411 1 2 . 1 1 104 104 TYR C C 104 173.821 173.821 174.627 -0.806 17927 1412 1 2 . 1 1 104 104 TYR CA C 104 58.498 58.498 58.121 0.377 17927 1413 1 2 . 1 1 104 104 TYR CB C 104 38.393 38.393 39.995 -1.602 17927 1414 1 2 . 1 1 104 104 TYR H H 104 7.203 7.203 7.210 -0.007 17927 1415 1 2 . 1 1 105 105 LEU N N 105 119.433 119.433 116.892 2.541 17927 1416 1 2 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.975 0.010 17927 1417 1 2 . 1 1 105 105 LEU C C 105 176.721 176.721 176.341 0.380 17927 1418 1 2 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.911 -0.126 17927 1419 1 2 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.159 -0.716 17927 1420 1 2 . 1 1 105 105 LEU H H 105 7.582 7.582 7.776 -0.194 17927 1421 1 2 . 1 1 106 106 ILE N N 106 119.575 119.575 112.710 6.865 17927 1422 1 2 . 1 1 106 106 ILE HA H 106 4.002 4.002 4.125 -0.123 17927 1423 1 2 . 1 1 106 106 ILE C C 106 175.459 175.459 175.907 -0.448 17927 1424 1 2 . 1 1 106 106 ILE CA C 106 62.043 62.043 60.829 1.214 17927 1425 1 2 . 1 1 106 106 ILE CB C 106 36.335 36.335 35.668 0.667 17927 1426 1 2 . 1 1 106 106 ILE H H 106 8.774 8.774 7.700 1.074 17927 1427 1 2 . 1 1 107 107 ASN N N 107 126.514 126.514 119.692 6.822 17927 1428 1 2 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.546 0.317 17927 1429 1 2 . 1 1 107 107 ASN C C 107 174.584 174.584 175.990 -1.406 17927 1430 1 2 . 1 1 107 107 ASN CA C 107 53.112 53.112 54.634 -1.522 17927 1431 1 2 . 1 1 107 107 ASN CB C 107 38.977 38.977 38.489 0.488 17927 1432 1 2 . 1 1 107 107 ASN H H 107 8.364 8.364 7.475 0.889 17927 1433 1 2 . 1 1 108 108 GLY N N 108 108.469 108.469 109.465 -0.996 17927 1434 1 2 . 1 1 108 108 GLY C C 108 171.245 171.245 172.607 -1.362 17927 1435 1 2 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.403 0.866 17927 1436 1 2 . 1 1 108 108 GLY H H 108 7.678 7.678 7.880 -0.202 17927 1437 1 2 . 1 1 109 109 ILE N N 109 112.817 112.817 121.452 -8.635 17927 1438 1 2 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.605 -0.199 17927 1439 1 2 . 1 1 109 109 ILE C C 109 173.498 173.498 173.995 -0.497 17927 1440 1 2 . 1 1 109 109 ILE CA C 109 58.384 58.384 57.370 1.014 17927 1441 1 2 . 1 1 109 109 ILE CB C 109 40.322 40.322 39.167 1.155 17927 1442 1 2 . 1 1 109 109 ILE H H 109 7.868 7.868 7.471 0.397 17927 1443 1 2 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.498 0.244 17927 1444 1 2 . 1 1 110 110 PRO C C 110 175.715 175.715 175.498 0.217 17927 1445 1 2 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.438 -0.161 17927 1446 1 2 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.545 3.823 17927 1447 1 2 . 1 1 111 111 ARG N N 111 122.358 122.358 120.996 1.362 17927 1448 1 2 . 1 1 111 111 ARG HA H 111 4.469 4.469 4.038 0.431 17927 1449 1 2 . 1 1 111 111 ARG C C 111 171.541 171.541 174.734 -3.193 17927 1450 1 2 . 1 1 111 111 ARG CA C 111 54.356 54.356 53.883 0.473 17927 1451 1 2 . 1 1 111 111 ARG CB C 111 33.430 33.430 32.532 0.898 17927 1452 1 2 . 1 1 111 111 ARG H H 111 7.732 7.732 8.471 -0.739 17927 1453 1 2 . 1 1 112 112 PHE N N 112 125.103 125.103 121.968 3.135 17927 1454 1 2 . 1 1 112 112 PHE HA H 112 5.773 5.773 5.116 0.657 17927 1455 1 2 . 1 1 112 112 PHE C C 112 175.097 175.097 174.767 0.330 17927 1456 1 2 . 1 1 112 112 PHE CA C 112 55.791 55.791 55.837 -0.046 17927 1457 1 2 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.088 1.840 17927 1458 1 2 . 1 1 112 112 PHE H H 112 8.929 8.929 7.502 1.427 17927 1459 1 2 . 1 1 113 113 ILE N N 113 123.778 123.778 123.156 0.622 17927 1460 1 2 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.949 -0.406 17927 1461 1 2 . 1 1 113 113 ILE C C 113 173.197 173.197 173.978 -0.781 17927 1462 1 2 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.766 0.520 17927 1463 1 2 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.455 1.791 17927 1464 1 2 . 1 1 113 113 ILE H H 113 8.873 8.873 8.930 -0.057 17927 1465 1 2 . 1 1 114 114 LEU N N 114 127.146 127.146 127.098 0.048 17927 1466 1 2 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.422 0.592 17927 1467 1 2 . 1 1 114 114 LEU C C 114 175.080 175.080 174.541 0.539 17927 1468 1 2 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.494 -0.093 17927 1469 1 2 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.064 1.306 17927 1470 1 2 . 1 1 114 114 LEU H H 114 8.974 8.974 9.018 -0.044 17927 1471 1 2 . 1 1 115 115 LEU N N 115 128.323 128.323 125.052 3.271 17927 1472 1 2 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.131 0.301 17927 1473 1 2 . 1 1 115 115 LEU C C 115 176.660 176.660 175.490 1.170 17927 1474 1 2 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.795 -0.718 17927 1475 1 2 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.378 -1.794 17927 1476 1 2 . 1 1 115 115 LEU H H 115 9.874 9.874 9.364 0.510 17927 1477 1 2 . 1 1 116 116 ASP N N 116 119.834 119.834 121.367 -1.533 17927 1478 1 2 . 1 1 116 116 ASP HA H 116 4.935 4.935 5.021 -0.086 17927 1479 1 2 . 1 1 116 116 ASP C C 116 176.898 176.898 177.436 -0.538 17927 1480 1 2 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.186 -0.881 17927 1481 1 2 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.760 -1.732 17927 1482 1 2 . 1 1 116 116 ASP H H 116 9.357 9.357 8.724 0.633 17927 1483 1 2 . 1 1 117 117 ARG N N 117 113.356 113.356 120.860 -7.504 17927 1484 1 2 . 1 1 117 117 ARG HA H 117 3.717 3.717 4.120 -0.403 17927 1485 1 2 . 1 1 117 117 ARG C C 117 177.105 177.105 178.250 -1.145 17927 1486 1 2 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.389 -1.204 17927 1487 1 2 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.967 0.470 17927 1488 1 2 . 1 1 117 117 ARG H H 117 7.697 7.697 8.355 -0.658 17927 1489 1 2 . 1 1 118 118 ASP N N 118 117.226 117.226 116.912 0.314 17927 1490 1 2 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.529 0.366 17927 1491 1 2 . 1 1 118 118 ASP C C 118 176.657 176.657 176.611 0.046 17927 1492 1 2 . 1 1 118 118 ASP CA C 118 53.517 53.517 54.175 -0.658 17927 1493 1 2 . 1 1 118 118 ASP CB C 118 42.556 42.556 41.076 1.480 17927 1494 1 2 . 1 1 118 118 ASP H H 118 8.456 8.456 7.912 0.544 17927 1495 1 2 . 1 1 119 119 GLY N N 119 109.074 109.074 107.524 1.550 17927 1496 1 2 . 1 1 119 119 GLY C C 119 173.355 173.355 174.103 -0.748 17927 1497 1 2 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.334 0.922 17927 1498 1 2 . 1 1 119 119 GLY H H 119 8.183 8.183 8.364 -0.181 17927 1499 1 2 . 1 1 120 120 LYS N N 120 120.744 120.744 121.251 -0.507 17927 1500 1 2 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.590 -0.057 17927 1501 1 2 . 1 1 120 120 LYS C C 120 177.229 177.229 176.312 0.917 17927 1502 1 2 . 1 1 120 120 LYS CA C 120 55.287 55.287 54.441 0.846 17927 1503 1 2 . 1 1 120 120 LYS CB C 120 32.581 32.581 32.237 0.344 17927 1504 1 2 . 1 1 120 120 LYS H H 120 8.449 8.449 7.528 0.921 17927 1505 1 2 . 1 1 121 121 ILE N N 121 121.221 121.221 127.901 -6.680 17927 1506 1 2 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.846 0.040 17927 1507 1 2 . 1 1 121 121 ILE C C 121 177.819 177.819 176.412 1.407 17927 1508 1 2 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.582 0.333 17927 1509 1 2 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.288 2.102 17927 1510 1 2 . 1 1 121 121 ILE H H 121 8.715 8.715 8.903 -0.188 17927 1511 1 2 . 1 1 122 122 ILE N N 122 127.165 127.165 128.489 -1.324 17927 1512 1 2 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.325 0.016 17927 1513 1 2 . 1 1 122 122 ILE C C 122 176.978 176.978 176.764 0.214 17927 1514 1 2 . 1 1 122 122 ILE CA C 122 63.719 63.719 61.936 1.783 17927 1515 1 2 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.516 0.136 17927 1516 1 2 . 1 1 122 122 ILE H H 122 8.974 8.974 8.717 0.257 17927 1517 1 2 . 1 1 123 123 SER N N 123 111.227 111.227 115.489 -4.262 17927 1518 1 2 . 1 1 123 123 SER HA H 123 4.738 4.738 4.786 -0.048 17927 1519 1 2 . 1 1 123 123 SER C C 123 174.184 174.184 173.691 0.493 17927 1520 1 2 . 1 1 123 123 SER CA C 123 57.383 57.383 57.199 0.184 17927 1521 1 2 . 1 1 123 123 SER CB C 123 65.326 65.326 64.764 0.562 17927 1522 1 2 . 1 1 123 123 SER H H 123 7.850 7.850 8.478 -0.628 17927 1523 1 2 . 1 1 124 124 ALA N N 124 131.373 131.373 128.439 2.934 17927 1524 1 2 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.331 0.154 17927 1525 1 2 . 1 1 124 124 ALA C C 124 175.147 175.147 176.201 -1.054 17927 1526 1 2 . 1 1 124 124 ALA CA C 124 53.035 53.035 53.771 -0.736 17927 1527 1 2 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.349 -0.687 17927 1528 1 2 . 1 1 124 124 ALA H H 124 9.384 9.384 8.816 0.568 17927 1529 1 2 . 1 1 125 125 ASN N N 125 119.476 119.476 114.402 5.074 17927 1530 1 2 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.274 -0.218 17927 1531 1 2 . 1 1 125 125 ASN C C 125 173.593 173.593 175.102 -1.509 17927 1532 1 2 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.763 -0.410 17927 1533 1 2 . 1 1 125 125 ASN CB C 125 38.304 38.304 39.819 -1.515 17927 1534 1 2 . 1 1 125 125 ASN H H 125 8.191 8.191 7.805 0.386 17927 1535 1 2 . 1 1 126 126 MET N N 126 122.705 122.705 126.812 -4.107 17927 1536 1 2 . 1 1 126 126 MET HA H 126 4.585 4.585 4.662 -0.077 17927 1537 1 2 . 1 1 126 126 MET C C 126 175.215 175.215 176.031 -0.816 17927 1538 1 2 . 1 1 126 126 MET CA C 126 53.849 53.849 57.361 -3.512 17927 1539 1 2 . 1 1 126 126 MET CB C 126 31.312 31.312 33.768 -2.456 17927 1540 1 2 . 1 1 126 126 MET H H 126 8.376 8.376 9.341 -0.965 17927 1541 1 2 . 1 1 127 127 THR N N 127 111.016 111.016 109.230 1.786 17927 1542 1 2 . 1 1 127 127 THR HA H 127 4.291 4.291 4.127 0.164 17927 1543 1 2 . 1 1 127 127 THR C C 127 174.574 174.574 172.749 1.825 17927 1544 1 2 . 1 1 127 127 THR CA C 127 62.085 62.085 62.366 -0.281 17927 1545 1 2 . 1 1 127 127 THR CB C 127 69.733 69.733 70.626 -0.893 17927 1546 1 2 . 1 1 127 127 THR H H 127 7.714 7.714 8.193 -0.478 17927 1547 1 2 . 1 1 128 128 ARG N N 128 118.722 118.722 120.201 -1.479 17927 1548 1 2 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.308 -1.000 17927 1549 1 2 . 1 1 128 128 ARG C C 128 176.978 176.978 173.729 3.249 17927 1550 1 2 . 1 1 128 128 ARG CA C 128 54.727 54.727 54.849 -0.122 17927 1551 1 2 . 1 1 128 128 ARG CB C 128 29.598 29.598 31.844 -2.246 17927 1552 1 2 . 1 1 128 128 ARG H H 128 8.658 8.658 7.210 1.448 17927 1553 1 2 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.531 -0.598 17927 1554 1 2 . 1 1 129 129 PRO C C 129 175.794 175.794 177.044 -1.250 17927 1555 1 2 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.356 1.192 17927 1556 1 2 . 1 1 129 129 PRO CB C 129 31.677 31.677 32.215 -0.538 17927 1557 1 2 . 1 1 130 130 SER N N 130 108.696 108.696 109.295 -0.599 17927 1558 1 2 . 1 1 130 130 SER HA H 130 3.988 3.988 4.405 -0.417 17927 1559 1 2 . 1 1 130 130 SER C C 130 174.445 174.445 174.093 0.352 17927 1560 1 2 . 1 1 130 130 SER CA C 130 58.911 58.911 57.794 1.117 17927 1561 1 2 . 1 1 130 130 SER CB C 130 62.680 62.680 63.484 -0.804 17927 1562 1 2 . 1 1 130 130 SER H H 130 8.375 8.375 8.065 0.310 17927 1563 1 2 . 1 1 131 131 ASP N N 131 126.377 126.377 124.422 1.955 17927 1564 1 2 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.952 -0.080 17927 1565 1 2 . 1 1 131 131 ASP C C 131 176.879 176.879 175.210 1.669 17927 1566 1 2 . 1 1 131 131 ASP CA C 131 51.195 51.195 51.521 -0.326 17927 1567 1 2 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.654 0.162 17927 1568 1 2 . 1 1 131 131 ASP H H 131 7.514 7.514 7.499 0.015 17927 1569 1 2 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.067 0.325 17927 1570 1 2 . 1 1 132 132 PRO C C 132 178.097 178.097 178.136 -0.039 17927 1571 1 2 . 1 1 132 132 PRO CA C 132 65.079 65.079 65.055 0.024 17927 1572 1 2 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.144 0.265 17927 1573 1 2 . 1 1 133 133 LYS N N 133 116.306 116.306 115.516 0.790 17927 1574 1 2 . 1 1 133 133 LYS HA H 133 3.958 3.958 3.915 0.043 17927 1575 1 2 . 1 1 133 133 LYS C C 133 179.532 179.532 178.943 0.589 17927 1576 1 2 . 1 1 133 133 LYS CA C 133 58.521 58.521 58.686 -0.165 17927 1577 1 2 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.014 1.177 17927 1578 1 2 . 1 1 133 133 LYS H H 133 8.842 8.842 8.568 0.274 17927 1579 1 2 . 1 1 134 134 THR N N 134 120.833 120.833 116.004 4.829 17927 1580 1 2 . 1 1 134 134 THR HA H 134 3.147 3.147 3.628 -0.481 17927 1581 1 2 . 1 1 134 134 THR C C 134 173.356 173.356 175.174 -1.818 17927 1582 1 2 . 1 1 134 134 THR CA C 134 66.383 66.383 66.276 0.107 17927 1583 1 2 . 1 1 134 134 THR CB C 134 66.847 66.847 67.993 -1.146 17927 1584 1 2 . 1 1 134 134 THR H H 134 8.292 8.292 7.461 0.831 17927 1585 1 2 . 1 1 135 135 ALA N N 135 121.720 121.720 122.818 -1.098 17927 1586 1 2 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.158 0.425 17927 1587 1 2 . 1 1 135 135 ALA C C 135 178.902 178.902 179.241 -0.339 17927 1588 1 2 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.683 0.316 17927 1589 1 2 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.150 -0.375 17927 1590 1 2 . 1 1 135 135 ALA H H 135 7.030 7.030 7.322 -0.292 17927 1591 1 2 . 1 1 136 136 GLU N N 136 114.623 114.623 117.589 -2.966 17927 1592 1 2 . 1 1 136 136 GLU HA H 136 3.922 3.922 3.925 -0.003 17927 1593 1 2 . 1 1 136 136 GLU C C 136 179.199 179.199 178.748 0.451 17927 1594 1 2 . 1 1 136 136 GLU CA C 136 59.837 59.837 59.126 0.711 17927 1595 1 2 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.469 0.317 17927 1596 1 2 . 1 1 136 136 GLU H H 136 7.216 7.216 8.574 -1.358 17927 1597 1 2 . 1 1 137 137 LYS N N 137 120.789 120.789 120.397 0.392 17927 1598 1 2 . 1 1 137 137 LYS HA H 137 4.204 4.204 4.050 0.154 17927 1599 1 2 . 1 1 137 137 LYS C C 137 178.834 178.834 178.874 -0.040 17927 1600 1 2 . 1 1 137 137 LYS CA C 137 57.343 57.343 59.109 -1.766 17927 1601 1 2 . 1 1 137 137 LYS CB C 137 30.463 30.463 32.106 -1.643 17927 1602 1 2 . 1 1 137 137 LYS H H 137 7.681 7.681 7.548 0.133 17927 1603 1 2 . 1 1 138 138 PHE N N 138 118.373 118.373 118.234 0.139 17927 1604 1 2 . 1 1 138 138 PHE HA H 138 4.033 4.033 4.151 -0.118 17927 1605 1 2 . 1 1 138 138 PHE C C 138 178.027 178.027 177.911 0.116 17927 1606 1 2 . 1 1 138 138 PHE CA C 138 57.507 57.507 59.591 -2.084 17927 1607 1 2 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.636 -1.747 17927 1608 1 2 . 1 1 138 138 PHE H H 138 8.059 8.059 7.310 0.749 17927 1609 1 2 . 1 1 139 139 ASN N N 139 117.611 117.611 117.709 -0.098 17927 1610 1 2 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.428 -0.024 17927 1611 1 2 . 1 1 139 139 ASN C C 139 178.190 178.190 177.480 0.710 17927 1612 1 2 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.177 0.047 17927 1613 1 2 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.852 -1.119 17927 1614 1 2 . 1 1 139 139 ASN H H 139 8.683 8.683 8.181 0.502 17927 1615 1 2 . 1 1 140 140 GLU N N 140 121.432 121.432 120.856 0.576 17927 1616 1 2 . 1 1 140 140 GLU HA H 140 4.005 4.005 3.940 0.065 17927 1617 1 2 . 1 1 140 140 GLU C C 140 179.751 179.751 179.583 0.168 17927 1618 1 2 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.447 -0.137 17927 1619 1 2 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.596 0.459 17927 1620 1 2 . 1 1 140 140 GLU H H 140 7.868 7.868 8.116 -0.248 17927 1621 1 2 . 1 1 141 141 LEU N N 141 119.968 119.968 118.681 1.287 17927 1622 1 2 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.001 0.015 17927 1623 1 2 . 1 1 141 141 LEU C C 141 179.293 179.293 178.226 1.067 17927 1624 1 2 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.180 0.256 17927 1625 1 2 . 1 1 141 141 LEU CB C 141 41.183 41.183 42.053 -0.870 17927 1626 1 2 . 1 1 141 141 LEU H H 141 8.303 8.303 8.157 0.146 17927 1627 1 2 . 1 1 142 142 LEU N N 142 115.040 115.040 115.797 -0.757 17927 1628 1 2 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.346 0.038 17927 1629 1 2 . 1 1 142 142 LEU C C 142 178.002 178.002 177.609 0.393 17927 1630 1 2 . 1 1 142 142 LEU CA C 142 55.279 55.279 54.983 0.297 17927 1631 1 2 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.513 0.133 17927 1632 1 2 . 1 1 142 142 LEU H H 142 8.230 8.230 7.660 0.570 17927 1633 1 2 . 1 1 143 143 GLY N N 143 108.977 108.977 106.497 2.480 17927 1634 1 2 . 1 1 143 143 GLY C C 143 175.216 175.216 174.690 0.526 17927 1635 1 2 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.800 0.941 17927 1636 1 2 . 1 1 143 143 GLY H H 143 7.762 7.762 7.752 0.010 17927 1637 1 2 . 1 1 144 144 LEU N N 144 119.660 119.660 121.097 -1.437 17927 1638 1 2 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.327 0.161 17927 1639 1 2 . 1 1 144 144 LEU C C 144 177.375 177.375 175.831 1.544 17927 1640 1 2 . 1 1 144 144 LEU CA C 144 54.525 54.525 54.909 -0.384 17927 1641 1 2 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.227 0.546 17927 1642 1 2 . 1 1 144 144 LEU H H 144 8.241 8.241 8.026 0.215 17927 1643 1 2 . 1 1 145 145 GLU N N 145 119.959 119.959 116.784 3.175 17927 1644 1 2 . 1 1 145 145 GLU HA H 145 4.241 4.241 3.931 0.310 17927 1645 1 2 . 1 1 145 145 GLU C C 145 177.075 177.075 175.696 1.379 17927 1646 1 2 . 1 1 145 145 GLU CA C 145 56.799 56.799 56.841 -0.042 17927 1647 1 2 . 1 1 145 145 GLU CB C 145 30.168 30.168 29.744 0.424 17927 1648 1 2 . 1 1 145 145 GLU H H 145 8.410 8.410 7.528 0.882 17927 1649 1 2 . 1 1 146 146 GLY N N 146 109.412 109.412 109.149 0.263 17927 1650 1 2 . 1 1 146 146 GLY C C 146 174.276 174.276 174.586 -0.310 17927 1651 1 2 . 1 1 146 146 GLY CA C 146 45.445 45.445 44.423 1.022 17927 1652 1 2 . 1 1 146 146 GLY H H 146 8.422 8.422 8.402 0.020 17927 1653 1 2 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.440 0.216 17927 1654 1 2 . 1 1 151 151 HIS C C 151 173.990 173.990 175.297 -1.307 17927 1655 1 2 . 1 1 151 151 HIS CA C 151 56.044 56.044 57.099 -1.056 17927 1656 1 2 . 1 1 151 151 HIS CB C 151 30.076 30.076 30.288 -0.212 17927 1657 1 3 . 1 1 2 2 SER HA H 2 4.121 4.121 4.553 -0.432 17927 1658 1 3 . 1 1 2 2 SER CA C 2 57.293 57.293 58.874 -1.581 17927 1659 1 3 . 1 1 2 2 SER CB C 2 63.545 63.545 63.194 0.351 17927 1660 1 3 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.634 -0.202 17927 1661 1 3 . 1 1 3 3 LEU C C 3 177.383 177.383 175.821 1.562 17927 1662 1 3 . 1 1 3 3 LEU CA C 3 55.575 55.575 55.387 0.188 17927 1663 1 3 . 1 1 3 3 LEU CB C 3 42.584 42.584 43.705 -1.121 17927 1664 1 3 . 1 1 4 4 ARG N N 4 122.080 122.080 123.590 -1.510 17927 1665 1 3 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.473 -0.089 17927 1666 1 3 . 1 1 4 4 ARG C C 4 176.410 176.410 174.562 1.848 17927 1667 1 3 . 1 1 4 4 ARG CA C 4 56.269 56.269 56.310 -0.041 17927 1668 1 3 . 1 1 4 4 ARG CB C 4 30.842 30.842 31.591 -0.749 17927 1669 1 3 . 1 1 4 4 ARG H H 4 8.410 8.410 9.007 -0.597 17927 1670 1 3 . 1 1 5 5 SER N N 5 117.023 117.023 113.452 3.571 17927 1671 1 3 . 1 1 5 5 SER HA H 5 4.423 4.423 4.814 -0.391 17927 1672 1 3 . 1 1 5 5 SER C C 5 175.039 175.039 175.177 -0.138 17927 1673 1 3 . 1 1 5 5 SER CA C 5 58.605 58.605 57.163 1.442 17927 1674 1 3 . 1 1 5 5 SER CB C 5 64.044 64.044 66.049 -2.005 17927 1675 1 3 . 1 1 5 5 SER H H 5 8.292 8.292 7.814 0.478 17927 1676 1 3 . 1 1 6 6 GLY N N 6 110.718 110.718 107.880 2.838 17927 1677 1 3 . 1 1 6 6 GLY C C 6 173.654 173.654 174.248 -0.594 17927 1678 1 3 . 1 1 6 6 GLY CA C 6 45.273 45.273 45.556 -0.283 17927 1679 1 3 . 1 1 6 6 GLY H H 6 8.446 8.446 8.728 -0.282 17927 1680 1 3 . 1 1 7 7 ASN N N 7 119.287 119.287 117.242 2.045 17927 1681 1 3 . 1 1 7 7 ASN HA H 7 5.024 5.024 5.139 -0.115 17927 1682 1 3 . 1 1 7 7 ASN C C 7 173.672 173.672 173.166 0.506 17927 1683 1 3 . 1 1 7 7 ASN CA C 7 51.357 51.357 50.835 0.522 17927 1684 1 3 . 1 1 7 7 ASN CB C 7 38.927 38.927 40.582 -1.655 17927 1685 1 3 . 1 1 7 7 ASN H H 7 8.273 8.273 7.693 0.580 17927 1686 1 3 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.450 -0.003 17927 1687 1 3 . 1 1 8 8 PRO C C 8 176.899 176.899 176.584 0.315 17927 1688 1 3 . 1 1 8 8 PRO CA C 8 63.429 63.429 64.435 -1.006 17927 1689 1 3 . 1 1 8 8 PRO CB C 8 32.216 32.216 32.230 -0.014 17927 1690 1 3 . 1 1 9 9 SER N N 9 115.642 115.642 112.537 3.105 17927 1691 1 3 . 1 1 9 9 SER HA H 9 4.415 4.415 4.457 -0.042 17927 1692 1 3 . 1 1 9 9 SER C C 9 174.714 174.714 175.017 -0.303 17927 1693 1 3 . 1 1 9 9 SER CA C 9 58.488 58.488 59.053 -0.565 17927 1694 1 3 . 1 1 9 9 SER CB C 9 64.048 64.048 63.625 0.423 17927 1695 1 3 . 1 1 9 9 SER H H 9 8.336 8.336 7.850 0.486 17927 1696 1 3 . 1 1 10 10 ALA N N 10 126.808 126.808 118.662 8.146 17927 1697 1 3 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.360 -0.098 17927 1698 1 3 . 1 1 10 10 ALA C C 10 177.233 177.233 176.120 1.113 17927 1699 1 3 . 1 1 10 10 ALA CA C 10 53.230 53.230 53.748 -0.518 17927 1700 1 3 . 1 1 10 10 ALA CB C 10 19.187 19.187 18.055 1.132 17927 1701 1 3 . 1 1 10 10 ALA H H 10 8.137 8.137 9.103 -0.966 17927 1702 1 3 . 1 1 11 11 ALA N N 11 120.449 120.449 120.226 0.223 17927 1703 1 3 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.892 -0.631 17927 1704 1 3 . 1 1 11 11 ALA C C 11 177.469 177.469 175.988 1.481 17927 1705 1 3 . 1 1 11 11 ALA CA C 11 52.475 52.475 51.035 1.440 17927 1706 1 3 . 1 1 11 11 ALA CB C 11 19.485 19.485 21.085 -1.600 17927 1707 1 3 . 1 1 11 11 ALA H H 11 7.851 7.851 7.900 -0.049 17927 1708 1 3 . 1 1 12 12 SER N N 12 114.186 114.186 116.398 -2.212 17927 1709 1 3 . 1 1 12 12 SER HA H 12 4.312 4.312 3.971 0.341 17927 1710 1 3 . 1 1 12 12 SER C C 12 173.593 173.593 173.168 0.425 17927 1711 1 3 . 1 1 12 12 SER CA C 12 58.099 58.099 59.309 -1.210 17927 1712 1 3 . 1 1 12 12 SER CB C 12 63.320 63.320 62.762 0.558 17927 1713 1 3 . 1 1 12 12 SER H H 12 7.990 7.990 8.833 -0.843 17927 1714 1 3 . 1 1 13 13 PHE N N 13 118.092 118.092 120.131 -2.039 17927 1715 1 3 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.738 0.042 17927 1716 1 3 . 1 1 13 13 PHE C C 13 174.220 174.220 173.384 0.836 17927 1717 1 3 . 1 1 13 13 PHE CA C 13 56.717 56.717 56.175 0.542 17927 1718 1 3 . 1 1 13 13 PHE CB C 13 41.151 41.151 42.230 -1.079 17927 1719 1 3 . 1 1 13 13 PHE H H 13 7.147 7.147 7.310 -0.163 17927 1720 1 3 . 1 1 14 14 SER N N 14 116.456 116.456 114.010 2.446 17927 1721 1 3 . 1 1 14 14 SER HA H 14 5.162 5.162 5.117 0.045 17927 1722 1 3 . 1 1 14 14 SER C C 14 172.626 172.626 172.734 -0.108 17927 1723 1 3 . 1 1 14 14 SER CA C 14 57.390 57.390 58.001 -0.611 17927 1724 1 3 . 1 1 14 14 SER CB C 14 64.518 64.518 65.622 -1.104 17927 1725 1 3 . 1 1 14 14 SER H H 14 7.616 7.616 8.013 -0.397 17927 1726 1 3 . 1 1 15 15 TYR N N 15 122.384 122.384 123.689 -1.305 17927 1727 1 3 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.867 0.339 17927 1728 1 3 . 1 1 15 15 TYR C C 15 172.543 172.543 172.683 -0.140 17927 1729 1 3 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.759 -0.813 17927 1730 1 3 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.067 1.160 17927 1731 1 3 . 1 1 15 15 TYR H H 15 8.558 8.558 9.181 -0.623 17927 1732 1 3 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.913 0.196 17927 1733 1 3 . 1 1 16 16 PRO C C 16 176.475 176.475 176.140 0.335 17927 1734 1 3 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.107 -0.126 17927 1735 1 3 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.215 0.447 17927 1736 1 3 . 1 1 17 17 ASP N N 17 119.834 119.834 124.523 -4.689 17927 1737 1 3 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.845 0.894 17927 1738 1 3 . 1 1 17 17 ASP C C 17 180.740 180.740 178.281 2.459 17927 1739 1 3 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.804 -2.087 17927 1740 1 3 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.158 -0.597 17927 1741 1 3 . 1 1 17 17 ASP H H 17 8.643 8.643 8.826 -0.183 17927 1742 1 3 . 1 1 18 18 ILE N N 18 118.340 118.340 121.311 -2.971 17927 1743 1 3 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.698 0.753 17927 1744 1 3 . 1 1 18 18 ILE C C 18 175.742 175.742 177.386 -1.644 17927 1745 1 3 . 1 1 18 18 ILE CA C 18 61.894 61.894 63.454 -1.560 17927 1746 1 3 . 1 1 18 18 ILE CB C 18 39.240 39.240 37.017 2.224 17927 1747 1 3 . 1 1 18 18 ILE H H 18 8.450 8.450 8.790 -0.340 17927 1748 1 3 . 1 1 19 19 ASN N N 19 119.377 119.377 115.817 3.560 17927 1749 1 3 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.625 0.390 17927 1750 1 3 . 1 1 19 19 ASN C C 19 175.892 175.892 176.030 -0.138 17927 1751 1 3 . 1 1 19 19 ASN CA C 19 53.307 53.307 53.963 -0.656 17927 1752 1 3 . 1 1 19 19 ASN CB C 19 39.825 39.825 39.094 0.731 17927 1753 1 3 . 1 1 19 19 ASN H H 19 8.376 8.376 8.819 -0.443 17927 1754 1 3 . 1 1 20 20 GLY N N 20 109.535 109.535 108.579 0.956 17927 1755 1 3 . 1 1 20 20 GLY C C 20 174.285 174.285 173.282 1.003 17927 1756 1 3 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.039 0.754 17927 1757 1 3 . 1 1 20 20 GLY H H 20 8.539 8.539 8.418 0.121 17927 1758 1 3 . 1 1 21 21 LYS N N 21 124.675 124.675 121.270 3.405 17927 1759 1 3 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.571 -0.128 17927 1760 1 3 . 1 1 21 21 LYS C C 21 176.537 176.537 175.849 0.688 17927 1761 1 3 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.690 0.754 17927 1762 1 3 . 1 1 21 21 LYS CB C 21 32.754 32.754 33.037 -0.283 17927 1763 1 3 . 1 1 21 21 LYS H H 21 8.608 8.608 7.439 1.169 17927 1764 1 3 . 1 1 22 22 THR N N 22 120.666 120.666 124.373 -3.707 17927 1765 1 3 . 1 1 22 22 THR HA H 22 4.087 4.087 4.292 -0.205 17927 1766 1 3 . 1 1 22 22 THR C C 22 174.431 174.431 174.135 0.296 17927 1767 1 3 . 1 1 22 22 THR CA C 22 64.292 64.292 63.608 0.684 17927 1768 1 3 . 1 1 22 22 THR CB C 22 69.069 69.069 68.252 0.817 17927 1769 1 3 . 1 1 22 22 THR H H 22 8.595 8.595 8.776 -0.181 17927 1770 1 3 . 1 1 23 23 VAL N N 23 131.207 131.207 128.891 2.316 17927 1771 1 3 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.422 -0.230 17927 1772 1 3 . 1 1 23 23 VAL C C 23 174.244 174.244 174.401 -0.157 17927 1773 1 3 . 1 1 23 23 VAL CA C 23 62.456 62.456 60.588 1.868 17927 1774 1 3 . 1 1 23 23 VAL CB C 23 33.791 33.791 34.690 -0.899 17927 1775 1 3 . 1 1 23 23 VAL H H 23 8.937 8.937 8.817 0.120 17927 1776 1 3 . 1 1 24 24 SER N N 24 120.787 120.787 120.399 0.388 17927 1777 1 3 . 1 1 24 24 SER HA H 24 5.407 5.407 5.014 0.393 17927 1778 1 3 . 1 1 24 24 SER C C 24 176.169 176.169 174.514 1.655 17927 1779 1 3 . 1 1 24 24 SER CA C 24 55.135 55.135 56.440 -1.305 17927 1780 1 3 . 1 1 24 24 SER CB C 24 65.646 65.646 66.063 -0.417 17927 1781 1 3 . 1 1 24 24 SER H H 24 8.554 8.554 8.337 0.217 17927 1782 1 3 . 1 1 25 25 LEU N N 25 124.332 124.332 122.281 2.051 17927 1783 1 3 . 1 1 25 25 LEU HA H 25 3.687 3.687 4.022 -0.335 17927 1784 1 3 . 1 1 25 25 LEU C C 25 179.364 179.364 176.517 2.847 17927 1785 1 3 . 1 1 25 25 LEU CA C 25 58.217 58.217 54.967 3.250 17927 1786 1 3 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.580 -1.042 17927 1787 1 3 . 1 1 25 25 LEU H H 25 7.811 7.811 8.835 -1.024 17927 1788 1 3 . 1 1 26 26 ALA N N 26 119.799 119.799 118.786 1.013 17927 1789 1 3 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.091 -0.098 17927 1790 1 3 . 1 1 26 26 ALA C C 26 179.719 179.719 177.369 2.350 17927 1791 1 3 . 1 1 26 26 ALA CA C 26 54.663 54.663 53.628 1.035 17927 1792 1 3 . 1 1 26 26 ALA CB C 26 18.323 18.323 18.997 -0.674 17927 1793 1 3 . 1 1 26 26 ALA H H 26 8.099 8.099 8.042 0.057 17927 1794 1 3 . 1 1 27 27 ASP N N 27 116.553 116.553 118.388 -1.835 17927 1795 1 3 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.480 -0.007 17927 1796 1 3 . 1 1 27 27 ASP C C 27 176.915 176.915 177.978 -1.063 17927 1797 1 3 . 1 1 27 27 ASP CA C 27 56.251 56.251 56.260 -0.009 17927 1798 1 3 . 1 1 27 27 ASP CB C 27 40.788 40.788 41.167 -0.379 17927 1799 1 3 . 1 1 27 27 ASP H H 27 7.572 7.572 7.520 0.052 17927 1800 1 3 . 1 1 28 28 LEU N N 28 118.950 118.950 117.828 1.122 17927 1801 1 3 . 1 1 28 28 LEU HA H 28 4.233 4.233 4.397 -0.164 17927 1802 1 3 . 1 1 28 28 LEU C C 28 175.542 175.542 176.317 -0.775 17927 1803 1 3 . 1 1 28 28 LEU CA C 28 53.706 53.706 54.386 -0.680 17927 1804 1 3 . 1 1 28 28 LEU CB C 28 41.049 41.049 42.014 -0.965 17927 1805 1 3 . 1 1 28 28 LEU H H 28 7.363 7.363 7.154 0.209 17927 1806 1 3 . 1 1 29 29 LYS N N 29 118.429 118.429 119.661 -1.232 17927 1807 1 3 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.037 0.315 17927 1808 1 3 . 1 1 29 29 LYS C C 29 178.063 178.063 177.764 0.299 17927 1809 1 3 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.412 0.365 17927 1810 1 3 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.853 0.587 17927 1811 1 3 . 1 1 29 29 LYS H H 29 6.780 6.780 7.279 -0.499 17927 1812 1 3 . 1 1 30 30 GLY N N 30 112.426 112.426 113.442 -1.016 17927 1813 1 3 . 1 1 30 30 GLY C C 30 173.801 173.801 173.623 0.178 17927 1814 1 3 . 1 1 30 30 GLY CA C 30 44.611 44.611 45.257 -0.646 17927 1815 1 3 . 1 1 30 30 GLY H H 30 9.398 9.398 8.916 0.482 17927 1816 1 3 . 1 1 31 31 LYS N N 31 119.295 119.295 119.204 0.091 17927 1817 1 3 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.412 -0.260 17927 1818 1 3 . 1 1 31 31 LYS C C 31 173.862 173.862 175.971 -2.109 17927 1819 1 3 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.315 0.873 17927 1820 1 3 . 1 1 31 31 LYS CB C 31 36.968 36.968 34.914 2.054 17927 1821 1 3 . 1 1 31 31 LYS H H 31 7.496 7.496 7.433 0.063 17927 1822 1 3 . 1 1 32 32 TYR N N 32 116.984 116.984 122.661 -5.677 17927 1823 1 3 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.497 -0.340 17927 1824 1 3 . 1 1 32 32 TYR C C 32 175.226 175.226 175.575 -0.349 17927 1825 1 3 . 1 1 32 32 TYR CA C 32 60.590 60.590 59.989 0.601 17927 1826 1 3 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.468 -0.347 17927 1827 1 3 . 1 1 32 32 TYR H H 32 7.521 7.521 8.228 -0.707 17927 1828 1 3 . 1 1 33 33 ILE N N 33 118.052 118.052 120.521 -2.469 17927 1829 1 3 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.564 0.343 17927 1830 1 3 . 1 1 33 33 ILE C C 33 174.308 174.308 174.258 0.050 17927 1831 1 3 . 1 1 33 33 ILE CA C 33 60.702 60.702 58.953 1.750 17927 1832 1 3 . 1 1 33 33 ILE CB C 33 41.616 41.616 40.069 1.547 17927 1833 1 3 . 1 1 33 33 ILE H H 33 8.467 8.467 8.729 -0.262 17927 1834 1 3 . 1 1 34 34 TYR N N 34 130.242 130.242 129.518 0.724 17927 1835 1 3 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.097 0.429 17927 1836 1 3 . 1 1 34 34 TYR C C 34 174.245 174.245 173.713 0.532 17927 1837 1 3 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.586 0.572 17927 1838 1 3 . 1 1 34 34 TYR CB C 34 40.133 40.133 39.743 0.390 17927 1839 1 3 . 1 1 34 34 TYR H H 34 8.905 8.905 9.300 -0.395 17927 1840 1 3 . 1 1 35 35 ILE N N 35 128.697 128.697 130.167 -1.470 17927 1841 1 3 . 1 1 35 35 ILE HA H 35 5.342 5.342 4.893 0.449 17927 1842 1 3 . 1 1 35 35 ILE C C 35 174.520 174.520 174.172 0.348 17927 1843 1 3 . 1 1 35 35 ILE CA C 35 59.749 59.749 60.526 -0.777 17927 1844 1 3 . 1 1 35 35 ILE CB C 35 40.899 40.899 39.142 1.758 17927 1845 1 3 . 1 1 35 35 ILE H H 35 9.445 9.445 8.488 0.957 17927 1846 1 3 . 1 1 36 36 ASP N N 36 123.675 123.675 128.171 -4.496 17927 1847 1 3 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.219 -0.371 17927 1848 1 3 . 1 1 36 36 ASP C C 36 174.385 174.385 175.746 -1.361 17927 1849 1 3 . 1 1 36 36 ASP CA C 36 51.294 51.294 52.071 -0.777 17927 1850 1 3 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.413 -2.635 17927 1851 1 3 . 1 1 36 36 ASP H H 36 8.875 8.875 8.915 -0.040 17927 1852 1 3 . 1 1 37 37 VAL N N 37 127.159 127.159 126.486 0.673 17927 1853 1 3 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.939 0.020 17927 1854 1 3 . 1 1 37 37 VAL C C 37 175.046 175.046 175.461 -0.415 17927 1855 1 3 . 1 1 37 37 VAL CA C 37 62.245 62.245 61.849 0.396 17927 1856 1 3 . 1 1 37 37 VAL CB C 37 31.807 31.807 31.130 0.677 17927 1857 1 3 . 1 1 37 37 VAL H H 37 8.603 8.603 8.076 0.527 17927 1858 1 3 . 1 1 38 38 TRP N N 38 124.161 124.161 127.316 -3.155 17927 1859 1 3 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.112 0.125 17927 1860 1 3 . 1 1 38 38 TRP C C 38 171.995 171.995 173.463 -1.468 17927 1861 1 3 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.245 1.962 17927 1862 1 3 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.674 2.513 17927 1863 1 3 . 1 1 38 38 TRP H H 38 8.562 8.562 8.669 -0.107 17927 1864 1 3 . 1 1 39 39 ALA N N 39 116.252 116.252 124.728 -8.476 17927 1865 1 3 . 1 1 39 39 ALA HA H 39 3.678 3.678 3.979 -0.301 17927 1866 1 3 . 1 1 39 39 ALA C C 39 178.664 178.664 177.225 1.439 17927 1867 1 3 . 1 1 39 39 ALA CA C 39 51.466 51.466 49.843 1.623 17927 1868 1 3 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.200 1.141 17927 1869 1 3 . 1 1 39 39 ALA H H 39 6.757 6.757 7.574 -0.817 17927 1870 1 3 . 1 1 40 40 THR N N 40 114.321 114.321 116.382 -2.061 17927 1871 1 3 . 1 1 40 40 THR HA H 40 3.907 3.907 4.131 -0.224 17927 1872 1 3 . 1 1 40 40 THR C C 40 175.885 175.885 175.850 0.035 17927 1873 1 3 . 1 1 40 40 THR CA C 40 65.447 65.447 65.131 0.316 17927 1874 1 3 . 1 1 40 40 THR CB C 40 70.106 70.106 69.278 0.828 17927 1875 1 3 . 1 1 40 40 THR H H 40 9.639 9.639 8.943 0.696 17927 1876 1 3 . 1 1 41 41 TRP N N 41 114.483 114.483 121.597 -7.114 17927 1877 1 3 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.823 -0.260 17927 1878 1 3 . 1 1 41 41 TRP C C 41 176.189 176.189 176.401 -0.212 17927 1879 1 3 . 1 1 41 41 TRP CA C 41 54.698 54.698 56.575 -1.877 17927 1880 1 3 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.190 1.787 17927 1881 1 3 . 1 1 41 41 TRP H H 41 6.401 6.401 6.949 -0.548 17927 1882 1 3 . 1 1 42 42 CYS N N 42 123.536 123.536 114.880 8.656 17927 1883 1 3 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.250 0.318 17927 1884 1 3 . 1 1 42 42 CYS C C 42 175.726 175.726 176.415 -0.689 17927 1885 1 3 . 1 1 42 42 CYS CA C 42 58.700 58.700 58.536 0.164 17927 1886 1 3 . 1 1 42 42 CYS CB C 42 27.121 27.121 27.234 -0.113 17927 1887 1 3 . 1 1 42 42 CYS H H 42 6.883 6.883 7.300 -0.417 17927 1888 1 3 . 1 1 43 43 GLY N N 43 120.977 120.977 110.956 10.021 17927 1889 1 3 . 1 1 43 43 GLY CA C 43 49.204 49.204 46.900 2.304 17927 1890 1 3 . 1 1 43 43 GLY H H 43 9.653 9.653 7.586 2.067 17927 1891 1 3 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.281 0.206 17927 1892 1 3 . 1 1 44 44 PRO C C 44 179.956 179.956 178.557 1.399 17927 1893 1 3 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.152 0.490 17927 1894 1 3 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.574 1.004 17927 1895 1 3 . 1 1 45 45 CYS N N 45 113.925 113.925 117.102 -3.177 17927 1896 1 3 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.140 0.173 17927 1897 1 3 . 1 1 45 45 CYS C C 45 178.325 178.325 176.764 1.561 17927 1898 1 3 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.187 2.205 17927 1899 1 3 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.610 0.895 17927 1900 1 3 . 1 1 45 45 CYS H H 45 7.676 7.676 7.646 0.030 17927 1901 1 3 . 1 1 46 46 ARG N N 46 120.336 120.336 118.211 2.125 17927 1902 1 3 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.256 -0.187 17927 1903 1 3 . 1 1 46 46 ARG C C 46 180.446 180.446 177.622 2.824 17927 1904 1 3 . 1 1 46 46 ARG CA C 46 59.785 59.785 58.093 1.692 17927 1905 1 3 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.819 0.049 17927 1906 1 3 . 1 1 46 46 ARG H H 46 8.109 8.109 8.083 0.026 17927 1907 1 3 . 1 1 47 47 GLY N N 47 105.408 105.408 106.284 -0.876 17927 1908 1 3 . 1 1 47 47 GLY C C 47 175.258 175.258 175.222 0.036 17927 1909 1 3 . 1 1 47 47 GLY CA C 47 46.594 46.594 45.958 0.637 17927 1910 1 3 . 1 1 47 47 GLY H H 47 8.466 8.466 7.946 0.520 17927 1911 1 3 . 1 1 48 48 GLU N N 48 116.343 116.343 120.241 -3.898 17927 1912 1 3 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.449 0.076 17927 1913 1 3 . 1 1 48 48 GLU C C 48 176.535 176.535 178.510 -1.975 17927 1914 1 3 . 1 1 48 48 GLU CA C 48 55.792 55.792 56.466 -0.674 17927 1915 1 3 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.749 1.233 17927 1916 1 3 . 1 1 48 48 GLU H H 48 7.050 7.050 7.714 -0.664 17927 1917 1 3 . 1 1 49 49 LEU N N 49 118.652 118.652 121.444 -2.792 17927 1918 1 3 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.179 -0.027 17927 1919 1 3 . 1 1 49 49 LEU C C 49 176.832 176.832 176.571 0.261 17927 1920 1 3 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.428 -1.083 17927 1921 1 3 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.328 -0.832 17927 1922 1 3 . 1 1 49 49 LEU H H 49 7.385 7.385 7.479 -0.094 17927 1923 1 3 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.144 0.109 17927 1924 1 3 . 1 1 50 50 PRO C C 50 179.744 179.744 178.093 1.651 17927 1925 1 3 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.132 0.427 17927 1926 1 3 . 1 1 50 50 PRO CB C 50 30.762 30.762 31.009 -0.247 17927 1927 1 3 . 1 1 51 51 ALA N N 51 120.418 120.418 118.690 1.728 17927 1928 1 3 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.126 0.019 17927 1929 1 3 . 1 1 51 51 ALA C C 51 180.329 180.329 179.528 0.801 17927 1930 1 3 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.585 -0.151 17927 1931 1 3 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.297 0.073 17927 1932 1 3 . 1 1 51 51 ALA H H 51 7.731 7.731 7.947 -0.216 17927 1933 1 3 . 1 1 52 52 LEU N N 52 121.506 121.506 118.979 2.527 17927 1934 1 3 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.976 0.012 17927 1935 1 3 . 1 1 52 52 LEU C C 52 177.944 177.944 178.107 -0.163 17927 1936 1 3 . 1 1 52 52 LEU CA C 52 58.327 58.327 58.241 0.086 17927 1937 1 3 . 1 1 52 52 LEU CB C 52 42.382 42.382 42.019 0.363 17927 1938 1 3 . 1 1 52 52 LEU H H 52 8.355 8.355 8.381 -0.026 17927 1939 1 3 . 1 1 53 53 LYS N N 53 119.732 119.732 119.195 0.537 17927 1940 1 3 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.825 0.078 17927 1941 1 3 . 1 1 53 53 LYS C C 53 179.030 179.030 178.879 0.151 17927 1942 1 3 . 1 1 53 53 LYS CA C 53 59.846 59.846 60.027 -0.181 17927 1943 1 3 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.938 0.273 17927 1944 1 3 . 1 1 53 53 LYS H H 53 8.148 8.148 7.403 0.745 17927 1945 1 3 . 1 1 54 54 GLU N N 54 117.779 117.779 119.241 -1.462 17927 1946 1 3 . 1 1 54 54 GLU HA H 54 4.059 4.059 4.033 0.026 17927 1947 1 3 . 1 1 54 54 GLU C C 54 179.646 179.646 179.302 0.344 17927 1948 1 3 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.283 0.342 17927 1949 1 3 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.149 0.418 17927 1950 1 3 . 1 1 54 54 GLU H H 54 7.585 7.585 7.811 -0.226 17927 1951 1 3 . 1 1 55 55 LEU N N 55 120.581 120.581 119.770 0.811 17927 1952 1 3 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.185 0.008 17927 1953 1 3 . 1 1 55 55 LEU C C 55 178.557 178.557 178.195 0.362 17927 1954 1 3 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.678 0.557 17927 1955 1 3 . 1 1 55 55 LEU CB C 55 43.011 43.011 42.113 0.898 17927 1956 1 3 . 1 1 55 55 LEU H H 55 8.096 8.096 7.833 0.263 17927 1957 1 3 . 1 1 56 56 GLU N N 56 118.023 118.023 119.172 -1.149 17927 1958 1 3 . 1 1 56 56 GLU HA H 56 3.177 3.177 3.242 -0.065 17927 1959 1 3 . 1 1 56 56 GLU C C 56 179.650 179.650 179.092 0.558 17927 1960 1 3 . 1 1 56 56 GLU CA C 56 58.871 58.871 58.882 -0.011 17927 1961 1 3 . 1 1 56 56 GLU CB C 56 26.985 26.985 28.649 -1.664 17927 1962 1 3 . 1 1 56 56 GLU H H 56 8.181 8.181 8.141 0.040 17927 1963 1 3 . 1 1 57 57 GLU N N 57 117.828 117.828 118.355 -0.527 17927 1964 1 3 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.092 0.012 17927 1965 1 3 . 1 1 57 57 GLU C C 57 179.700 179.700 177.504 2.196 17927 1966 1 3 . 1 1 57 57 GLU CA C 57 59.027 59.027 57.828 1.199 17927 1967 1 3 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.489 0.176 17927 1968 1 3 . 1 1 57 57 GLU H H 57 7.762 7.762 8.204 -0.442 17927 1969 1 3 . 1 1 58 58 LYS N N 58 120.896 120.896 118.166 2.730 17927 1970 1 3 . 1 1 58 58 LYS HA H 58 3.979 3.979 4.032 -0.053 17927 1971 1 3 . 1 1 58 58 LYS C C 58 178.715 178.715 177.555 1.160 17927 1972 1 3 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.239 0.839 17927 1973 1 3 . 1 1 58 58 LYS CB C 58 32.980 32.980 32.983 -0.003 17927 1974 1 3 . 1 1 58 58 LYS H H 58 8.410 8.410 7.601 0.809 17927 1975 1 3 . 1 1 59 59 TYR N N 59 113.713 113.713 115.880 -2.167 17927 1976 1 3 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.589 -0.277 17927 1977 1 3 . 1 1 59 59 TYR C C 59 175.025 175.025 174.624 0.401 17927 1978 1 3 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.878 2.095 17927 1979 1 3 . 1 1 59 59 TYR CB C 59 37.434 37.434 39.164 -1.730 17927 1980 1 3 . 1 1 59 59 TYR H H 59 8.102 8.102 7.675 0.427 17927 1981 1 3 . 1 1 60 60 ALA N N 60 126.637 126.637 122.369 4.268 17927 1982 1 3 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.375 0.043 17927 1983 1 3 . 1 1 60 60 ALA C C 60 179.208 179.208 178.423 0.785 17927 1984 1 3 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.555 0.979 17927 1985 1 3 . 1 1 60 60 ALA CB C 60 18.589 18.589 19.015 -0.426 17927 1986 1 3 . 1 1 60 60 ALA H H 60 7.201 7.201 7.493 -0.292 17927 1987 1 3 . 1 1 61 61 GLY N N 61 111.816 111.816 110.410 1.406 17927 1988 1 3 . 1 1 61 61 GLY C C 61 174.698 174.698 174.614 0.084 17927 1989 1 3 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.118 0.786 17927 1990 1 3 . 1 1 61 61 GLY H H 61 9.184 9.184 8.863 0.321 17927 1991 1 3 . 1 1 62 62 LYS N N 62 118.497 118.497 120.514 -2.017 17927 1992 1 3 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.611 0.268 17927 1993 1 3 . 1 1 62 62 LYS C C 62 179.019 179.019 176.341 2.678 17927 1994 1 3 . 1 1 62 62 LYS CA C 62 53.988 53.988 54.290 -0.302 17927 1995 1 3 . 1 1 62 62 LYS CB C 62 33.840 33.840 33.580 0.260 17927 1996 1 3 . 1 1 62 62 LYS H H 62 8.019 8.019 7.625 0.394 17927 1997 1 3 . 1 1 63 63 ASP N N 63 122.982 122.982 120.738 2.244 17927 1998 1 3 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.670 -0.143 17927 1999 1 3 . 1 1 63 63 ASP C C 63 174.065 174.065 174.839 -0.774 17927 2000 1 3 . 1 1 63 63 ASP CA C 63 55.055 55.055 54.522 0.533 17927 2001 1 3 . 1 1 63 63 ASP CB C 63 38.582 38.582 39.487 -0.905 17927 2002 1 3 . 1 1 63 63 ASP H H 63 8.709 8.709 8.660 0.049 17927 2003 1 3 . 1 1 64 64 ILE N N 64 122.219 122.219 113.118 9.101 17927 2004 1 3 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.546 0.061 17927 2005 1 3 . 1 1 64 64 ILE C C 64 174.627 174.627 174.074 0.553 17927 2006 1 3 . 1 1 64 64 ILE CA C 64 59.712 59.712 59.023 0.689 17927 2007 1 3 . 1 1 64 64 ILE CB C 64 42.133 42.133 40.913 1.220 17927 2008 1 3 . 1 1 64 64 ILE H H 64 8.678 8.678 7.325 1.353 17927 2009 1 3 . 1 1 65 65 HIS N N 65 125.584 125.584 123.174 2.410 17927 2010 1 3 . 1 1 65 65 HIS HA H 65 5.043 5.043 5.046 -0.003 17927 2011 1 3 . 1 1 65 65 HIS C C 65 174.153 174.153 173.892 0.261 17927 2012 1 3 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.557 0.402 17927 2013 1 3 . 1 1 65 65 HIS CB C 65 34.156 34.156 33.408 0.748 17927 2014 1 3 . 1 1 65 65 HIS H H 65 9.204 9.204 8.960 0.244 17927 2015 1 3 . 1 1 66 66 PHE N N 66 123.244 123.244 122.535 0.709 17927 2016 1 3 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.839 0.371 17927 2017 1 3 . 1 1 66 66 PHE C C 66 175.463 175.463 174.670 0.793 17927 2018 1 3 . 1 1 66 66 PHE CA C 66 58.088 58.088 57.988 0.100 17927 2019 1 3 . 1 1 66 66 PHE CB C 66 39.637 39.637 39.859 -0.222 17927 2020 1 3 . 1 1 66 66 PHE H H 66 9.262 9.262 9.224 0.038 17927 2021 1 3 . 1 1 67 67 VAL N N 67 126.201 126.201 125.345 0.856 17927 2022 1 3 . 1 1 67 67 VAL HA H 67 4.834 4.834 5.324 -0.490 17927 2023 1 3 . 1 1 67 67 VAL C C 67 174.364 174.364 175.506 -1.142 17927 2024 1 3 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.372 0.352 17927 2025 1 3 . 1 1 67 67 VAL CB C 67 34.893 34.893 33.780 1.113 17927 2026 1 3 . 1 1 67 67 VAL H H 67 8.843 8.843 9.341 -0.498 17927 2027 1 3 . 1 1 68 68 SER N N 68 124.528 124.528 123.994 0.534 17927 2028 1 3 . 1 1 68 68 SER HA H 68 5.585 5.585 5.350 0.235 17927 2029 1 3 . 1 1 68 68 SER C C 68 172.858 172.858 173.165 -0.307 17927 2030 1 3 . 1 1 68 68 SER CA C 68 57.282 57.282 57.509 -0.227 17927 2031 1 3 . 1 1 68 68 SER CB C 68 65.032 65.032 63.724 1.308 17927 2032 1 3 . 1 1 68 68 SER H H 68 9.243 9.243 8.846 0.397 17927 2033 1 3 . 1 1 69 69 LEU N N 69 126.695 126.695 125.955 0.740 17927 2034 1 3 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.456 -0.939 17927 2035 1 3 . 1 1 69 69 LEU C C 69 174.652 174.652 176.387 -1.735 17927 2036 1 3 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.705 -0.877 17927 2037 1 3 . 1 1 69 69 LEU CB C 69 43.895 43.895 45.709 -1.814 17927 2038 1 3 . 1 1 69 69 LEU H H 69 9.360 9.360 9.000 0.360 17927 2039 1 3 . 1 1 70 70 SER N N 70 116.379 116.379 116.427 -0.048 17927 2040 1 3 . 1 1 70 70 SER HA H 70 4.905 4.905 5.184 -0.279 17927 2041 1 3 . 1 1 70 70 SER C C 70 176.307 176.307 174.549 1.758 17927 2042 1 3 . 1 1 70 70 SER CA C 70 55.213 55.213 56.359 -1.146 17927 2043 1 3 . 1 1 70 70 SER CB C 70 63.519 63.519 65.041 -1.522 17927 2044 1 3 . 1 1 70 70 SER H H 70 7.981 7.981 8.493 -0.512 17927 2045 1 3 . 1 1 71 71 CYS N N 71 124.670 124.670 124.925 -0.255 17927 2046 1 3 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.818 0.140 17927 2047 1 3 . 1 1 71 71 CYS C C 71 173.996 173.996 174.388 -0.392 17927 2048 1 3 . 1 1 71 71 CYS CA C 71 55.483 55.483 56.723 -1.240 17927 2049 1 3 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.374 0.738 17927 2050 1 3 . 1 1 71 71 CYS H H 71 8.609 8.609 9.043 -0.434 17927 2051 1 3 . 1 1 72 72 ASP N N 72 122.398 122.398 123.883 -1.485 17927 2052 1 3 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.863 -0.571 17927 2053 1 3 . 1 1 72 72 ASP C C 72 176.653 176.653 176.640 0.013 17927 2054 1 3 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.255 1.527 17927 2055 1 3 . 1 1 72 72 ASP CB C 72 41.526 41.526 40.677 0.849 17927 2056 1 3 . 1 1 72 72 ASP H H 72 8.557 8.557 7.842 0.715 17927 2057 1 3 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.023 0.042 17927 2058 1 3 . 1 1 73 73 LYS C C 73 176.545 176.545 176.165 0.380 17927 2059 1 3 . 1 1 73 73 LYS CA C 73 58.458 58.458 59.010 -0.551 17927 2060 1 3 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.123 0.518 17927 2061 1 3 . 1 1 74 74 ASN N N 74 117.616 117.616 117.641 -0.025 17927 2062 1 3 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.790 0.115 17927 2063 1 3 . 1 1 74 74 ASN C C 74 174.894 174.894 175.502 -0.608 17927 2064 1 3 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.125 -0.604 17927 2065 1 3 . 1 1 74 74 ASN CB C 74 38.109 38.109 37.185 0.924 17927 2066 1 3 . 1 1 74 74 ASN H H 74 8.625 8.625 8.076 0.549 17927 2067 1 3 . 1 1 75 75 LYS N N 75 126.797 126.797 123.708 3.089 17927 2068 1 3 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.833 -0.410 17927 2069 1 3 . 1 1 75 75 LYS C C 75 178.058 178.058 177.880 0.178 17927 2070 1 3 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.335 -0.162 17927 2071 1 3 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.408 0.883 17927 2072 1 3 . 1 1 75 75 LYS H H 75 8.588 8.588 8.088 0.500 17927 2073 1 3 . 1 1 76 76 LYS N N 76 117.875 117.875 119.810 -1.935 17927 2074 1 3 . 1 1 76 76 LYS HA H 76 4.200 4.200 4.534 -0.334 17927 2075 1 3 . 1 1 76 76 LYS C C 76 178.791 178.791 179.035 -0.244 17927 2076 1 3 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.299 -0.691 17927 2077 1 3 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.675 -0.185 17927 2078 1 3 . 1 1 76 76 LYS H H 76 8.041 8.041 8.550 -0.509 17927 2079 1 3 . 1 1 77 77 ALA N N 77 121.567 121.567 121.928 -0.361 17927 2080 1 3 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.208 -0.085 17927 2081 1 3 . 1 1 77 77 ALA C C 77 181.191 181.191 179.783 1.408 17927 2082 1 3 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.858 0.098 17927 2083 1 3 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.100 -0.341 17927 2084 1 3 . 1 1 77 77 ALA H H 77 7.366 7.366 8.257 -0.891 17927 2085 1 3 . 1 1 78 78 TRP N N 78 119.497 119.497 120.659 -1.162 17927 2086 1 3 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.167 -0.090 17927 2087 1 3 . 1 1 78 78 TRP C C 78 175.942 175.942 177.481 -1.539 17927 2088 1 3 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.067 2.694 17927 2089 1 3 . 1 1 78 78 TRP CB C 78 27.272 27.272 30.239 -2.967 17927 2090 1 3 . 1 1 78 78 TRP H H 78 7.187 7.187 8.395 -1.208 17927 2091 1 3 . 1 1 79 79 GLU N N 79 118.771 118.771 119.257 -0.486 17927 2092 1 3 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.453 -0.439 17927 2093 1 3 . 1 1 79 79 GLU C C 79 179.863 179.863 178.078 1.785 17927 2094 1 3 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.728 -0.619 17927 2095 1 3 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.999 1.221 17927 2096 1 3 . 1 1 79 79 GLU H H 79 8.813 8.813 8.987 -0.174 17927 2097 1 3 . 1 1 80 80 ASN N N 80 115.964 115.964 117.668 -1.704 17927 2098 1 3 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.504 -0.165 17927 2099 1 3 . 1 1 80 80 ASN C C 80 176.749 176.749 177.518 -0.769 17927 2100 1 3 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.554 0.481 17927 2101 1 3 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.176 0.313 17927 2102 1 3 . 1 1 80 80 ASN H H 80 8.491 8.491 7.890 0.601 17927 2103 1 3 . 1 1 81 81 MET N N 81 119.670 119.670 121.255 -1.585 17927 2104 1 3 . 1 1 81 81 MET HA H 81 4.149 4.149 4.161 -0.012 17927 2105 1 3 . 1 1 81 81 MET C C 81 177.933 177.933 177.495 0.438 17927 2106 1 3 . 1 1 81 81 MET CA C 81 60.276 60.276 58.128 2.148 17927 2107 1 3 . 1 1 81 81 MET CB C 81 32.518 32.518 32.295 0.223 17927 2108 1 3 . 1 1 81 81 MET H H 81 7.667 7.667 7.586 0.081 17927 2109 1 3 . 1 1 82 82 VAL N N 82 117.634 117.634 118.288 -0.654 17927 2110 1 3 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.384 -0.081 17927 2111 1 3 . 1 1 82 82 VAL C C 82 179.005 179.005 177.253 1.752 17927 2112 1 3 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.321 0.716 17927 2113 1 3 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.225 0.540 17927 2114 1 3 . 1 1 82 82 VAL H H 82 8.338 8.338 8.099 0.239 17927 2115 1 3 . 1 1 83 83 THR N N 83 110.519 110.519 114.741 -4.222 17927 2116 1 3 . 1 1 83 83 THR HA H 83 3.983 3.983 3.901 0.082 17927 2117 1 3 . 1 1 83 83 THR C C 83 177.591 177.591 175.895 1.696 17927 2118 1 3 . 1 1 83 83 THR CA C 83 65.431 65.431 66.260 -0.829 17927 2119 1 3 . 1 1 83 83 THR CB C 83 69.156 69.156 68.644 0.512 17927 2120 1 3 . 1 1 83 83 THR H H 83 7.659 7.659 7.511 0.148 17927 2121 1 3 . 1 1 84 84 LYS N N 84 123.927 123.927 120.193 3.734 17927 2122 1 3 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.205 -0.136 17927 2123 1 3 . 1 1 84 84 LYS C C 84 178.582 178.582 177.902 0.680 17927 2124 1 3 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.150 1.727 17927 2125 1 3 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.658 -0.335 17927 2126 1 3 . 1 1 84 84 LYS H H 84 8.665 8.665 7.584 1.081 17927 2127 1 3 . 1 1 85 85 ASP N N 85 116.280 116.280 116.943 -0.663 17927 2128 1 3 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.582 0.168 17927 2129 1 3 . 1 1 85 85 ASP C C 85 175.086 175.086 175.736 -0.650 17927 2130 1 3 . 1 1 85 85 ASP CA C 85 54.693 54.693 55.194 -0.501 17927 2131 1 3 . 1 1 85 85 ASP CB C 85 39.685 39.685 41.504 -1.819 17927 2132 1 3 . 1 1 85 85 ASP H H 85 8.179 8.179 8.357 -0.178 17927 2133 1 3 . 1 1 86 86 GLN N N 86 116.258 116.258 115.325 0.933 17927 2134 1 3 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.860 0.048 17927 2135 1 3 . 1 1 86 86 GLN C C 86 175.659 175.659 174.780 0.879 17927 2136 1 3 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.243 -0.072 17927 2137 1 3 . 1 1 86 86 GLN CB C 86 26.290 26.290 25.805 0.485 17927 2138 1 3 . 1 1 86 86 GLN H H 86 7.431 7.431 8.101 -0.670 17927 2139 1 3 . 1 1 87 87 LEU N N 87 117.031 117.031 120.175 -3.144 17927 2140 1 3 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.346 -0.256 17927 2141 1 3 . 1 1 87 87 LEU C C 87 178.225 178.225 176.630 1.595 17927 2142 1 3 . 1 1 87 87 LEU CA C 87 55.932 55.932 54.833 1.099 17927 2143 1 3 . 1 1 87 87 LEU CB C 87 41.202 41.202 42.294 -1.092 17927 2144 1 3 . 1 1 87 87 LEU H H 87 7.736 7.736 7.473 0.263 17927 2145 1 3 . 1 1 88 88 LYS N N 88 122.367 122.367 122.863 -0.496 17927 2146 1 3 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.249 0.387 17927 2147 1 3 . 1 1 88 88 LYS C C 88 177.538 177.538 176.312 1.226 17927 2148 1 3 . 1 1 88 88 LYS CA C 88 54.930 54.930 55.088 -0.158 17927 2149 1 3 . 1 1 88 88 LYS CB C 88 33.316 33.316 33.607 -0.291 17927 2150 1 3 . 1 1 88 88 LYS H H 88 8.496 8.496 8.249 0.247 17927 2151 1 3 . 1 1 89 89 GLY N N 89 108.452 108.452 106.535 1.917 17927 2152 1 3 . 1 1 89 89 GLY C C 89 173.781 173.781 173.569 0.212 17927 2153 1 3 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.584 0.774 17927 2154 1 3 . 1 1 89 89 GLY H H 89 8.497 8.497 8.583 -0.086 17927 2155 1 3 . 1 1 90 90 ILE N N 90 123.295 123.295 122.584 0.711 17927 2156 1 3 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.041 0.330 17927 2157 1 3 . 1 1 90 90 ILE C C 90 175.606 175.606 174.891 0.715 17927 2158 1 3 . 1 1 90 90 ILE CA C 90 62.001 62.001 61.706 0.295 17927 2159 1 3 . 1 1 90 90 ILE CB C 90 38.036 38.036 37.479 0.557 17927 2160 1 3 . 1 1 90 90 ILE H H 90 8.728 8.728 8.267 0.461 17927 2161 1 3 . 1 1 91 91 GLN N N 91 128.632 128.632 126.140 2.492 17927 2162 1 3 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.843 -0.077 17927 2163 1 3 . 1 1 91 91 GLN C C 91 174.618 174.618 174.352 0.266 17927 2164 1 3 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.790 1.060 17927 2165 1 3 . 1 1 91 91 GLN CB C 91 28.341 28.341 30.691 -2.350 17927 2166 1 3 . 1 1 91 91 GLN H H 91 8.762 8.762 8.434 0.328 17927 2167 1 3 . 1 1 92 92 LEU N N 92 120.830 120.830 122.878 -2.048 17927 2168 1 3 . 1 1 92 92 LEU HA H 92 5.580 5.580 4.943 0.637 17927 2169 1 3 . 1 1 92 92 LEU C C 92 176.828 176.828 175.235 1.593 17927 2170 1 3 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.415 -0.614 17927 2171 1 3 . 1 1 92 92 LEU CB C 92 44.210 44.210 46.162 -1.952 17927 2172 1 3 . 1 1 92 92 LEU H H 92 9.011 9.011 9.269 -0.258 17927 2173 1 3 . 1 1 93 93 HIS N N 93 121.481 121.481 119.565 1.916 17927 2174 1 3 . 1 1 93 93 HIS HA H 93 3.931 3.931 4.972 -1.041 17927 2175 1 3 . 1 1 93 93 HIS C C 93 173.590 173.590 173.012 0.578 17927 2176 1 3 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.670 0.913 17927 2177 1 3 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.450 -1.200 17927 2178 1 3 . 1 1 93 93 HIS H H 93 8.038 8.038 8.288 -0.250 17927 2179 1 3 . 1 1 94 94 MET N N 94 121.881 121.881 124.845 -2.964 17927 2180 1 3 . 1 1 94 94 MET HA H 94 3.866 3.866 3.842 0.024 17927 2181 1 3 . 1 1 94 94 MET C C 94 177.035 177.035 176.481 0.554 17927 2182 1 3 . 1 1 94 94 MET CA C 94 55.189 55.189 57.177 -1.988 17927 2183 1 3 . 1 1 94 94 MET CB C 94 33.993 33.993 34.008 -0.015 17927 2184 1 3 . 1 1 94 94 MET H H 94 8.039 8.039 8.531 -0.492 17927 2185 1 3 . 1 1 95 95 GLY N N 95 104.041 104.041 105.957 -1.916 17927 2186 1 3 . 1 1 95 95 GLY C C 95 174.251 174.251 175.034 -0.783 17927 2187 1 3 . 1 1 95 95 GLY CA C 95 46.580 46.580 46.664 -0.084 17927 2188 1 3 . 1 1 95 95 GLY H H 95 5.666 5.666 7.968 -2.302 17927 2189 1 3 . 1 1 96 96 THR N N 96 114.114 114.114 114.616 -0.502 17927 2190 1 3 . 1 1 96 96 THR HA H 96 4.211 4.211 4.216 -0.005 17927 2191 1 3 . 1 1 96 96 THR C C 96 175.122 175.122 174.324 0.798 17927 2192 1 3 . 1 1 96 96 THR CA C 96 61.339 61.339 63.369 -2.030 17927 2193 1 3 . 1 1 96 96 THR CB C 96 68.615 68.615 69.314 -0.700 17927 2194 1 3 . 1 1 96 96 THR H H 96 8.517 8.517 7.819 0.698 17927 2195 1 3 . 1 1 97 97 ASP N N 97 121.892 121.892 120.198 1.694 17927 2196 1 3 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.632 -0.047 17927 2197 1 3 . 1 1 97 97 ASP C C 97 178.241 178.241 175.400 2.841 17927 2198 1 3 . 1 1 97 97 ASP CA C 97 55.800 55.800 53.921 1.879 17927 2199 1 3 . 1 1 97 97 ASP CB C 97 43.129 43.129 43.004 0.125 17927 2200 1 3 . 1 1 97 97 ASP H H 97 7.563 7.563 7.855 -0.292 17927 2201 1 3 . 1 1 98 98 ARG N N 98 127.508 127.508 120.847 6.661 17927 2202 1 3 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.553 -0.161 17927 2203 1 3 . 1 1 98 98 ARG C C 98 176.724 176.724 176.375 0.349 17927 2204 1 3 . 1 1 98 98 ARG CA C 98 55.939 55.939 55.962 -0.024 17927 2205 1 3 . 1 1 98 98 ARG CB C 98 30.291 30.291 30.237 0.054 17927 2206 1 3 . 1 1 98 98 ARG H H 98 9.225 9.225 8.425 0.800 17927 2207 1 3 . 1 1 99 99 THR N N 99 116.384 116.384 118.925 -2.541 17927 2208 1 3 . 1 1 99 99 THR HA H 99 3.987 3.987 4.152 -0.165 17927 2209 1 3 . 1 1 99 99 THR C C 99 176.969 176.969 175.068 1.901 17927 2210 1 3 . 1 1 99 99 THR CA C 99 67.714 67.714 67.279 0.435 17927 2211 1 3 . 1 1 99 99 THR CB C 99 68.777 68.777 69.131 -0.354 17927 2212 1 3 . 1 1 99 99 THR H H 99 8.382 8.382 8.673 -0.291 17927 2213 1 3 . 1 1 100 100 PHE N N 100 123.232 123.232 122.874 0.358 17927 2214 1 3 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.214 -0.041 17927 2215 1 3 . 1 1 100 100 PHE C C 100 177.010 177.010 176.434 0.576 17927 2216 1 3 . 1 1 100 100 PHE CA C 100 61.923 61.923 60.953 0.970 17927 2217 1 3 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.370 1.392 17927 2218 1 3 . 1 1 100 100 PHE H H 100 7.998 7.998 9.179 -1.181 17927 2219 1 3 . 1 1 101 101 MET N N 101 115.968 115.968 118.940 -2.972 17927 2220 1 3 . 1 1 101 101 MET HA H 101 3.975 3.975 3.924 0.051 17927 2221 1 3 . 1 1 101 101 MET C C 101 178.763 178.763 177.425 1.338 17927 2222 1 3 . 1 1 101 101 MET CA C 101 58.552 58.552 57.961 0.591 17927 2223 1 3 . 1 1 101 101 MET CB C 101 32.593 32.593 31.646 0.947 17927 2224 1 3 . 1 1 101 101 MET H H 101 7.828 7.828 7.945 -0.117 17927 2225 1 3 . 1 1 102 102 ASP N N 102 117.553 117.553 119.747 -2.194 17927 2226 1 3 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.374 0.148 17927 2227 1 3 . 1 1 102 102 ASP C C 102 179.503 179.503 178.682 0.821 17927 2228 1 3 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.666 -0.776 17927 2229 1 3 . 1 1 102 102 ASP CB C 102 39.926 39.926 41.082 -1.156 17927 2230 1 3 . 1 1 102 102 ASP H H 102 8.828 8.828 7.938 0.890 17927 2231 1 3 . 1 1 103 103 ALA N N 103 122.984 122.984 122.837 0.147 17927 2232 1 3 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.133 -0.147 17927 2233 1 3 . 1 1 103 103 ALA C C 103 178.782 178.782 178.696 0.086 17927 2234 1 3 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.609 0.485 17927 2235 1 3 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.385 0.178 17927 2236 1 3 . 1 1 103 103 ALA H H 103 7.567 7.567 7.795 -0.228 17927 2237 1 3 . 1 1 104 104 TYR N N 104 112.159 112.159 114.614 -2.455 17927 2238 1 3 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.641 -0.417 17927 2239 1 3 . 1 1 104 104 TYR C C 104 173.821 173.821 174.811 -0.990 17927 2240 1 3 . 1 1 104 104 TYR CA C 104 58.498 58.498 55.778 2.720 17927 2241 1 3 . 1 1 104 104 TYR CB C 104 38.393 38.393 38.081 0.312 17927 2242 1 3 . 1 1 104 104 TYR H H 104 7.203 7.203 7.165 0.038 17927 2243 1 3 . 1 1 105 105 LEU N N 105 119.433 119.433 116.818 2.615 17927 2244 1 3 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.982 0.003 17927 2245 1 3 . 1 1 105 105 LEU C C 105 176.721 176.721 176.706 0.015 17927 2246 1 3 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.487 0.298 17927 2247 1 3 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.506 -1.063 17927 2248 1 3 . 1 1 105 105 LEU H H 105 7.582 7.582 7.945 -0.363 17927 2249 1 3 . 1 1 106 106 ILE N N 106 119.575 119.575 114.425 5.150 17927 2250 1 3 . 1 1 106 106 ILE HA H 106 4.002 4.002 4.106 -0.104 17927 2251 1 3 . 1 1 106 106 ILE C C 106 175.459 175.459 174.504 0.955 17927 2252 1 3 . 1 1 106 106 ILE CA C 106 62.043 62.043 60.804 1.239 17927 2253 1 3 . 1 1 106 106 ILE CB C 106 36.335 36.335 35.767 0.568 17927 2254 1 3 . 1 1 106 106 ILE H H 106 8.774 8.774 7.764 1.010 17927 2255 1 3 . 1 1 107 107 ASN N N 107 126.514 126.514 122.727 3.787 17927 2256 1 3 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.666 0.197 17927 2257 1 3 . 1 1 107 107 ASN C C 107 174.584 174.584 176.212 -1.628 17927 2258 1 3 . 1 1 107 107 ASN CA C 107 53.112 53.112 54.732 -1.620 17927 2259 1 3 . 1 1 107 107 ASN CB C 107 38.977 38.977 39.559 -0.582 17927 2260 1 3 . 1 1 107 107 ASN H H 107 8.364 8.364 8.023 0.341 17927 2261 1 3 . 1 1 108 108 GLY N N 108 108.469 108.469 109.562 -1.093 17927 2262 1 3 . 1 1 108 108 GLY C C 108 171.245 171.245 173.709 -2.464 17927 2263 1 3 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.460 0.809 17927 2264 1 3 . 1 1 108 108 GLY H H 108 7.678 7.678 8.285 -0.607 17927 2265 1 3 . 1 1 109 109 ILE N N 109 112.817 112.817 120.405 -7.588 17927 2266 1 3 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.562 -0.156 17927 2267 1 3 . 1 1 109 109 ILE C C 109 173.498 173.498 174.471 -0.973 17927 2268 1 3 . 1 1 109 109 ILE CA C 109 58.384 58.384 57.727 0.657 17927 2269 1 3 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.350 1.972 17927 2270 1 3 . 1 1 109 109 ILE H H 109 7.868 7.868 7.479 0.389 17927 2271 1 3 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.464 0.278 17927 2272 1 3 . 1 1 110 110 PRO C C 110 175.715 175.715 175.523 0.192 17927 2273 1 3 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.578 -0.301 17927 2274 1 3 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.431 3.938 17927 2275 1 3 . 1 1 111 111 ARG N N 111 122.358 122.358 120.375 1.983 17927 2276 1 3 . 1 1 111 111 ARG HA H 111 4.469 4.469 4.081 0.388 17927 2277 1 3 . 1 1 111 111 ARG C C 111 171.541 171.541 174.795 -3.254 17927 2278 1 3 . 1 1 111 111 ARG CA C 111 54.356 54.356 54.059 0.296 17927 2279 1 3 . 1 1 111 111 ARG CB C 111 33.430 33.430 33.669 -0.239 17927 2280 1 3 . 1 1 111 111 ARG H H 111 7.732 7.732 8.377 -0.645 17927 2281 1 3 . 1 1 112 112 PHE N N 112 125.103 125.103 120.851 4.252 17927 2282 1 3 . 1 1 112 112 PHE HA H 112 5.773 5.773 5.066 0.707 17927 2283 1 3 . 1 1 112 112 PHE C C 112 175.097 175.097 174.795 0.302 17927 2284 1 3 . 1 1 112 112 PHE CA C 112 55.791 55.791 55.876 -0.085 17927 2285 1 3 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.258 1.669 17927 2286 1 3 . 1 1 112 112 PHE H H 112 8.929 8.929 7.576 1.353 17927 2287 1 3 . 1 1 113 113 ILE N N 113 123.778 123.778 122.951 0.827 17927 2288 1 3 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.992 -0.449 17927 2289 1 3 . 1 1 113 113 ILE C C 113 173.197 173.197 174.197 -1.000 17927 2290 1 3 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.799 0.487 17927 2291 1 3 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.505 1.741 17927 2292 1 3 . 1 1 113 113 ILE H H 113 8.873 8.873 8.849 0.024 17927 2293 1 3 . 1 1 114 114 LEU N N 114 127.146 127.146 126.341 0.805 17927 2294 1 3 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.440 0.574 17927 2295 1 3 . 1 1 114 114 LEU C C 114 175.080 175.080 174.655 0.425 17927 2296 1 3 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.301 0.100 17927 2297 1 3 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.465 0.905 17927 2298 1 3 . 1 1 114 114 LEU H H 114 8.974 8.974 8.800 0.174 17927 2299 1 3 . 1 1 115 115 LEU N N 115 128.323 128.323 124.218 4.105 17927 2300 1 3 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.069 0.363 17927 2301 1 3 . 1 1 115 115 LEU C C 115 176.660 176.660 175.551 1.109 17927 2302 1 3 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.911 -0.834 17927 2303 1 3 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.387 -1.803 17927 2304 1 3 . 1 1 115 115 LEU H H 115 9.874 9.874 9.278 0.596 17927 2305 1 3 . 1 1 116 116 ASP N N 116 119.834 119.834 121.717 -1.883 17927 2306 1 3 . 1 1 116 116 ASP HA H 116 4.935 4.935 4.828 0.107 17927 2307 1 3 . 1 1 116 116 ASP C C 116 176.898 176.898 177.631 -0.733 17927 2308 1 3 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.154 -0.849 17927 2309 1 3 . 1 1 116 116 ASP CB C 116 41.028 41.028 43.098 -2.070 17927 2310 1 3 . 1 1 116 116 ASP H H 116 9.357 9.357 9.005 0.352 17927 2311 1 3 . 1 1 117 117 ARG N N 117 113.356 113.356 121.221 -7.865 17927 2312 1 3 . 1 1 117 117 ARG HA H 117 3.717 3.717 3.933 -0.216 17927 2313 1 3 . 1 1 117 117 ARG C C 117 177.105 177.105 177.721 -0.616 17927 2314 1 3 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.369 -1.184 17927 2315 1 3 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.784 0.653 17927 2316 1 3 . 1 1 117 117 ARG H H 117 7.697 7.697 8.060 -0.363 17927 2317 1 3 . 1 1 118 118 ASP N N 118 117.226 117.226 116.829 0.397 17927 2318 1 3 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.451 0.444 17927 2319 1 3 . 1 1 118 118 ASP C C 118 176.657 176.657 176.974 -0.317 17927 2320 1 3 . 1 1 118 118 ASP CA C 118 53.517 53.517 55.224 -1.707 17927 2321 1 3 . 1 1 118 118 ASP CB C 118 42.556 42.556 41.067 1.489 17927 2322 1 3 . 1 1 118 118 ASP H H 118 8.456 8.456 7.810 0.646 17927 2323 1 3 . 1 1 119 119 GLY N N 119 109.074 109.074 107.042 2.032 17927 2324 1 3 . 1 1 119 119 GLY C C 119 173.355 173.355 173.532 -0.177 17927 2325 1 3 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.133 1.123 17927 2326 1 3 . 1 1 119 119 GLY H H 119 8.183 8.183 8.289 -0.106 17927 2327 1 3 . 1 1 120 120 LYS N N 120 120.744 120.744 119.858 0.886 17927 2328 1 3 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.933 -0.400 17927 2329 1 3 . 1 1 120 120 LYS C C 120 177.229 177.229 176.327 0.902 17927 2330 1 3 . 1 1 120 120 LYS CA C 120 55.287 55.287 53.201 2.086 17927 2331 1 3 . 1 1 120 120 LYS CB C 120 32.581 32.581 33.654 -1.073 17927 2332 1 3 . 1 1 120 120 LYS H H 120 8.449 8.449 7.451 0.998 17927 2333 1 3 . 1 1 121 121 ILE N N 121 121.221 121.221 127.455 -6.234 17927 2334 1 3 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.894 -0.008 17927 2335 1 3 . 1 1 121 121 ILE C C 121 177.819 177.819 176.804 1.015 17927 2336 1 3 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.323 0.592 17927 2337 1 3 . 1 1 121 121 ILE CB C 121 39.390 39.390 36.806 2.584 17927 2338 1 3 . 1 1 121 121 ILE H H 121 8.715 8.715 8.995 -0.280 17927 2339 1 3 . 1 1 122 122 ILE N N 122 127.165 127.165 127.972 -0.807 17927 2340 1 3 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.076 0.265 17927 2341 1 3 . 1 1 122 122 ILE C C 122 176.978 176.978 176.590 0.388 17927 2342 1 3 . 1 1 122 122 ILE CA C 122 63.719 63.719 63.174 0.545 17927 2343 1 3 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.660 -0.008 17927 2344 1 3 . 1 1 122 122 ILE H H 122 8.974 8.974 8.573 0.401 17927 2345 1 3 . 1 1 123 123 SER N N 123 111.227 111.227 115.584 -4.357 17927 2346 1 3 . 1 1 123 123 SER HA H 123 4.738 4.738 4.715 0.023 17927 2347 1 3 . 1 1 123 123 SER C C 123 174.184 174.184 173.702 0.482 17927 2348 1 3 . 1 1 123 123 SER CA C 123 57.383 57.383 56.803 0.579 17927 2349 1 3 . 1 1 123 123 SER CB C 123 65.326 65.326 64.778 0.548 17927 2350 1 3 . 1 1 123 123 SER H H 123 7.850 7.850 7.956 -0.106 17927 2351 1 3 . 1 1 124 124 ALA N N 124 131.373 131.373 127.156 4.217 17927 2352 1 3 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.004 0.481 17927 2353 1 3 . 1 1 124 124 ALA C C 124 175.147 175.147 176.075 -0.928 17927 2354 1 3 . 1 1 124 124 ALA CA C 124 53.035 53.035 54.004 -0.969 17927 2355 1 3 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.150 -0.488 17927 2356 1 3 . 1 1 124 124 ALA H H 124 9.384 9.384 8.803 0.581 17927 2357 1 3 . 1 1 125 125 ASN N N 125 119.476 119.476 114.117 5.359 17927 2358 1 3 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.229 -0.173 17927 2359 1 3 . 1 1 125 125 ASN C C 125 173.593 173.593 174.326 -0.733 17927 2360 1 3 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.720 -0.368 17927 2361 1 3 . 1 1 125 125 ASN CB C 125 38.304 38.304 39.896 -1.592 17927 2362 1 3 . 1 1 125 125 ASN H H 125 8.191 8.191 7.753 0.438 17927 2363 1 3 . 1 1 126 126 MET N N 126 122.705 122.705 125.526 -2.821 17927 2364 1 3 . 1 1 126 126 MET HA H 126 4.585 4.585 4.783 -0.198 17927 2365 1 3 . 1 1 126 126 MET C C 126 175.215 175.215 174.590 0.625 17927 2366 1 3 . 1 1 126 126 MET CA C 126 53.849 53.849 54.763 -0.914 17927 2367 1 3 . 1 1 126 126 MET CB C 126 31.312 31.312 34.920 -3.608 17927 2368 1 3 . 1 1 126 126 MET H H 126 8.376 8.376 9.389 -1.013 17927 2369 1 3 . 1 1 127 127 THR N N 127 111.016 111.016 111.745 -0.729 17927 2370 1 3 . 1 1 127 127 THR HA H 127 4.291 4.291 3.784 0.507 17927 2371 1 3 . 1 1 127 127 THR C C 127 174.574 174.574 172.807 1.767 17927 2372 1 3 . 1 1 127 127 THR CA C 127 62.085 62.085 60.568 1.517 17927 2373 1 3 . 1 1 127 127 THR CB C 127 69.733 69.733 71.046 -1.313 17927 2374 1 3 . 1 1 127 127 THR H H 127 7.714 7.714 7.979 -0.265 17927 2375 1 3 . 1 1 128 128 ARG N N 128 118.722 118.722 124.492 -5.770 17927 2376 1 3 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.953 -1.645 17927 2377 1 3 . 1 1 128 128 ARG C C 128 176.978 176.978 175.718 1.260 17927 2378 1 3 . 1 1 128 128 ARG CA C 128 54.727 54.727 53.163 1.564 17927 2379 1 3 . 1 1 128 128 ARG CB C 128 29.598 29.598 31.513 -1.915 17927 2380 1 3 . 1 1 128 128 ARG H H 128 8.658 8.658 8.017 0.641 17927 2381 1 3 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.098 -0.165 17927 2382 1 3 . 1 1 129 129 PRO C C 129 175.794 175.794 177.494 -1.700 17927 2383 1 3 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.837 0.712 17927 2384 1 3 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.781 -0.104 17927 2385 1 3 . 1 1 130 130 SER N N 130 108.696 108.696 112.463 -3.767 17927 2386 1 3 . 1 1 130 130 SER HA H 130 3.988 3.988 4.199 -0.211 17927 2387 1 3 . 1 1 130 130 SER C C 130 174.445 174.445 174.912 -0.467 17927 2388 1 3 . 1 1 130 130 SER CA C 130 58.911 58.911 60.602 -1.692 17927 2389 1 3 . 1 1 130 130 SER CB C 130 62.680 62.680 63.307 -0.627 17927 2390 1 3 . 1 1 130 130 SER H H 130 8.375 8.375 8.357 0.018 17927 2391 1 3 . 1 1 131 131 ASP N N 131 126.377 126.377 120.438 5.939 17927 2392 1 3 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.899 -0.027 17927 2393 1 3 . 1 1 131 131 ASP C C 131 176.879 176.879 175.422 1.457 17927 2394 1 3 . 1 1 131 131 ASP CA C 131 51.195 51.195 50.938 0.257 17927 2395 1 3 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.165 0.651 17927 2396 1 3 . 1 1 131 131 ASP H H 131 7.514 7.514 8.026 -0.512 17927 2397 1 3 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.324 0.068 17927 2398 1 3 . 1 1 132 132 PRO C C 132 178.097 178.097 177.774 0.323 17927 2399 1 3 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.317 0.762 17927 2400 1 3 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.233 0.175 17927 2401 1 3 . 1 1 133 133 LYS N N 133 116.306 116.306 118.445 -2.139 17927 2402 1 3 . 1 1 133 133 LYS HA H 133 3.958 3.958 4.118 -0.160 17927 2403 1 3 . 1 1 133 133 LYS C C 133 179.532 179.532 178.942 0.590 17927 2404 1 3 . 1 1 133 133 LYS CA C 133 58.521 58.521 58.758 -0.237 17927 2405 1 3 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.487 0.704 17927 2406 1 3 . 1 1 133 133 LYS H H 133 8.842 8.842 7.763 1.079 17927 2407 1 3 . 1 1 134 134 THR N N 134 120.833 120.833 116.012 4.821 17927 2408 1 3 . 1 1 134 134 THR HA H 134 3.147 3.147 3.602 -0.455 17927 2409 1 3 . 1 1 134 134 THR C C 134 173.356 173.356 175.250 -1.894 17927 2410 1 3 . 1 1 134 134 THR CA C 134 66.383 66.383 66.232 0.151 17927 2411 1 3 . 1 1 134 134 THR CB C 134 66.847 66.847 68.018 -1.171 17927 2412 1 3 . 1 1 134 134 THR H H 134 8.292 8.292 8.264 0.028 17927 2413 1 3 . 1 1 135 135 ALA N N 135 121.720 121.720 123.444 -1.724 17927 2414 1 3 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.334 0.249 17927 2415 1 3 . 1 1 135 135 ALA C C 135 178.902 178.902 179.271 -0.369 17927 2416 1 3 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.781 0.218 17927 2417 1 3 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.174 -0.399 17927 2418 1 3 . 1 1 135 135 ALA H H 135 7.030 7.030 7.624 -0.594 17927 2419 1 3 . 1 1 136 136 GLU N N 136 114.623 114.623 118.582 -3.959 17927 2420 1 3 . 1 1 136 136 GLU HA H 136 3.922 3.922 3.918 0.004 17927 2421 1 3 . 1 1 136 136 GLU C C 136 179.199 179.199 179.065 0.134 17927 2422 1 3 . 1 1 136 136 GLU CA C 136 59.837 59.837 58.999 0.838 17927 2423 1 3 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.487 0.299 17927 2424 1 3 . 1 1 136 136 GLU H H 136 7.216 7.216 8.286 -1.070 17927 2425 1 3 . 1 1 137 137 LYS N N 137 120.789 120.789 119.696 1.093 17927 2426 1 3 . 1 1 137 137 LYS HA H 137 4.204 4.204 4.016 0.188 17927 2427 1 3 . 1 1 137 137 LYS C C 137 178.834 178.834 178.778 0.056 17927 2428 1 3 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.627 -1.284 17927 2429 1 3 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.705 -1.242 17927 2430 1 3 . 1 1 137 137 LYS H H 137 7.681 7.681 7.891 -0.210 17927 2431 1 3 . 1 1 138 138 PHE N N 138 118.373 118.373 117.894 0.479 17927 2432 1 3 . 1 1 138 138 PHE HA H 138 4.033 4.033 3.995 0.038 17927 2433 1 3 . 1 1 138 138 PHE C C 138 178.027 178.027 178.023 0.004 17927 2434 1 3 . 1 1 138 138 PHE CA C 138 57.507 57.507 59.867 -2.360 17927 2435 1 3 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.194 -1.305 17927 2436 1 3 . 1 1 138 138 PHE H H 138 8.059 8.059 7.708 0.351 17927 2437 1 3 . 1 1 139 139 ASN N N 139 117.611 117.611 117.472 0.139 17927 2438 1 3 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.475 -0.071 17927 2439 1 3 . 1 1 139 139 ASN C C 139 178.190 178.190 177.790 0.400 17927 2440 1 3 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.263 -0.039 17927 2441 1 3 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.645 -0.911 17927 2442 1 3 . 1 1 139 139 ASN H H 139 8.683 8.683 8.014 0.669 17927 2443 1 3 . 1 1 140 140 GLU N N 140 121.432 121.432 121.195 0.237 17927 2444 1 3 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.045 -0.040 17927 2445 1 3 . 1 1 140 140 GLU C C 140 179.751 179.751 179.767 -0.016 17927 2446 1 3 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.510 -0.200 17927 2447 1 3 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.689 0.366 17927 2448 1 3 . 1 1 140 140 GLU H H 140 7.868 7.868 7.749 0.119 17927 2449 1 3 . 1 1 141 141 LEU N N 141 119.968 119.968 119.127 0.841 17927 2450 1 3 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.040 -0.024 17927 2451 1 3 . 1 1 141 141 LEU C C 141 179.293 179.293 178.967 0.326 17927 2452 1 3 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.164 0.272 17927 2453 1 3 . 1 1 141 141 LEU CB C 141 41.183 41.183 42.062 -0.879 17927 2454 1 3 . 1 1 141 141 LEU H H 141 8.303 8.303 8.309 -0.006 17927 2455 1 3 . 1 1 142 142 LEU N N 142 115.040 115.040 114.009 1.031 17927 2456 1 3 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.302 0.082 17927 2457 1 3 . 1 1 142 142 LEU C C 142 178.002 178.002 177.349 0.653 17927 2458 1 3 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.278 0.001 17927 2459 1 3 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.470 0.176 17927 2460 1 3 . 1 1 142 142 LEU H H 142 8.230 8.230 8.341 -0.111 17927 2461 1 3 . 1 1 143 143 GLY N N 143 108.977 108.977 106.124 2.853 17927 2462 1 3 . 1 1 143 143 GLY C C 143 175.216 175.216 175.145 0.071 17927 2463 1 3 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.965 0.776 17927 2464 1 3 . 1 1 143 143 GLY H H 143 7.762 7.762 7.851 -0.089 17927 2465 1 3 . 1 1 144 144 LEU N N 144 119.660 119.660 119.804 -0.144 17927 2466 1 3 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.260 0.228 17927 2467 1 3 . 1 1 144 144 LEU C C 144 177.375 177.375 176.599 0.776 17927 2468 1 3 . 1 1 144 144 LEU CA C 144 54.525 54.525 57.068 -2.543 17927 2469 1 3 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.921 -0.148 17927 2470 1 3 . 1 1 144 144 LEU H H 144 8.241 8.241 8.671 -0.430 17927 2471 1 3 . 1 1 145 145 GLU N N 145 119.959 119.959 117.025 2.934 17927 2472 1 3 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.353 -0.112 17927 2473 1 3 . 1 1 145 145 GLU C C 145 177.075 177.075 175.831 1.244 17927 2474 1 3 . 1 1 145 145 GLU CA C 145 56.799 56.799 55.237 1.562 17927 2475 1 3 . 1 1 145 145 GLU CB C 145 30.168 30.168 31.786 -1.618 17927 2476 1 3 . 1 1 145 145 GLU H H 145 8.410 8.410 7.471 0.939 17927 2477 1 3 . 1 1 146 146 GLY N N 146 109.412 109.412 107.617 1.795 17927 2478 1 3 . 1 1 146 146 GLY C C 146 174.276 174.276 175.069 -0.793 17927 2479 1 3 . 1 1 146 146 GLY CA C 146 45.445 45.445 45.936 -0.491 17927 2480 1 3 . 1 1 146 146 GLY H H 146 8.422 8.422 8.485 -0.063 17927 2481 1 3 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.987 -0.331 17927 2482 1 3 . 1 1 151 151 HIS C C 151 173.990 173.990 174.155 -0.165 17927 2483 1 3 . 1 1 151 151 HIS CA C 151 56.044 56.044 55.802 0.242 17927 2484 1 3 . 1 1 151 151 HIS CB C 151 30.076 30.076 31.109 -1.033 17927 2485 1 4 . 1 1 2 2 SER HA H 2 4.121 4.121 4.642 -0.521 17927 2486 1 4 . 1 1 2 2 SER CA C 2 57.293 57.293 57.934 -0.641 17927 2487 1 4 . 1 1 2 2 SER CB C 2 63.545 63.545 63.701 -0.156 17927 2488 1 4 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.051 0.382 17927 2489 1 4 . 1 1 3 3 LEU C C 3 177.383 177.383 177.911 -0.528 17927 2490 1 4 . 1 1 3 3 LEU CA C 3 55.575 55.575 57.483 -1.908 17927 2491 1 4 . 1 1 3 3 LEU CB C 3 42.584 42.584 41.329 1.255 17927 2492 1 4 . 1 1 4 4 ARG N N 4 122.080 122.080 114.923 7.157 17927 2493 1 4 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.486 -0.102 17927 2494 1 4 . 1 1 4 4 ARG C C 4 176.410 176.410 175.335 1.075 17927 2495 1 4 . 1 1 4 4 ARG CA C 4 56.269 56.269 55.316 0.952 17927 2496 1 4 . 1 1 4 4 ARG CB C 4 30.842 30.842 31.923 -1.081 17927 2497 1 4 . 1 1 4 4 ARG H H 4 8.410 8.410 8.316 0.094 17927 2498 1 4 . 1 1 5 5 SER N N 5 117.023 117.023 115.175 1.848 17927 2499 1 4 . 1 1 5 5 SER HA H 5 4.423 4.423 4.764 -0.341 17927 2500 1 4 . 1 1 5 5 SER C C 5 175.039 175.039 174.233 0.806 17927 2501 1 4 . 1 1 5 5 SER CA C 5 58.605 58.605 57.694 0.911 17927 2502 1 4 . 1 1 5 5 SER CB C 5 64.044 64.044 64.728 -0.684 17927 2503 1 4 . 1 1 5 5 SER H H 5 8.292 8.292 7.939 0.353 17927 2504 1 4 . 1 1 6 6 GLY N N 6 110.718 110.718 114.138 -3.420 17927 2505 1 4 . 1 1 6 6 GLY C C 6 173.654 173.654 173.518 0.136 17927 2506 1 4 . 1 1 6 6 GLY CA C 6 45.273 45.273 44.889 0.384 17927 2507 1 4 . 1 1 6 6 GLY H H 6 8.446 8.446 8.608 -0.162 17927 2508 1 4 . 1 1 7 7 ASN N N 7 119.287 119.287 120.719 -1.432 17927 2509 1 4 . 1 1 7 7 ASN HA H 7 5.024 5.024 5.279 -0.255 17927 2510 1 4 . 1 1 7 7 ASN C C 7 173.672 173.672 173.481 0.191 17927 2511 1 4 . 1 1 7 7 ASN CA C 7 51.357 51.357 51.115 0.242 17927 2512 1 4 . 1 1 7 7 ASN CB C 7 38.927 38.927 39.984 -1.057 17927 2513 1 4 . 1 1 7 7 ASN H H 7 8.273 8.273 8.308 -0.035 17927 2514 1 4 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.536 -0.089 17927 2515 1 4 . 1 1 8 8 PRO C C 8 176.899 176.899 176.938 -0.039 17927 2516 1 4 . 1 1 8 8 PRO CA C 8 63.429 63.429 64.084 -0.655 17927 2517 1 4 . 1 1 8 8 PRO CB C 8 32.216 32.216 32.197 0.019 17927 2518 1 4 . 1 1 9 9 SER N N 9 115.642 115.642 113.267 2.375 17927 2519 1 4 . 1 1 9 9 SER HA H 9 4.415 4.415 4.641 -0.226 17927 2520 1 4 . 1 1 9 9 SER C C 9 174.714 174.714 175.322 -0.608 17927 2521 1 4 . 1 1 9 9 SER CA C 9 58.488 58.488 56.981 1.507 17927 2522 1 4 . 1 1 9 9 SER CB C 9 64.048 64.048 64.271 -0.223 17927 2523 1 4 . 1 1 9 9 SER H H 9 8.336 8.336 8.023 0.313 17927 2524 1 4 . 1 1 10 10 ALA N N 10 126.808 126.808 124.527 2.281 17927 2525 1 4 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.666 -0.404 17927 2526 1 4 . 1 1 10 10 ALA C C 10 177.233 177.233 178.225 -0.992 17927 2527 1 4 . 1 1 10 10 ALA CA C 10 53.230 53.230 54.332 -1.102 17927 2528 1 4 . 1 1 10 10 ALA CB C 10 19.187 19.187 17.597 1.590 17927 2529 1 4 . 1 1 10 10 ALA H H 10 8.137 8.137 9.128 -0.991 17927 2530 1 4 . 1 1 11 11 ALA N N 11 120.449 120.449 120.993 -0.544 17927 2531 1 4 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.244 0.017 17927 2532 1 4 . 1 1 11 11 ALA C C 11 177.469 177.469 177.360 0.109 17927 2533 1 4 . 1 1 11 11 ALA CA C 11 52.475 52.475 54.153 -1.678 17927 2534 1 4 . 1 1 11 11 ALA CB C 11 19.485 19.485 19.333 0.152 17927 2535 1 4 . 1 1 11 11 ALA H H 11 7.851 7.851 8.025 -0.174 17927 2536 1 4 . 1 1 12 12 SER N N 12 114.186 114.186 112.762 1.424 17927 2537 1 4 . 1 1 12 12 SER HA H 12 4.312 4.312 4.561 -0.249 17927 2538 1 4 . 1 1 12 12 SER C C 12 173.593 173.593 173.193 0.400 17927 2539 1 4 . 1 1 12 12 SER CA C 12 58.099 58.099 57.832 0.267 17927 2540 1 4 . 1 1 12 12 SER CB C 12 63.320 63.320 63.151 0.169 17927 2541 1 4 . 1 1 12 12 SER H H 12 7.990 7.990 8.081 -0.091 17927 2542 1 4 . 1 1 13 13 PHE N N 13 118.092 118.092 121.790 -3.698 17927 2543 1 4 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.686 0.094 17927 2544 1 4 . 1 1 13 13 PHE C C 13 174.220 174.220 173.292 0.928 17927 2545 1 4 . 1 1 13 13 PHE CA C 13 56.717 56.717 55.508 1.209 17927 2546 1 4 . 1 1 13 13 PHE CB C 13 41.151 41.151 40.759 0.392 17927 2547 1 4 . 1 1 13 13 PHE H H 13 7.147 7.147 7.435 -0.288 17927 2548 1 4 . 1 1 14 14 SER N N 14 116.456 116.456 114.417 2.039 17927 2549 1 4 . 1 1 14 14 SER HA H 14 5.162 5.162 4.927 0.235 17927 2550 1 4 . 1 1 14 14 SER C C 14 172.626 172.626 172.810 -0.184 17927 2551 1 4 . 1 1 14 14 SER CA C 14 57.390 57.390 57.803 -0.413 17927 2552 1 4 . 1 1 14 14 SER CB C 14 64.518 64.518 65.427 -0.909 17927 2553 1 4 . 1 1 14 14 SER H H 14 7.616 7.616 7.878 -0.262 17927 2554 1 4 . 1 1 15 15 TYR N N 15 122.384 122.384 124.465 -2.081 17927 2555 1 4 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.918 0.288 17927 2556 1 4 . 1 1 15 15 TYR C C 15 172.543 172.543 172.985 -0.442 17927 2557 1 4 . 1 1 15 15 TYR CA C 15 55.946 55.946 55.954 -0.008 17927 2558 1 4 . 1 1 15 15 TYR CB C 15 43.227 43.227 41.547 1.680 17927 2559 1 4 . 1 1 15 15 TYR H H 15 8.558 8.558 9.177 -0.619 17927 2560 1 4 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.747 0.362 17927 2561 1 4 . 1 1 16 16 PRO C C 16 176.475 176.475 176.488 -0.013 17927 2562 1 4 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.543 -0.562 17927 2563 1 4 . 1 1 16 16 PRO CB C 16 32.662 32.662 31.917 0.745 17927 2564 1 4 . 1 1 17 17 ASP N N 17 119.834 119.834 125.666 -5.832 17927 2565 1 4 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.892 0.847 17927 2566 1 4 . 1 1 17 17 ASP C C 17 180.740 180.740 178.246 2.494 17927 2567 1 4 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.417 -1.700 17927 2568 1 4 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.551 -0.990 17927 2569 1 4 . 1 1 17 17 ASP H H 17 8.643 8.643 8.846 -0.203 17927 2570 1 4 . 1 1 18 18 ILE N N 18 118.340 118.340 121.420 -3.080 17927 2571 1 4 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.771 0.680 17927 2572 1 4 . 1 1 18 18 ILE C C 18 175.742 175.742 176.640 -0.898 17927 2573 1 4 . 1 1 18 18 ILE CA C 18 61.894 61.894 64.806 -2.912 17927 2574 1 4 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.252 0.988 17927 2575 1 4 . 1 1 18 18 ILE H H 18 8.450 8.450 8.339 0.111 17927 2576 1 4 . 1 1 19 19 ASN N N 19 119.377 119.377 117.232 2.145 17927 2577 1 4 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.621 0.394 17927 2578 1 4 . 1 1 19 19 ASN C C 19 175.892 175.892 175.857 0.035 17927 2579 1 4 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.236 -0.929 17927 2580 1 4 . 1 1 19 19 ASN CB C 19 39.825 39.825 39.072 0.753 17927 2581 1 4 . 1 1 19 19 ASN H H 19 8.376 8.376 8.724 -0.348 17927 2582 1 4 . 1 1 20 20 GLY N N 20 109.535 109.535 108.440 1.095 17927 2583 1 4 . 1 1 20 20 GLY C C 20 174.285 174.285 173.288 0.997 17927 2584 1 4 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.089 0.704 17927 2585 1 4 . 1 1 20 20 GLY H H 20 8.539 8.539 8.523 0.016 17927 2586 1 4 . 1 1 21 21 LYS N N 21 124.675 124.675 121.226 3.449 17927 2587 1 4 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.560 -0.117 17927 2588 1 4 . 1 1 21 21 LYS C C 21 176.537 176.537 176.001 0.536 17927 2589 1 4 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.803 0.641 17927 2590 1 4 . 1 1 21 21 LYS CB C 21 32.754 32.754 33.248 -0.494 17927 2591 1 4 . 1 1 21 21 LYS H H 21 8.608 8.608 7.440 1.168 17927 2592 1 4 . 1 1 22 22 THR N N 22 120.666 120.666 124.795 -4.129 17927 2593 1 4 . 1 1 22 22 THR HA H 22 4.087 4.087 4.239 -0.152 17927 2594 1 4 . 1 1 22 22 THR C C 22 174.431 174.431 173.876 0.555 17927 2595 1 4 . 1 1 22 22 THR CA C 22 64.292 64.292 63.568 0.724 17927 2596 1 4 . 1 1 22 22 THR CB C 22 69.069 69.069 68.276 0.793 17927 2597 1 4 . 1 1 22 22 THR H H 22 8.595 8.595 8.705 -0.110 17927 2598 1 4 . 1 1 23 23 VAL N N 23 131.207 131.207 129.372 1.835 17927 2599 1 4 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.335 -0.143 17927 2600 1 4 . 1 1 23 23 VAL C C 23 174.244 174.244 174.608 -0.364 17927 2601 1 4 . 1 1 23 23 VAL CA C 23 62.456 62.456 60.123 2.333 17927 2602 1 4 . 1 1 23 23 VAL CB C 23 33.791 33.791 34.639 -0.848 17927 2603 1 4 . 1 1 23 23 VAL H H 23 8.937 8.937 8.425 0.512 17927 2604 1 4 . 1 1 24 24 SER N N 24 120.787 120.787 120.470 0.317 17927 2605 1 4 . 1 1 24 24 SER HA H 24 5.407 5.407 5.127 0.280 17927 2606 1 4 . 1 1 24 24 SER C C 24 176.169 176.169 173.590 2.579 17927 2607 1 4 . 1 1 24 24 SER CA C 24 55.135 55.135 55.795 -0.660 17927 2608 1 4 . 1 1 24 24 SER CB C 24 65.646 65.646 65.428 0.218 17927 2609 1 4 . 1 1 24 24 SER H H 24 8.554 8.554 9.189 -0.635 17927 2610 1 4 . 1 1 25 25 LEU N N 25 124.332 124.332 120.018 4.314 17927 2611 1 4 . 1 1 25 25 LEU HA H 25 3.687 3.687 4.211 -0.524 17927 2612 1 4 . 1 1 25 25 LEU C C 25 179.364 179.364 176.443 2.921 17927 2613 1 4 . 1 1 25 25 LEU CA C 25 58.217 58.217 53.535 4.682 17927 2614 1 4 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.828 -1.290 17927 2615 1 4 . 1 1 25 25 LEU H H 25 7.811 7.811 7.880 -0.069 17927 2616 1 4 . 1 1 26 26 ALA N N 26 119.799 119.799 120.834 -1.035 17927 2617 1 4 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.168 -0.175 17927 2618 1 4 . 1 1 26 26 ALA C C 26 179.719 179.719 178.235 1.484 17927 2619 1 4 . 1 1 26 26 ALA CA C 26 54.663 54.663 53.567 1.096 17927 2620 1 4 . 1 1 26 26 ALA CB C 26 18.323 18.323 19.596 -1.273 17927 2621 1 4 . 1 1 26 26 ALA H H 26 8.099 8.099 7.221 0.878 17927 2622 1 4 . 1 1 27 27 ASP N N 27 116.553 116.553 118.106 -1.553 17927 2623 1 4 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.433 0.040 17927 2624 1 4 . 1 1 27 27 ASP C C 27 176.915 176.915 177.329 -0.414 17927 2625 1 4 . 1 1 27 27 ASP CA C 27 56.251 56.251 56.381 -0.130 17927 2626 1 4 . 1 1 27 27 ASP CB C 27 40.788 40.788 40.655 0.133 17927 2627 1 4 . 1 1 27 27 ASP H H 27 7.572 7.572 7.749 -0.177 17927 2628 1 4 . 1 1 28 28 LEU N N 28 118.950 118.950 117.394 1.556 17927 2629 1 4 . 1 1 28 28 LEU HA H 28 4.233 4.233 4.201 0.032 17927 2630 1 4 . 1 1 28 28 LEU C C 28 175.542 175.542 176.290 -0.748 17927 2631 1 4 . 1 1 28 28 LEU CA C 28 53.706 53.706 53.837 -0.131 17927 2632 1 4 . 1 1 28 28 LEU CB C 28 41.049 41.049 41.910 -0.861 17927 2633 1 4 . 1 1 28 28 LEU H H 28 7.363 7.363 7.473 -0.110 17927 2634 1 4 . 1 1 29 29 LYS N N 29 118.429 118.429 119.851 -1.422 17927 2635 1 4 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.044 0.308 17927 2636 1 4 . 1 1 29 29 LYS C C 29 178.063 178.063 177.236 0.827 17927 2637 1 4 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.268 0.509 17927 2638 1 4 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.848 0.592 17927 2639 1 4 . 1 1 29 29 LYS H H 29 6.780 6.780 6.916 -0.136 17927 2640 1 4 . 1 1 30 30 GLY N N 30 112.426 112.426 114.380 -1.954 17927 2641 1 4 . 1 1 30 30 GLY C C 30 173.801 173.801 173.157 0.644 17927 2642 1 4 . 1 1 30 30 GLY CA C 30 44.611 44.611 44.890 -0.279 17927 2643 1 4 . 1 1 30 30 GLY H H 30 9.398 9.398 8.753 0.645 17927 2644 1 4 . 1 1 31 31 LYS N N 31 119.295 119.295 120.248 -0.953 17927 2645 1 4 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.497 -0.345 17927 2646 1 4 . 1 1 31 31 LYS C C 31 173.862 173.862 176.386 -2.524 17927 2647 1 4 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.397 0.791 17927 2648 1 4 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.243 1.725 17927 2649 1 4 . 1 1 31 31 LYS H H 31 7.496 7.496 7.370 0.126 17927 2650 1 4 . 1 1 32 32 TYR N N 32 116.984 116.984 122.009 -5.025 17927 2651 1 4 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.464 -0.307 17927 2652 1 4 . 1 1 32 32 TYR C C 32 175.226 175.226 175.931 -0.705 17927 2653 1 4 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.100 0.490 17927 2654 1 4 . 1 1 32 32 TYR CB C 32 39.121 39.121 38.643 0.478 17927 2655 1 4 . 1 1 32 32 TYR H H 32 7.521 7.521 7.861 -0.340 17927 2656 1 4 . 1 1 33 33 ILE N N 33 118.052 118.052 121.442 -3.390 17927 2657 1 4 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.426 0.481 17927 2658 1 4 . 1 1 33 33 ILE C C 33 174.308 174.308 173.969 0.339 17927 2659 1 4 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.581 0.121 17927 2660 1 4 . 1 1 33 33 ILE CB C 33 41.616 41.616 39.977 1.639 17927 2661 1 4 . 1 1 33 33 ILE H H 33 8.467 8.467 8.873 -0.406 17927 2662 1 4 . 1 1 34 34 TYR N N 34 130.242 130.242 129.409 0.833 17927 2663 1 4 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.431 0.095 17927 2664 1 4 . 1 1 34 34 TYR C C 34 174.245 174.245 173.465 0.780 17927 2665 1 4 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.757 0.401 17927 2666 1 4 . 1 1 34 34 TYR CB C 34 40.133 40.133 41.806 -1.673 17927 2667 1 4 . 1 1 34 34 TYR H H 34 8.905 8.905 8.907 -0.002 17927 2668 1 4 . 1 1 35 35 ILE N N 35 128.697 128.697 127.665 1.032 17927 2669 1 4 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.173 0.169 17927 2670 1 4 . 1 1 35 35 ILE C C 35 174.520 174.520 173.853 0.667 17927 2671 1 4 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.376 0.374 17927 2672 1 4 . 1 1 35 35 ILE CB C 35 40.899 40.899 41.547 -0.648 17927 2673 1 4 . 1 1 35 35 ILE H H 35 9.445 9.445 8.811 0.634 17927 2674 1 4 . 1 1 36 36 ASP N N 36 123.675 123.675 124.814 -1.139 17927 2675 1 4 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.912 -1.064 17927 2676 1 4 . 1 1 36 36 ASP C C 36 174.385 174.385 175.637 -1.252 17927 2677 1 4 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.563 -0.270 17927 2678 1 4 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.400 -2.622 17927 2679 1 4 . 1 1 36 36 ASP H H 36 8.875 8.875 8.727 0.148 17927 2680 1 4 . 1 1 37 37 VAL N N 37 127.159 127.159 118.766 8.393 17927 2681 1 4 . 1 1 37 37 VAL HA H 37 4.959 4.959 5.212 -0.253 17927 2682 1 4 . 1 1 37 37 VAL C C 37 175.046 175.046 176.133 -1.087 17927 2683 1 4 . 1 1 37 37 VAL CA C 37 62.245 62.245 61.296 0.949 17927 2684 1 4 . 1 1 37 37 VAL CB C 37 31.807 31.807 32.835 -1.028 17927 2685 1 4 . 1 1 37 37 VAL H H 37 8.603 8.603 7.956 0.647 17927 2686 1 4 . 1 1 38 38 TRP N N 38 124.161 124.161 124.920 -0.759 17927 2687 1 4 . 1 1 38 38 TRP HA H 38 5.237 5.237 4.996 0.241 17927 2688 1 4 . 1 1 38 38 TRP C C 38 171.995 171.995 173.125 -1.130 17927 2689 1 4 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.917 1.290 17927 2690 1 4 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.634 2.553 17927 2691 1 4 . 1 1 38 38 TRP H H 38 8.562 8.562 8.545 0.017 17927 2692 1 4 . 1 1 39 39 ALA N N 39 116.252 116.252 125.271 -9.019 17927 2693 1 4 . 1 1 39 39 ALA HA H 39 3.678 3.678 4.047 -0.369 17927 2694 1 4 . 1 1 39 39 ALA C C 39 178.664 178.664 175.538 3.126 17927 2695 1 4 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.632 0.834 17927 2696 1 4 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.296 1.045 17927 2697 1 4 . 1 1 39 39 ALA H H 39 6.757 6.757 7.912 -1.155 17927 2698 1 4 . 1 1 40 40 THR N N 40 114.321 114.321 115.243 -0.922 17927 2699 1 4 . 1 1 40 40 THR HA H 40 3.907 3.907 4.412 -0.505 17927 2700 1 4 . 1 1 40 40 THR C C 40 175.885 175.885 175.739 0.146 17927 2701 1 4 . 1 1 40 40 THR CA C 40 65.447 65.447 63.522 1.925 17927 2702 1 4 . 1 1 40 40 THR CB C 40 70.106 70.106 69.296 0.810 17927 2703 1 4 . 1 1 40 40 THR H H 40 9.639 9.639 8.787 0.852 17927 2704 1 4 . 1 1 41 41 TRP N N 41 114.483 114.483 120.588 -6.105 17927 2705 1 4 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.601 -0.038 17927 2706 1 4 . 1 1 41 41 TRP C C 41 176.189 176.189 176.059 0.130 17927 2707 1 4 . 1 1 41 41 TRP CA C 41 54.698 54.698 57.726 -3.028 17927 2708 1 4 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.237 1.740 17927 2709 1 4 . 1 1 41 41 TRP H H 41 6.401 6.401 7.722 -1.321 17927 2710 1 4 . 1 1 42 42 CYS N N 42 123.536 123.536 119.012 4.524 17927 2711 1 4 . 1 1 42 42 CYS HA H 42 4.568 4.568 3.987 0.581 17927 2712 1 4 . 1 1 42 42 CYS C C 42 175.726 175.726 175.977 -0.251 17927 2713 1 4 . 1 1 42 42 CYS CA C 42 58.700 58.700 59.447 -0.747 17927 2714 1 4 . 1 1 42 42 CYS CB C 42 27.121 27.121 29.043 -1.922 17927 2715 1 4 . 1 1 42 42 CYS H H 42 6.883 6.883 6.998 -0.115 17927 2716 1 4 . 1 1 43 43 GLY N N 43 120.977 120.977 107.395 13.582 17927 2717 1 4 . 1 1 43 43 GLY CA C 43 49.204 49.204 45.184 4.021 17927 2718 1 4 . 1 1 43 43 GLY H H 43 9.653 9.653 7.622 2.031 17927 2719 1 4 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.323 0.164 17927 2720 1 4 . 1 1 44 44 PRO C C 44 179.956 179.956 178.539 1.417 17927 2721 1 4 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.341 0.300 17927 2722 1 4 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.110 1.468 17927 2723 1 4 . 1 1 45 45 CYS N N 45 113.925 113.925 113.300 0.625 17927 2724 1 4 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.629 -0.316 17927 2725 1 4 . 1 1 45 45 CYS C C 45 178.325 178.325 176.934 1.391 17927 2726 1 4 . 1 1 45 45 CYS CA C 45 63.392 63.392 59.781 3.611 17927 2727 1 4 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.247 1.258 17927 2728 1 4 . 1 1 45 45 CYS H H 45 7.676 7.676 7.807 -0.131 17927 2729 1 4 . 1 1 46 46 ARG N N 46 120.336 120.336 120.917 -0.581 17927 2730 1 4 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.422 -0.353 17927 2731 1 4 . 1 1 46 46 ARG C C 46 180.446 180.446 178.811 1.635 17927 2732 1 4 . 1 1 46 46 ARG CA C 46 59.785 59.785 58.318 1.467 17927 2733 1 4 . 1 1 46 46 ARG CB C 46 29.868 29.868 30.091 -0.223 17927 2734 1 4 . 1 1 46 46 ARG H H 46 8.109 8.109 8.548 -0.439 17927 2735 1 4 . 1 1 47 47 GLY N N 47 105.408 105.408 106.518 -1.110 17927 2736 1 4 . 1 1 47 47 GLY C C 47 175.258 175.258 174.655 0.603 17927 2737 1 4 . 1 1 47 47 GLY CA C 47 46.594 46.594 45.629 0.965 17927 2738 1 4 . 1 1 47 47 GLY H H 47 8.466 8.466 8.022 0.444 17927 2739 1 4 . 1 1 48 48 GLU N N 48 116.343 116.343 119.375 -3.032 17927 2740 1 4 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.477 0.048 17927 2741 1 4 . 1 1 48 48 GLU C C 48 176.535 176.535 177.768 -1.233 17927 2742 1 4 . 1 1 48 48 GLU CA C 48 55.792 55.792 56.437 -0.645 17927 2743 1 4 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.800 1.182 17927 2744 1 4 . 1 1 48 48 GLU H H 48 7.050 7.050 7.577 -0.527 17927 2745 1 4 . 1 1 49 49 LEU N N 49 118.652 118.652 121.182 -2.530 17927 2746 1 4 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.161 -0.009 17927 2747 1 4 . 1 1 49 49 LEU C C 49 176.832 176.832 176.794 0.038 17927 2748 1 4 . 1 1 49 49 LEU CA C 49 59.345 59.345 59.655 -0.310 17927 2749 1 4 . 1 1 49 49 LEU CB C 49 38.496 38.496 38.803 -0.308 17927 2750 1 4 . 1 1 49 49 LEU H H 49 7.385 7.385 7.386 -0.001 17927 2751 1 4 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.140 0.113 17927 2752 1 4 . 1 1 50 50 PRO C C 50 179.744 179.744 178.113 1.631 17927 2753 1 4 . 1 1 50 50 PRO CA C 50 66.559 66.559 65.986 0.573 17927 2754 1 4 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.968 -0.206 17927 2755 1 4 . 1 1 51 51 ALA N N 51 120.418 120.418 117.598 2.820 17927 2756 1 4 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.208 -0.063 17927 2757 1 4 . 1 1 51 51 ALA C C 51 180.329 180.329 179.576 0.753 17927 2758 1 4 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.346 0.088 17927 2759 1 4 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.224 0.146 17927 2760 1 4 . 1 1 51 51 ALA H H 51 7.731 7.731 7.462 0.269 17927 2761 1 4 . 1 1 52 52 LEU N N 52 121.506 121.506 120.055 1.451 17927 2762 1 4 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.789 0.199 17927 2763 1 4 . 1 1 52 52 LEU C C 52 177.944 177.944 177.943 0.001 17927 2764 1 4 . 1 1 52 52 LEU CA C 52 58.327 58.327 57.767 0.559 17927 2765 1 4 . 1 1 52 52 LEU CB C 52 42.382 42.382 41.949 0.433 17927 2766 1 4 . 1 1 52 52 LEU H H 52 8.355 8.355 7.624 0.731 17927 2767 1 4 . 1 1 53 53 LYS N N 53 119.732 119.732 118.669 1.063 17927 2768 1 4 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.848 0.055 17927 2769 1 4 . 1 1 53 53 LYS C C 53 179.030 179.030 178.546 0.484 17927 2770 1 4 . 1 1 53 53 LYS CA C 53 59.846 59.846 59.424 0.422 17927 2771 1 4 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.665 0.546 17927 2772 1 4 . 1 1 53 53 LYS H H 53 8.148 8.148 7.490 0.658 17927 2773 1 4 . 1 1 54 54 GLU N N 54 117.779 117.779 120.168 -2.389 17927 2774 1 4 . 1 1 54 54 GLU HA H 54 4.059 4.059 3.951 0.108 17927 2775 1 4 . 1 1 54 54 GLU C C 54 179.646 179.646 179.127 0.519 17927 2776 1 4 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.004 0.621 17927 2777 1 4 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.074 0.493 17927 2778 1 4 . 1 1 54 54 GLU H H 54 7.585 7.585 7.799 -0.214 17927 2779 1 4 . 1 1 55 55 LEU N N 55 120.581 120.581 119.503 1.078 17927 2780 1 4 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.147 0.046 17927 2781 1 4 . 1 1 55 55 LEU C C 55 178.557 178.557 178.879 -0.322 17927 2782 1 4 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.078 1.157 17927 2783 1 4 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.175 1.836 17927 2784 1 4 . 1 1 55 55 LEU H H 55 8.096 8.096 7.716 0.380 17927 2785 1 4 . 1 1 56 56 GLU N N 56 118.023 118.023 120.177 -2.154 17927 2786 1 4 . 1 1 56 56 GLU HA H 56 3.177 3.177 4.203 -1.026 17927 2787 1 4 . 1 1 56 56 GLU C C 56 179.650 179.650 179.069 0.581 17927 2788 1 4 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.211 -0.340 17927 2789 1 4 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.402 -2.417 17927 2790 1 4 . 1 1 56 56 GLU H H 56 8.181 8.181 7.964 0.217 17927 2791 1 4 . 1 1 57 57 GLU N N 57 117.828 117.828 118.089 -0.261 17927 2792 1 4 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.140 -0.036 17927 2793 1 4 . 1 1 57 57 GLU C C 57 179.700 179.700 178.963 0.737 17927 2794 1 4 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.521 0.506 17927 2795 1 4 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.144 0.521 17927 2796 1 4 . 1 1 57 57 GLU H H 57 7.762 7.762 8.361 -0.599 17927 2797 1 4 . 1 1 58 58 LYS N N 58 120.896 120.896 119.830 1.066 17927 2798 1 4 . 1 1 58 58 LYS HA H 58 3.979 3.979 4.001 -0.022 17927 2799 1 4 . 1 1 58 58 LYS C C 58 178.715 178.715 176.976 1.739 17927 2800 1 4 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.515 0.563 17927 2801 1 4 . 1 1 58 58 LYS CB C 58 32.980 32.980 32.824 0.156 17927 2802 1 4 . 1 1 58 58 LYS H H 58 8.410 8.410 7.726 0.684 17927 2803 1 4 . 1 1 59 59 TYR N N 59 113.713 113.713 116.569 -2.856 17927 2804 1 4 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.643 -0.331 17927 2805 1 4 . 1 1 59 59 TYR C C 59 175.025 175.025 174.070 0.955 17927 2806 1 4 . 1 1 59 59 TYR CA C 59 58.973 58.973 55.404 3.569 17927 2807 1 4 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.454 -1.020 17927 2808 1 4 . 1 1 59 59 TYR H H 59 8.102 8.102 7.517 0.585 17927 2809 1 4 . 1 1 60 60 ALA N N 60 126.637 126.637 122.674 3.963 17927 2810 1 4 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.322 0.096 17927 2811 1 4 . 1 1 60 60 ALA C C 60 179.208 179.208 178.882 0.326 17927 2812 1 4 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.876 0.658 17927 2813 1 4 . 1 1 60 60 ALA CB C 60 18.589 18.589 18.137 0.452 17927 2814 1 4 . 1 1 60 60 ALA H H 60 7.201 7.201 7.273 -0.072 17927 2815 1 4 . 1 1 61 61 GLY N N 61 111.816 111.816 112.173 -0.357 17927 2816 1 4 . 1 1 61 61 GLY C C 61 174.698 174.698 174.589 0.109 17927 2817 1 4 . 1 1 61 61 GLY CA C 61 45.904 45.904 44.670 1.234 17927 2818 1 4 . 1 1 61 61 GLY H H 61 9.184 9.184 9.057 0.127 17927 2819 1 4 . 1 1 62 62 LYS N N 62 118.497 118.497 121.356 -2.859 17927 2820 1 4 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.360 0.519 17927 2821 1 4 . 1 1 62 62 LYS C C 62 179.019 179.019 176.158 2.861 17927 2822 1 4 . 1 1 62 62 LYS CA C 62 53.988 53.988 55.507 -1.519 17927 2823 1 4 . 1 1 62 62 LYS CB C 62 33.840 33.840 32.913 0.927 17927 2824 1 4 . 1 1 62 62 LYS H H 62 8.019 8.019 7.781 0.238 17927 2825 1 4 . 1 1 63 63 ASP N N 63 122.982 122.982 120.126 2.856 17927 2826 1 4 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.700 -0.173 17927 2827 1 4 . 1 1 63 63 ASP C C 63 174.065 174.065 174.691 -0.626 17927 2828 1 4 . 1 1 63 63 ASP CA C 63 55.055 55.055 53.302 1.753 17927 2829 1 4 . 1 1 63 63 ASP CB C 63 38.582 38.582 39.595 -1.013 17927 2830 1 4 . 1 1 63 63 ASP H H 63 8.709 8.709 8.621 0.088 17927 2831 1 4 . 1 1 64 64 ILE N N 64 122.219 122.219 112.045 10.174 17927 2832 1 4 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.906 -0.299 17927 2833 1 4 . 1 1 64 64 ILE C C 64 174.627 174.627 173.241 1.386 17927 2834 1 4 . 1 1 64 64 ILE CA C 64 59.712 59.712 58.833 0.879 17927 2835 1 4 . 1 1 64 64 ILE CB C 64 42.133 42.133 41.639 0.494 17927 2836 1 4 . 1 1 64 64 ILE H H 64 8.678 8.678 7.035 1.643 17927 2837 1 4 . 1 1 65 65 HIS N N 65 125.584 125.584 118.124 7.460 17927 2838 1 4 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.862 0.181 17927 2839 1 4 . 1 1 65 65 HIS C C 65 174.153 174.153 173.857 0.296 17927 2840 1 4 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.332 0.627 17927 2841 1 4 . 1 1 65 65 HIS CB C 65 34.156 34.156 33.959 0.197 17927 2842 1 4 . 1 1 65 65 HIS H H 65 9.204 9.204 8.174 1.030 17927 2843 1 4 . 1 1 66 66 PHE N N 66 123.244 123.244 122.721 0.523 17927 2844 1 4 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.910 0.300 17927 2845 1 4 . 1 1 66 66 PHE C C 66 175.463 175.463 174.352 1.111 17927 2846 1 4 . 1 1 66 66 PHE CA C 66 58.088 58.088 57.613 0.475 17927 2847 1 4 . 1 1 66 66 PHE CB C 66 39.637 39.637 38.835 0.802 17927 2848 1 4 . 1 1 66 66 PHE H H 66 9.262 9.262 8.886 0.376 17927 2849 1 4 . 1 1 67 67 VAL N N 67 126.201 126.201 124.444 1.757 17927 2850 1 4 . 1 1 67 67 VAL HA H 67 4.834 4.834 4.676 0.158 17927 2851 1 4 . 1 1 67 67 VAL C C 67 174.364 174.364 175.135 -0.771 17927 2852 1 4 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.951 -0.227 17927 2853 1 4 . 1 1 67 67 VAL CB C 67 34.893 34.893 33.862 1.030 17927 2854 1 4 . 1 1 67 67 VAL H H 67 8.843 8.843 9.078 -0.235 17927 2855 1 4 . 1 1 68 68 SER N N 68 124.528 124.528 122.860 1.668 17927 2856 1 4 . 1 1 68 68 SER HA H 68 5.585 5.585 5.647 -0.062 17927 2857 1 4 . 1 1 68 68 SER C C 68 172.858 172.858 173.289 -0.431 17927 2858 1 4 . 1 1 68 68 SER CA C 68 57.282 57.282 56.836 0.446 17927 2859 1 4 . 1 1 68 68 SER CB C 68 65.032 65.032 64.220 0.812 17927 2860 1 4 . 1 1 68 68 SER H H 68 9.243 9.243 9.006 0.237 17927 2861 1 4 . 1 1 69 69 LEU N N 69 126.695 126.695 127.844 -1.149 17927 2862 1 4 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.906 -1.389 17927 2863 1 4 . 1 1 69 69 LEU C C 69 174.652 174.652 176.038 -1.386 17927 2864 1 4 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.588 -0.761 17927 2865 1 4 . 1 1 69 69 LEU CB C 69 43.895 43.895 45.632 -1.737 17927 2866 1 4 . 1 1 69 69 LEU H H 69 9.360 9.360 9.294 0.066 17927 2867 1 4 . 1 1 70 70 SER N N 70 116.379 116.379 116.412 -0.033 17927 2868 1 4 . 1 1 70 70 SER HA H 70 4.905 4.905 4.992 -0.087 17927 2869 1 4 . 1 1 70 70 SER C C 70 176.307 176.307 174.454 1.853 17927 2870 1 4 . 1 1 70 70 SER CA C 70 55.213 55.213 56.485 -1.272 17927 2871 1 4 . 1 1 70 70 SER CB C 70 63.519 63.519 64.791 -1.272 17927 2872 1 4 . 1 1 70 70 SER H H 70 7.981 7.981 8.804 -0.823 17927 2873 1 4 . 1 1 71 71 CYS N N 71 124.670 124.670 127.545 -2.875 17927 2874 1 4 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.596 0.362 17927 2875 1 4 . 1 1 71 71 CYS C C 71 173.996 173.996 173.949 0.047 17927 2876 1 4 . 1 1 71 71 CYS CA C 71 55.483 55.483 56.628 -1.145 17927 2877 1 4 . 1 1 71 71 CYS CB C 71 28.112 28.112 26.981 1.131 17927 2878 1 4 . 1 1 71 71 CYS H H 71 8.609 8.609 9.169 -0.560 17927 2879 1 4 . 1 1 72 72 ASP N N 72 122.398 122.398 122.486 -0.088 17927 2880 1 4 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.590 -0.298 17927 2881 1 4 . 1 1 72 72 ASP C C 72 176.653 176.653 176.210 0.443 17927 2882 1 4 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.512 1.270 17927 2883 1 4 . 1 1 72 72 ASP CB C 72 41.526 41.526 41.387 0.139 17927 2884 1 4 . 1 1 72 72 ASP H H 72 8.557 8.557 7.548 1.009 17927 2885 1 4 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.144 -0.079 17927 2886 1 4 . 1 1 73 73 LYS C C 73 176.545 176.545 176.219 0.326 17927 2887 1 4 . 1 1 73 73 LYS CA C 73 58.458 58.458 57.866 0.592 17927 2888 1 4 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.523 0.118 17927 2889 1 4 . 1 1 74 74 ASN N N 74 117.616 117.616 119.084 -1.468 17927 2890 1 4 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.764 0.141 17927 2891 1 4 . 1 1 74 74 ASN C C 74 174.894 174.894 175.444 -0.550 17927 2892 1 4 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.770 -1.249 17927 2893 1 4 . 1 1 74 74 ASN CB C 74 38.109 38.109 37.506 0.603 17927 2894 1 4 . 1 1 74 74 ASN H H 74 8.625 8.625 8.386 0.239 17927 2895 1 4 . 1 1 75 75 LYS N N 75 126.797 126.797 124.189 2.608 17927 2896 1 4 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.729 -0.306 17927 2897 1 4 . 1 1 75 75 LYS C C 75 178.058 178.058 177.817 0.241 17927 2898 1 4 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.310 -0.137 17927 2899 1 4 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.371 0.920 17927 2900 1 4 . 1 1 75 75 LYS H H 75 8.588 8.588 7.802 0.786 17927 2901 1 4 . 1 1 76 76 LYS N N 76 117.875 117.875 119.306 -1.431 17927 2902 1 4 . 1 1 76 76 LYS HA H 76 4.200 4.200 4.396 -0.196 17927 2903 1 4 . 1 1 76 76 LYS C C 76 178.791 178.791 178.918 -0.127 17927 2904 1 4 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.103 -0.495 17927 2905 1 4 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.329 0.161 17927 2906 1 4 . 1 1 76 76 LYS H H 76 8.041 8.041 8.435 -0.394 17927 2907 1 4 . 1 1 77 77 ALA N N 77 121.567 121.567 121.458 0.109 17927 2908 1 4 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.217 -0.094 17927 2909 1 4 . 1 1 77 77 ALA C C 77 181.191 181.191 179.597 1.594 17927 2910 1 4 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.684 0.274 17927 2911 1 4 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.029 -0.270 17927 2912 1 4 . 1 1 77 77 ALA H H 77 7.366 7.366 8.238 -0.872 17927 2913 1 4 . 1 1 78 78 TRP N N 78 119.497 119.497 120.764 -1.267 17927 2914 1 4 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.261 -0.184 17927 2915 1 4 . 1 1 78 78 TRP C C 78 175.942 175.942 177.146 -1.204 17927 2916 1 4 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.085 2.676 17927 2917 1 4 . 1 1 78 78 TRP CB C 78 27.272 27.272 30.186 -2.914 17927 2918 1 4 . 1 1 78 78 TRP H H 78 7.187 7.187 8.147 -0.960 17927 2919 1 4 . 1 1 79 79 GLU N N 79 118.771 118.771 119.432 -0.661 17927 2920 1 4 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.515 -0.501 17927 2921 1 4 . 1 1 79 79 GLU C C 79 179.863 179.863 178.127 1.736 17927 2922 1 4 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.724 -0.614 17927 2923 1 4 . 1 1 79 79 GLU CB C 79 30.220 30.220 29.049 1.171 17927 2924 1 4 . 1 1 79 79 GLU H H 79 8.813 8.813 9.001 -0.188 17927 2925 1 4 . 1 1 80 80 ASN N N 80 115.964 115.964 117.958 -1.994 17927 2926 1 4 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.513 -0.174 17927 2927 1 4 . 1 1 80 80 ASN C C 80 176.749 176.749 177.520 -0.771 17927 2928 1 4 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.827 0.208 17927 2929 1 4 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.235 0.254 17927 2930 1 4 . 1 1 80 80 ASN H H 80 8.491 8.491 7.946 0.545 17927 2931 1 4 . 1 1 81 81 MET N N 81 119.670 119.670 121.545 -1.875 17927 2932 1 4 . 1 1 81 81 MET HA H 81 4.149 4.149 4.163 -0.014 17927 2933 1 4 . 1 1 81 81 MET C C 81 177.933 177.933 177.674 0.259 17927 2934 1 4 . 1 1 81 81 MET CA C 81 60.276 60.276 59.174 1.102 17927 2935 1 4 . 1 1 81 81 MET CB C 81 32.518 32.518 33.009 -0.491 17927 2936 1 4 . 1 1 81 81 MET H H 81 7.667 7.667 7.764 -0.097 17927 2937 1 4 . 1 1 82 82 VAL N N 82 117.634 117.634 118.224 -0.590 17927 2938 1 4 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.620 -0.317 17927 2939 1 4 . 1 1 82 82 VAL C C 82 179.005 179.005 177.965 1.040 17927 2940 1 4 . 1 1 82 82 VAL CA C 82 67.037 67.037 65.623 1.415 17927 2941 1 4 . 1 1 82 82 VAL CB C 82 31.765 31.765 30.827 0.938 17927 2942 1 4 . 1 1 82 82 VAL H H 82 8.338 8.338 8.321 0.017 17927 2943 1 4 . 1 1 83 83 THR N N 83 110.519 110.519 116.479 -5.960 17927 2944 1 4 . 1 1 83 83 THR HA H 83 3.983 3.983 3.969 0.014 17927 2945 1 4 . 1 1 83 83 THR C C 83 177.591 177.591 175.954 1.637 17927 2946 1 4 . 1 1 83 83 THR CA C 83 65.431 65.431 66.526 -1.095 17927 2947 1 4 . 1 1 83 83 THR CB C 83 69.156 69.156 68.754 0.402 17927 2948 1 4 . 1 1 83 83 THR H H 83 7.659 7.659 7.556 0.103 17927 2949 1 4 . 1 1 84 84 LYS N N 84 123.927 123.927 121.606 2.321 17927 2950 1 4 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.099 -0.030 17927 2951 1 4 . 1 1 84 84 LYS C C 84 178.582 178.582 178.130 0.452 17927 2952 1 4 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.629 1.248 17927 2953 1 4 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.513 -0.189 17927 2954 1 4 . 1 1 84 84 LYS H H 84 8.665 8.665 7.795 0.870 17927 2955 1 4 . 1 1 85 85 ASP N N 85 116.280 116.280 116.566 -0.286 17927 2956 1 4 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.687 0.063 17927 2957 1 4 . 1 1 85 85 ASP C C 85 175.086 175.086 174.980 0.106 17927 2958 1 4 . 1 1 85 85 ASP CA C 85 54.693 54.693 55.323 -0.630 17927 2959 1 4 . 1 1 85 85 ASP CB C 85 39.685 39.685 40.761 -1.075 17927 2960 1 4 . 1 1 85 85 ASP H H 85 8.179 8.179 8.271 -0.092 17927 2961 1 4 . 1 1 86 86 GLN N N 86 116.258 116.258 112.925 3.333 17927 2962 1 4 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.921 -0.013 17927 2963 1 4 . 1 1 86 86 GLN C C 86 175.659 175.659 175.253 0.406 17927 2964 1 4 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.522 -0.351 17927 2965 1 4 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.398 -0.108 17927 2966 1 4 . 1 1 86 86 GLN H H 86 7.431 7.431 7.489 -0.058 17927 2967 1 4 . 1 1 87 87 LEU N N 87 117.031 117.031 120.330 -3.299 17927 2968 1 4 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.145 -0.055 17927 2969 1 4 . 1 1 87 87 LEU C C 87 178.225 178.225 176.032 2.193 17927 2970 1 4 . 1 1 87 87 LEU CA C 87 55.932 55.932 55.366 0.566 17927 2971 1 4 . 1 1 87 87 LEU CB C 87 41.202 41.202 40.286 0.916 17927 2972 1 4 . 1 1 87 87 LEU H H 87 7.736 7.736 7.366 0.370 17927 2973 1 4 . 1 1 88 88 LYS N N 88 122.367 122.367 123.561 -1.194 17927 2974 1 4 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.644 -0.008 17927 2975 1 4 . 1 1 88 88 LYS C C 88 177.538 177.538 176.191 1.347 17927 2976 1 4 . 1 1 88 88 LYS CA C 88 54.930 54.930 54.288 0.641 17927 2977 1 4 . 1 1 88 88 LYS CB C 88 33.316 33.316 35.271 -1.955 17927 2978 1 4 . 1 1 88 88 LYS H H 88 8.496 8.496 7.899 0.597 17927 2979 1 4 . 1 1 89 89 GLY N N 89 108.452 108.452 106.598 1.854 17927 2980 1 4 . 1 1 89 89 GLY C C 89 173.781 173.781 173.178 0.603 17927 2981 1 4 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.438 0.920 17927 2982 1 4 . 1 1 89 89 GLY H H 89 8.497 8.497 7.997 0.500 17927 2983 1 4 . 1 1 90 90 ILE N N 90 123.295 123.295 124.197 -0.902 17927 2984 1 4 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.202 0.169 17927 2985 1 4 . 1 1 90 90 ILE C C 90 175.606 175.606 174.413 1.193 17927 2986 1 4 . 1 1 90 90 ILE CA C 90 62.001 62.001 61.486 0.515 17927 2987 1 4 . 1 1 90 90 ILE CB C 90 38.036 38.036 37.610 0.426 17927 2988 1 4 . 1 1 90 90 ILE H H 90 8.728 8.728 8.223 0.505 17927 2989 1 4 . 1 1 91 91 GLN N N 91 128.632 128.632 125.841 2.791 17927 2990 1 4 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.929 -0.164 17927 2991 1 4 . 1 1 91 91 GLN C C 91 174.618 174.618 174.334 0.284 17927 2992 1 4 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.842 1.008 17927 2993 1 4 . 1 1 91 91 GLN CB C 91 28.341 28.341 30.003 -1.662 17927 2994 1 4 . 1 1 91 91 GLN H H 91 8.762 8.762 8.432 0.330 17927 2995 1 4 . 1 1 92 92 LEU N N 92 120.830 120.830 123.970 -3.140 17927 2996 1 4 . 1 1 92 92 LEU HA H 92 5.580 5.580 4.994 0.586 17927 2997 1 4 . 1 1 92 92 LEU C C 92 176.828 176.828 175.296 1.532 17927 2998 1 4 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.860 -1.059 17927 2999 1 4 . 1 1 92 92 LEU CB C 92 44.210 44.210 46.175 -1.965 17927 3000 1 4 . 1 1 92 92 LEU H H 92 9.011 9.011 9.282 -0.271 17927 3001 1 4 . 1 1 93 93 HIS N N 93 121.481 121.481 121.537 -0.056 17927 3002 1 4 . 1 1 93 93 HIS HA H 93 3.931 3.931 4.930 -0.999 17927 3003 1 4 . 1 1 93 93 HIS C C 93 173.590 173.590 172.867 0.723 17927 3004 1 4 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.574 1.010 17927 3005 1 4 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.217 -0.967 17927 3006 1 4 . 1 1 93 93 HIS H H 93 8.038 8.038 8.664 -0.626 17927 3007 1 4 . 1 1 94 94 MET N N 94 121.881 121.881 124.816 -2.935 17927 3008 1 4 . 1 1 94 94 MET HA H 94 3.866 3.866 3.476 0.390 17927 3009 1 4 . 1 1 94 94 MET C C 94 177.035 177.035 176.434 0.601 17927 3010 1 4 . 1 1 94 94 MET CA C 94 55.189 55.189 56.879 -1.690 17927 3011 1 4 . 1 1 94 94 MET CB C 94 33.993 33.993 33.787 0.206 17927 3012 1 4 . 1 1 94 94 MET H H 94 8.039 8.039 8.456 -0.417 17927 3013 1 4 . 1 1 95 95 GLY N N 95 104.041 104.041 105.917 -1.876 17927 3014 1 4 . 1 1 95 95 GLY C C 95 174.251 174.251 175.217 -0.966 17927 3015 1 4 . 1 1 95 95 GLY CA C 95 46.580 46.580 46.597 -0.017 17927 3016 1 4 . 1 1 95 95 GLY H H 95 5.666 5.666 7.679 -2.013 17927 3017 1 4 . 1 1 96 96 THR N N 96 114.114 114.114 116.319 -2.205 17927 3018 1 4 . 1 1 96 96 THR HA H 96 4.211 4.211 4.205 0.006 17927 3019 1 4 . 1 1 96 96 THR C C 96 175.122 175.122 175.234 -0.112 17927 3020 1 4 . 1 1 96 96 THR CA C 96 61.339 61.339 63.763 -2.424 17927 3021 1 4 . 1 1 96 96 THR CB C 96 68.615 68.615 69.342 -0.727 17927 3022 1 4 . 1 1 96 96 THR H H 96 8.517 8.517 7.775 0.742 17927 3023 1 4 . 1 1 97 97 ASP N N 97 121.892 121.892 124.045 -2.153 17927 3024 1 4 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.937 -0.352 17927 3025 1 4 . 1 1 97 97 ASP C C 97 178.241 178.241 175.865 2.376 17927 3026 1 4 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.008 1.792 17927 3027 1 4 . 1 1 97 97 ASP CB C 97 43.129 43.129 39.547 3.583 17927 3028 1 4 . 1 1 97 97 ASP H H 97 7.563 7.563 8.337 -0.774 17927 3029 1 4 . 1 1 98 98 ARG N N 98 127.508 127.508 119.215 8.293 17927 3030 1 4 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.229 0.163 17927 3031 1 4 . 1 1 98 98 ARG C C 98 176.724 176.724 177.135 -0.411 17927 3032 1 4 . 1 1 98 98 ARG CA C 98 55.939 55.939 56.910 -0.971 17927 3033 1 4 . 1 1 98 98 ARG CB C 98 30.291 30.291 29.089 1.202 17927 3034 1 4 . 1 1 98 98 ARG H H 98 9.225 9.225 7.648 1.577 17927 3035 1 4 . 1 1 99 99 THR N N 99 116.384 116.384 115.053 1.331 17927 3036 1 4 . 1 1 99 99 THR HA H 99 3.987 3.987 4.149 -0.162 17927 3037 1 4 . 1 1 99 99 THR C C 99 176.969 176.969 175.275 1.694 17927 3038 1 4 . 1 1 99 99 THR CA C 99 67.714 67.714 65.528 2.186 17927 3039 1 4 . 1 1 99 99 THR CB C 99 68.777 68.777 68.771 0.006 17927 3040 1 4 . 1 1 99 99 THR H H 99 8.382 8.382 7.888 0.494 17927 3041 1 4 . 1 1 100 100 PHE N N 100 123.232 123.232 121.574 1.658 17927 3042 1 4 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.429 -0.256 17927 3043 1 4 . 1 1 100 100 PHE C C 100 177.010 177.010 176.261 0.749 17927 3044 1 4 . 1 1 100 100 PHE CA C 100 61.923 61.923 59.920 2.003 17927 3045 1 4 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.269 1.493 17927 3046 1 4 . 1 1 100 100 PHE H H 100 7.998 7.998 8.056 -0.058 17927 3047 1 4 . 1 1 101 101 MET N N 101 115.968 115.968 118.031 -2.063 17927 3048 1 4 . 1 1 101 101 MET HA H 101 3.975 3.975 4.067 -0.092 17927 3049 1 4 . 1 1 101 101 MET C C 101 178.763 178.763 178.428 0.335 17927 3050 1 4 . 1 1 101 101 MET CA C 101 58.552 58.552 57.706 0.845 17927 3051 1 4 . 1 1 101 101 MET CB C 101 32.593 32.593 31.334 1.259 17927 3052 1 4 . 1 1 101 101 MET H H 101 7.828 7.828 7.638 0.190 17927 3053 1 4 . 1 1 102 102 ASP N N 102 117.553 117.553 118.728 -1.175 17927 3054 1 4 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.406 0.116 17927 3055 1 4 . 1 1 102 102 ASP C C 102 179.503 179.503 177.519 1.984 17927 3056 1 4 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.165 -0.275 17927 3057 1 4 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.591 -0.665 17927 3058 1 4 . 1 1 102 102 ASP H H 102 8.828 8.828 7.727 1.101 17927 3059 1 4 . 1 1 103 103 ALA N N 103 122.984 122.984 120.001 2.983 17927 3060 1 4 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.010 -0.024 17927 3061 1 4 . 1 1 103 103 ALA C C 103 178.782 178.782 177.994 0.788 17927 3062 1 4 . 1 1 103 103 ALA CA C 103 55.094 55.094 53.850 1.244 17927 3063 1 4 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.505 0.058 17927 3064 1 4 . 1 1 103 103 ALA H H 103 7.567 7.567 7.470 0.097 17927 3065 1 4 . 1 1 104 104 TYR N N 104 112.159 112.159 114.234 -2.075 17927 3066 1 4 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.473 -0.249 17927 3067 1 4 . 1 1 104 104 TYR C C 104 173.821 173.821 175.300 -1.479 17927 3068 1 4 . 1 1 104 104 TYR CA C 104 58.498 58.498 58.207 0.291 17927 3069 1 4 . 1 1 104 104 TYR CB C 104 38.393 38.393 39.724 -1.331 17927 3070 1 4 . 1 1 104 104 TYR H H 104 7.203 7.203 7.249 -0.046 17927 3071 1 4 . 1 1 105 105 LEU N N 105 119.433 119.433 115.912 3.521 17927 3072 1 4 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.995 -0.010 17927 3073 1 4 . 1 1 105 105 LEU C C 105 176.721 176.721 176.341 0.380 17927 3074 1 4 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.965 -0.180 17927 3075 1 4 . 1 1 105 105 LEU CB C 105 38.443 38.443 40.293 -1.850 17927 3076 1 4 . 1 1 105 105 LEU H H 105 7.582 7.582 7.624 -0.042 17927 3077 1 4 . 1 1 106 106 ILE N N 106 119.575 119.575 117.349 2.226 17927 3078 1 4 . 1 1 106 106 ILE HA H 106 4.002 4.002 4.251 -0.249 17927 3079 1 4 . 1 1 106 106 ILE C C 106 175.459 175.459 174.618 0.841 17927 3080 1 4 . 1 1 106 106 ILE CA C 106 62.043 62.043 60.580 1.463 17927 3081 1 4 . 1 1 106 106 ILE CB C 106 36.335 36.335 38.524 -2.189 17927 3082 1 4 . 1 1 106 106 ILE H H 106 8.774 8.774 7.382 1.392 17927 3083 1 4 . 1 1 107 107 ASN N N 107 126.514 126.514 121.677 4.837 17927 3084 1 4 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.751 0.112 17927 3085 1 4 . 1 1 107 107 ASN C C 107 174.584 174.584 175.471 -0.887 17927 3086 1 4 . 1 1 107 107 ASN CA C 107 53.112 53.112 53.049 0.063 17927 3087 1 4 . 1 1 107 107 ASN CB C 107 38.977 38.977 38.454 0.523 17927 3088 1 4 . 1 1 107 107 ASN H H 107 8.364 8.364 8.492 -0.128 17927 3089 1 4 . 1 1 108 108 GLY N N 108 108.469 108.469 110.469 -2.000 17927 3090 1 4 . 1 1 108 108 GLY C C 108 171.245 171.245 173.370 -2.125 17927 3091 1 4 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.527 0.742 17927 3092 1 4 . 1 1 108 108 GLY H H 108 7.678 7.678 7.937 -0.259 17927 3093 1 4 . 1 1 109 109 ILE N N 109 112.817 112.817 119.631 -6.814 17927 3094 1 4 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.629 -0.223 17927 3095 1 4 . 1 1 109 109 ILE C C 109 173.498 173.498 174.500 -1.002 17927 3096 1 4 . 1 1 109 109 ILE CA C 109 58.384 58.384 56.897 1.487 17927 3097 1 4 . 1 1 109 109 ILE CB C 109 40.322 40.322 39.139 1.183 17927 3098 1 4 . 1 1 109 109 ILE H H 109 7.868 7.868 7.721 0.147 17927 3099 1 4 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.443 0.299 17927 3100 1 4 . 1 1 110 110 PRO C C 110 175.715 175.715 175.616 0.099 17927 3101 1 4 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.284 -0.007 17927 3102 1 4 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.491 3.877 17927 3103 1 4 . 1 1 111 111 ARG N N 111 122.358 122.358 122.065 0.293 17927 3104 1 4 . 1 1 111 111 ARG HA H 111 4.469 4.469 3.996 0.473 17927 3105 1 4 . 1 1 111 111 ARG C C 111 171.541 171.541 174.798 -3.257 17927 3106 1 4 . 1 1 111 111 ARG CA C 111 54.356 54.356 54.394 -0.038 17927 3107 1 4 . 1 1 111 111 ARG CB C 111 33.430 33.430 32.141 1.289 17927 3108 1 4 . 1 1 111 111 ARG H H 111 7.732 7.732 8.265 -0.533 17927 3109 1 4 . 1 1 112 112 PHE N N 112 125.103 125.103 120.794 4.309 17927 3110 1 4 . 1 1 112 112 PHE HA H 112 5.773 5.773 5.222 0.551 17927 3111 1 4 . 1 1 112 112 PHE C C 112 175.097 175.097 175.062 0.035 17927 3112 1 4 . 1 1 112 112 PHE CA C 112 55.791 55.791 56.202 -0.410 17927 3113 1 4 . 1 1 112 112 PHE CB C 112 40.928 40.928 40.355 0.573 17927 3114 1 4 . 1 1 112 112 PHE H H 112 8.929 8.929 8.397 0.532 17927 3115 1 4 . 1 1 113 113 ILE N N 113 123.778 123.778 122.215 1.563 17927 3116 1 4 . 1 1 113 113 ILE HA H 113 4.543 4.543 5.127 -0.584 17927 3117 1 4 . 1 1 113 113 ILE C C 113 173.197 173.197 174.073 -0.876 17927 3118 1 4 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.765 0.521 17927 3119 1 4 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.252 1.994 17927 3120 1 4 . 1 1 113 113 ILE H H 113 8.873 8.873 9.291 -0.418 17927 3121 1 4 . 1 1 114 114 LEU N N 114 127.146 127.146 127.806 -0.660 17927 3122 1 4 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.349 0.665 17927 3123 1 4 . 1 1 114 114 LEU C C 114 175.080 175.080 174.471 0.609 17927 3124 1 4 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.544 -0.143 17927 3125 1 4 . 1 1 114 114 LEU CB C 114 47.370 47.370 45.713 1.657 17927 3126 1 4 . 1 1 114 114 LEU H H 114 8.974 8.974 8.642 0.332 17927 3127 1 4 . 1 1 115 115 LEU N N 115 128.323 128.323 125.019 3.304 17927 3128 1 4 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.297 0.135 17927 3129 1 4 . 1 1 115 115 LEU C C 115 176.660 176.660 175.742 0.918 17927 3130 1 4 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.498 -0.421 17927 3131 1 4 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.057 -1.473 17927 3132 1 4 . 1 1 115 115 LEU H H 115 9.874 9.874 9.339 0.535 17927 3133 1 4 . 1 1 116 116 ASP N N 116 119.834 119.834 121.316 -1.482 17927 3134 1 4 . 1 1 116 116 ASP HA H 116 4.935 4.935 5.007 -0.072 17927 3135 1 4 . 1 1 116 116 ASP C C 116 176.898 176.898 178.017 -1.119 17927 3136 1 4 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.419 -1.114 17927 3137 1 4 . 1 1 116 116 ASP CB C 116 41.028 41.028 43.276 -2.248 17927 3138 1 4 . 1 1 116 116 ASP H H 116 9.357 9.357 8.769 0.588 17927 3139 1 4 . 1 1 117 117 ARG N N 117 113.356 113.356 121.309 -7.953 17927 3140 1 4 . 1 1 117 117 ARG HA H 117 3.717 3.717 4.165 -0.448 17927 3141 1 4 . 1 1 117 117 ARG C C 117 177.105 177.105 177.693 -0.588 17927 3142 1 4 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.372 -1.187 17927 3143 1 4 . 1 1 117 117 ARG CB C 117 30.437 30.437 30.197 0.240 17927 3144 1 4 . 1 1 117 117 ARG H H 117 7.697 7.697 8.840 -1.143 17927 3145 1 4 . 1 1 118 118 ASP N N 118 117.226 117.226 116.669 0.557 17927 3146 1 4 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.579 0.316 17927 3147 1 4 . 1 1 118 118 ASP C C 118 176.657 176.657 176.663 -0.006 17927 3148 1 4 . 1 1 118 118 ASP CA C 118 53.517 53.517 53.920 -0.403 17927 3149 1 4 . 1 1 118 118 ASP CB C 118 42.556 42.556 40.954 1.602 17927 3150 1 4 . 1 1 118 118 ASP H H 118 8.456 8.456 8.235 0.221 17927 3151 1 4 . 1 1 119 119 GLY N N 119 109.074 109.074 108.083 0.991 17927 3152 1 4 . 1 1 119 119 GLY C C 119 173.355 173.355 174.417 -1.062 17927 3153 1 4 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.372 0.884 17927 3154 1 4 . 1 1 119 119 GLY H H 119 8.183 8.183 8.190 -0.007 17927 3155 1 4 . 1 1 120 120 LYS N N 120 120.744 120.744 121.109 -0.365 17927 3156 1 4 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.472 0.061 17927 3157 1 4 . 1 1 120 120 LYS C C 120 177.229 177.229 176.302 0.927 17927 3158 1 4 . 1 1 120 120 LYS CA C 120 55.287 55.287 54.608 0.679 17927 3159 1 4 . 1 1 120 120 LYS CB C 120 32.581 32.581 31.638 0.943 17927 3160 1 4 . 1 1 120 120 LYS H H 120 8.449 8.449 7.558 0.891 17927 3161 1 4 . 1 1 121 121 ILE N N 121 121.221 121.221 128.123 -6.902 17927 3162 1 4 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.886 -0.000 17927 3163 1 4 . 1 1 121 121 ILE C C 121 177.819 177.819 176.236 1.583 17927 3164 1 4 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.237 0.678 17927 3165 1 4 . 1 1 121 121 ILE CB C 121 39.390 39.390 36.959 2.431 17927 3166 1 4 . 1 1 121 121 ILE H H 121 8.715 8.715 8.742 -0.028 17927 3167 1 4 . 1 1 122 122 ILE N N 122 127.165 127.165 129.104 -1.939 17927 3168 1 4 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.235 0.106 17927 3169 1 4 . 1 1 122 122 ILE C C 122 176.978 176.978 176.832 0.146 17927 3170 1 4 . 1 1 122 122 ILE CA C 122 63.719 63.719 62.200 1.519 17927 3171 1 4 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.305 0.347 17927 3172 1 4 . 1 1 122 122 ILE H H 122 8.974 8.974 8.535 0.439 17927 3173 1 4 . 1 1 123 123 SER N N 123 111.227 111.227 114.670 -3.443 17927 3174 1 4 . 1 1 123 123 SER HA H 123 4.738 4.738 4.731 0.007 17927 3175 1 4 . 1 1 123 123 SER C C 123 174.184 174.184 173.740 0.444 17927 3176 1 4 . 1 1 123 123 SER CA C 123 57.383 57.383 57.411 -0.028 17927 3177 1 4 . 1 1 123 123 SER CB C 123 65.326 65.326 64.903 0.423 17927 3178 1 4 . 1 1 123 123 SER H H 123 7.850 7.850 8.348 -0.498 17927 3179 1 4 . 1 1 124 124 ALA N N 124 131.373 131.373 128.583 2.790 17927 3180 1 4 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.169 0.316 17927 3181 1 4 . 1 1 124 124 ALA C C 124 175.147 175.147 176.989 -1.842 17927 3182 1 4 . 1 1 124 124 ALA CA C 124 53.035 53.035 54.362 -1.327 17927 3183 1 4 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.151 -0.488 17927 3184 1 4 . 1 1 124 124 ALA H H 124 9.384 9.384 8.722 0.662 17927 3185 1 4 . 1 1 125 125 ASN N N 125 119.476 119.476 116.312 3.164 17927 3186 1 4 . 1 1 125 125 ASN HA H 125 5.056 5.056 4.842 0.214 17927 3187 1 4 . 1 1 125 125 ASN C C 125 173.593 173.593 174.101 -0.508 17927 3188 1 4 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.402 -0.050 17927 3189 1 4 . 1 1 125 125 ASN CB C 125 38.304 38.304 38.122 0.182 17927 3190 1 4 . 1 1 125 125 ASN H H 125 8.191 8.191 8.038 0.153 17927 3191 1 4 . 1 1 126 126 MET N N 126 122.705 122.705 125.458 -2.753 17927 3192 1 4 . 1 1 126 126 MET HA H 126 4.585 4.585 5.141 -0.556 17927 3193 1 4 . 1 1 126 126 MET C C 126 175.215 175.215 174.320 0.895 17927 3194 1 4 . 1 1 126 126 MET CA C 126 53.849 53.849 53.515 0.334 17927 3195 1 4 . 1 1 126 126 MET CB C 126 31.312 31.312 36.665 -5.353 17927 3196 1 4 . 1 1 126 126 MET H H 126 8.376 8.376 9.031 -0.655 17927 3197 1 4 . 1 1 127 127 THR N N 127 111.016 111.016 110.536 0.480 17927 3198 1 4 . 1 1 127 127 THR HA H 127 4.291 4.291 4.674 -0.383 17927 3199 1 4 . 1 1 127 127 THR C C 127 174.574 174.574 172.990 1.584 17927 3200 1 4 . 1 1 127 127 THR CA C 127 62.085 62.085 59.450 2.635 17927 3201 1 4 . 1 1 127 127 THR CB C 127 69.733 69.733 71.366 -1.633 17927 3202 1 4 . 1 1 127 127 THR H H 127 7.714 7.714 8.026 -0.312 17927 3203 1 4 . 1 1 128 128 ARG N N 128 118.722 118.722 120.534 -1.812 17927 3204 1 4 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.703 -1.395 17927 3205 1 4 . 1 1 128 128 ARG C C 128 176.978 176.978 175.905 1.073 17927 3206 1 4 . 1 1 128 128 ARG CA C 128 54.727 54.727 53.652 1.075 17927 3207 1 4 . 1 1 128 128 ARG CB C 128 29.598 29.598 30.661 -1.063 17927 3208 1 4 . 1 1 128 128 ARG H H 128 8.658 8.658 7.599 1.059 17927 3209 1 4 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.263 -0.330 17927 3210 1 4 . 1 1 129 129 PRO C C 129 175.794 175.794 177.027 -1.233 17927 3211 1 4 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.364 1.185 17927 3212 1 4 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.653 0.024 17927 3213 1 4 . 1 1 130 130 SER N N 130 108.696 108.696 111.774 -3.078 17927 3214 1 4 . 1 1 130 130 SER HA H 130 3.988 3.988 4.205 -0.217 17927 3215 1 4 . 1 1 130 130 SER C C 130 174.445 174.445 174.552 -0.107 17927 3216 1 4 . 1 1 130 130 SER CA C 130 58.911 58.911 59.961 -1.050 17927 3217 1 4 . 1 1 130 130 SER CB C 130 62.680 62.680 63.028 -0.348 17927 3218 1 4 . 1 1 130 130 SER H H 130 8.375 8.375 8.118 0.257 17927 3219 1 4 . 1 1 131 131 ASP N N 131 126.377 126.377 121.213 5.164 17927 3220 1 4 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.973 -0.102 17927 3221 1 4 . 1 1 131 131 ASP C C 131 176.879 176.879 174.944 1.935 17927 3222 1 4 . 1 1 131 131 ASP CA C 131 51.195 51.195 50.850 0.345 17927 3223 1 4 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.615 0.201 17927 3224 1 4 . 1 1 131 131 ASP H H 131 7.514 7.514 7.887 -0.373 17927 3225 1 4 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.194 0.198 17927 3226 1 4 . 1 1 132 132 PRO C C 132 178.097 178.097 178.590 -0.493 17927 3227 1 4 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.723 0.356 17927 3228 1 4 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.312 0.097 17927 3229 1 4 . 1 1 133 133 LYS N N 133 116.306 116.306 117.722 -1.416 17927 3230 1 4 . 1 1 133 133 LYS HA H 133 3.958 3.958 4.261 -0.303 17927 3231 1 4 . 1 1 133 133 LYS C C 133 179.532 179.532 179.153 0.379 17927 3232 1 4 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.532 -1.011 17927 3233 1 4 . 1 1 133 133 LYS CB C 133 32.191 32.191 32.056 0.135 17927 3234 1 4 . 1 1 133 133 LYS H H 133 8.842 8.842 8.845 -0.003 17927 3235 1 4 . 1 1 134 134 THR N N 134 120.833 120.833 114.648 6.185 17927 3236 1 4 . 1 1 134 134 THR HA H 134 3.147 3.147 3.627 -0.480 17927 3237 1 4 . 1 1 134 134 THR C C 134 173.356 173.356 175.108 -1.752 17927 3238 1 4 . 1 1 134 134 THR CA C 134 66.383 66.383 65.393 0.990 17927 3239 1 4 . 1 1 134 134 THR CB C 134 66.847 66.847 67.885 -1.038 17927 3240 1 4 . 1 1 134 134 THR H H 134 8.292 8.292 7.309 0.983 17927 3241 1 4 . 1 1 135 135 ALA N N 135 121.720 121.720 123.929 -2.209 17927 3242 1 4 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.904 -0.321 17927 3243 1 4 . 1 1 135 135 ALA C C 135 178.902 178.902 179.884 -0.982 17927 3244 1 4 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.876 0.123 17927 3245 1 4 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.237 -0.462 17927 3246 1 4 . 1 1 135 135 ALA H H 135 7.030 7.030 7.255 -0.225 17927 3247 1 4 . 1 1 136 136 GLU N N 136 114.623 114.623 117.824 -3.201 17927 3248 1 4 . 1 1 136 136 GLU HA H 136 3.922 3.922 4.496 -0.574 17927 3249 1 4 . 1 1 136 136 GLU C C 136 179.199 179.199 178.610 0.589 17927 3250 1 4 . 1 1 136 136 GLU CA C 136 59.837 59.837 58.247 1.590 17927 3251 1 4 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.306 0.480 17927 3252 1 4 . 1 1 136 136 GLU H H 136 7.216 7.216 8.588 -1.372 17927 3253 1 4 . 1 1 137 137 LYS N N 137 120.789 120.789 120.486 0.303 17927 3254 1 4 . 1 1 137 137 LYS HA H 137 4.204 4.204 4.122 0.082 17927 3255 1 4 . 1 1 137 137 LYS C C 137 178.834 178.834 178.661 0.173 17927 3256 1 4 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.645 -1.302 17927 3257 1 4 . 1 1 137 137 LYS CB C 137 30.463 30.463 32.232 -1.769 17927 3258 1 4 . 1 1 137 137 LYS H H 137 7.681 7.681 7.303 0.378 17927 3259 1 4 . 1 1 138 138 PHE N N 138 118.373 118.373 118.382 -0.009 17927 3260 1 4 . 1 1 138 138 PHE HA H 138 4.033 4.033 4.015 0.018 17927 3261 1 4 . 1 1 138 138 PHE C C 138 178.027 178.027 177.406 0.621 17927 3262 1 4 . 1 1 138 138 PHE CA C 138 57.507 57.507 59.680 -2.173 17927 3263 1 4 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.809 -1.919 17927 3264 1 4 . 1 1 138 138 PHE H H 138 8.059 8.059 8.008 0.051 17927 3265 1 4 . 1 1 139 139 ASN N N 139 117.611 117.611 116.617 0.994 17927 3266 1 4 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.370 0.034 17927 3267 1 4 . 1 1 139 139 ASN C C 139 178.190 178.190 177.250 0.940 17927 3268 1 4 . 1 1 139 139 ASN CA C 139 56.224 56.224 55.955 0.269 17927 3269 1 4 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.949 -1.215 17927 3270 1 4 . 1 1 139 139 ASN H H 139 8.683 8.683 7.954 0.729 17927 3271 1 4 . 1 1 140 140 GLU N N 140 121.432 121.432 122.449 -1.017 17927 3272 1 4 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.049 -0.044 17927 3273 1 4 . 1 1 140 140 GLU C C 140 179.751 179.751 179.457 0.294 17927 3274 1 4 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.510 -0.200 17927 3275 1 4 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.593 0.462 17927 3276 1 4 . 1 1 140 140 GLU H H 140 7.868 7.868 7.700 0.168 17927 3277 1 4 . 1 1 141 141 LEU N N 141 119.968 119.968 119.011 0.957 17927 3278 1 4 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.008 0.008 17927 3279 1 4 . 1 1 141 141 LEU C C 141 179.293 179.293 179.335 -0.042 17927 3280 1 4 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.432 0.004 17927 3281 1 4 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.833 -0.650 17927 3282 1 4 . 1 1 141 141 LEU H H 141 8.303 8.303 8.250 0.053 17927 3283 1 4 . 1 1 142 142 LEU N N 142 115.040 115.040 115.881 -0.841 17927 3284 1 4 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.233 0.151 17927 3285 1 4 . 1 1 142 142 LEU C C 142 178.002 178.002 177.821 0.181 17927 3286 1 4 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.751 -0.472 17927 3287 1 4 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.191 0.455 17927 3288 1 4 . 1 1 142 142 LEU H H 142 8.230 8.230 7.699 0.531 17927 3289 1 4 . 1 1 143 143 GLY N N 143 108.977 108.977 106.854 2.123 17927 3290 1 4 . 1 1 143 143 GLY C C 143 175.216 175.216 174.645 0.571 17927 3291 1 4 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.414 1.327 17927 3292 1 4 . 1 1 143 143 GLY H H 143 7.762 7.762 7.853 -0.091 17927 3293 1 4 . 1 1 144 144 LEU N N 144 119.660 119.660 120.638 -0.978 17927 3294 1 4 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.556 -0.068 17927 3295 1 4 . 1 1 144 144 LEU C C 144 177.375 177.375 175.879 1.496 17927 3296 1 4 . 1 1 144 144 LEU CA C 144 54.525 54.525 54.088 0.437 17927 3297 1 4 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.231 0.542 17927 3298 1 4 . 1 1 144 144 LEU H H 144 8.241 8.241 8.050 0.191 17927 3299 1 4 . 1 1 145 145 GLU N N 145 119.959 119.959 118.950 1.009 17927 3300 1 4 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.217 0.024 17927 3301 1 4 . 1 1 145 145 GLU C C 145 177.075 177.075 177.095 -0.020 17927 3302 1 4 . 1 1 145 145 GLU CA C 145 56.799 56.799 57.464 -0.665 17927 3303 1 4 . 1 1 145 145 GLU CB C 145 30.168 30.168 30.369 -0.202 17927 3304 1 4 . 1 1 145 145 GLU H H 145 8.410 8.410 7.729 0.681 17927 3305 1 4 . 1 1 146 146 GLY N N 146 109.412 109.412 110.466 -1.054 17927 3306 1 4 . 1 1 146 146 GLY C C 146 174.276 174.276 174.779 -0.503 17927 3307 1 4 . 1 1 146 146 GLY CA C 146 45.445 45.445 44.725 0.720 17927 3308 1 4 . 1 1 146 146 GLY H H 146 8.422 8.422 8.673 -0.251 17927 3309 1 4 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.517 0.139 17927 3310 1 4 . 1 1 151 151 HIS C C 151 173.990 173.990 173.838 0.152 17927 3311 1 4 . 1 1 151 151 HIS CA C 151 56.044 56.044 55.885 0.159 17927 3312 1 4 . 1 1 151 151 HIS CB C 151 30.076 30.076 30.723 -0.647 17927 3313 1 5 . 1 1 2 2 SER HA H 2 4.121 4.121 4.988 -0.867 17927 3314 1 5 . 1 1 2 2 SER CA C 2 57.293 57.293 57.580 -0.286 17927 3315 1 5 . 1 1 2 2 SER CB C 2 63.545 63.545 64.542 -0.997 17927 3316 1 5 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.468 -0.036 17927 3317 1 5 . 1 1 3 3 LEU C C 3 177.383 177.383 175.649 1.734 17927 3318 1 5 . 1 1 3 3 LEU CA C 3 55.575 55.575 55.121 0.454 17927 3319 1 5 . 1 1 3 3 LEU CB C 3 42.584 42.584 41.151 1.433 17927 3320 1 5 . 1 1 4 4 ARG N N 4 122.080 122.080 120.724 1.356 17927 3321 1 5 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.527 -0.143 17927 3322 1 5 . 1 1 4 4 ARG C C 4 176.410 176.410 174.988 1.422 17927 3323 1 5 . 1 1 4 4 ARG CA C 4 56.269 56.269 55.519 0.750 17927 3324 1 5 . 1 1 4 4 ARG CB C 4 30.842 30.842 31.013 -0.171 17927 3325 1 5 . 1 1 4 4 ARG H H 4 8.410 8.410 7.664 0.746 17927 3326 1 5 . 1 1 5 5 SER N N 5 117.023 117.023 122.087 -5.064 17927 3327 1 5 . 1 1 5 5 SER HA H 5 4.423 4.423 4.503 -0.080 17927 3328 1 5 . 1 1 5 5 SER C C 5 175.039 175.039 174.804 0.235 17927 3329 1 5 . 1 1 5 5 SER CA C 5 58.605 58.605 59.399 -0.794 17927 3330 1 5 . 1 1 5 5 SER CB C 5 64.044 64.044 63.560 0.483 17927 3331 1 5 . 1 1 5 5 SER H H 5 8.292 8.292 8.848 -0.556 17927 3332 1 5 . 1 1 6 6 GLY N N 6 110.718 110.718 112.015 -1.297 17927 3333 1 5 . 1 1 6 6 GLY C C 6 173.654 173.654 173.036 0.618 17927 3334 1 5 . 1 1 6 6 GLY CA C 6 45.273 45.273 44.638 0.635 17927 3335 1 5 . 1 1 6 6 GLY H H 6 8.446 8.446 8.703 -0.257 17927 3336 1 5 . 1 1 7 7 ASN N N 7 119.287 119.287 115.505 3.782 17927 3337 1 5 . 1 1 7 7 ASN HA H 7 5.024 5.024 4.449 0.575 17927 3338 1 5 . 1 1 7 7 ASN C C 7 173.672 173.672 174.389 -0.717 17927 3339 1 5 . 1 1 7 7 ASN CA C 7 51.357 51.357 53.270 -1.913 17927 3340 1 5 . 1 1 7 7 ASN CB C 7 38.927 38.927 37.445 1.482 17927 3341 1 5 . 1 1 7 7 ASN H H 7 8.273 8.273 8.048 0.225 17927 3342 1 5 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.327 0.120 17927 3343 1 5 . 1 1 8 8 PRO C C 8 176.899 176.899 176.788 0.111 17927 3344 1 5 . 1 1 8 8 PRO CA C 8 63.429 63.429 63.705 -0.276 17927 3345 1 5 . 1 1 8 8 PRO CB C 8 32.216 32.216 32.127 0.089 17927 3346 1 5 . 1 1 9 9 SER N N 9 115.642 115.642 111.928 3.714 17927 3347 1 5 . 1 1 9 9 SER HA H 9 4.415 4.415 4.404 0.011 17927 3348 1 5 . 1 1 9 9 SER C C 9 174.714 174.714 175.266 -0.552 17927 3349 1 5 . 1 1 9 9 SER CA C 9 58.488 58.488 59.343 -0.855 17927 3350 1 5 . 1 1 9 9 SER CB C 9 64.048 64.048 62.654 1.394 17927 3351 1 5 . 1 1 9 9 SER H H 9 8.336 8.336 8.149 0.187 17927 3352 1 5 . 1 1 10 10 ALA N N 10 126.808 126.808 125.535 1.273 17927 3353 1 5 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.467 -0.205 17927 3354 1 5 . 1 1 10 10 ALA C C 10 177.233 177.233 177.560 -0.327 17927 3355 1 5 . 1 1 10 10 ALA CA C 10 53.230 53.230 54.325 -1.095 17927 3356 1 5 . 1 1 10 10 ALA CB C 10 19.187 19.187 18.425 0.762 17927 3357 1 5 . 1 1 10 10 ALA H H 10 8.137 8.137 9.278 -1.141 17927 3358 1 5 . 1 1 11 11 ALA N N 11 120.449 120.449 123.177 -2.728 17927 3359 1 5 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.323 -0.062 17927 3360 1 5 . 1 1 11 11 ALA C C 11 177.469 177.469 176.350 1.119 17927 3361 1 5 . 1 1 11 11 ALA CA C 11 52.475 52.475 51.331 1.144 17927 3362 1 5 . 1 1 11 11 ALA CB C 11 19.485 19.485 17.816 1.669 17927 3363 1 5 . 1 1 11 11 ALA H H 11 7.851 7.851 7.877 -0.026 17927 3364 1 5 . 1 1 12 12 SER N N 12 114.186 114.186 114.602 -0.416 17927 3365 1 5 . 1 1 12 12 SER HA H 12 4.312 4.312 3.961 0.351 17927 3366 1 5 . 1 1 12 12 SER C C 12 173.593 173.593 173.202 0.391 17927 3367 1 5 . 1 1 12 12 SER CA C 12 58.099 58.099 59.066 -0.967 17927 3368 1 5 . 1 1 12 12 SER CB C 12 63.320 63.320 62.241 1.079 17927 3369 1 5 . 1 1 12 12 SER H H 12 7.990 7.990 8.014 -0.024 17927 3370 1 5 . 1 1 13 13 PHE N N 13 118.092 118.092 119.254 -1.162 17927 3371 1 5 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.594 0.186 17927 3372 1 5 . 1 1 13 13 PHE C C 13 174.220 174.220 173.533 0.687 17927 3373 1 5 . 1 1 13 13 PHE CA C 13 56.717 56.717 55.590 1.127 17927 3374 1 5 . 1 1 13 13 PHE CB C 13 41.151 41.151 41.127 0.024 17927 3375 1 5 . 1 1 13 13 PHE H H 13 7.147 7.147 7.334 -0.187 17927 3376 1 5 . 1 1 14 14 SER N N 14 116.456 116.456 114.441 2.015 17927 3377 1 5 . 1 1 14 14 SER HA H 14 5.162 5.162 5.106 0.056 17927 3378 1 5 . 1 1 14 14 SER C C 14 172.626 172.626 172.722 -0.096 17927 3379 1 5 . 1 1 14 14 SER CA C 14 57.390 57.390 56.889 0.500 17927 3380 1 5 . 1 1 14 14 SER CB C 14 64.518 64.518 65.053 -0.535 17927 3381 1 5 . 1 1 14 14 SER H H 14 7.616 7.616 8.132 -0.516 17927 3382 1 5 . 1 1 15 15 TYR N N 15 122.384 122.384 121.751 0.633 17927 3383 1 5 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.971 0.235 17927 3384 1 5 . 1 1 15 15 TYR C C 15 172.543 172.543 173.247 -0.704 17927 3385 1 5 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.311 -0.365 17927 3386 1 5 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.483 0.744 17927 3387 1 5 . 1 1 15 15 TYR H H 15 8.558 8.558 9.123 -0.565 17927 3388 1 5 . 1 1 16 16 PRO HA H 16 5.109 5.109 5.388 -0.279 17927 3389 1 5 . 1 1 16 16 PRO C C 16 176.475 176.475 177.042 -0.567 17927 3390 1 5 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.172 -0.191 17927 3391 1 5 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.032 0.630 17927 3392 1 5 . 1 1 17 17 ASP N N 17 119.834 119.834 125.464 -5.630 17927 3393 1 5 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.838 0.901 17927 3394 1 5 . 1 1 17 17 ASP C C 17 180.740 180.740 177.938 2.802 17927 3395 1 5 . 1 1 17 17 ASP CA C 17 51.717 51.717 54.022 -2.304 17927 3396 1 5 . 1 1 17 17 ASP CB C 17 42.561 42.561 42.710 -0.149 17927 3397 1 5 . 1 1 17 17 ASP H H 17 8.643 8.643 8.901 -0.258 17927 3398 1 5 . 1 1 18 18 ILE N N 18 118.340 118.340 122.003 -3.663 17927 3399 1 5 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.872 0.579 17927 3400 1 5 . 1 1 18 18 ILE C C 18 175.742 175.742 176.343 -0.601 17927 3401 1 5 . 1 1 18 18 ILE CA C 18 61.894 61.894 62.684 -0.790 17927 3402 1 5 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.327 0.913 17927 3403 1 5 . 1 1 18 18 ILE H H 18 8.450 8.450 8.148 0.302 17927 3404 1 5 . 1 1 19 19 ASN N N 19 119.377 119.377 116.235 3.142 17927 3405 1 5 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.631 0.384 17927 3406 1 5 . 1 1 19 19 ASN C C 19 175.892 175.892 175.521 0.371 17927 3407 1 5 . 1 1 19 19 ASN CA C 19 53.307 53.307 53.587 -0.279 17927 3408 1 5 . 1 1 19 19 ASN CB C 19 39.825 39.825 38.833 0.992 17927 3409 1 5 . 1 1 19 19 ASN H H 19 8.376 8.376 8.888 -0.512 17927 3410 1 5 . 1 1 20 20 GLY N N 20 109.535 109.535 108.225 1.310 17927 3411 1 5 . 1 1 20 20 GLY C C 20 174.285 174.285 173.341 0.944 17927 3412 1 5 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.383 0.410 17927 3413 1 5 . 1 1 20 20 GLY H H 20 8.539 8.539 8.255 0.284 17927 3414 1 5 . 1 1 21 21 LYS N N 21 124.675 124.675 120.183 4.492 17927 3415 1 5 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.687 -0.244 17927 3416 1 5 . 1 1 21 21 LYS C C 21 176.537 176.537 175.896 0.641 17927 3417 1 5 . 1 1 21 21 LYS CA C 21 55.444 55.444 53.927 1.517 17927 3418 1 5 . 1 1 21 21 LYS CB C 21 32.754 32.754 35.456 -2.702 17927 3419 1 5 . 1 1 21 21 LYS H H 21 8.608 8.608 7.676 0.932 17927 3420 1 5 . 1 1 22 22 THR N N 22 120.666 120.666 122.115 -1.449 17927 3421 1 5 . 1 1 22 22 THR HA H 22 4.087 4.087 4.352 -0.265 17927 3422 1 5 . 1 1 22 22 THR C C 22 174.431 174.431 173.534 0.897 17927 3423 1 5 . 1 1 22 22 THR CA C 22 64.292 64.292 62.526 1.766 17927 3424 1 5 . 1 1 22 22 THR CB C 22 69.069 69.069 68.845 0.224 17927 3425 1 5 . 1 1 22 22 THR H H 22 8.595 8.595 8.564 0.031 17927 3426 1 5 . 1 1 23 23 VAL N N 23 131.207 131.207 129.161 2.046 17927 3427 1 5 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.451 -0.259 17927 3428 1 5 . 1 1 23 23 VAL C C 23 174.244 174.244 174.569 -0.325 17927 3429 1 5 . 1 1 23 23 VAL CA C 23 62.456 62.456 60.236 2.220 17927 3430 1 5 . 1 1 23 23 VAL CB C 23 33.791 33.791 34.156 -0.365 17927 3431 1 5 . 1 1 23 23 VAL H H 23 8.937 8.937 8.360 0.577 17927 3432 1 5 . 1 1 24 24 SER N N 24 120.787 120.787 120.276 0.511 17927 3433 1 5 . 1 1 24 24 SER HA H 24 5.407 5.407 5.104 0.303 17927 3434 1 5 . 1 1 24 24 SER C C 24 176.169 176.169 174.914 1.255 17927 3435 1 5 . 1 1 24 24 SER CA C 24 55.135 55.135 56.279 -1.144 17927 3436 1 5 . 1 1 24 24 SER CB C 24 65.646 65.646 66.392 -0.746 17927 3437 1 5 . 1 1 24 24 SER H H 24 8.554 8.554 8.249 0.305 17927 3438 1 5 . 1 1 25 25 LEU N N 25 124.332 124.332 121.463 2.869 17927 3439 1 5 . 1 1 25 25 LEU HA H 25 3.687 3.687 3.764 -0.077 17927 3440 1 5 . 1 1 25 25 LEU C C 25 179.364 179.364 177.159 2.205 17927 3441 1 5 . 1 1 25 25 LEU CA C 25 58.217 58.217 55.584 2.632 17927 3442 1 5 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.606 -1.068 17927 3443 1 5 . 1 1 25 25 LEU H H 25 7.811 7.811 8.665 -0.854 17927 3444 1 5 . 1 1 26 26 ALA N N 26 119.799 119.799 119.793 0.006 17927 3445 1 5 . 1 1 26 26 ALA HA H 26 3.993 3.993 3.831 0.162 17927 3446 1 5 . 1 1 26 26 ALA C C 26 179.719 179.719 179.252 0.467 17927 3447 1 5 . 1 1 26 26 ALA CA C 26 54.663 54.663 54.933 -0.270 17927 3448 1 5 . 1 1 26 26 ALA CB C 26 18.323 18.323 17.818 0.505 17927 3449 1 5 . 1 1 26 26 ALA H H 26 8.099 8.099 8.035 0.064 17927 3450 1 5 . 1 1 27 27 ASP N N 27 116.553 116.553 119.279 -2.726 17927 3451 1 5 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.351 0.122 17927 3452 1 5 . 1 1 27 27 ASP C C 27 176.915 176.915 177.389 -0.474 17927 3453 1 5 . 1 1 27 27 ASP CA C 27 56.251 56.251 56.464 -0.213 17927 3454 1 5 . 1 1 27 27 ASP CB C 27 40.788 40.788 40.846 -0.058 17927 3455 1 5 . 1 1 27 27 ASP H H 27 7.572 7.572 8.077 -0.505 17927 3456 1 5 . 1 1 28 28 LEU N N 28 118.950 118.950 116.339 2.611 17927 3457 1 5 . 1 1 28 28 LEU HA H 28 4.233 4.233 2.850 1.383 17927 3458 1 5 . 1 1 28 28 LEU C C 28 175.542 175.542 176.689 -1.147 17927 3459 1 5 . 1 1 28 28 LEU CA C 28 53.706 53.706 54.418 -0.712 17927 3460 1 5 . 1 1 28 28 LEU CB C 28 41.049 41.049 41.232 -0.183 17927 3461 1 5 . 1 1 28 28 LEU H H 28 7.363 7.363 6.840 0.523 17927 3462 1 5 . 1 1 29 29 LYS N N 29 118.429 118.429 118.656 -0.227 17927 3463 1 5 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.571 -0.219 17927 3464 1 5 . 1 1 29 29 LYS C C 29 178.063 178.063 178.060 0.003 17927 3465 1 5 . 1 1 29 29 LYS CA C 29 57.777 57.777 56.926 0.851 17927 3466 1 5 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.873 0.567 17927 3467 1 5 . 1 1 29 29 LYS H H 29 6.780 6.780 7.002 -0.222 17927 3468 1 5 . 1 1 30 30 GLY N N 30 112.426 112.426 108.012 4.414 17927 3469 1 5 . 1 1 30 30 GLY C C 30 173.801 173.801 173.296 0.505 17927 3470 1 5 . 1 1 30 30 GLY CA C 30 44.611 44.611 46.054 -1.443 17927 3471 1 5 . 1 1 30 30 GLY H H 30 9.398 9.398 8.528 0.870 17927 3472 1 5 . 1 1 31 31 LYS N N 31 119.295 119.295 120.242 -0.947 17927 3473 1 5 . 1 1 31 31 LYS HA H 31 4.152 4.152 5.066 -0.914 17927 3474 1 5 . 1 1 31 31 LYS C C 31 173.862 173.862 176.149 -2.287 17927 3475 1 5 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.580 0.608 17927 3476 1 5 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.622 1.346 17927 3477 1 5 . 1 1 31 31 LYS H H 31 7.496 7.496 7.207 0.289 17927 3478 1 5 . 1 1 32 32 TYR N N 32 116.984 116.984 123.806 -6.822 17927 3479 1 5 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.435 -0.278 17927 3480 1 5 . 1 1 32 32 TYR C C 32 175.226 175.226 175.412 -0.186 17927 3481 1 5 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.974 -0.384 17927 3482 1 5 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.400 -0.279 17927 3483 1 5 . 1 1 32 32 TYR H H 32 7.521 7.521 9.290 -1.769 17927 3484 1 5 . 1 1 33 33 ILE N N 33 118.052 118.052 118.652 -0.600 17927 3485 1 5 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.518 0.389 17927 3486 1 5 . 1 1 33 33 ILE C C 33 174.308 174.308 174.183 0.125 17927 3487 1 5 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.300 0.402 17927 3488 1 5 . 1 1 33 33 ILE CB C 33 41.616 41.616 41.240 0.376 17927 3489 1 5 . 1 1 33 33 ILE H H 33 8.467 8.467 8.844 -0.377 17927 3490 1 5 . 1 1 34 34 TYR N N 34 130.242 130.242 128.575 1.667 17927 3491 1 5 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.190 0.336 17927 3492 1 5 . 1 1 34 34 TYR C C 34 174.245 174.245 173.390 0.855 17927 3493 1 5 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.943 0.215 17927 3494 1 5 . 1 1 34 34 TYR CB C 34 40.133 40.133 41.006 -0.873 17927 3495 1 5 . 1 1 34 34 TYR H H 34 8.905 8.905 9.165 -0.260 17927 3496 1 5 . 1 1 35 35 ILE N N 35 128.697 128.697 128.938 -0.241 17927 3497 1 5 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.400 -0.058 17927 3498 1 5 . 1 1 35 35 ILE C C 35 174.520 174.520 174.276 0.244 17927 3499 1 5 . 1 1 35 35 ILE CA C 35 59.749 59.749 58.449 1.300 17927 3500 1 5 . 1 1 35 35 ILE CB C 35 40.899 40.899 39.138 1.761 17927 3501 1 5 . 1 1 35 35 ILE H H 35 9.445 9.445 8.411 1.034 17927 3502 1 5 . 1 1 36 36 ASP N N 36 123.675 123.675 125.680 -2.005 17927 3503 1 5 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.827 -0.979 17927 3504 1 5 . 1 1 36 36 ASP C C 36 174.385 174.385 174.771 -0.386 17927 3505 1 5 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.849 -0.555 17927 3506 1 5 . 1 1 36 36 ASP CB C 36 41.778 41.778 46.001 -4.223 17927 3507 1 5 . 1 1 36 36 ASP H H 36 8.875 8.875 8.514 0.361 17927 3508 1 5 . 1 1 37 37 VAL N N 37 127.159 127.159 120.350 6.809 17927 3509 1 5 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.838 0.121 17927 3510 1 5 . 1 1 37 37 VAL C C 37 175.046 175.046 174.878 0.168 17927 3511 1 5 . 1 1 37 37 VAL CA C 37 62.245 62.245 61.005 1.240 17927 3512 1 5 . 1 1 37 37 VAL CB C 37 31.807 31.807 33.208 -1.401 17927 3513 1 5 . 1 1 37 37 VAL H H 37 8.603 8.603 8.026 0.577 17927 3514 1 5 . 1 1 38 38 TRP N N 38 124.161 124.161 125.880 -1.719 17927 3515 1 5 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.425 -0.188 17927 3516 1 5 . 1 1 38 38 TRP C C 38 171.995 171.995 173.515 -1.520 17927 3517 1 5 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.770 1.437 17927 3518 1 5 . 1 1 38 38 TRP CB C 38 33.187 33.187 31.731 1.456 17927 3519 1 5 . 1 1 38 38 TRP H H 38 8.562 8.562 8.650 -0.088 17927 3520 1 5 . 1 1 39 39 ALA N N 39 116.252 116.252 125.115 -8.863 17927 3521 1 5 . 1 1 39 39 ALA HA H 39 3.678 3.678 3.326 0.352 17927 3522 1 5 . 1 1 39 39 ALA C C 39 178.664 178.664 175.120 3.544 17927 3523 1 5 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.338 1.128 17927 3524 1 5 . 1 1 39 39 ALA CB C 39 22.341 22.341 20.834 1.507 17927 3525 1 5 . 1 1 39 39 ALA H H 39 6.757 6.757 7.773 -1.016 17927 3526 1 5 . 1 1 40 40 THR N N 40 114.321 114.321 113.560 0.761 17927 3527 1 5 . 1 1 40 40 THR HA H 40 3.907 3.907 4.466 -0.559 17927 3528 1 5 . 1 1 40 40 THR C C 40 175.885 175.885 175.775 0.110 17927 3529 1 5 . 1 1 40 40 THR CA C 40 65.447 65.447 63.789 1.658 17927 3530 1 5 . 1 1 40 40 THR CB C 40 70.106 70.106 69.181 0.925 17927 3531 1 5 . 1 1 40 40 THR H H 40 9.639 9.639 8.217 1.422 17927 3532 1 5 . 1 1 41 41 TRP N N 41 114.483 114.483 121.237 -6.754 17927 3533 1 5 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.787 -0.224 17927 3534 1 5 . 1 1 41 41 TRP C C 41 176.189 176.189 175.679 0.510 17927 3535 1 5 . 1 1 41 41 TRP CA C 41 54.698 54.698 56.410 -1.712 17927 3536 1 5 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.838 1.139 17927 3537 1 5 . 1 1 41 41 TRP H H 41 6.401 6.401 7.319 -0.918 17927 3538 1 5 . 1 1 42 42 CYS N N 42 123.536 123.536 119.785 3.751 17927 3539 1 5 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.673 -0.105 17927 3540 1 5 . 1 1 42 42 CYS C C 42 175.726 175.726 175.965 -0.239 17927 3541 1 5 . 1 1 42 42 CYS CA C 42 58.700 58.700 56.759 1.941 17927 3542 1 5 . 1 1 42 42 CYS CB C 42 27.121 27.121 25.948 1.173 17927 3543 1 5 . 1 1 42 42 CYS H H 42 6.883 6.883 7.200 -0.317 17927 3544 1 5 . 1 1 43 43 GLY N N 43 120.977 120.977 112.995 7.982 17927 3545 1 5 . 1 1 43 43 GLY CA C 43 49.204 49.204 47.327 1.877 17927 3546 1 5 . 1 1 43 43 GLY H H 43 9.653 9.653 8.525 1.128 17927 3547 1 5 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.293 0.194 17927 3548 1 5 . 1 1 44 44 PRO C C 44 179.956 179.956 178.632 1.324 17927 3549 1 5 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.202 0.440 17927 3550 1 5 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.392 1.186 17927 3551 1 5 . 1 1 45 45 CYS N N 45 113.925 113.925 114.927 -1.002 17927 3552 1 5 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.383 -0.070 17927 3553 1 5 . 1 1 45 45 CYS C C 45 178.325 178.325 176.216 2.109 17927 3554 1 5 . 1 1 45 45 CYS CA C 45 63.392 63.392 60.838 2.554 17927 3555 1 5 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.455 1.050 17927 3556 1 5 . 1 1 45 45 CYS H H 45 7.676 7.676 8.310 -0.634 17927 3557 1 5 . 1 1 46 46 ARG N N 46 120.336 120.336 118.460 1.876 17927 3558 1 5 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.197 -0.128 17927 3559 1 5 . 1 1 46 46 ARG C C 46 180.446 180.446 177.770 2.676 17927 3560 1 5 . 1 1 46 46 ARG CA C 46 59.785 59.785 57.930 1.855 17927 3561 1 5 . 1 1 46 46 ARG CB C 46 29.868 29.868 30.034 -0.166 17927 3562 1 5 . 1 1 46 46 ARG H H 46 8.109 8.109 7.756 0.353 17927 3563 1 5 . 1 1 47 47 GLY N N 47 105.408 105.408 106.826 -1.418 17927 3564 1 5 . 1 1 47 47 GLY C C 47 175.258 175.258 174.782 0.476 17927 3565 1 5 . 1 1 47 47 GLY CA C 47 46.594 46.594 45.866 0.728 17927 3566 1 5 . 1 1 47 47 GLY H H 47 8.466 8.466 7.883 0.583 17927 3567 1 5 . 1 1 48 48 GLU N N 48 116.343 116.343 119.229 -2.886 17927 3568 1 5 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.494 0.031 17927 3569 1 5 . 1 1 48 48 GLU C C 48 176.535 176.535 178.024 -1.489 17927 3570 1 5 . 1 1 48 48 GLU CA C 48 55.792 55.792 55.779 0.013 17927 3571 1 5 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.798 1.184 17927 3572 1 5 . 1 1 48 48 GLU H H 48 7.050 7.050 7.718 -0.668 17927 3573 1 5 . 1 1 49 49 LEU N N 49 118.652 118.652 122.229 -3.577 17927 3574 1 5 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.211 -0.059 17927 3575 1 5 . 1 1 49 49 LEU C C 49 176.832 176.832 176.662 0.170 17927 3576 1 5 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.094 -0.749 17927 3577 1 5 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.497 -1.001 17927 3578 1 5 . 1 1 49 49 LEU H H 49 7.385 7.385 7.654 -0.269 17927 3579 1 5 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.173 0.080 17927 3580 1 5 . 1 1 50 50 PRO C C 50 179.744 179.744 178.055 1.689 17927 3581 1 5 . 1 1 50 50 PRO CA C 50 66.559 66.559 65.726 0.833 17927 3582 1 5 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.905 -0.144 17927 3583 1 5 . 1 1 51 51 ALA N N 51 120.418 120.418 119.398 1.020 17927 3584 1 5 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.147 -0.002 17927 3585 1 5 . 1 1 51 51 ALA C C 51 180.329 180.329 179.636 0.693 17927 3586 1 5 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.524 -0.090 17927 3587 1 5 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.085 0.285 17927 3588 1 5 . 1 1 51 51 ALA H H 51 7.731 7.731 8.288 -0.557 17927 3589 1 5 . 1 1 52 52 LEU N N 52 121.506 121.506 119.082 2.424 17927 3590 1 5 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.927 0.061 17927 3591 1 5 . 1 1 52 52 LEU C C 52 177.944 177.944 177.872 0.072 17927 3592 1 5 . 1 1 52 52 LEU CA C 52 58.327 58.327 57.600 0.727 17927 3593 1 5 . 1 1 52 52 LEU CB C 52 42.382 42.382 41.735 0.647 17927 3594 1 5 . 1 1 52 52 LEU H H 52 8.355 8.355 7.415 0.940 17927 3595 1 5 . 1 1 53 53 LYS N N 53 119.732 119.732 119.591 0.141 17927 3596 1 5 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.839 0.064 17927 3597 1 5 . 1 1 53 53 LYS C C 53 179.030 179.030 178.316 0.714 17927 3598 1 5 . 1 1 53 53 LYS CA C 53 59.846 59.846 59.520 0.327 17927 3599 1 5 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.909 0.302 17927 3600 1 5 . 1 1 53 53 LYS H H 53 8.148 8.148 7.286 0.862 17927 3601 1 5 . 1 1 54 54 GLU N N 54 117.779 117.779 119.343 -1.564 17927 3602 1 5 . 1 1 54 54 GLU HA H 54 4.059 4.059 3.941 0.118 17927 3603 1 5 . 1 1 54 54 GLU C C 54 179.646 179.646 179.240 0.406 17927 3604 1 5 . 1 1 54 54 GLU CA C 54 59.625 59.625 58.922 0.703 17927 3605 1 5 . 1 1 54 54 GLU CB C 54 29.567 29.567 28.962 0.605 17927 3606 1 5 . 1 1 54 54 GLU H H 54 7.585 7.585 7.851 -0.266 17927 3607 1 5 . 1 1 55 55 LEU N N 55 120.581 120.581 119.948 0.633 17927 3608 1 5 . 1 1 55 55 LEU HA H 55 4.193 4.193 3.840 0.353 17927 3609 1 5 . 1 1 55 55 LEU C C 55 178.557 178.557 178.787 -0.230 17927 3610 1 5 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.939 0.296 17927 3611 1 5 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.442 1.569 17927 3612 1 5 . 1 1 55 55 LEU H H 55 8.096 8.096 8.195 -0.099 17927 3613 1 5 . 1 1 56 56 GLU N N 56 118.023 118.023 119.042 -1.019 17927 3614 1 5 . 1 1 56 56 GLU HA H 56 3.177 3.177 3.788 -0.611 17927 3615 1 5 . 1 1 56 56 GLU C C 56 179.650 179.650 179.336 0.314 17927 3616 1 5 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.448 -0.577 17927 3617 1 5 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.534 -2.549 17927 3618 1 5 . 1 1 56 56 GLU H H 56 8.181 8.181 7.755 0.426 17927 3619 1 5 . 1 1 57 57 GLU N N 57 117.828 117.828 117.371 0.457 17927 3620 1 5 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.174 -0.070 17927 3621 1 5 . 1 1 57 57 GLU C C 57 179.700 179.700 178.740 0.960 17927 3622 1 5 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.469 0.558 17927 3623 1 5 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.229 0.436 17927 3624 1 5 . 1 1 57 57 GLU H H 57 7.762 7.762 8.120 -0.358 17927 3625 1 5 . 1 1 58 58 LYS N N 58 120.896 120.896 118.959 1.937 17927 3626 1 5 . 1 1 58 58 LYS HA H 58 3.979 3.979 3.932 0.047 17927 3627 1 5 . 1 1 58 58 LYS C C 58 178.715 178.715 176.468 2.247 17927 3628 1 5 . 1 1 58 58 LYS CA C 58 59.078 59.078 57.976 1.102 17927 3629 1 5 . 1 1 58 58 LYS CB C 58 32.980 32.980 32.508 0.472 17927 3630 1 5 . 1 1 58 58 LYS H H 58 8.410 8.410 7.796 0.614 17927 3631 1 5 . 1 1 59 59 TYR N N 59 113.713 113.713 115.540 -1.827 17927 3632 1 5 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.740 -0.428 17927 3633 1 5 . 1 1 59 59 TYR C C 59 175.025 175.025 175.005 0.020 17927 3634 1 5 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.393 2.580 17927 3635 1 5 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.952 -1.518 17927 3636 1 5 . 1 1 59 59 TYR H H 59 8.102 8.102 7.407 0.695 17927 3637 1 5 . 1 1 60 60 ALA N N 60 126.637 126.637 123.799 2.838 17927 3638 1 5 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.296 0.122 17927 3639 1 5 . 1 1 60 60 ALA C C 60 179.208 179.208 177.713 1.495 17927 3640 1 5 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.910 0.624 17927 3641 1 5 . 1 1 60 60 ALA CB C 60 18.589 18.589 17.508 1.081 17927 3642 1 5 . 1 1 60 60 ALA H H 60 7.201 7.201 7.605 -0.404 17927 3643 1 5 . 1 1 61 61 GLY N N 61 111.816 111.816 111.814 0.002 17927 3644 1 5 . 1 1 61 61 GLY C C 61 174.698 174.698 174.823 -0.125 17927 3645 1 5 . 1 1 61 61 GLY CA C 61 45.904 45.904 44.838 1.066 17927 3646 1 5 . 1 1 61 61 GLY H H 61 9.184 9.184 8.313 0.871 17927 3647 1 5 . 1 1 62 62 LYS N N 62 118.497 118.497 121.513 -3.016 17927 3648 1 5 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.564 0.315 17927 3649 1 5 . 1 1 62 62 LYS C C 62 179.019 179.019 175.182 3.837 17927 3650 1 5 . 1 1 62 62 LYS CA C 62 53.988 53.988 55.422 -1.435 17927 3651 1 5 . 1 1 62 62 LYS CB C 62 33.840 33.840 33.748 0.092 17927 3652 1 5 . 1 1 62 62 LYS H H 62 8.019 8.019 7.907 0.112 17927 3653 1 5 . 1 1 63 63 ASP N N 63 122.982 122.982 119.915 3.067 17927 3654 1 5 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.826 -0.299 17927 3655 1 5 . 1 1 63 63 ASP C C 63 174.065 174.065 174.751 -0.686 17927 3656 1 5 . 1 1 63 63 ASP CA C 63 55.055 55.055 53.202 1.853 17927 3657 1 5 . 1 1 63 63 ASP CB C 63 38.582 38.582 40.954 -2.372 17927 3658 1 5 . 1 1 63 63 ASP H H 63 8.709 8.709 8.564 0.145 17927 3659 1 5 . 1 1 64 64 ILE N N 64 122.219 122.219 120.583 1.636 17927 3660 1 5 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.359 0.248 17927 3661 1 5 . 1 1 64 64 ILE C C 64 174.627 174.627 173.369 1.258 17927 3662 1 5 . 1 1 64 64 ILE CA C 64 59.712 59.712 59.852 -0.140 17927 3663 1 5 . 1 1 64 64 ILE CB C 64 42.133 42.133 40.824 1.309 17927 3664 1 5 . 1 1 64 64 ILE H H 64 8.678 8.678 7.709 0.969 17927 3665 1 5 . 1 1 65 65 HIS N N 65 125.584 125.584 126.402 -0.818 17927 3666 1 5 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.816 0.227 17927 3667 1 5 . 1 1 65 65 HIS C C 65 174.153 174.153 174.092 0.061 17927 3668 1 5 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.410 0.549 17927 3669 1 5 . 1 1 65 65 HIS CB C 65 34.156 34.156 30.393 3.763 17927 3670 1 5 . 1 1 65 65 HIS H H 65 9.204 9.204 8.944 0.260 17927 3671 1 5 . 1 1 66 66 PHE N N 66 123.244 123.244 125.934 -2.690 17927 3672 1 5 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.634 0.576 17927 3673 1 5 . 1 1 66 66 PHE C C 66 175.463 175.463 174.606 0.857 17927 3674 1 5 . 1 1 66 66 PHE CA C 66 58.088 58.088 58.553 -0.465 17927 3675 1 5 . 1 1 66 66 PHE CB C 66 39.637 39.637 38.368 1.269 17927 3676 1 5 . 1 1 66 66 PHE H H 66 9.262 9.262 9.028 0.234 17927 3677 1 5 . 1 1 67 67 VAL N N 67 126.201 126.201 125.527 0.674 17927 3678 1 5 . 1 1 67 67 VAL HA H 67 4.834 4.834 5.414 -0.580 17927 3679 1 5 . 1 1 67 67 VAL C C 67 174.364 174.364 175.386 -1.022 17927 3680 1 5 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.277 0.447 17927 3681 1 5 . 1 1 67 67 VAL CB C 67 34.893 34.893 33.890 1.003 17927 3682 1 5 . 1 1 67 67 VAL H H 67 8.843 8.843 9.304 -0.461 17927 3683 1 5 . 1 1 68 68 SER N N 68 124.528 124.528 122.723 1.805 17927 3684 1 5 . 1 1 68 68 SER HA H 68 5.585 5.585 5.532 0.053 17927 3685 1 5 . 1 1 68 68 SER C C 68 172.858 172.858 173.036 -0.178 17927 3686 1 5 . 1 1 68 68 SER CA C 68 57.282 57.282 57.331 -0.049 17927 3687 1 5 . 1 1 68 68 SER CB C 68 65.032 65.032 65.405 -0.373 17927 3688 1 5 . 1 1 68 68 SER H H 68 9.243 9.243 8.628 0.615 17927 3689 1 5 . 1 1 69 69 LEU N N 69 126.695 126.695 123.747 2.948 17927 3690 1 5 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.634 -1.117 17927 3691 1 5 . 1 1 69 69 LEU C C 69 174.652 174.652 176.798 -2.146 17927 3692 1 5 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.565 -0.738 17927 3693 1 5 . 1 1 69 69 LEU CB C 69 43.895 43.895 43.829 0.066 17927 3694 1 5 . 1 1 69 69 LEU H H 69 9.360 9.360 9.237 0.123 17927 3695 1 5 . 1 1 70 70 SER N N 70 116.379 116.379 118.282 -1.903 17927 3696 1 5 . 1 1 70 70 SER HA H 70 4.905 4.905 4.962 -0.057 17927 3697 1 5 . 1 1 70 70 SER C C 70 176.307 176.307 174.513 1.794 17927 3698 1 5 . 1 1 70 70 SER CA C 70 55.213 55.213 56.397 -1.184 17927 3699 1 5 . 1 1 70 70 SER CB C 70 63.519 63.519 63.940 -0.421 17927 3700 1 5 . 1 1 70 70 SER H H 70 7.981 7.981 8.984 -1.003 17927 3701 1 5 . 1 1 71 71 CYS N N 71 124.670 124.670 128.081 -3.411 17927 3702 1 5 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.513 0.445 17927 3703 1 5 . 1 1 71 71 CYS C C 71 173.996 173.996 174.156 -0.160 17927 3704 1 5 . 1 1 71 71 CYS CA C 71 55.483 55.483 58.504 -3.021 17927 3705 1 5 . 1 1 71 71 CYS CB C 71 28.112 28.112 26.566 1.546 17927 3706 1 5 . 1 1 71 71 CYS H H 71 8.609 8.609 9.076 -0.467 17927 3707 1 5 . 1 1 72 72 ASP N N 72 122.398 122.398 123.201 -0.803 17927 3708 1 5 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.740 -0.448 17927 3709 1 5 . 1 1 72 72 ASP C C 72 176.653 176.653 176.715 -0.062 17927 3710 1 5 . 1 1 72 72 ASP CA C 72 56.782 56.782 54.606 2.175 17927 3711 1 5 . 1 1 72 72 ASP CB C 72 41.526 41.526 41.901 -0.374 17927 3712 1 5 . 1 1 72 72 ASP H H 72 8.557 8.557 7.445 1.112 17927 3713 1 5 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.227 -0.162 17927 3714 1 5 . 1 1 73 73 LYS C C 73 176.545 176.545 176.174 0.371 17927 3715 1 5 . 1 1 73 73 LYS CA C 73 58.458 58.458 57.319 1.139 17927 3716 1 5 . 1 1 73 73 LYS CB C 73 32.641 32.641 31.933 0.708 17927 3717 1 5 . 1 1 74 74 ASN N N 74 117.616 117.616 120.122 -2.506 17927 3718 1 5 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.902 0.003 17927 3719 1 5 . 1 1 74 74 ASN C C 74 174.894 174.894 175.001 -0.107 17927 3720 1 5 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.258 -0.737 17927 3721 1 5 . 1 1 74 74 ASN CB C 74 38.109 38.109 38.182 -0.073 17927 3722 1 5 . 1 1 74 74 ASN H H 74 8.625 8.625 7.848 0.777 17927 3723 1 5 . 1 1 75 75 LYS N N 75 126.797 126.797 123.374 3.423 17927 3724 1 5 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.732 -0.309 17927 3725 1 5 . 1 1 75 75 LYS C C 75 178.058 178.058 177.816 0.242 17927 3726 1 5 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.436 -0.263 17927 3727 1 5 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.291 1.000 17927 3728 1 5 . 1 1 75 75 LYS H H 75 8.588 8.588 7.669 0.919 17927 3729 1 5 . 1 1 76 76 LYS N N 76 117.875 117.875 119.099 -1.224 17927 3730 1 5 . 1 1 76 76 LYS HA H 76 4.200 4.200 4.340 -0.140 17927 3731 1 5 . 1 1 76 76 LYS C C 76 178.791 178.791 178.674 0.117 17927 3732 1 5 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.365 -0.757 17927 3733 1 5 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.545 -0.055 17927 3734 1 5 . 1 1 76 76 LYS H H 76 8.041 8.041 8.365 -0.324 17927 3735 1 5 . 1 1 77 77 ALA N N 77 121.567 121.567 121.119 0.448 17927 3736 1 5 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.180 -0.057 17927 3737 1 5 . 1 1 77 77 ALA C C 77 181.191 181.191 179.640 1.551 17927 3738 1 5 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.663 0.294 17927 3739 1 5 . 1 1 77 77 ALA CB C 77 17.759 17.759 17.945 -0.186 17927 3740 1 5 . 1 1 77 77 ALA H H 77 7.366 7.366 8.207 -0.841 17927 3741 1 5 . 1 1 78 78 TRP N N 78 119.497 119.497 120.284 -0.787 17927 3742 1 5 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.164 -0.087 17927 3743 1 5 . 1 1 78 78 TRP C C 78 175.942 175.942 177.455 -1.513 17927 3744 1 5 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.479 2.282 17927 3745 1 5 . 1 1 78 78 TRP CB C 78 27.272 27.272 29.732 -2.460 17927 3746 1 5 . 1 1 78 78 TRP H H 78 7.187 7.187 8.498 -1.311 17927 3747 1 5 . 1 1 79 79 GLU N N 79 118.771 118.771 118.773 -0.002 17927 3748 1 5 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.578 -0.564 17927 3749 1 5 . 1 1 79 79 GLU C C 79 179.863 179.863 179.064 0.799 17927 3750 1 5 . 1 1 79 79 GLU CA C 79 59.110 59.110 60.175 -1.065 17927 3751 1 5 . 1 1 79 79 GLU CB C 79 30.220 30.220 29.232 0.988 17927 3752 1 5 . 1 1 79 79 GLU H H 79 8.813 8.813 8.446 0.367 17927 3753 1 5 . 1 1 80 80 ASN N N 80 115.964 115.964 117.639 -1.675 17927 3754 1 5 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.423 -0.084 17927 3755 1 5 . 1 1 80 80 ASN C C 80 176.749 176.749 177.607 -0.858 17927 3756 1 5 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.719 0.316 17927 3757 1 5 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.262 0.227 17927 3758 1 5 . 1 1 80 80 ASN H H 80 8.491 8.491 7.724 0.767 17927 3759 1 5 . 1 1 81 81 MET N N 81 119.670 119.670 122.309 -2.639 17927 3760 1 5 . 1 1 81 81 MET HA H 81 4.149 4.149 4.222 -0.073 17927 3761 1 5 . 1 1 81 81 MET C C 81 177.933 177.933 177.654 0.279 17927 3762 1 5 . 1 1 81 81 MET CA C 81 60.276 60.276 58.039 2.236 17927 3763 1 5 . 1 1 81 81 MET CB C 81 32.518 32.518 32.044 0.474 17927 3764 1 5 . 1 1 81 81 MET H H 81 7.667 7.667 7.752 -0.085 17927 3765 1 5 . 1 1 82 82 VAL N N 82 117.634 117.634 118.427 -0.793 17927 3766 1 5 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.456 -0.153 17927 3767 1 5 . 1 1 82 82 VAL C C 82 179.005 179.005 177.418 1.587 17927 3768 1 5 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.066 0.971 17927 3769 1 5 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.389 0.376 17927 3770 1 5 . 1 1 82 82 VAL H H 82 8.338 8.338 7.447 0.891 17927 3771 1 5 . 1 1 83 83 THR N N 83 110.519 110.519 115.100 -4.581 17927 3772 1 5 . 1 1 83 83 THR HA H 83 3.983 3.983 3.985 -0.002 17927 3773 1 5 . 1 1 83 83 THR C C 83 177.591 177.591 176.171 1.420 17927 3774 1 5 . 1 1 83 83 THR CA C 83 65.431 65.431 66.285 -0.854 17927 3775 1 5 . 1 1 83 83 THR CB C 83 69.156 69.156 68.741 0.415 17927 3776 1 5 . 1 1 83 83 THR H H 83 7.659 7.659 7.728 -0.069 17927 3777 1 5 . 1 1 84 84 LYS N N 84 123.927 123.927 121.495 2.432 17927 3778 1 5 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.167 -0.098 17927 3779 1 5 . 1 1 84 84 LYS C C 84 178.582 178.582 177.948 0.634 17927 3780 1 5 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.300 1.577 17927 3781 1 5 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.508 -0.185 17927 3782 1 5 . 1 1 84 84 LYS H H 84 8.665 8.665 7.651 1.014 17927 3783 1 5 . 1 1 85 85 ASP N N 85 116.280 116.280 117.494 -1.214 17927 3784 1 5 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.658 0.092 17927 3785 1 5 . 1 1 85 85 ASP C C 85 175.086 175.086 175.237 -0.151 17927 3786 1 5 . 1 1 85 85 ASP CA C 85 54.693 54.693 55.167 -0.474 17927 3787 1 5 . 1 1 85 85 ASP CB C 85 39.685 39.685 40.822 -1.137 17927 3788 1 5 . 1 1 85 85 ASP H H 85 8.179 8.179 8.251 -0.072 17927 3789 1 5 . 1 1 86 86 GLN N N 86 116.258 116.258 112.811 3.447 17927 3790 1 5 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.852 0.056 17927 3791 1 5 . 1 1 86 86 GLN C C 86 175.659 175.659 175.304 0.355 17927 3792 1 5 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.282 -0.111 17927 3793 1 5 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.022 0.268 17927 3794 1 5 . 1 1 86 86 GLN H H 86 7.431 7.431 7.675 -0.244 17927 3795 1 5 . 1 1 87 87 LEU N N 87 117.031 117.031 118.391 -1.360 17927 3796 1 5 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.171 -0.081 17927 3797 1 5 . 1 1 87 87 LEU C C 87 178.225 178.225 176.584 1.641 17927 3798 1 5 . 1 1 87 87 LEU CA C 87 55.932 55.932 56.109 -0.177 17927 3799 1 5 . 1 1 87 87 LEU CB C 87 41.202 41.202 42.152 -0.950 17927 3800 1 5 . 1 1 87 87 LEU H H 87 7.736 7.736 7.333 0.403 17927 3801 1 5 . 1 1 88 88 LYS N N 88 122.367 122.367 120.128 2.239 17927 3802 1 5 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.878 -0.242 17927 3803 1 5 . 1 1 88 88 LYS C C 88 177.538 177.538 176.435 1.103 17927 3804 1 5 . 1 1 88 88 LYS CA C 88 54.930 54.930 54.489 0.441 17927 3805 1 5 . 1 1 88 88 LYS CB C 88 33.316 33.316 35.388 -2.072 17927 3806 1 5 . 1 1 88 88 LYS H H 88 8.496 8.496 8.369 0.127 17927 3807 1 5 . 1 1 89 89 GLY N N 89 108.452 108.452 106.766 1.686 17927 3808 1 5 . 1 1 89 89 GLY C C 89 173.781 173.781 174.003 -0.222 17927 3809 1 5 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.617 0.741 17927 3810 1 5 . 1 1 89 89 GLY H H 89 8.497 8.497 8.611 -0.114 17927 3811 1 5 . 1 1 90 90 ILE N N 90 123.295 123.295 122.699 0.596 17927 3812 1 5 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.025 0.346 17927 3813 1 5 . 1 1 90 90 ILE C C 90 175.606 175.606 175.220 0.386 17927 3814 1 5 . 1 1 90 90 ILE CA C 90 62.001 62.001 61.733 0.268 17927 3815 1 5 . 1 1 90 90 ILE CB C 90 38.036 38.036 37.945 0.091 17927 3816 1 5 . 1 1 90 90 ILE H H 90 8.728 8.728 8.394 0.334 17927 3817 1 5 . 1 1 91 91 GLN N N 91 128.632 128.632 127.189 1.443 17927 3818 1 5 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.423 0.343 17927 3819 1 5 . 1 1 91 91 GLN C C 91 174.618 174.618 174.484 0.134 17927 3820 1 5 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.742 1.108 17927 3821 1 5 . 1 1 91 91 GLN CB C 91 28.341 28.341 28.655 -0.314 17927 3822 1 5 . 1 1 91 91 GLN H H 91 8.762 8.762 8.621 0.141 17927 3823 1 5 . 1 1 92 92 LEU N N 92 120.830 120.830 123.954 -3.124 17927 3824 1 5 . 1 1 92 92 LEU HA H 92 5.580 5.580 4.855 0.725 17927 3825 1 5 . 1 1 92 92 LEU C C 92 176.828 176.828 175.213 1.615 17927 3826 1 5 . 1 1 92 92 LEU CA C 92 52.801 52.801 54.202 -1.401 17927 3827 1 5 . 1 1 92 92 LEU CB C 92 44.210 44.210 44.798 -0.588 17927 3828 1 5 . 1 1 92 92 LEU H H 92 9.011 9.011 9.249 -0.238 17927 3829 1 5 . 1 1 93 93 HIS N N 93 121.481 121.481 123.575 -2.094 17927 3830 1 5 . 1 1 93 93 HIS HA H 93 3.931 3.931 5.167 -1.236 17927 3831 1 5 . 1 1 93 93 HIS C C 93 173.590 173.590 173.562 0.028 17927 3832 1 5 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.415 1.168 17927 3833 1 5 . 1 1 93 93 HIS CB C 93 32.250 32.250 32.622 -0.372 17927 3834 1 5 . 1 1 93 93 HIS H H 93 8.038 8.038 8.887 -0.849 17927 3835 1 5 . 1 1 94 94 MET N N 94 121.881 121.881 124.245 -2.364 17927 3836 1 5 . 1 1 94 94 MET HA H 94 3.866 3.866 3.515 0.351 17927 3837 1 5 . 1 1 94 94 MET C C 94 177.035 177.035 175.842 1.193 17927 3838 1 5 . 1 1 94 94 MET CA C 94 55.189 55.189 57.312 -2.123 17927 3839 1 5 . 1 1 94 94 MET CB C 94 33.993 33.993 33.297 0.696 17927 3840 1 5 . 1 1 94 94 MET H H 94 8.039 8.039 8.247 -0.208 17927 3841 1 5 . 1 1 95 95 GLY N N 95 104.041 104.041 104.378 -0.337 17927 3842 1 5 . 1 1 95 95 GLY C C 95 174.251 174.251 174.076 0.175 17927 3843 1 5 . 1 1 95 95 GLY CA C 95 46.580 46.580 44.881 1.699 17927 3844 1 5 . 1 1 95 95 GLY H H 95 5.666 5.666 7.545 -1.879 17927 3845 1 5 . 1 1 96 96 THR N N 96 114.114 114.114 117.262 -3.148 17927 3846 1 5 . 1 1 96 96 THR HA H 96 4.211 4.211 4.459 -0.248 17927 3847 1 5 . 1 1 96 96 THR C C 96 175.122 175.122 173.424 1.698 17927 3848 1 5 . 1 1 96 96 THR CA C 96 61.339 61.339 62.055 -0.716 17927 3849 1 5 . 1 1 96 96 THR CB C 96 68.615 68.615 69.723 -1.108 17927 3850 1 5 . 1 1 96 96 THR H H 96 8.517 8.517 8.251 0.266 17927 3851 1 5 . 1 1 97 97 ASP N N 97 121.892 121.892 121.297 0.595 17927 3852 1 5 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.602 -0.017 17927 3853 1 5 . 1 1 97 97 ASP C C 97 178.241 178.241 175.995 2.246 17927 3854 1 5 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.417 1.383 17927 3855 1 5 . 1 1 97 97 ASP CB C 97 43.129 43.129 42.429 0.700 17927 3856 1 5 . 1 1 97 97 ASP H H 97 7.563 7.563 7.830 -0.267 17927 3857 1 5 . 1 1 98 98 ARG N N 98 127.508 127.508 125.529 1.979 17927 3858 1 5 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.569 -0.177 17927 3859 1 5 . 1 1 98 98 ARG C C 98 176.724 176.724 176.749 -0.025 17927 3860 1 5 . 1 1 98 98 ARG CA C 98 55.939 55.939 56.647 -0.708 17927 3861 1 5 . 1 1 98 98 ARG CB C 98 30.291 30.291 31.108 -0.817 17927 3862 1 5 . 1 1 98 98 ARG H H 98 9.225 9.225 8.785 0.440 17927 3863 1 5 . 1 1 99 99 THR N N 99 116.384 116.384 118.628 -2.244 17927 3864 1 5 . 1 1 99 99 THR HA H 99 3.987 3.987 4.127 -0.140 17927 3865 1 5 . 1 1 99 99 THR C C 99 176.969 176.969 175.778 1.191 17927 3866 1 5 . 1 1 99 99 THR CA C 99 67.714 67.714 67.195 0.519 17927 3867 1 5 . 1 1 99 99 THR CB C 99 68.777 68.777 68.813 -0.036 17927 3868 1 5 . 1 1 99 99 THR H H 99 8.382 8.382 8.310 0.072 17927 3869 1 5 . 1 1 100 100 PHE N N 100 123.232 123.232 122.577 0.655 17927 3870 1 5 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.471 -0.298 17927 3871 1 5 . 1 1 100 100 PHE C C 100 177.010 177.010 176.635 0.375 17927 3872 1 5 . 1 1 100 100 PHE CA C 100 61.923 61.923 60.158 1.765 17927 3873 1 5 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.320 1.442 17927 3874 1 5 . 1 1 100 100 PHE H H 100 7.998 7.998 9.326 -1.328 17927 3875 1 5 . 1 1 101 101 MET N N 101 115.968 115.968 120.475 -4.507 17927 3876 1 5 . 1 1 101 101 MET HA H 101 3.975 3.975 4.007 -0.032 17927 3877 1 5 . 1 1 101 101 MET C C 101 178.763 178.763 177.771 0.992 17927 3878 1 5 . 1 1 101 101 MET CA C 101 58.552 58.552 58.433 0.119 17927 3879 1 5 . 1 1 101 101 MET CB C 101 32.593 32.593 32.070 0.523 17927 3880 1 5 . 1 1 101 101 MET H H 101 7.828 7.828 7.750 0.078 17927 3881 1 5 . 1 1 102 102 ASP N N 102 117.553 117.553 118.205 -0.652 17927 3882 1 5 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.439 0.083 17927 3883 1 5 . 1 1 102 102 ASP C C 102 179.503 179.503 178.808 0.695 17927 3884 1 5 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.373 -0.483 17927 3885 1 5 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.658 -0.732 17927 3886 1 5 . 1 1 102 102 ASP H H 102 8.828 8.828 8.495 0.333 17927 3887 1 5 . 1 1 103 103 ALA N N 103 122.984 122.984 122.734 0.250 17927 3888 1 5 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.008 -0.022 17927 3889 1 5 . 1 1 103 103 ALA C C 103 178.782 178.782 178.323 0.459 17927 3890 1 5 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.484 0.610 17927 3891 1 5 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.254 0.309 17927 3892 1 5 . 1 1 103 103 ALA H H 103 7.567 7.567 7.526 0.041 17927 3893 1 5 . 1 1 104 104 TYR N N 104 112.159 112.159 114.527 -2.368 17927 3894 1 5 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.584 -0.360 17927 3895 1 5 . 1 1 104 104 TYR C C 104 173.821 173.821 174.726 -0.905 17927 3896 1 5 . 1 1 104 104 TYR CA C 104 58.498 58.498 57.301 1.197 17927 3897 1 5 . 1 1 104 104 TYR CB C 104 38.393 38.393 38.876 -0.483 17927 3898 1 5 . 1 1 104 104 TYR H H 104 7.203 7.203 7.370 -0.167 17927 3899 1 5 . 1 1 105 105 LEU N N 105 119.433 119.433 116.554 2.879 17927 3900 1 5 . 1 1 105 105 LEU HA H 105 3.985 3.985 4.019 -0.034 17927 3901 1 5 . 1 1 105 105 LEU C C 105 176.721 176.721 176.300 0.421 17927 3902 1 5 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.845 -0.060 17927 3903 1 5 . 1 1 105 105 LEU CB C 105 38.443 38.443 38.999 -0.556 17927 3904 1 5 . 1 1 105 105 LEU H H 105 7.582 7.582 7.735 -0.153 17927 3905 1 5 . 1 1 106 106 ILE N N 106 119.575 119.575 113.148 6.427 17927 3906 1 5 . 1 1 106 106 ILE HA H 106 4.002 4.002 4.128 -0.126 17927 3907 1 5 . 1 1 106 106 ILE C C 106 175.459 175.459 174.716 0.743 17927 3908 1 5 . 1 1 106 106 ILE CA C 106 62.043 62.043 62.021 0.022 17927 3909 1 5 . 1 1 106 106 ILE CB C 106 36.335 36.335 39.250 -2.915 17927 3910 1 5 . 1 1 106 106 ILE H H 106 8.774 8.774 7.253 1.521 17927 3911 1 5 . 1 1 107 107 ASN N N 107 126.514 126.514 122.369 4.145 17927 3912 1 5 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.749 0.114 17927 3913 1 5 . 1 1 107 107 ASN C C 107 174.584 174.584 175.883 -1.299 17927 3914 1 5 . 1 1 107 107 ASN CA C 107 53.112 53.112 53.560 -0.448 17927 3915 1 5 . 1 1 107 107 ASN CB C 107 38.977 38.977 39.657 -0.680 17927 3916 1 5 . 1 1 107 107 ASN H H 107 8.364 8.364 8.580 -0.216 17927 3917 1 5 . 1 1 108 108 GLY N N 108 108.469 108.469 111.794 -3.325 17927 3918 1 5 . 1 1 108 108 GLY C C 108 171.245 171.245 174.730 -3.485 17927 3919 1 5 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.750 0.519 17927 3920 1 5 . 1 1 108 108 GLY H H 108 7.678 7.678 8.329 -0.651 17927 3921 1 5 . 1 1 109 109 ILE N N 109 112.817 112.817 121.004 -8.187 17927 3922 1 5 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.308 0.098 17927 3923 1 5 . 1 1 109 109 ILE C C 109 173.498 173.498 174.850 -1.352 17927 3924 1 5 . 1 1 109 109 ILE CA C 109 58.384 58.384 57.604 0.780 17927 3925 1 5 . 1 1 109 109 ILE CB C 109 40.322 40.322 37.331 2.991 17927 3926 1 5 . 1 1 109 109 ILE H H 109 7.868 7.868 7.574 0.294 17927 3927 1 5 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.416 0.326 17927 3928 1 5 . 1 1 110 110 PRO C C 110 175.715 175.715 176.160 -0.445 17927 3929 1 5 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.589 -0.312 17927 3930 1 5 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.697 3.671 17927 3931 1 5 . 1 1 111 111 ARG N N 111 122.358 122.358 119.181 3.177 17927 3932 1 5 . 1 1 111 111 ARG HA H 111 4.469 4.469 4.120 0.349 17927 3933 1 5 . 1 1 111 111 ARG C C 111 171.541 171.541 174.392 -2.851 17927 3934 1 5 . 1 1 111 111 ARG CA C 111 54.356 54.356 53.930 0.426 17927 3935 1 5 . 1 1 111 111 ARG CB C 111 33.430 33.430 33.731 -0.301 17927 3936 1 5 . 1 1 111 111 ARG H H 111 7.732 7.732 8.460 -0.728 17927 3937 1 5 . 1 1 112 112 PHE N N 112 125.103 125.103 120.769 4.334 17927 3938 1 5 . 1 1 112 112 PHE HA H 112 5.773 5.773 5.210 0.563 17927 3939 1 5 . 1 1 112 112 PHE C C 112 175.097 175.097 174.721 0.376 17927 3940 1 5 . 1 1 112 112 PHE CA C 112 55.791 55.791 55.821 -0.029 17927 3941 1 5 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.176 1.752 17927 3942 1 5 . 1 1 112 112 PHE H H 112 8.929 8.929 7.392 1.537 17927 3943 1 5 . 1 1 113 113 ILE N N 113 123.778 123.778 122.884 0.894 17927 3944 1 5 . 1 1 113 113 ILE HA H 113 4.543 4.543 5.042 -0.499 17927 3945 1 5 . 1 1 113 113 ILE C C 113 173.197 173.197 174.077 -0.880 17927 3946 1 5 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.672 0.614 17927 3947 1 5 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.462 1.784 17927 3948 1 5 . 1 1 113 113 ILE H H 113 8.873 8.873 8.994 -0.121 17927 3949 1 5 . 1 1 114 114 LEU N N 114 127.146 127.146 126.502 0.644 17927 3950 1 5 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.346 0.668 17927 3951 1 5 . 1 1 114 114 LEU C C 114 175.080 175.080 174.445 0.635 17927 3952 1 5 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.647 -0.246 17927 3953 1 5 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.398 0.972 17927 3954 1 5 . 1 1 114 114 LEU H H 114 8.974 8.974 9.100 -0.126 17927 3955 1 5 . 1 1 115 115 LEU N N 115 128.323 128.323 124.732 3.591 17927 3956 1 5 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.170 0.262 17927 3957 1 5 . 1 1 115 115 LEU C C 115 176.660 176.660 175.454 1.206 17927 3958 1 5 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.650 -0.573 17927 3959 1 5 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.371 -1.787 17927 3960 1 5 . 1 1 115 115 LEU H H 115 9.874 9.874 9.324 0.550 17927 3961 1 5 . 1 1 116 116 ASP N N 116 119.834 119.834 121.231 -1.397 17927 3962 1 5 . 1 1 116 116 ASP HA H 116 4.935 4.935 4.904 0.031 17927 3963 1 5 . 1 1 116 116 ASP C C 116 176.898 176.898 177.283 -0.385 17927 3964 1 5 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.413 -1.108 17927 3965 1 5 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.751 -1.722 17927 3966 1 5 . 1 1 116 116 ASP H H 116 9.357 9.357 8.726 0.631 17927 3967 1 5 . 1 1 117 117 ARG N N 117 113.356 113.356 120.861 -7.505 17927 3968 1 5 . 1 1 117 117 ARG HA H 117 3.717 3.717 4.010 -0.293 17927 3969 1 5 . 1 1 117 117 ARG C C 117 177.105 177.105 178.074 -0.969 17927 3970 1 5 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.194 -1.009 17927 3971 1 5 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.934 0.503 17927 3972 1 5 . 1 1 117 117 ARG H H 117 7.697 7.697 8.143 -0.446 17927 3973 1 5 . 1 1 118 118 ASP N N 118 117.226 117.226 116.750 0.476 17927 3974 1 5 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.585 0.310 17927 3975 1 5 . 1 1 118 118 ASP C C 118 176.657 176.657 176.436 0.221 17927 3976 1 5 . 1 1 118 118 ASP CA C 118 53.517 53.517 53.794 -0.277 17927 3977 1 5 . 1 1 118 118 ASP CB C 118 42.556 42.556 40.858 1.698 17927 3978 1 5 . 1 1 118 118 ASP H H 118 8.456 8.456 8.247 0.209 17927 3979 1 5 . 1 1 119 119 GLY N N 119 109.074 109.074 108.331 0.743 17927 3980 1 5 . 1 1 119 119 GLY C C 119 173.355 173.355 174.269 -0.914 17927 3981 1 5 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.626 0.630 17927 3982 1 5 . 1 1 119 119 GLY H H 119 8.183 8.183 8.136 0.047 17927 3983 1 5 . 1 1 120 120 LYS N N 120 120.744 120.744 121.197 -0.453 17927 3984 1 5 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.502 0.031 17927 3985 1 5 . 1 1 120 120 LYS C C 120 177.229 177.229 176.214 1.015 17927 3986 1 5 . 1 1 120 120 LYS CA C 120 55.287 55.287 54.675 0.612 17927 3987 1 5 . 1 1 120 120 LYS CB C 120 32.581 32.581 31.944 0.637 17927 3988 1 5 . 1 1 120 120 LYS H H 120 8.449 8.449 7.523 0.926 17927 3989 1 5 . 1 1 121 121 ILE N N 121 121.221 121.221 128.021 -6.800 17927 3990 1 5 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.845 0.041 17927 3991 1 5 . 1 1 121 121 ILE C C 121 177.819 177.819 176.307 1.512 17927 3992 1 5 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.441 0.474 17927 3993 1 5 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.194 2.196 17927 3994 1 5 . 1 1 121 121 ILE H H 121 8.715 8.715 8.768 -0.053 17927 3995 1 5 . 1 1 122 122 ILE N N 122 127.165 127.165 128.799 -1.634 17927 3996 1 5 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.296 0.045 17927 3997 1 5 . 1 1 122 122 ILE C C 122 176.978 176.978 176.775 0.203 17927 3998 1 5 . 1 1 122 122 ILE CA C 122 63.719 63.719 61.968 1.751 17927 3999 1 5 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.449 0.203 17927 4000 1 5 . 1 1 122 122 ILE H H 122 8.974 8.974 8.566 0.408 17927 4001 1 5 . 1 1 123 123 SER N N 123 111.227 111.227 115.198 -3.971 17927 4002 1 5 . 1 1 123 123 SER HA H 123 4.738 4.738 4.775 -0.037 17927 4003 1 5 . 1 1 123 123 SER C C 123 174.184 174.184 173.679 0.505 17927 4004 1 5 . 1 1 123 123 SER CA C 123 57.383 57.383 57.424 -0.041 17927 4005 1 5 . 1 1 123 123 SER CB C 123 65.326 65.326 64.987 0.339 17927 4006 1 5 . 1 1 123 123 SER H H 123 7.850 7.850 8.468 -0.618 17927 4007 1 5 . 1 1 124 124 ALA N N 124 131.373 131.373 126.144 5.229 17927 4008 1 5 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.273 0.212 17927 4009 1 5 . 1 1 124 124 ALA C C 124 175.147 175.147 176.338 -1.191 17927 4010 1 5 . 1 1 124 124 ALA CA C 124 53.035 53.035 53.366 -0.331 17927 4011 1 5 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.293 -0.631 17927 4012 1 5 . 1 1 124 124 ALA H H 124 9.384 9.384 8.635 0.749 17927 4013 1 5 . 1 1 125 125 ASN N N 125 119.476 119.476 115.016 4.460 17927 4014 1 5 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.053 0.003 17927 4015 1 5 . 1 1 125 125 ASN C C 125 173.593 173.593 174.420 -0.827 17927 4016 1 5 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.970 -0.618 17927 4017 1 5 . 1 1 125 125 ASN CB C 125 38.304 38.304 40.033 -1.729 17927 4018 1 5 . 1 1 125 125 ASN H H 125 8.191 8.191 7.564 0.627 17927 4019 1 5 . 1 1 126 126 MET N N 126 122.705 122.705 126.116 -3.411 17927 4020 1 5 . 1 1 126 126 MET HA H 126 4.585 4.585 4.716 -0.131 17927 4021 1 5 . 1 1 126 126 MET C C 126 175.215 175.215 175.677 -0.462 17927 4022 1 5 . 1 1 126 126 MET CA C 126 53.849 53.849 56.376 -2.527 17927 4023 1 5 . 1 1 126 126 MET CB C 126 31.312 31.312 34.083 -2.771 17927 4024 1 5 . 1 1 126 126 MET H H 126 8.376 8.376 9.197 -0.821 17927 4025 1 5 . 1 1 127 127 THR N N 127 111.016 111.016 109.245 1.771 17927 4026 1 5 . 1 1 127 127 THR HA H 127 4.291 4.291 4.019 0.272 17927 4027 1 5 . 1 1 127 127 THR C C 127 174.574 174.574 173.351 1.223 17927 4028 1 5 . 1 1 127 127 THR CA C 127 62.085 62.085 61.692 0.393 17927 4029 1 5 . 1 1 127 127 THR CB C 127 69.733 69.733 70.708 -0.975 17927 4030 1 5 . 1 1 127 127 THR H H 127 7.714 7.714 8.140 -0.426 17927 4031 1 5 . 1 1 128 128 ARG N N 128 118.722 118.722 118.718 0.004 17927 4032 1 5 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.577 -1.269 17927 4033 1 5 . 1 1 128 128 ARG C C 128 176.978 176.978 173.750 3.228 17927 4034 1 5 . 1 1 128 128 ARG CA C 128 54.727 54.727 54.752 -0.024 17927 4035 1 5 . 1 1 128 128 ARG CB C 128 29.598 29.598 31.059 -1.461 17927 4036 1 5 . 1 1 128 128 ARG H H 128 8.658 8.658 7.359 1.298 17927 4037 1 5 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.421 -0.488 17927 4038 1 5 . 1 1 129 129 PRO C C 129 175.794 175.794 177.294 -1.500 17927 4039 1 5 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.540 1.009 17927 4040 1 5 . 1 1 129 129 PRO CB C 129 31.677 31.677 32.240 -0.563 17927 4041 1 5 . 1 1 130 130 SER N N 130 108.696 108.696 112.368 -3.672 17927 4042 1 5 . 1 1 130 130 SER HA H 130 3.988 3.988 4.294 -0.306 17927 4043 1 5 . 1 1 130 130 SER C C 130 174.445 174.445 174.741 -0.296 17927 4044 1 5 . 1 1 130 130 SER CA C 130 58.911 58.911 59.795 -0.884 17927 4045 1 5 . 1 1 130 130 SER CB C 130 62.680 62.680 63.452 -0.772 17927 4046 1 5 . 1 1 130 130 SER H H 130 8.375 8.375 8.445 -0.070 17927 4047 1 5 . 1 1 131 131 ASP N N 131 126.377 126.377 123.667 2.710 17927 4048 1 5 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.904 -0.032 17927 4049 1 5 . 1 1 131 131 ASP C C 131 176.879 176.879 175.065 1.814 17927 4050 1 5 . 1 1 131 131 ASP CA C 131 51.195 51.195 51.784 -0.589 17927 4051 1 5 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.111 0.705 17927 4052 1 5 . 1 1 131 131 ASP H H 131 7.514 7.514 7.815 -0.301 17927 4053 1 5 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.137 0.255 17927 4054 1 5 . 1 1 132 132 PRO C C 132 178.097 178.097 177.968 0.129 17927 4055 1 5 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.640 0.439 17927 4056 1 5 . 1 1 132 132 PRO CB C 132 32.409 32.409 31.977 0.432 17927 4057 1 5 . 1 1 133 133 LYS N N 133 116.306 116.306 117.105 -0.799 17927 4058 1 5 . 1 1 133 133 LYS HA H 133 3.958 3.958 3.928 0.030 17927 4059 1 5 . 1 1 133 133 LYS C C 133 179.532 179.532 178.955 0.577 17927 4060 1 5 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.425 -0.904 17927 4061 1 5 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.424 0.768 17927 4062 1 5 . 1 1 133 133 LYS H H 133 8.842 8.842 7.862 0.980 17927 4063 1 5 . 1 1 134 134 THR N N 134 120.833 120.833 115.865 4.968 17927 4064 1 5 . 1 1 134 134 THR HA H 134 3.147 3.147 3.708 -0.561 17927 4065 1 5 . 1 1 134 134 THR C C 134 173.356 173.356 175.394 -2.038 17927 4066 1 5 . 1 1 134 134 THR CA C 134 66.383 66.383 66.314 0.069 17927 4067 1 5 . 1 1 134 134 THR CB C 134 66.847 66.847 68.617 -1.770 17927 4068 1 5 . 1 1 134 134 THR H H 134 8.292 8.292 7.684 0.608 17927 4069 1 5 . 1 1 135 135 ALA N N 135 121.720 121.720 123.465 -1.745 17927 4070 1 5 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.391 0.192 17927 4071 1 5 . 1 1 135 135 ALA C C 135 178.902 178.902 179.582 -0.680 17927 4072 1 5 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.588 0.411 17927 4073 1 5 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.183 -0.408 17927 4074 1 5 . 1 1 135 135 ALA H H 135 7.030 7.030 7.211 -0.181 17927 4075 1 5 . 1 1 136 136 GLU N N 136 114.623 114.623 116.546 -1.923 17927 4076 1 5 . 1 1 136 136 GLU HA H 136 3.922 3.922 4.167 -0.245 17927 4077 1 5 . 1 1 136 136 GLU C C 136 179.199 179.199 178.986 0.213 17927 4078 1 5 . 1 1 136 136 GLU CA C 136 59.837 59.837 57.729 2.108 17927 4079 1 5 . 1 1 136 136 GLU CB C 136 29.786 29.786 28.590 1.196 17927 4080 1 5 . 1 1 136 136 GLU H H 136 7.216 7.216 7.945 -0.729 17927 4081 1 5 . 1 1 137 137 LYS N N 137 120.789 120.789 120.303 0.486 17927 4082 1 5 . 1 1 137 137 LYS HA H 137 4.204 4.204 4.048 0.156 17927 4083 1 5 . 1 1 137 137 LYS C C 137 178.834 178.834 178.632 0.202 17927 4084 1 5 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.727 -1.384 17927 4085 1 5 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.758 -1.295 17927 4086 1 5 . 1 1 137 137 LYS H H 137 7.681 7.681 7.661 0.020 17927 4087 1 5 . 1 1 138 138 PHE N N 138 118.373 118.373 116.953 1.420 17927 4088 1 5 . 1 1 138 138 PHE HA H 138 4.033 4.033 3.985 0.048 17927 4089 1 5 . 1 1 138 138 PHE C C 138 178.027 178.027 177.830 0.197 17927 4090 1 5 . 1 1 138 138 PHE CA C 138 57.507 57.507 59.196 -1.689 17927 4091 1 5 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.145 -1.256 17927 4092 1 5 . 1 1 138 138 PHE H H 138 8.059 8.059 7.163 0.896 17927 4093 1 5 . 1 1 139 139 ASN N N 139 117.611 117.611 117.524 0.087 17927 4094 1 5 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.396 0.008 17927 4095 1 5 . 1 1 139 139 ASN C C 139 178.190 178.190 177.613 0.577 17927 4096 1 5 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.041 0.183 17927 4097 1 5 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.749 -1.015 17927 4098 1 5 . 1 1 139 139 ASN H H 139 8.683 8.683 7.705 0.978 17927 4099 1 5 . 1 1 140 140 GLU N N 140 121.432 121.432 121.778 -0.346 17927 4100 1 5 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.131 -0.126 17927 4101 1 5 . 1 1 140 140 GLU C C 140 179.751 179.751 179.484 0.267 17927 4102 1 5 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.438 -0.128 17927 4103 1 5 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.602 0.453 17927 4104 1 5 . 1 1 140 140 GLU H H 140 7.868 7.868 7.733 0.135 17927 4105 1 5 . 1 1 141 141 LEU N N 141 119.968 119.968 118.847 1.121 17927 4106 1 5 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.101 -0.086 17927 4107 1 5 . 1 1 141 141 LEU C C 141 179.293 179.293 178.674 0.619 17927 4108 1 5 . 1 1 141 141 LEU CA C 141 57.436 57.436 58.031 -0.595 17927 4109 1 5 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.351 -0.168 17927 4110 1 5 . 1 1 141 141 LEU H H 141 8.303 8.303 7.751 0.552 17927 4111 1 5 . 1 1 142 142 LEU N N 142 115.040 115.040 116.657 -1.617 17927 4112 1 5 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.249 0.135 17927 4113 1 5 . 1 1 142 142 LEU C C 142 178.002 178.002 178.064 -0.062 17927 4114 1 5 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.727 -0.448 17927 4115 1 5 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.528 0.118 17927 4116 1 5 . 1 1 142 142 LEU H H 142 8.230 8.230 7.552 0.678 17927 4117 1 5 . 1 1 143 143 GLY N N 143 108.977 108.977 105.503 3.474 17927 4118 1 5 . 1 1 143 143 GLY C C 143 175.216 175.216 174.492 0.724 17927 4119 1 5 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.168 1.573 17927 4120 1 5 . 1 1 143 143 GLY H H 143 7.762 7.762 8.394 -0.632 17927 4121 1 5 . 1 1 144 144 LEU N N 144 119.660 119.660 120.005 -0.345 17927 4122 1 5 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.220 0.268 17927 4123 1 5 . 1 1 144 144 LEU C C 144 177.375 177.375 178.103 -0.728 17927 4124 1 5 . 1 1 144 144 LEU CA C 144 54.525 54.525 57.128 -2.603 17927 4125 1 5 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.107 0.666 17927 4126 1 5 . 1 1 144 144 LEU H H 144 8.241 8.241 7.798 0.443 17927 4127 1 5 . 1 1 145 145 GLU N N 145 119.959 119.959 118.697 1.262 17927 4128 1 5 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.217 0.024 17927 4129 1 5 . 1 1 145 145 GLU C C 145 177.075 177.075 177.931 -0.856 17927 4130 1 5 . 1 1 145 145 GLU CA C 145 56.799 56.799 57.971 -1.172 17927 4131 1 5 . 1 1 145 145 GLU CB C 145 30.168 30.168 29.056 1.111 17927 4132 1 5 . 1 1 145 145 GLU H H 145 8.410 8.410 8.559 -0.149 17927 4133 1 5 . 1 1 146 146 GLY N N 146 109.412 109.412 105.732 3.680 17927 4134 1 5 . 1 1 146 146 GLY C C 146 174.276 174.276 174.154 0.122 17927 4135 1 5 . 1 1 146 146 GLY CA C 146 45.445 45.445 46.450 -1.005 17927 4136 1 5 . 1 1 146 146 GLY H H 146 8.422 8.422 8.165 0.257 17927 4137 1 5 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.728 -0.072 17927 4138 1 5 . 1 1 151 151 HIS C C 151 173.990 173.990 173.342 0.648 17927 4139 1 5 . 1 1 151 151 HIS CA C 151 56.044 56.044 56.404 -0.360 17927 4140 1 5 . 1 1 151 151 HIS CB C 151 30.076 30.076 31.096 -1.020 17927 4141 1 6 . 1 1 2 2 SER HA H 2 4.121 4.121 4.785 -0.664 17927 4142 1 6 . 1 1 2 2 SER CA C 2 57.293 57.293 57.815 -0.522 17927 4143 1 6 . 1 1 2 2 SER CB C 2 63.545 63.545 63.221 0.324 17927 4144 1 6 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.276 0.156 17927 4145 1 6 . 1 1 3 3 LEU C C 3 177.383 177.383 176.841 0.542 17927 4146 1 6 . 1 1 3 3 LEU CA C 3 55.575 55.575 55.447 0.128 17927 4147 1 6 . 1 1 3 3 LEU CB C 3 42.584 42.584 41.459 1.125 17927 4148 1 6 . 1 1 4 4 ARG N N 4 122.080 122.080 122.569 -0.489 17927 4149 1 6 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.467 -0.083 17927 4150 1 6 . 1 1 4 4 ARG C C 4 176.410 176.410 175.337 1.073 17927 4151 1 6 . 1 1 4 4 ARG CA C 4 56.269 56.269 55.435 0.834 17927 4152 1 6 . 1 1 4 4 ARG CB C 4 30.842 30.842 31.026 -0.184 17927 4153 1 6 . 1 1 4 4 ARG H H 4 8.410 8.410 8.334 0.076 17927 4154 1 6 . 1 1 5 5 SER N N 5 117.023 117.023 114.927 2.096 17927 4155 1 6 . 1 1 5 5 SER HA H 5 4.423 4.423 4.658 -0.235 17927 4156 1 6 . 1 1 5 5 SER C C 5 175.039 175.039 174.124 0.915 17927 4157 1 6 . 1 1 5 5 SER CA C 5 58.605 58.605 57.804 0.801 17927 4158 1 6 . 1 1 5 5 SER CB C 5 64.044 64.044 64.978 -0.934 17927 4159 1 6 . 1 1 5 5 SER H H 5 8.292 8.292 7.617 0.675 17927 4160 1 6 . 1 1 6 6 GLY N N 6 110.718 110.718 115.165 -4.447 17927 4161 1 6 . 1 1 6 6 GLY C C 6 173.654 173.654 173.386 0.268 17927 4162 1 6 . 1 1 6 6 GLY CA C 6 45.273 45.273 44.844 0.429 17927 4163 1 6 . 1 1 6 6 GLY H H 6 8.446 8.446 8.540 -0.094 17927 4164 1 6 . 1 1 7 7 ASN N N 7 119.287 119.287 121.882 -2.595 17927 4165 1 6 . 1 1 7 7 ASN HA H 7 5.024 5.024 5.056 -0.032 17927 4166 1 6 . 1 1 7 7 ASN C C 7 173.672 173.672 172.904 0.768 17927 4167 1 6 . 1 1 7 7 ASN CA C 7 51.357 51.357 50.973 0.384 17927 4168 1 6 . 1 1 7 7 ASN CB C 7 38.927 38.927 38.998 -0.071 17927 4169 1 6 . 1 1 7 7 ASN H H 7 8.273 8.273 8.716 -0.443 17927 4170 1 6 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.585 -0.138 17927 4171 1 6 . 1 1 8 8 PRO C C 8 176.899 176.899 176.417 0.482 17927 4172 1 6 . 1 1 8 8 PRO CA C 8 63.429 63.429 63.074 0.355 17927 4173 1 6 . 1 1 8 8 PRO CB C 8 32.216 32.216 32.176 0.040 17927 4174 1 6 . 1 1 9 9 SER N N 9 115.642 115.642 116.734 -1.092 17927 4175 1 6 . 1 1 9 9 SER HA H 9 4.415 4.415 4.834 -0.419 17927 4176 1 6 . 1 1 9 9 SER C C 9 174.714 174.714 175.201 -0.487 17927 4177 1 6 . 1 1 9 9 SER CA C 9 58.488 58.488 57.365 1.123 17927 4178 1 6 . 1 1 9 9 SER CB C 9 64.048 64.048 64.690 -0.642 17927 4179 1 6 . 1 1 9 9 SER H H 9 8.336 8.336 8.519 -0.183 17927 4180 1 6 . 1 1 10 10 ALA N N 10 126.808 126.808 124.359 2.449 17927 4181 1 6 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.945 -0.683 17927 4182 1 6 . 1 1 10 10 ALA C C 10 177.233 177.233 176.276 0.957 17927 4183 1 6 . 1 1 10 10 ALA CA C 10 53.230 53.230 53.306 -0.076 17927 4184 1 6 . 1 1 10 10 ALA CB C 10 19.187 19.187 17.159 2.028 17927 4185 1 6 . 1 1 10 10 ALA H H 10 8.137 8.137 8.712 -0.575 17927 4186 1 6 . 1 1 11 11 ALA N N 11 120.449 120.449 122.947 -2.498 17927 4187 1 6 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.735 -0.474 17927 4188 1 6 . 1 1 11 11 ALA C C 11 177.469 177.469 176.127 1.342 17927 4189 1 6 . 1 1 11 11 ALA CA C 11 52.475 52.475 52.553 -0.079 17927 4190 1 6 . 1 1 11 11 ALA CB C 11 19.485 19.485 21.334 -1.849 17927 4191 1 6 . 1 1 11 11 ALA H H 11 7.851 7.851 8.250 -0.399 17927 4192 1 6 . 1 1 12 12 SER N N 12 114.186 114.186 113.227 0.959 17927 4193 1 6 . 1 1 12 12 SER HA H 12 4.312 4.312 4.614 -0.302 17927 4194 1 6 . 1 1 12 12 SER C C 12 173.593 173.593 174.209 -0.616 17927 4195 1 6 . 1 1 12 12 SER CA C 12 58.099 58.099 57.422 0.677 17927 4196 1 6 . 1 1 12 12 SER CB C 12 63.320 63.320 63.972 -0.652 17927 4197 1 6 . 1 1 12 12 SER H H 12 7.990 7.990 7.712 0.278 17927 4198 1 6 . 1 1 13 13 PHE N N 13 118.092 118.092 120.299 -2.207 17927 4199 1 6 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.374 0.406 17927 4200 1 6 . 1 1 13 13 PHE C C 13 174.220 174.220 173.624 0.596 17927 4201 1 6 . 1 1 13 13 PHE CA C 13 56.717 56.717 57.787 -1.070 17927 4202 1 6 . 1 1 13 13 PHE CB C 13 41.151 41.151 39.308 1.843 17927 4203 1 6 . 1 1 13 13 PHE H H 13 7.147 7.147 7.426 -0.279 17927 4204 1 6 . 1 1 14 14 SER N N 14 116.456 116.456 116.606 -0.150 17927 4205 1 6 . 1 1 14 14 SER HA H 14 5.162 5.162 5.135 0.027 17927 4206 1 6 . 1 1 14 14 SER C C 14 172.626 172.626 172.935 -0.309 17927 4207 1 6 . 1 1 14 14 SER CA C 14 57.390 57.390 57.399 -0.009 17927 4208 1 6 . 1 1 14 14 SER CB C 14 64.518 64.518 65.191 -0.673 17927 4209 1 6 . 1 1 14 14 SER H H 14 7.616 7.616 8.022 -0.406 17927 4210 1 6 . 1 1 15 15 TYR N N 15 122.384 122.384 122.830 -0.446 17927 4211 1 6 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.966 0.240 17927 4212 1 6 . 1 1 15 15 TYR C C 15 172.543 172.543 173.224 -0.681 17927 4213 1 6 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.190 -0.244 17927 4214 1 6 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.294 0.933 17927 4215 1 6 . 1 1 15 15 TYR H H 15 8.558 8.558 9.258 -0.700 17927 4216 1 6 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.890 0.219 17927 4217 1 6 . 1 1 16 16 PRO C C 16 176.475 176.475 176.361 0.114 17927 4218 1 6 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.193 -0.212 17927 4219 1 6 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.040 0.622 17927 4220 1 6 . 1 1 17 17 ASP N N 17 119.834 119.834 124.707 -4.873 17927 4221 1 6 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.958 0.781 17927 4222 1 6 . 1 1 17 17 ASP C C 17 180.740 180.740 178.766 1.974 17927 4223 1 6 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.481 -1.764 17927 4224 1 6 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.482 -0.921 17927 4225 1 6 . 1 1 17 17 ASP H H 17 8.643 8.643 8.802 -0.159 17927 4226 1 6 . 1 1 18 18 ILE N N 18 118.340 118.340 116.959 1.381 17927 4227 1 6 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.697 0.754 17927 4228 1 6 . 1 1 18 18 ILE C C 18 175.742 175.742 177.106 -1.364 17927 4229 1 6 . 1 1 18 18 ILE CA C 18 61.894 61.894 64.276 -2.382 17927 4230 1 6 . 1 1 18 18 ILE CB C 18 39.240 39.240 37.356 1.884 17927 4231 1 6 . 1 1 18 18 ILE H H 18 8.450 8.450 8.675 -0.225 17927 4232 1 6 . 1 1 19 19 ASN N N 19 119.377 119.377 118.249 1.128 17927 4233 1 6 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.608 0.407 17927 4234 1 6 . 1 1 19 19 ASN C C 19 175.892 175.892 176.040 -0.148 17927 4235 1 6 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.223 -0.916 17927 4236 1 6 . 1 1 19 19 ASN CB C 19 39.825 39.825 39.489 0.336 17927 4237 1 6 . 1 1 19 19 ASN H H 19 8.376 8.376 8.986 -0.610 17927 4238 1 6 . 1 1 20 20 GLY N N 20 109.535 109.535 108.535 1.000 17927 4239 1 6 . 1 1 20 20 GLY C C 20 174.285 174.285 173.319 0.966 17927 4240 1 6 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.030 0.763 17927 4241 1 6 . 1 1 20 20 GLY H H 20 8.539 8.539 8.582 -0.043 17927 4242 1 6 . 1 1 21 21 LYS N N 21 124.675 124.675 121.545 3.130 17927 4243 1 6 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.463 -0.020 17927 4244 1 6 . 1 1 21 21 LYS C C 21 176.537 176.537 176.064 0.473 17927 4245 1 6 . 1 1 21 21 LYS CA C 21 55.444 55.444 55.020 0.424 17927 4246 1 6 . 1 1 21 21 LYS CB C 21 32.754 32.754 32.974 -0.220 17927 4247 1 6 . 1 1 21 21 LYS H H 21 8.608 8.608 7.463 1.145 17927 4248 1 6 . 1 1 22 22 THR N N 22 120.666 120.666 123.485 -2.819 17927 4249 1 6 . 1 1 22 22 THR HA H 22 4.087 4.087 4.209 -0.122 17927 4250 1 6 . 1 1 22 22 THR C C 22 174.431 174.431 174.094 0.337 17927 4251 1 6 . 1 1 22 22 THR CA C 22 64.292 64.292 63.628 0.664 17927 4252 1 6 . 1 1 22 22 THR CB C 22 69.069 69.069 68.856 0.213 17927 4253 1 6 . 1 1 22 22 THR H H 22 8.595 8.595 8.653 -0.058 17927 4254 1 6 . 1 1 23 23 VAL N N 23 131.207 131.207 129.452 1.755 17927 4255 1 6 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.460 -0.268 17927 4256 1 6 . 1 1 23 23 VAL C C 23 174.244 174.244 174.284 -0.040 17927 4257 1 6 . 1 1 23 23 VAL CA C 23 62.456 62.456 60.908 1.548 17927 4258 1 6 . 1 1 23 23 VAL CB C 23 33.791 33.791 35.139 -1.348 17927 4259 1 6 . 1 1 23 23 VAL H H 23 8.937 8.937 8.804 0.133 17927 4260 1 6 . 1 1 24 24 SER N N 24 120.787 120.787 119.567 1.220 17927 4261 1 6 . 1 1 24 24 SER HA H 24 5.407 5.407 5.312 0.095 17927 4262 1 6 . 1 1 24 24 SER C C 24 176.169 176.169 174.129 2.040 17927 4263 1 6 . 1 1 24 24 SER CA C 24 55.135 55.135 56.001 -0.866 17927 4264 1 6 . 1 1 24 24 SER CB C 24 65.646 65.646 66.045 -0.399 17927 4265 1 6 . 1 1 24 24 SER H H 24 8.554 8.554 9.368 -0.814 17927 4266 1 6 . 1 1 25 25 LEU N N 25 124.332 124.332 120.100 4.232 17927 4267 1 6 . 1 1 25 25 LEU HA H 25 3.687 3.687 4.250 -0.563 17927 4268 1 6 . 1 1 25 25 LEU C C 25 179.364 179.364 176.197 3.167 17927 4269 1 6 . 1 1 25 25 LEU CA C 25 58.217 58.217 53.749 4.468 17927 4270 1 6 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.517 -0.979 17927 4271 1 6 . 1 1 25 25 LEU H H 25 7.811 7.811 7.957 -0.146 17927 4272 1 6 . 1 1 26 26 ALA N N 26 119.799 119.799 120.901 -1.102 17927 4273 1 6 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.110 -0.117 17927 4274 1 6 . 1 1 26 26 ALA C C 26 179.719 179.719 177.843 1.876 17927 4275 1 6 . 1 1 26 26 ALA CA C 26 54.663 54.663 53.719 0.944 17927 4276 1 6 . 1 1 26 26 ALA CB C 26 18.323 18.323 19.683 -1.360 17927 4277 1 6 . 1 1 26 26 ALA H H 26 8.099 8.099 7.301 0.798 17927 4278 1 6 . 1 1 27 27 ASP N N 27 116.553 116.553 116.730 -0.177 17927 4279 1 6 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.440 0.033 17927 4280 1 6 . 1 1 27 27 ASP C C 27 176.915 176.915 177.636 -0.721 17927 4281 1 6 . 1 1 27 27 ASP CA C 27 56.251 56.251 55.761 0.490 17927 4282 1 6 . 1 1 27 27 ASP CB C 27 40.788 40.788 40.776 0.012 17927 4283 1 6 . 1 1 27 27 ASP H H 27 7.572 7.572 7.674 -0.102 17927 4284 1 6 . 1 1 28 28 LEU N N 28 118.950 118.950 118.267 0.683 17927 4285 1 6 . 1 1 28 28 LEU HA H 28 4.233 4.233 3.925 0.308 17927 4286 1 6 . 1 1 28 28 LEU C C 28 175.542 175.542 176.260 -0.718 17927 4287 1 6 . 1 1 28 28 LEU CA C 28 53.706 53.706 54.406 -0.699 17927 4288 1 6 . 1 1 28 28 LEU CB C 28 41.049 41.049 41.769 -0.720 17927 4289 1 6 . 1 1 28 28 LEU H H 28 7.363 7.363 7.450 -0.087 17927 4290 1 6 . 1 1 29 29 LYS N N 29 118.429 118.429 118.994 -0.565 17927 4291 1 6 . 1 1 29 29 LYS HA H 29 4.352 4.352 3.997 0.355 17927 4292 1 6 . 1 1 29 29 LYS C C 29 178.063 178.063 177.176 0.887 17927 4293 1 6 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.194 0.583 17927 4294 1 6 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.499 0.941 17927 4295 1 6 . 1 1 29 29 LYS H H 29 6.780 6.780 7.215 -0.435 17927 4296 1 6 . 1 1 30 30 GLY N N 30 112.426 112.426 113.772 -1.346 17927 4297 1 6 . 1 1 30 30 GLY C C 30 173.801 173.801 173.181 0.620 17927 4298 1 6 . 1 1 30 30 GLY CA C 30 44.611 44.611 44.904 -0.293 17927 4299 1 6 . 1 1 30 30 GLY H H 30 9.398 9.398 8.966 0.432 17927 4300 1 6 . 1 1 31 31 LYS N N 31 119.295 119.295 119.083 0.212 17927 4301 1 6 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.611 -0.459 17927 4302 1 6 . 1 1 31 31 LYS C C 31 173.862 173.862 176.417 -2.555 17927 4303 1 6 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.915 0.273 17927 4304 1 6 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.037 1.931 17927 4305 1 6 . 1 1 31 31 LYS H H 31 7.496 7.496 7.460 0.036 17927 4306 1 6 . 1 1 32 32 TYR N N 32 116.984 116.984 123.553 -6.569 17927 4307 1 6 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.531 -0.374 17927 4308 1 6 . 1 1 32 32 TYR C C 32 175.226 175.226 175.730 -0.504 17927 4309 1 6 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.353 0.237 17927 4310 1 6 . 1 1 32 32 TYR CB C 32 39.121 39.121 38.961 0.160 17927 4311 1 6 . 1 1 32 32 TYR H H 32 7.521 7.521 8.921 -1.400 17927 4312 1 6 . 1 1 33 33 ILE N N 33 118.052 118.052 121.407 -3.355 17927 4313 1 6 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.436 0.471 17927 4314 1 6 . 1 1 33 33 ILE C C 33 174.308 174.308 174.332 -0.024 17927 4315 1 6 . 1 1 33 33 ILE CA C 33 60.702 60.702 59.172 1.530 17927 4316 1 6 . 1 1 33 33 ILE CB C 33 41.616 41.616 39.428 2.188 17927 4317 1 6 . 1 1 33 33 ILE H H 33 8.467 8.467 9.180 -0.713 17927 4318 1 6 . 1 1 34 34 TYR N N 34 130.242 130.242 129.824 0.418 17927 4319 1 6 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.278 0.248 17927 4320 1 6 . 1 1 34 34 TYR C C 34 174.245 174.245 173.441 0.804 17927 4321 1 6 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.603 0.555 17927 4322 1 6 . 1 1 34 34 TYR CB C 34 40.133 40.133 40.573 -0.440 17927 4323 1 6 . 1 1 34 34 TYR H H 34 8.905 8.905 9.295 -0.390 17927 4324 1 6 . 1 1 35 35 ILE N N 35 128.697 128.697 129.786 -1.089 17927 4325 1 6 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.271 0.071 17927 4326 1 6 . 1 1 35 35 ILE C C 35 174.520 174.520 174.200 0.320 17927 4327 1 6 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.889 -0.140 17927 4328 1 6 . 1 1 35 35 ILE CB C 35 40.899 40.899 39.956 0.943 17927 4329 1 6 . 1 1 35 35 ILE H H 35 9.445 9.445 7.822 1.623 17927 4330 1 6 . 1 1 36 36 ASP N N 36 123.675 123.675 125.733 -2.058 17927 4331 1 6 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.644 -0.796 17927 4332 1 6 . 1 1 36 36 ASP C C 36 174.385 174.385 174.893 -0.508 17927 4333 1 6 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.325 -0.031 17927 4334 1 6 . 1 1 36 36 ASP CB C 36 41.778 41.778 45.859 -4.081 17927 4335 1 6 . 1 1 36 36 ASP H H 36 8.875 8.875 8.866 0.009 17927 4336 1 6 . 1 1 37 37 VAL N N 37 127.159 127.159 121.705 5.454 17927 4337 1 6 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.850 0.109 17927 4338 1 6 . 1 1 37 37 VAL C C 37 175.046 175.046 175.565 -0.519 17927 4339 1 6 . 1 1 37 37 VAL CA C 37 62.245 62.245 60.882 1.363 17927 4340 1 6 . 1 1 37 37 VAL CB C 37 31.807 31.807 32.546 -0.739 17927 4341 1 6 . 1 1 37 37 VAL H H 37 8.603 8.603 7.855 0.748 17927 4342 1 6 . 1 1 38 38 TRP N N 38 124.161 124.161 127.717 -3.556 17927 4343 1 6 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.158 0.079 17927 4344 1 6 . 1 1 38 38 TRP C C 38 171.995 171.995 173.673 -1.678 17927 4345 1 6 . 1 1 38 38 TRP CA C 38 55.207 55.207 52.970 2.237 17927 4346 1 6 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.112 3.075 17927 4347 1 6 . 1 1 38 38 TRP H H 38 8.562 8.562 8.630 -0.068 17927 4348 1 6 . 1 1 39 39 ALA N N 39 116.252 116.252 125.485 -9.233 17927 4349 1 6 . 1 1 39 39 ALA HA H 39 3.678 3.678 4.075 -0.397 17927 4350 1 6 . 1 1 39 39 ALA C C 39 178.664 178.664 176.046 2.618 17927 4351 1 6 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.469 0.997 17927 4352 1 6 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.693 0.648 17927 4353 1 6 . 1 1 39 39 ALA H H 39 6.757 6.757 7.788 -1.031 17927 4354 1 6 . 1 1 40 40 THR N N 40 114.321 114.321 116.199 -1.878 17927 4355 1 6 . 1 1 40 40 THR HA H 40 3.907 3.907 4.581 -0.674 17927 4356 1 6 . 1 1 40 40 THR C C 40 175.885 175.885 175.135 0.750 17927 4357 1 6 . 1 1 40 40 THR CA C 40 65.447 65.447 62.627 2.820 17927 4358 1 6 . 1 1 40 40 THR CB C 40 70.106 70.106 69.496 0.610 17927 4359 1 6 . 1 1 40 40 THR H H 40 9.639 9.639 8.703 0.936 17927 4360 1 6 . 1 1 41 41 TRP N N 41 114.483 114.483 119.736 -5.253 17927 4361 1 6 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.659 -0.096 17927 4362 1 6 . 1 1 41 41 TRP C C 41 176.189 176.189 175.425 0.764 17927 4363 1 6 . 1 1 41 41 TRP CA C 41 54.698 54.698 55.260 -0.562 17927 4364 1 6 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.482 1.495 17927 4365 1 6 . 1 1 41 41 TRP H H 41 6.401 6.401 7.256 -0.855 17927 4366 1 6 . 1 1 42 42 CYS N N 42 123.536 123.536 121.686 1.850 17927 4367 1 6 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.302 0.266 17927 4368 1 6 . 1 1 42 42 CYS C C 42 175.726 175.726 175.781 -0.055 17927 4369 1 6 . 1 1 42 42 CYS CA C 42 58.700 58.700 58.102 0.598 17927 4370 1 6 . 1 1 42 42 CYS CB C 42 27.121 27.121 28.002 -0.881 17927 4371 1 6 . 1 1 42 42 CYS H H 42 6.883 6.883 7.144 -0.261 17927 4372 1 6 . 1 1 43 43 GLY N N 43 120.977 120.977 114.696 6.281 17927 4373 1 6 . 1 1 43 43 GLY CA C 43 49.204 49.204 47.461 1.743 17927 4374 1 6 . 1 1 43 43 GLY H H 43 9.653 9.653 8.818 0.835 17927 4375 1 6 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.330 0.157 17927 4376 1 6 . 1 1 44 44 PRO C C 44 179.956 179.956 178.521 1.435 17927 4377 1 6 . 1 1 44 44 PRO CA C 44 65.642 65.642 64.828 0.814 17927 4378 1 6 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.217 1.361 17927 4379 1 6 . 1 1 45 45 CYS N N 45 113.925 113.925 117.662 -3.737 17927 4380 1 6 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.169 0.144 17927 4381 1 6 . 1 1 45 45 CYS C C 45 178.325 178.325 176.190 2.135 17927 4382 1 6 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.593 1.799 17927 4383 1 6 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.516 0.989 17927 4384 1 6 . 1 1 45 45 CYS H H 45 7.676 7.676 7.740 -0.064 17927 4385 1 6 . 1 1 46 46 ARG N N 46 120.336 120.336 118.654 1.682 17927 4386 1 6 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.230 -0.161 17927 4387 1 6 . 1 1 46 46 ARG C C 46 180.446 180.446 178.255 2.191 17927 4388 1 6 . 1 1 46 46 ARG CA C 46 59.785 59.785 57.277 2.508 17927 4389 1 6 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.399 0.469 17927 4390 1 6 . 1 1 46 46 ARG H H 46 8.109 8.109 7.723 0.386 17927 4391 1 6 . 1 1 47 47 GLY N N 47 105.408 105.408 107.044 -1.636 17927 4392 1 6 . 1 1 47 47 GLY C C 47 175.258 175.258 174.862 0.396 17927 4393 1 6 . 1 1 47 47 GLY CA C 47 46.594 46.594 46.011 0.583 17927 4394 1 6 . 1 1 47 47 GLY H H 47 8.466 8.466 8.144 0.322 17927 4395 1 6 . 1 1 48 48 GLU N N 48 116.343 116.343 120.086 -3.743 17927 4396 1 6 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.380 0.145 17927 4397 1 6 . 1 1 48 48 GLU C C 48 176.535 176.535 178.032 -1.497 17927 4398 1 6 . 1 1 48 48 GLU CA C 48 55.792 55.792 56.569 -0.777 17927 4399 1 6 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.622 1.360 17927 4400 1 6 . 1 1 48 48 GLU H H 48 7.050 7.050 7.664 -0.614 17927 4401 1 6 . 1 1 49 49 LEU N N 49 118.652 118.652 122.534 -3.882 17927 4402 1 6 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.182 -0.030 17927 4403 1 6 . 1 1 49 49 LEU C C 49 176.832 176.832 176.437 0.395 17927 4404 1 6 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.245 -0.900 17927 4405 1 6 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.436 -0.940 17927 4406 1 6 . 1 1 49 49 LEU H H 49 7.385 7.385 7.579 -0.194 17927 4407 1 6 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.113 0.140 17927 4408 1 6 . 1 1 50 50 PRO C C 50 179.744 179.744 177.985 1.759 17927 4409 1 6 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.128 0.431 17927 4410 1 6 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.901 -0.139 17927 4411 1 6 . 1 1 51 51 ALA N N 51 120.418 120.418 118.756 1.662 17927 4412 1 6 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.192 -0.047 17927 4413 1 6 . 1 1 51 51 ALA C C 51 180.329 180.329 179.842 0.487 17927 4414 1 6 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.639 -0.205 17927 4415 1 6 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.282 0.088 17927 4416 1 6 . 1 1 51 51 ALA H H 51 7.731 7.731 8.027 -0.296 17927 4417 1 6 . 1 1 52 52 LEU N N 52 121.506 121.506 119.125 2.381 17927 4418 1 6 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.970 0.018 17927 4419 1 6 . 1 1 52 52 LEU C C 52 177.944 177.944 178.394 -0.450 17927 4420 1 6 . 1 1 52 52 LEU CA C 52 58.327 58.327 57.471 0.856 17927 4421 1 6 . 1 1 52 52 LEU CB C 52 42.382 42.382 42.060 0.321 17927 4422 1 6 . 1 1 52 52 LEU H H 52 8.355 8.355 7.825 0.530 17927 4423 1 6 . 1 1 53 53 LYS N N 53 119.732 119.732 119.680 0.052 17927 4424 1 6 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.784 0.119 17927 4425 1 6 . 1 1 53 53 LYS C C 53 179.030 179.030 178.854 0.176 17927 4426 1 6 . 1 1 53 53 LYS CA C 53 59.846 59.846 60.070 -0.224 17927 4427 1 6 . 1 1 53 53 LYS CB C 53 32.211 32.211 32.023 0.188 17927 4428 1 6 . 1 1 53 53 LYS H H 53 8.148 8.148 7.934 0.214 17927 4429 1 6 . 1 1 54 54 GLU N N 54 117.779 117.779 118.935 -1.156 17927 4430 1 6 . 1 1 54 54 GLU HA H 54 4.059 4.059 3.973 0.086 17927 4431 1 6 . 1 1 54 54 GLU C C 54 179.646 179.646 178.960 0.686 17927 4432 1 6 . 1 1 54 54 GLU CA C 54 59.625 59.625 58.947 0.678 17927 4433 1 6 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.125 0.442 17927 4434 1 6 . 1 1 54 54 GLU H H 54 7.585 7.585 8.151 -0.566 17927 4435 1 6 . 1 1 55 55 LEU N N 55 120.581 120.581 120.651 -0.070 17927 4436 1 6 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.049 0.144 17927 4437 1 6 . 1 1 55 55 LEU C C 55 178.557 178.557 178.392 0.165 17927 4438 1 6 . 1 1 55 55 LEU CA C 55 58.235 58.235 58.007 0.228 17927 4439 1 6 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.953 1.058 17927 4440 1 6 . 1 1 55 55 LEU H H 55 8.096 8.096 7.846 0.250 17927 4441 1 6 . 1 1 56 56 GLU N N 56 118.023 118.023 118.447 -0.424 17927 4442 1 6 . 1 1 56 56 GLU HA H 56 3.177 3.177 3.842 -0.665 17927 4443 1 6 . 1 1 56 56 GLU C C 56 179.650 179.650 178.784 0.866 17927 4444 1 6 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.255 -0.384 17927 4445 1 6 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.215 -2.231 17927 4446 1 6 . 1 1 56 56 GLU H H 56 8.181 8.181 7.463 0.718 17927 4447 1 6 . 1 1 57 57 GLU N N 57 117.828 117.828 118.321 -0.493 17927 4448 1 6 . 1 1 57 57 GLU HA H 57 4.104 4.104 3.969 0.135 17927 4449 1 6 . 1 1 57 57 GLU C C 57 179.700 179.700 179.350 0.350 17927 4450 1 6 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.935 0.092 17927 4451 1 6 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.078 0.587 17927 4452 1 6 . 1 1 57 57 GLU H H 57 7.762 7.762 7.755 0.007 17927 4453 1 6 . 1 1 58 58 LYS N N 58 120.896 120.896 120.344 0.552 17927 4454 1 6 . 1 1 58 58 LYS HA H 58 3.979 3.979 3.911 0.068 17927 4455 1 6 . 1 1 58 58 LYS C C 58 178.715 178.715 177.907 0.808 17927 4456 1 6 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.788 0.290 17927 4457 1 6 . 1 1 58 58 LYS CB C 58 32.980 32.980 32.306 0.674 17927 4458 1 6 . 1 1 58 58 LYS H H 58 8.410 8.410 7.637 0.773 17927 4459 1 6 . 1 1 59 59 TYR N N 59 113.713 113.713 114.832 -1.119 17927 4460 1 6 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.607 -0.295 17927 4461 1 6 . 1 1 59 59 TYR C C 59 175.025 175.025 174.238 0.787 17927 4462 1 6 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.192 2.781 17927 4463 1 6 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.197 -0.763 17927 4464 1 6 . 1 1 59 59 TYR H H 59 8.102 8.102 7.498 0.604 17927 4465 1 6 . 1 1 60 60 ALA N N 60 126.637 126.637 122.905 3.732 17927 4466 1 6 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.336 0.082 17927 4467 1 6 . 1 1 60 60 ALA C C 60 179.208 179.208 178.206 1.002 17927 4468 1 6 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.479 1.055 17927 4469 1 6 . 1 1 60 60 ALA CB C 60 18.589 18.589 19.185 -0.596 17927 4470 1 6 . 1 1 60 60 ALA H H 60 7.201 7.201 7.431 -0.230 17927 4471 1 6 . 1 1 61 61 GLY N N 61 111.816 111.816 110.030 1.786 17927 4472 1 6 . 1 1 61 61 GLY C C 61 174.698 174.698 173.997 0.701 17927 4473 1 6 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.856 0.048 17927 4474 1 6 . 1 1 61 61 GLY H H 61 9.184 9.184 8.787 0.398 17927 4475 1 6 . 1 1 62 62 LYS N N 62 118.497 118.497 119.351 -0.854 17927 4476 1 6 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.608 0.271 17927 4477 1 6 . 1 1 62 62 LYS C C 62 179.019 179.019 175.049 3.970 17927 4478 1 6 . 1 1 62 62 LYS CA C 62 53.988 53.988 54.441 -0.453 17927 4479 1 6 . 1 1 62 62 LYS CB C 62 33.840 33.840 34.599 -0.759 17927 4480 1 6 . 1 1 62 62 LYS H H 62 8.019 8.019 7.755 0.264 17927 4481 1 6 . 1 1 63 63 ASP N N 63 122.982 122.982 121.147 1.835 17927 4482 1 6 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.847 -0.320 17927 4483 1 6 . 1 1 63 63 ASP C C 63 174.065 174.065 174.575 -0.510 17927 4484 1 6 . 1 1 63 63 ASP CA C 63 55.055 55.055 53.374 1.681 17927 4485 1 6 . 1 1 63 63 ASP CB C 63 38.582 38.582 40.318 -1.736 17927 4486 1 6 . 1 1 63 63 ASP H H 63 8.709 8.709 8.633 0.076 17927 4487 1 6 . 1 1 64 64 ILE N N 64 122.219 122.219 118.883 3.336 17927 4488 1 6 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.265 0.342 17927 4489 1 6 . 1 1 64 64 ILE C C 64 174.627 174.627 174.078 0.549 17927 4490 1 6 . 1 1 64 64 ILE CA C 64 59.712 59.712 60.334 -0.622 17927 4491 1 6 . 1 1 64 64 ILE CB C 64 42.133 42.133 42.138 -0.005 17927 4492 1 6 . 1 1 64 64 ILE H H 64 8.678 8.678 7.411 1.267 17927 4493 1 6 . 1 1 65 65 HIS N N 65 125.584 125.584 124.811 0.773 17927 4494 1 6 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.939 0.104 17927 4495 1 6 . 1 1 65 65 HIS C C 65 174.153 174.153 173.752 0.401 17927 4496 1 6 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.372 0.587 17927 4497 1 6 . 1 1 65 65 HIS CB C 65 34.156 34.156 31.366 2.790 17927 4498 1 6 . 1 1 65 65 HIS H H 65 9.204 9.204 8.717 0.487 17927 4499 1 6 . 1 1 66 66 PHE N N 66 123.244 123.244 125.888 -2.644 17927 4500 1 6 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.915 0.295 17927 4501 1 6 . 1 1 66 66 PHE C C 66 175.463 175.463 174.809 0.654 17927 4502 1 6 . 1 1 66 66 PHE CA C 66 58.088 58.088 58.417 -0.329 17927 4503 1 6 . 1 1 66 66 PHE CB C 66 39.637 39.637 38.695 0.942 17927 4504 1 6 . 1 1 66 66 PHE H H 66 9.262 9.262 9.201 0.061 17927 4505 1 6 . 1 1 67 67 VAL N N 67 126.201 126.201 125.506 0.695 17927 4506 1 6 . 1 1 67 67 VAL HA H 67 4.834 4.834 5.399 -0.565 17927 4507 1 6 . 1 1 67 67 VAL C C 67 174.364 174.364 175.538 -1.174 17927 4508 1 6 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.336 0.388 17927 4509 1 6 . 1 1 67 67 VAL CB C 67 34.893 34.893 33.593 1.300 17927 4510 1 6 . 1 1 67 67 VAL H H 67 8.843 8.843 9.303 -0.460 17927 4511 1 6 . 1 1 68 68 SER N N 68 124.528 124.528 123.418 1.110 17927 4512 1 6 . 1 1 68 68 SER HA H 68 5.585 5.585 5.504 0.081 17927 4513 1 6 . 1 1 68 68 SER C C 68 172.858 172.858 172.817 0.041 17927 4514 1 6 . 1 1 68 68 SER CA C 68 57.282 57.282 57.057 0.225 17927 4515 1 6 . 1 1 68 68 SER CB C 68 65.032 65.032 65.048 -0.016 17927 4516 1 6 . 1 1 68 68 SER H H 68 9.243 9.243 8.820 0.423 17927 4517 1 6 . 1 1 69 69 LEU N N 69 126.695 126.695 125.088 1.607 17927 4518 1 6 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.610 -1.093 17927 4519 1 6 . 1 1 69 69 LEU C C 69 174.652 174.652 176.509 -1.857 17927 4520 1 6 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.210 -0.383 17927 4521 1 6 . 1 1 69 69 LEU CB C 69 43.895 43.895 45.081 -1.186 17927 4522 1 6 . 1 1 69 69 LEU H H 69 9.360 9.360 9.172 0.188 17927 4523 1 6 . 1 1 70 70 SER N N 70 116.379 116.379 116.988 -0.609 17927 4524 1 6 . 1 1 70 70 SER HA H 70 4.905 4.905 5.158 -0.253 17927 4525 1 6 . 1 1 70 70 SER C C 70 176.307 176.307 175.018 1.289 17927 4526 1 6 . 1 1 70 70 SER CA C 70 55.213 55.213 56.340 -1.127 17927 4527 1 6 . 1 1 70 70 SER CB C 70 63.519 63.519 64.332 -0.813 17927 4528 1 6 . 1 1 70 70 SER H H 70 7.981 7.981 8.475 -0.494 17927 4529 1 6 . 1 1 71 71 CYS N N 71 124.670 124.670 127.937 -3.267 17927 4530 1 6 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.528 0.430 17927 4531 1 6 . 1 1 71 71 CYS C C 71 173.996 173.996 174.139 -0.143 17927 4532 1 6 . 1 1 71 71 CYS CA C 71 55.483 55.483 58.424 -2.941 17927 4533 1 6 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.555 0.557 17927 4534 1 6 . 1 1 71 71 CYS H H 71 8.609 8.609 9.155 -0.546 17927 4535 1 6 . 1 1 72 72 ASP N N 72 122.398 122.398 121.444 0.954 17927 4536 1 6 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.549 -0.257 17927 4537 1 6 . 1 1 72 72 ASP C C 72 176.653 176.653 176.323 0.330 17927 4538 1 6 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.578 1.204 17927 4539 1 6 . 1 1 72 72 ASP CB C 72 41.526 41.526 41.440 0.086 17927 4540 1 6 . 1 1 72 72 ASP H H 72 8.557 8.557 7.770 0.787 17927 4541 1 6 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.297 -0.232 17927 4542 1 6 . 1 1 73 73 LYS C C 73 176.545 176.545 176.270 0.275 17927 4543 1 6 . 1 1 73 73 LYS CA C 73 58.458 58.458 57.742 0.716 17927 4544 1 6 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.524 0.117 17927 4545 1 6 . 1 1 74 74 ASN N N 74 117.616 117.616 118.683 -1.067 17927 4546 1 6 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.766 0.139 17927 4547 1 6 . 1 1 74 74 ASN C C 74 174.894 174.894 175.395 -0.501 17927 4548 1 6 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.175 -0.654 17927 4549 1 6 . 1 1 74 74 ASN CB C 74 38.109 38.109 36.943 1.166 17927 4550 1 6 . 1 1 74 74 ASN H H 74 8.625 8.625 7.996 0.629 17927 4551 1 6 . 1 1 75 75 LYS N N 75 126.797 126.797 122.687 4.110 17927 4552 1 6 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.765 -0.342 17927 4553 1 6 . 1 1 75 75 LYS C C 75 178.058 178.058 177.926 0.132 17927 4554 1 6 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.637 -0.464 17927 4555 1 6 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.327 0.964 17927 4556 1 6 . 1 1 75 75 LYS H H 75 8.588 8.588 8.033 0.555 17927 4557 1 6 . 1 1 76 76 LYS N N 76 117.875 117.875 119.304 -1.429 17927 4558 1 6 . 1 1 76 76 LYS HA H 76 4.200 4.200 4.309 -0.109 17927 4559 1 6 . 1 1 76 76 LYS C C 76 178.791 178.791 178.657 0.134 17927 4560 1 6 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.264 -0.656 17927 4561 1 6 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.211 0.279 17927 4562 1 6 . 1 1 76 76 LYS H H 76 8.041 8.041 8.692 -0.651 17927 4563 1 6 . 1 1 77 77 ALA N N 77 121.567 121.567 121.767 -0.200 17927 4564 1 6 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.184 -0.061 17927 4565 1 6 . 1 1 77 77 ALA C C 77 181.191 181.191 179.602 1.589 17927 4566 1 6 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.550 0.408 17927 4567 1 6 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.078 -0.319 17927 4568 1 6 . 1 1 77 77 ALA H H 77 7.366 7.366 7.985 -0.619 17927 4569 1 6 . 1 1 78 78 TRP N N 78 119.497 119.497 120.971 -1.474 17927 4570 1 6 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.204 -0.127 17927 4571 1 6 . 1 1 78 78 TRP C C 78 175.942 175.942 177.157 -1.215 17927 4572 1 6 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.397 2.364 17927 4573 1 6 . 1 1 78 78 TRP CB C 78 27.272 27.272 30.231 -2.959 17927 4574 1 6 . 1 1 78 78 TRP H H 78 7.187 7.187 8.438 -1.251 17927 4575 1 6 . 1 1 79 79 GLU N N 79 118.771 118.771 118.882 -0.111 17927 4576 1 6 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.426 -0.412 17927 4577 1 6 . 1 1 79 79 GLU C C 79 179.863 179.863 178.249 1.614 17927 4578 1 6 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.586 -0.476 17927 4579 1 6 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.892 1.328 17927 4580 1 6 . 1 1 79 79 GLU H H 79 8.813 8.813 8.946 -0.133 17927 4581 1 6 . 1 1 80 80 ASN N N 80 115.964 115.964 117.724 -1.760 17927 4582 1 6 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.517 -0.178 17927 4583 1 6 . 1 1 80 80 ASN C C 80 176.749 176.749 177.325 -0.576 17927 4584 1 6 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.247 0.788 17927 4585 1 6 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.324 0.165 17927 4586 1 6 . 1 1 80 80 ASN H H 80 8.491 8.491 7.918 0.573 17927 4587 1 6 . 1 1 81 81 MET N N 81 119.670 119.670 120.859 -1.189 17927 4588 1 6 . 1 1 81 81 MET HA H 81 4.149 4.149 4.188 -0.039 17927 4589 1 6 . 1 1 81 81 MET C C 81 177.933 177.933 177.597 0.336 17927 4590 1 6 . 1 1 81 81 MET CA C 81 60.276 60.276 57.609 2.667 17927 4591 1 6 . 1 1 81 81 MET CB C 81 32.518 32.518 31.954 0.564 17927 4592 1 6 . 1 1 81 81 MET H H 81 7.667 7.667 7.635 0.032 17927 4593 1 6 . 1 1 82 82 VAL N N 82 117.634 117.634 118.509 -0.875 17927 4594 1 6 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.556 -0.253 17927 4595 1 6 . 1 1 82 82 VAL C C 82 179.005 179.005 177.336 1.669 17927 4596 1 6 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.261 0.776 17927 4597 1 6 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.045 0.720 17927 4598 1 6 . 1 1 82 82 VAL H H 82 8.338 8.338 8.041 0.297 17927 4599 1 6 . 1 1 83 83 THR N N 83 110.519 110.519 116.456 -5.937 17927 4600 1 6 . 1 1 83 83 THR HA H 83 3.983 3.983 4.019 -0.036 17927 4601 1 6 . 1 1 83 83 THR C C 83 177.591 177.591 176.372 1.219 17927 4602 1 6 . 1 1 83 83 THR CA C 83 65.431 65.431 66.204 -0.773 17927 4603 1 6 . 1 1 83 83 THR CB C 83 69.156 69.156 68.427 0.729 17927 4604 1 6 . 1 1 83 83 THR H H 83 7.659 7.659 7.540 0.119 17927 4605 1 6 . 1 1 84 84 LYS N N 84 123.927 123.927 119.579 4.348 17927 4606 1 6 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.203 -0.134 17927 4607 1 6 . 1 1 84 84 LYS C C 84 178.582 178.582 178.212 0.370 17927 4608 1 6 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.180 1.697 17927 4609 1 6 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.409 -0.086 17927 4610 1 6 . 1 1 84 84 LYS H H 84 8.665 8.665 7.765 0.900 17927 4611 1 6 . 1 1 85 85 ASP N N 85 116.280 116.280 117.955 -1.675 17927 4612 1 6 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.478 0.272 17927 4613 1 6 . 1 1 85 85 ASP C C 85 175.086 175.086 175.788 -0.702 17927 4614 1 6 . 1 1 85 85 ASP CA C 85 54.693 54.693 55.800 -1.107 17927 4615 1 6 . 1 1 85 85 ASP CB C 85 39.685 39.685 41.693 -2.008 17927 4616 1 6 . 1 1 85 85 ASP H H 85 8.179 8.179 8.416 -0.237 17927 4617 1 6 . 1 1 86 86 GLN N N 86 116.258 116.258 116.151 0.107 17927 4618 1 6 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.887 0.021 17927 4619 1 6 . 1 1 86 86 GLN C C 86 175.659 175.659 174.834 0.825 17927 4620 1 6 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.487 -0.316 17927 4621 1 6 . 1 1 86 86 GLN CB C 86 26.290 26.290 25.750 0.540 17927 4622 1 6 . 1 1 86 86 GLN H H 86 7.431 7.431 7.966 -0.535 17927 4623 1 6 . 1 1 87 87 LEU N N 87 117.031 117.031 120.765 -3.734 17927 4624 1 6 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.342 -0.252 17927 4625 1 6 . 1 1 87 87 LEU C C 87 178.225 178.225 176.496 1.729 17927 4626 1 6 . 1 1 87 87 LEU CA C 87 55.932 55.932 54.674 1.258 17927 4627 1 6 . 1 1 87 87 LEU CB C 87 41.202 41.202 43.020 -1.818 17927 4628 1 6 . 1 1 87 87 LEU H H 87 7.736 7.736 7.712 0.024 17927 4629 1 6 . 1 1 88 88 LYS N N 88 122.367 122.367 118.130 4.237 17927 4630 1 6 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.642 -0.006 17927 4631 1 6 . 1 1 88 88 LYS C C 88 177.538 177.538 175.440 2.098 17927 4632 1 6 . 1 1 88 88 LYS CA C 88 54.930 54.930 54.719 0.211 17927 4633 1 6 . 1 1 88 88 LYS CB C 88 33.316 33.316 34.446 -1.130 17927 4634 1 6 . 1 1 88 88 LYS H H 88 8.496 8.496 8.066 0.430 17927 4635 1 6 . 1 1 89 89 GLY N N 89 108.452 108.452 105.956 2.496 17927 4636 1 6 . 1 1 89 89 GLY C C 89 173.781 173.781 173.453 0.328 17927 4637 1 6 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.836 0.522 17927 4638 1 6 . 1 1 89 89 GLY H H 89 8.497 8.497 7.993 0.504 17927 4639 1 6 . 1 1 90 90 ILE N N 90 123.295 123.295 123.248 0.047 17927 4640 1 6 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.167 0.204 17927 4641 1 6 . 1 1 90 90 ILE C C 90 175.606 175.606 174.974 0.632 17927 4642 1 6 . 1 1 90 90 ILE CA C 90 62.001 62.001 61.430 0.571 17927 4643 1 6 . 1 1 90 90 ILE CB C 90 38.036 38.036 37.925 0.111 17927 4644 1 6 . 1 1 90 90 ILE H H 90 8.728 8.728 8.137 0.591 17927 4645 1 6 . 1 1 91 91 GLN N N 91 128.632 128.632 126.623 2.009 17927 4646 1 6 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.729 0.037 17927 4647 1 6 . 1 1 91 91 GLN C C 91 174.618 174.618 174.966 -0.348 17927 4648 1 6 . 1 1 91 91 GLN CA C 91 54.850 54.850 54.419 0.431 17927 4649 1 6 . 1 1 91 91 GLN CB C 91 28.341 28.341 29.447 -1.105 17927 4650 1 6 . 1 1 91 91 GLN H H 91 8.762 8.762 8.560 0.202 17927 4651 1 6 . 1 1 92 92 LEU N N 92 120.830 120.830 124.162 -3.332 17927 4652 1 6 . 1 1 92 92 LEU HA H 92 5.580 5.580 5.010 0.570 17927 4653 1 6 . 1 1 92 92 LEU C C 92 176.828 176.828 175.481 1.347 17927 4654 1 6 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.678 -0.878 17927 4655 1 6 . 1 1 92 92 LEU CB C 92 44.210 44.210 45.277 -1.067 17927 4656 1 6 . 1 1 92 92 LEU H H 92 9.011 9.011 9.273 -0.262 17927 4657 1 6 . 1 1 93 93 HIS N N 93 121.481 121.481 119.635 1.846 17927 4658 1 6 . 1 1 93 93 HIS HA H 93 3.931 3.931 5.135 -1.204 17927 4659 1 6 . 1 1 93 93 HIS C C 93 173.590 173.590 173.589 0.001 17927 4660 1 6 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.560 1.023 17927 4661 1 6 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.514 -1.264 17927 4662 1 6 . 1 1 93 93 HIS H H 93 8.038 8.038 8.724 -0.686 17927 4663 1 6 . 1 1 94 94 MET N N 94 121.881 121.881 124.453 -2.572 17927 4664 1 6 . 1 1 94 94 MET HA H 94 3.866 3.866 4.127 -0.261 17927 4665 1 6 . 1 1 94 94 MET C C 94 177.035 177.035 176.149 0.886 17927 4666 1 6 . 1 1 94 94 MET CA C 94 55.189 55.189 57.316 -2.127 17927 4667 1 6 . 1 1 94 94 MET CB C 94 33.993 33.993 33.888 0.105 17927 4668 1 6 . 1 1 94 94 MET H H 94 8.039 8.039 8.719 -0.680 17927 4669 1 6 . 1 1 95 95 GLY N N 95 104.041 104.041 105.335 -1.294 17927 4670 1 6 . 1 1 95 95 GLY C C 95 174.251 174.251 173.809 0.442 17927 4671 1 6 . 1 1 95 95 GLY CA C 95 46.580 46.580 45.782 0.798 17927 4672 1 6 . 1 1 95 95 GLY H H 95 5.666 5.666 7.880 -2.214 17927 4673 1 6 . 1 1 96 96 THR N N 96 114.114 114.114 114.147 -0.033 17927 4674 1 6 . 1 1 96 96 THR HA H 96 4.211 4.211 4.352 -0.141 17927 4675 1 6 . 1 1 96 96 THR C C 96 175.122 175.122 173.495 1.627 17927 4676 1 6 . 1 1 96 96 THR CA C 96 61.339 61.339 61.364 -0.024 17927 4677 1 6 . 1 1 96 96 THR CB C 96 68.615 68.615 69.528 -0.913 17927 4678 1 6 . 1 1 96 96 THR H H 96 8.517 8.517 7.886 0.631 17927 4679 1 6 . 1 1 97 97 ASP N N 97 121.892 121.892 120.749 1.143 17927 4680 1 6 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.655 -0.070 17927 4681 1 6 . 1 1 97 97 ASP C C 97 178.241 178.241 175.503 2.738 17927 4682 1 6 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.031 1.769 17927 4683 1 6 . 1 1 97 97 ASP CB C 97 43.129 43.129 43.210 -0.081 17927 4684 1 6 . 1 1 97 97 ASP H H 97 7.563 7.563 7.768 -0.205 17927 4685 1 6 . 1 1 98 98 ARG N N 98 127.508 127.508 121.368 6.140 17927 4686 1 6 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.561 -0.169 17927 4687 1 6 . 1 1 98 98 ARG C C 98 176.724 176.724 176.278 0.446 17927 4688 1 6 . 1 1 98 98 ARG CA C 98 55.939 55.939 56.535 -0.596 17927 4689 1 6 . 1 1 98 98 ARG CB C 98 30.291 30.291 29.894 0.397 17927 4690 1 6 . 1 1 98 98 ARG H H 98 9.225 9.225 8.432 0.793 17927 4691 1 6 . 1 1 99 99 THR N N 99 116.384 116.384 117.786 -1.402 17927 4692 1 6 . 1 1 99 99 THR HA H 99 3.987 3.987 4.157 -0.170 17927 4693 1 6 . 1 1 99 99 THR C C 99 176.969 176.969 175.617 1.352 17927 4694 1 6 . 1 1 99 99 THR CA C 99 67.714 67.714 66.581 1.133 17927 4695 1 6 . 1 1 99 99 THR CB C 99 68.777 68.777 68.601 0.176 17927 4696 1 6 . 1 1 99 99 THR H H 99 8.382 8.382 8.460 -0.078 17927 4697 1 6 . 1 1 100 100 PHE N N 100 123.232 123.232 122.598 0.634 17927 4698 1 6 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.248 -0.075 17927 4699 1 6 . 1 1 100 100 PHE C C 100 177.010 177.010 176.147 0.863 17927 4700 1 6 . 1 1 100 100 PHE CA C 100 61.923 61.923 61.311 0.612 17927 4701 1 6 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.507 1.255 17927 4702 1 6 . 1 1 100 100 PHE H H 100 7.998 7.998 8.635 -0.637 17927 4703 1 6 . 1 1 101 101 MET N N 101 115.968 115.968 114.947 1.021 17927 4704 1 6 . 1 1 101 101 MET HA H 101 3.975 3.975 4.366 -0.391 17927 4705 1 6 . 1 1 101 101 MET C C 101 178.763 178.763 177.455 1.308 17927 4706 1 6 . 1 1 101 101 MET CA C 101 58.552 58.552 56.914 1.638 17927 4707 1 6 . 1 1 101 101 MET CB C 101 32.593 32.593 31.885 0.708 17927 4708 1 6 . 1 1 101 101 MET H H 101 7.828 7.828 8.125 -0.297 17927 4709 1 6 . 1 1 102 102 ASP N N 102 117.553 117.553 120.689 -3.136 17927 4710 1 6 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.399 0.123 17927 4711 1 6 . 1 1 102 102 ASP C C 102 179.503 179.503 178.552 0.951 17927 4712 1 6 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.142 -0.252 17927 4713 1 6 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.973 -1.047 17927 4714 1 6 . 1 1 102 102 ASP H H 102 8.828 8.828 8.047 0.781 17927 4715 1 6 . 1 1 103 103 ALA N N 103 122.984 122.984 121.886 1.098 17927 4716 1 6 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.019 -0.033 17927 4717 1 6 . 1 1 103 103 ALA C C 103 178.782 178.782 178.147 0.635 17927 4718 1 6 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.171 0.923 17927 4719 1 6 . 1 1 103 103 ALA CB C 103 18.563 18.563 17.913 0.650 17927 4720 1 6 . 1 1 103 103 ALA H H 103 7.567 7.567 7.594 -0.027 17927 4721 1 6 . 1 1 104 104 TYR N N 104 112.159 112.159 114.312 -2.153 17927 4722 1 6 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.506 -0.282 17927 4723 1 6 . 1 1 104 104 TYR C C 104 173.821 173.821 174.976 -1.155 17927 4724 1 6 . 1 1 104 104 TYR CA C 104 58.498 58.498 57.898 0.600 17927 4725 1 6 . 1 1 104 104 TYR CB C 104 38.393 38.393 38.699 -0.306 17927 4726 1 6 . 1 1 104 104 TYR H H 104 7.203 7.203 7.123 0.080 17927 4727 1 6 . 1 1 105 105 LEU N N 105 119.433 119.433 117.026 2.407 17927 4728 1 6 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.993 -0.008 17927 4729 1 6 . 1 1 105 105 LEU C C 105 176.721 176.721 177.028 -0.307 17927 4730 1 6 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.674 0.111 17927 4731 1 6 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.474 -1.031 17927 4732 1 6 . 1 1 105 105 LEU H H 105 7.582 7.582 7.830 -0.248 17927 4733 1 6 . 1 1 106 106 ILE N N 106 119.575 119.575 118.746 0.829 17927 4734 1 6 . 1 1 106 106 ILE HA H 106 4.002 4.002 3.884 0.118 17927 4735 1 6 . 1 1 106 106 ILE C C 106 175.459 175.459 177.219 -1.760 17927 4736 1 6 . 1 1 106 106 ILE CA C 106 62.043 62.043 61.987 0.056 17927 4737 1 6 . 1 1 106 106 ILE CB C 106 36.335 36.335 38.961 -2.626 17927 4738 1 6 . 1 1 106 106 ILE H H 106 8.774 8.774 7.787 0.987 17927 4739 1 6 . 1 1 107 107 ASN N N 107 126.514 126.514 117.218 9.296 17927 4740 1 6 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.340 0.523 17927 4741 1 6 . 1 1 107 107 ASN C C 107 174.584 174.584 175.240 -0.656 17927 4742 1 6 . 1 1 107 107 ASN CA C 107 53.112 53.112 55.152 -2.040 17927 4743 1 6 . 1 1 107 107 ASN CB C 107 38.977 38.977 37.415 1.562 17927 4744 1 6 . 1 1 107 107 ASN H H 107 8.364 8.364 8.513 -0.149 17927 4745 1 6 . 1 1 108 108 GLY N N 108 108.469 108.469 109.152 -0.683 17927 4746 1 6 . 1 1 108 108 GLY C C 108 171.245 171.245 173.822 -2.577 17927 4747 1 6 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.445 0.824 17927 4748 1 6 . 1 1 108 108 GLY H H 108 7.678 7.678 8.217 -0.539 17927 4749 1 6 . 1 1 109 109 ILE N N 109 112.817 112.817 121.251 -8.434 17927 4750 1 6 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.442 -0.036 17927 4751 1 6 . 1 1 109 109 ILE C C 109 173.498 173.498 174.640 -1.142 17927 4752 1 6 . 1 1 109 109 ILE CA C 109 58.384 58.384 57.970 0.414 17927 4753 1 6 . 1 1 109 109 ILE CB C 109 40.322 40.322 37.723 2.599 17927 4754 1 6 . 1 1 109 109 ILE H H 109 7.868 7.868 7.655 0.213 17927 4755 1 6 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.421 0.321 17927 4756 1 6 . 1 1 110 110 PRO C C 110 175.715 175.715 175.279 0.436 17927 4757 1 6 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.104 0.173 17927 4758 1 6 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.323 4.045 17927 4759 1 6 . 1 1 111 111 ARG N N 111 122.358 122.358 119.937 2.421 17927 4760 1 6 . 1 1 111 111 ARG HA H 111 4.469 4.469 3.967 0.502 17927 4761 1 6 . 1 1 111 111 ARG C C 111 171.541 171.541 174.018 -2.477 17927 4762 1 6 . 1 1 111 111 ARG CA C 111 54.356 54.356 53.892 0.464 17927 4763 1 6 . 1 1 111 111 ARG CB C 111 33.430 33.430 32.497 0.933 17927 4764 1 6 . 1 1 111 111 ARG H H 111 7.732 7.732 8.123 -0.391 17927 4765 1 6 . 1 1 112 112 PHE N N 112 125.103 125.103 122.559 2.544 17927 4766 1 6 . 1 1 112 112 PHE HA H 112 5.773 5.773 5.036 0.737 17927 4767 1 6 . 1 1 112 112 PHE C C 112 175.097 175.097 175.033 0.064 17927 4768 1 6 . 1 1 112 112 PHE CA C 112 55.791 55.791 56.368 -0.577 17927 4769 1 6 . 1 1 112 112 PHE CB C 112 40.928 40.928 41.141 -0.212 17927 4770 1 6 . 1 1 112 112 PHE H H 112 8.929 8.929 8.063 0.866 17927 4771 1 6 . 1 1 113 113 ILE N N 113 123.778 123.778 121.482 2.296 17927 4772 1 6 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.589 -0.046 17927 4773 1 6 . 1 1 113 113 ILE C C 113 173.197 173.197 173.352 -0.155 17927 4774 1 6 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.544 0.742 17927 4775 1 6 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.815 1.431 17927 4776 1 6 . 1 1 113 113 ILE H H 113 8.873 8.873 8.243 0.630 17927 4777 1 6 . 1 1 114 114 LEU N N 114 127.146 127.146 126.255 0.891 17927 4778 1 6 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.467 0.547 17927 4779 1 6 . 1 1 114 114 LEU C C 114 175.080 175.080 174.354 0.726 17927 4780 1 6 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.769 -0.368 17927 4781 1 6 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.560 0.810 17927 4782 1 6 . 1 1 114 114 LEU H H 114 8.974 8.974 8.023 0.951 17927 4783 1 6 . 1 1 115 115 LEU N N 115 128.323 128.323 125.045 3.278 17927 4784 1 6 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.182 0.250 17927 4785 1 6 . 1 1 115 115 LEU C C 115 176.660 176.660 175.412 1.248 17927 4786 1 6 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.818 -0.741 17927 4787 1 6 . 1 1 115 115 LEU CB C 115 44.584 44.584 45.927 -1.343 17927 4788 1 6 . 1 1 115 115 LEU H H 115 9.874 9.874 9.364 0.510 17927 4789 1 6 . 1 1 116 116 ASP N N 116 119.834 119.834 122.213 -2.379 17927 4790 1 6 . 1 1 116 116 ASP HA H 116 4.935 4.935 4.999 -0.064 17927 4791 1 6 . 1 1 116 116 ASP C C 116 176.898 176.898 177.728 -0.830 17927 4792 1 6 . 1 1 116 116 ASP CA C 116 52.305 52.305 54.515 -2.210 17927 4793 1 6 . 1 1 116 116 ASP CB C 116 41.028 41.028 43.550 -2.522 17927 4794 1 6 . 1 1 116 116 ASP H H 116 9.357 9.357 8.932 0.425 17927 4795 1 6 . 1 1 117 117 ARG N N 117 113.356 113.356 121.417 -8.061 17927 4796 1 6 . 1 1 117 117 ARG HA H 117 3.717 3.717 4.146 -0.429 17927 4797 1 6 . 1 1 117 117 ARG C C 117 177.105 177.105 178.178 -1.073 17927 4798 1 6 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.873 -1.688 17927 4799 1 6 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.979 0.458 17927 4800 1 6 . 1 1 117 117 ARG H H 117 7.697 7.697 8.453 -0.756 17927 4801 1 6 . 1 1 118 118 ASP N N 118 117.226 117.226 117.090 0.136 17927 4802 1 6 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.501 0.394 17927 4803 1 6 . 1 1 118 118 ASP C C 118 176.657 176.657 176.813 -0.156 17927 4804 1 6 . 1 1 118 118 ASP CA C 118 53.517 53.517 54.790 -1.273 17927 4805 1 6 . 1 1 118 118 ASP CB C 118 42.556 42.556 41.118 1.438 17927 4806 1 6 . 1 1 118 118 ASP H H 118 8.456 8.456 7.802 0.654 17927 4807 1 6 . 1 1 119 119 GLY N N 119 109.074 109.074 107.160 1.914 17927 4808 1 6 . 1 1 119 119 GLY C C 119 173.355 173.355 174.088 -0.733 17927 4809 1 6 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.344 0.912 17927 4810 1 6 . 1 1 119 119 GLY H H 119 8.183 8.183 8.321 -0.138 17927 4811 1 6 . 1 1 120 120 LYS N N 120 120.744 120.744 121.217 -0.473 17927 4812 1 6 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.687 -0.154 17927 4813 1 6 . 1 1 120 120 LYS C C 120 177.229 177.229 176.029 1.200 17927 4814 1 6 . 1 1 120 120 LYS CA C 120 55.287 55.287 54.113 1.174 17927 4815 1 6 . 1 1 120 120 LYS CB C 120 32.581 32.581 32.675 -0.094 17927 4816 1 6 . 1 1 120 120 LYS H H 120 8.449 8.449 7.506 0.943 17927 4817 1 6 . 1 1 121 121 ILE N N 121 121.221 121.221 127.502 -6.281 17927 4818 1 6 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.852 0.034 17927 4819 1 6 . 1 1 121 121 ILE C C 121 177.819 177.819 176.813 1.006 17927 4820 1 6 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.360 0.555 17927 4821 1 6 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.095 2.295 17927 4822 1 6 . 1 1 121 121 ILE H H 121 8.715 8.715 8.985 -0.270 17927 4823 1 6 . 1 1 122 122 ILE N N 122 127.165 127.165 129.600 -2.435 17927 4824 1 6 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.023 0.318 17927 4825 1 6 . 1 1 122 122 ILE C C 122 176.978 176.978 176.690 0.288 17927 4826 1 6 . 1 1 122 122 ILE CA C 122 63.719 63.719 63.296 0.423 17927 4827 1 6 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.713 -0.061 17927 4828 1 6 . 1 1 122 122 ILE H H 122 8.974 8.974 8.822 0.152 17927 4829 1 6 . 1 1 123 123 SER N N 123 111.227 111.227 114.116 -2.889 17927 4830 1 6 . 1 1 123 123 SER HA H 123 4.738 4.738 4.732 0.006 17927 4831 1 6 . 1 1 123 123 SER C C 123 174.184 174.184 174.041 0.143 17927 4832 1 6 . 1 1 123 123 SER CA C 123 57.383 57.383 57.379 0.004 17927 4833 1 6 . 1 1 123 123 SER CB C 123 65.326 65.326 65.250 0.076 17927 4834 1 6 . 1 1 123 123 SER H H 123 7.850 7.850 7.904 -0.054 17927 4835 1 6 . 1 1 124 124 ALA N N 124 131.373 131.373 126.543 4.830 17927 4836 1 6 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.194 0.291 17927 4837 1 6 . 1 1 124 124 ALA C C 124 175.147 175.147 176.698 -1.551 17927 4838 1 6 . 1 1 124 124 ALA CA C 124 53.035 53.035 54.750 -1.715 17927 4839 1 6 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.295 -0.633 17927 4840 1 6 . 1 1 124 124 ALA H H 124 9.384 9.384 8.630 0.754 17927 4841 1 6 . 1 1 125 125 ASN N N 125 119.476 119.476 113.582 5.894 17927 4842 1 6 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.107 -0.051 17927 4843 1 6 . 1 1 125 125 ASN C C 125 173.593 173.593 174.266 -0.673 17927 4844 1 6 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.299 0.053 17927 4845 1 6 . 1 1 125 125 ASN CB C 125 38.304 38.304 39.857 -1.553 17927 4846 1 6 . 1 1 125 125 ASN H H 125 8.191 8.191 7.762 0.429 17927 4847 1 6 . 1 1 126 126 MET N N 126 122.705 122.705 125.624 -2.919 17927 4848 1 6 . 1 1 126 126 MET HA H 126 4.585 4.585 4.891 -0.306 17927 4849 1 6 . 1 1 126 126 MET C C 126 175.215 175.215 175.057 0.158 17927 4850 1 6 . 1 1 126 126 MET CA C 126 53.849 53.849 53.904 -0.056 17927 4851 1 6 . 1 1 126 126 MET CB C 126 31.312 31.312 34.424 -3.112 17927 4852 1 6 . 1 1 126 126 MET H H 126 8.376 8.376 9.128 -0.752 17927 4853 1 6 . 1 1 127 127 THR N N 127 111.016 111.016 113.109 -2.093 17927 4854 1 6 . 1 1 127 127 THR HA H 127 4.291 4.291 4.563 -0.272 17927 4855 1 6 . 1 1 127 127 THR C C 127 174.574 174.574 173.436 1.138 17927 4856 1 6 . 1 1 127 127 THR CA C 127 62.085 62.085 60.099 1.986 17927 4857 1 6 . 1 1 127 127 THR CB C 127 69.733 69.733 70.874 -1.141 17927 4858 1 6 . 1 1 127 127 THR H H 127 7.714 7.714 8.060 -0.346 17927 4859 1 6 . 1 1 128 128 ARG N N 128 118.722 118.722 120.310 -1.588 17927 4860 1 6 . 1 1 128 128 ARG HA H 128 3.308 3.308 3.190 0.118 17927 4861 1 6 . 1 1 128 128 ARG C C 128 176.978 176.978 175.639 1.339 17927 4862 1 6 . 1 1 128 128 ARG CA C 128 54.727 54.727 55.742 -1.015 17927 4863 1 6 . 1 1 128 128 ARG CB C 128 29.598 29.598 27.944 1.654 17927 4864 1 6 . 1 1 128 128 ARG H H 128 8.658 8.658 7.593 1.065 17927 4865 1 6 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.367 -0.434 17927 4866 1 6 . 1 1 129 129 PRO C C 129 175.794 175.794 177.434 -1.640 17927 4867 1 6 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.276 1.273 17927 4868 1 6 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.498 0.179 17927 4869 1 6 . 1 1 130 130 SER N N 130 108.696 108.696 111.120 -2.424 17927 4870 1 6 . 1 1 130 130 SER HA H 130 3.988 3.988 4.386 -0.398 17927 4871 1 6 . 1 1 130 130 SER C C 130 174.445 174.445 174.170 0.275 17927 4872 1 6 . 1 1 130 130 SER CA C 130 58.911 58.911 59.246 -0.335 17927 4873 1 6 . 1 1 130 130 SER CB C 130 62.680 62.680 63.163 -0.483 17927 4874 1 6 . 1 1 130 130 SER H H 130 8.375 8.375 8.212 0.163 17927 4875 1 6 . 1 1 131 131 ASP N N 131 126.377 126.377 123.019 3.358 17927 4876 1 6 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.953 -0.081 17927 4877 1 6 . 1 1 131 131 ASP C C 131 176.879 176.879 174.965 1.914 17927 4878 1 6 . 1 1 131 131 ASP CA C 131 51.195 51.195 51.470 -0.275 17927 4879 1 6 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.731 0.085 17927 4880 1 6 . 1 1 131 131 ASP H H 131 7.514 7.514 7.585 -0.071 17927 4881 1 6 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.137 0.255 17927 4882 1 6 . 1 1 132 132 PRO C C 132 178.097 178.097 178.346 -0.249 17927 4883 1 6 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.868 0.211 17927 4884 1 6 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.194 0.214 17927 4885 1 6 . 1 1 133 133 LYS N N 133 116.306 116.306 117.324 -1.018 17927 4886 1 6 . 1 1 133 133 LYS HA H 133 3.958 3.958 4.117 -0.159 17927 4887 1 6 . 1 1 133 133 LYS C C 133 179.532 179.532 178.788 0.744 17927 4888 1 6 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.592 -1.071 17927 4889 1 6 . 1 1 133 133 LYS CB C 133 32.191 32.191 32.139 0.052 17927 4890 1 6 . 1 1 133 133 LYS H H 133 8.842 8.842 8.530 0.312 17927 4891 1 6 . 1 1 134 134 THR N N 134 120.833 120.833 115.778 5.055 17927 4892 1 6 . 1 1 134 134 THR HA H 134 3.147 3.147 3.598 -0.451 17927 4893 1 6 . 1 1 134 134 THR C C 134 173.356 173.356 175.187 -1.831 17927 4894 1 6 . 1 1 134 134 THR CA C 134 66.383 66.383 65.747 0.636 17927 4895 1 6 . 1 1 134 134 THR CB C 134 66.847 66.847 68.376 -1.529 17927 4896 1 6 . 1 1 134 134 THR H H 134 8.292 8.292 7.379 0.913 17927 4897 1 6 . 1 1 135 135 ALA N N 135 121.720 121.720 124.455 -2.735 17927 4898 1 6 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.906 -0.323 17927 4899 1 6 . 1 1 135 135 ALA C C 135 178.902 178.902 179.396 -0.494 17927 4900 1 6 . 1 1 135 135 ALA CA C 135 54.999 54.999 55.057 -0.058 17927 4901 1 6 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.343 -0.568 17927 4902 1 6 . 1 1 135 135 ALA H H 135 7.030 7.030 7.363 -0.333 17927 4903 1 6 . 1 1 136 136 GLU N N 136 114.623 114.623 117.924 -3.301 17927 4904 1 6 . 1 1 136 136 GLU HA H 136 3.922 3.922 3.994 -0.072 17927 4905 1 6 . 1 1 136 136 GLU C C 136 179.199 179.199 178.801 0.398 17927 4906 1 6 . 1 1 136 136 GLU CA C 136 59.837 59.837 58.877 0.960 17927 4907 1 6 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.095 0.691 17927 4908 1 6 . 1 1 136 136 GLU H H 136 7.216 7.216 8.624 -1.408 17927 4909 1 6 . 1 1 137 137 LYS N N 137 120.789 120.789 120.608 0.181 17927 4910 1 6 . 1 1 137 137 LYS HA H 137 4.204 4.204 4.186 0.018 17927 4911 1 6 . 1 1 137 137 LYS C C 137 178.834 178.834 178.662 0.172 17927 4912 1 6 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.854 -1.511 17927 4913 1 6 . 1 1 137 137 LYS CB C 137 30.463 30.463 32.034 -1.571 17927 4914 1 6 . 1 1 137 137 LYS H H 137 7.681 7.681 7.198 0.483 17927 4915 1 6 . 1 1 138 138 PHE N N 138 118.373 118.373 118.738 -0.365 17927 4916 1 6 . 1 1 138 138 PHE HA H 138 4.033 4.033 3.868 0.165 17927 4917 1 6 . 1 1 138 138 PHE C C 138 178.027 178.027 177.785 0.242 17927 4918 1 6 . 1 1 138 138 PHE CA C 138 57.507 57.507 60.229 -2.722 17927 4919 1 6 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.533 -1.644 17927 4920 1 6 . 1 1 138 138 PHE H H 138 8.059 8.059 7.856 0.203 17927 4921 1 6 . 1 1 139 139 ASN N N 139 117.611 117.611 117.328 0.283 17927 4922 1 6 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.513 -0.109 17927 4923 1 6 . 1 1 139 139 ASN C C 139 178.190 178.190 177.829 0.361 17927 4924 1 6 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.160 0.064 17927 4925 1 6 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.860 -1.126 17927 4926 1 6 . 1 1 139 139 ASN H H 139 8.683 8.683 8.021 0.662 17927 4927 1 6 . 1 1 140 140 GLU N N 140 121.432 121.432 121.703 -0.271 17927 4928 1 6 . 1 1 140 140 GLU HA H 140 4.005 4.005 3.988 0.017 17927 4929 1 6 . 1 1 140 140 GLU C C 140 179.751 179.751 179.106 0.645 17927 4930 1 6 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.485 -0.175 17927 4931 1 6 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.723 0.332 17927 4932 1 6 . 1 1 140 140 GLU H H 140 7.868 7.868 8.265 -0.397 17927 4933 1 6 . 1 1 141 141 LEU N N 141 119.968 119.968 118.106 1.862 17927 4934 1 6 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.102 -0.086 17927 4935 1 6 . 1 1 141 141 LEU C C 141 179.293 179.293 179.675 -0.382 17927 4936 1 6 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.238 0.198 17927 4937 1 6 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.721 -0.538 17927 4938 1 6 . 1 1 141 141 LEU H H 141 8.303 8.303 8.565 -0.262 17927 4939 1 6 . 1 1 142 142 LEU N N 142 115.040 115.040 119.341 -4.301 17927 4940 1 6 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.473 -0.089 17927 4941 1 6 . 1 1 142 142 LEU C C 142 178.002 178.002 177.251 0.751 17927 4942 1 6 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.792 -0.513 17927 4943 1 6 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.574 0.072 17927 4944 1 6 . 1 1 142 142 LEU H H 142 8.230 8.230 8.140 0.090 17927 4945 1 6 . 1 1 143 143 GLY N N 143 108.977 108.977 106.146 2.831 17927 4946 1 6 . 1 1 143 143 GLY C C 143 175.216 175.216 174.627 0.589 17927 4947 1 6 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.682 1.059 17927 4948 1 6 . 1 1 143 143 GLY H H 143 7.762 7.762 7.737 0.025 17927 4949 1 6 . 1 1 144 144 LEU N N 144 119.660 119.660 119.435 0.225 17927 4950 1 6 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.415 0.073 17927 4951 1 6 . 1 1 144 144 LEU C C 144 177.375 177.375 176.983 0.392 17927 4952 1 6 . 1 1 144 144 LEU CA C 144 54.525 54.525 56.516 -1.991 17927 4953 1 6 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.751 0.022 17927 4954 1 6 . 1 1 144 144 LEU H H 144 8.241 8.241 8.261 -0.020 17927 4955 1 6 . 1 1 145 145 GLU N N 145 119.959 119.959 119.966 -0.007 17927 4956 1 6 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.367 -0.127 17927 4957 1 6 . 1 1 145 145 GLU C C 145 177.075 177.075 176.934 0.141 17927 4958 1 6 . 1 1 145 145 GLU CA C 145 56.799 56.799 55.824 0.975 17927 4959 1 6 . 1 1 145 145 GLU CB C 145 30.168 30.168 28.924 1.244 17927 4960 1 6 . 1 1 145 145 GLU H H 145 8.410 8.410 7.712 0.698 17927 4961 1 6 . 1 1 146 146 GLY N N 146 109.412 109.412 114.357 -4.945 17927 4962 1 6 . 1 1 146 146 GLY C C 146 174.276 174.276 175.114 -0.838 17927 4963 1 6 . 1 1 146 146 GLY CA C 146 45.445 45.445 44.822 0.623 17927 4964 1 6 . 1 1 146 146 GLY H H 146 8.422 8.422 8.790 -0.368 17927 4965 1 6 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.448 0.208 17927 4966 1 6 . 1 1 151 151 HIS C C 151 173.990 173.990 174.072 -0.082 17927 4967 1 6 . 1 1 151 151 HIS CA C 151 56.044 56.044 56.046 -0.002 17927 4968 1 6 . 1 1 151 151 HIS CB C 151 30.076 30.076 30.770 -0.694 17927 4969 1 7 . 1 1 2 2 SER HA H 2 4.121 4.121 4.587 -0.466 17927 4970 1 7 . 1 1 2 2 SER CA C 2 57.293 57.293 58.919 -1.625 17927 4971 1 7 . 1 1 2 2 SER CB C 2 63.545 63.545 64.179 -0.634 17927 4972 1 7 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.639 -0.207 17927 4973 1 7 . 1 1 3 3 LEU C C 3 177.383 177.383 177.212 0.171 17927 4974 1 7 . 1 1 3 3 LEU CA C 3 55.575 55.575 54.563 1.012 17927 4975 1 7 . 1 1 3 3 LEU CB C 3 42.584 42.584 40.747 1.837 17927 4976 1 7 . 1 1 4 4 ARG N N 4 122.080 122.080 123.709 -1.629 17927 4977 1 7 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.140 0.244 17927 4978 1 7 . 1 1 4 4 ARG C C 4 176.410 176.410 176.401 0.009 17927 4979 1 7 . 1 1 4 4 ARG CA C 4 56.269 56.269 58.389 -2.120 17927 4980 1 7 . 1 1 4 4 ARG CB C 4 30.842 30.842 30.160 0.682 17927 4981 1 7 . 1 1 4 4 ARG H H 4 8.410 8.410 8.136 0.274 17927 4982 1 7 . 1 1 5 5 SER N N 5 117.023 117.023 111.450 5.573 17927 4983 1 7 . 1 1 5 5 SER HA H 5 4.423 4.423 4.536 -0.113 17927 4984 1 7 . 1 1 5 5 SER C C 5 175.039 175.039 174.879 0.160 17927 4985 1 7 . 1 1 5 5 SER CA C 5 58.605 58.605 57.966 0.639 17927 4986 1 7 . 1 1 5 5 SER CB C 5 64.044 64.044 63.263 0.781 17927 4987 1 7 . 1 1 5 5 SER H H 5 8.292 8.292 8.021 0.271 17927 4988 1 7 . 1 1 6 6 GLY N N 6 110.718 110.718 110.020 0.698 17927 4989 1 7 . 1 1 6 6 GLY C C 6 173.654 173.654 172.914 0.740 17927 4990 1 7 . 1 1 6 6 GLY CA C 6 45.273 45.273 45.658 -0.385 17927 4991 1 7 . 1 1 6 6 GLY H H 6 8.446 8.446 7.988 0.458 17927 4992 1 7 . 1 1 7 7 ASN N N 7 119.287 119.287 119.464 -0.177 17927 4993 1 7 . 1 1 7 7 ASN HA H 7 5.024 5.024 5.242 -0.218 17927 4994 1 7 . 1 1 7 7 ASN C C 7 173.672 173.672 172.634 1.038 17927 4995 1 7 . 1 1 7 7 ASN CA C 7 51.357 51.357 51.104 0.253 17927 4996 1 7 . 1 1 7 7 ASN CB C 7 38.927 38.927 40.880 -1.953 17927 4997 1 7 . 1 1 7 7 ASN H H 7 8.273 8.273 8.177 0.096 17927 4998 1 7 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.534 -0.087 17927 4999 1 7 . 1 1 8 8 PRO C C 8 176.899 176.899 176.259 0.640 17927 5000 1 7 . 1 1 8 8 PRO CA C 8 63.429 63.429 63.070 0.359 17927 5001 1 7 . 1 1 8 8 PRO CB C 8 32.216 32.216 32.269 -0.053 17927 5002 1 7 . 1 1 9 9 SER N N 9 115.642 115.642 116.348 -0.706 17927 5003 1 7 . 1 1 9 9 SER HA H 9 4.415 4.415 4.647 -0.232 17927 5004 1 7 . 1 1 9 9 SER C C 9 174.714 174.714 174.601 0.113 17927 5005 1 7 . 1 1 9 9 SER CA C 9 58.488 58.488 57.157 1.331 17927 5006 1 7 . 1 1 9 9 SER CB C 9 64.048 64.048 64.620 -0.572 17927 5007 1 7 . 1 1 9 9 SER H H 9 8.336 8.336 8.375 -0.039 17927 5008 1 7 . 1 1 10 10 ALA N N 10 126.808 126.808 125.743 1.065 17927 5009 1 7 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.754 -0.492 17927 5010 1 7 . 1 1 10 10 ALA C C 10 177.233 177.233 176.169 1.064 17927 5011 1 7 . 1 1 10 10 ALA CA C 10 53.230 53.230 52.186 1.044 17927 5012 1 7 . 1 1 10 10 ALA CB C 10 19.187 19.187 17.402 1.784 17927 5013 1 7 . 1 1 10 10 ALA H H 10 8.137 8.137 8.625 -0.488 17927 5014 1 7 . 1 1 11 11 ALA N N 11 120.449 120.449 124.570 -4.121 17927 5015 1 7 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.737 -0.476 17927 5016 1 7 . 1 1 11 11 ALA C C 11 177.469 177.469 176.803 0.666 17927 5017 1 7 . 1 1 11 11 ALA CA C 11 52.475 52.475 51.425 1.050 17927 5018 1 7 . 1 1 11 11 ALA CB C 11 19.485 19.485 20.547 -1.062 17927 5019 1 7 . 1 1 11 11 ALA H H 11 7.851 7.851 7.900 -0.049 17927 5020 1 7 . 1 1 12 12 SER N N 12 114.186 114.186 116.696 -2.510 17927 5021 1 7 . 1 1 12 12 SER HA H 12 4.312 4.312 3.998 0.314 17927 5022 1 7 . 1 1 12 12 SER C C 12 173.593 173.593 174.058 -0.465 17927 5023 1 7 . 1 1 12 12 SER CA C 12 58.099 58.099 59.301 -1.202 17927 5024 1 7 . 1 1 12 12 SER CB C 12 63.320 63.320 62.650 0.670 17927 5025 1 7 . 1 1 12 12 SER H H 12 7.990 7.990 8.804 -0.814 17927 5026 1 7 . 1 1 13 13 PHE N N 13 118.092 118.092 119.658 -1.566 17927 5027 1 7 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.594 0.186 17927 5028 1 7 . 1 1 13 13 PHE C C 13 174.220 174.220 174.611 -0.391 17927 5029 1 7 . 1 1 13 13 PHE CA C 13 56.717 56.717 56.428 0.289 17927 5030 1 7 . 1 1 13 13 PHE CB C 13 41.151 41.151 39.984 1.167 17927 5031 1 7 . 1 1 13 13 PHE H H 13 7.147 7.147 7.466 -0.319 17927 5032 1 7 . 1 1 14 14 SER N N 14 116.456 116.456 113.440 3.016 17927 5033 1 7 . 1 1 14 14 SER HA H 14 5.162 5.162 4.992 0.170 17927 5034 1 7 . 1 1 14 14 SER C C 14 172.626 172.626 172.817 -0.191 17927 5035 1 7 . 1 1 14 14 SER CA C 14 57.390 57.390 57.527 -0.137 17927 5036 1 7 . 1 1 14 14 SER CB C 14 64.518 64.518 64.980 -0.462 17927 5037 1 7 . 1 1 14 14 SER H H 14 7.616 7.616 8.036 -0.420 17927 5038 1 7 . 1 1 15 15 TYR N N 15 122.384 122.384 124.093 -1.709 17927 5039 1 7 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.878 0.328 17927 5040 1 7 . 1 1 15 15 TYR C C 15 172.543 172.543 172.955 -0.412 17927 5041 1 7 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.436 -0.490 17927 5042 1 7 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.065 1.162 17927 5043 1 7 . 1 1 15 15 TYR H H 15 8.558 8.558 9.012 -0.454 17927 5044 1 7 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.826 0.283 17927 5045 1 7 . 1 1 16 16 PRO C C 16 176.475 176.475 176.636 -0.161 17927 5046 1 7 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.424 -0.443 17927 5047 1 7 . 1 1 16 16 PRO CB C 16 32.662 32.662 31.923 0.739 17927 5048 1 7 . 1 1 17 17 ASP N N 17 119.834 119.834 125.404 -5.570 17927 5049 1 7 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.795 0.944 17927 5050 1 7 . 1 1 17 17 ASP C C 17 180.740 180.740 178.007 2.733 17927 5051 1 7 . 1 1 17 17 ASP CA C 17 51.717 51.717 54.285 -2.568 17927 5052 1 7 . 1 1 17 17 ASP CB C 17 42.561 42.561 42.568 -0.007 17927 5053 1 7 . 1 1 17 17 ASP H H 17 8.643 8.643 8.994 -0.351 17927 5054 1 7 . 1 1 18 18 ILE N N 18 118.340 118.340 121.745 -3.405 17927 5055 1 7 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.852 0.599 17927 5056 1 7 . 1 1 18 18 ILE C C 18 175.742 175.742 176.504 -0.762 17927 5057 1 7 . 1 1 18 18 ILE CA C 18 61.894 61.894 62.832 -0.938 17927 5058 1 7 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.322 0.918 17927 5059 1 7 . 1 1 18 18 ILE H H 18 8.450 8.450 8.677 -0.227 17927 5060 1 7 . 1 1 19 19 ASN N N 19 119.377 119.377 117.423 1.954 17927 5061 1 7 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.637 0.378 17927 5062 1 7 . 1 1 19 19 ASN C C 19 175.892 175.892 175.628 0.264 17927 5063 1 7 . 1 1 19 19 ASN CA C 19 53.307 53.307 53.865 -0.558 17927 5064 1 7 . 1 1 19 19 ASN CB C 19 39.825 39.825 39.579 0.246 17927 5065 1 7 . 1 1 19 19 ASN H H 19 8.376 8.376 8.595 -0.219 17927 5066 1 7 . 1 1 20 20 GLY N N 20 109.535 109.535 108.171 1.364 17927 5067 1 7 . 1 1 20 20 GLY C C 20 174.285 174.285 173.197 1.088 17927 5068 1 7 . 1 1 20 20 GLY CA C 20 45.793 45.793 44.944 0.849 17927 5069 1 7 . 1 1 20 20 GLY H H 20 8.539 8.539 8.389 0.150 17927 5070 1 7 . 1 1 21 21 LYS N N 21 124.675 124.675 121.190 3.485 17927 5071 1 7 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.627 -0.184 17927 5072 1 7 . 1 1 21 21 LYS C C 21 176.537 176.537 175.834 0.703 17927 5073 1 7 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.440 1.004 17927 5074 1 7 . 1 1 21 21 LYS CB C 21 32.754 32.754 33.410 -0.656 17927 5075 1 7 . 1 1 21 21 LYS H H 21 8.608 8.608 7.586 1.022 17927 5076 1 7 . 1 1 22 22 THR N N 22 120.666 120.666 123.807 -3.141 17927 5077 1 7 . 1 1 22 22 THR HA H 22 4.087 4.087 4.251 -0.164 17927 5078 1 7 . 1 1 22 22 THR C C 22 174.431 174.431 174.112 0.319 17927 5079 1 7 . 1 1 22 22 THR CA C 22 64.292 64.292 63.789 0.503 17927 5080 1 7 . 1 1 22 22 THR CB C 22 69.069 69.069 68.175 0.894 17927 5081 1 7 . 1 1 22 22 THR H H 22 8.595 8.595 8.680 -0.085 17927 5082 1 7 . 1 1 23 23 VAL N N 23 131.207 131.207 129.005 2.202 17927 5083 1 7 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.413 -0.221 17927 5084 1 7 . 1 1 23 23 VAL C C 23 174.244 174.244 174.264 -0.020 17927 5085 1 7 . 1 1 23 23 VAL CA C 23 62.456 62.456 60.821 1.635 17927 5086 1 7 . 1 1 23 23 VAL CB C 23 33.791 33.791 35.386 -1.595 17927 5087 1 7 . 1 1 23 23 VAL H H 23 8.937 8.937 8.297 0.640 17927 5088 1 7 . 1 1 24 24 SER N N 24 120.787 120.787 118.287 2.500 17927 5089 1 7 . 1 1 24 24 SER HA H 24 5.407 5.407 5.163 0.244 17927 5090 1 7 . 1 1 24 24 SER C C 24 176.169 176.169 173.668 2.501 17927 5091 1 7 . 1 1 24 24 SER CA C 24 55.135 55.135 56.015 -0.880 17927 5092 1 7 . 1 1 24 24 SER CB C 24 65.646 65.646 66.149 -0.503 17927 5093 1 7 . 1 1 24 24 SER H H 24 8.554 8.554 9.316 -0.762 17927 5094 1 7 . 1 1 25 25 LEU N N 25 124.332 124.332 119.712 4.620 17927 5095 1 7 . 1 1 25 25 LEU HA H 25 3.687 3.687 4.400 -0.713 17927 5096 1 7 . 1 1 25 25 LEU C C 25 179.364 179.364 176.413 2.951 17927 5097 1 7 . 1 1 25 25 LEU CA C 25 58.217 58.217 53.505 4.712 17927 5098 1 7 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.196 -0.658 17927 5099 1 7 . 1 1 25 25 LEU H H 25 7.811 7.811 8.549 -0.738 17927 5100 1 7 . 1 1 26 26 ALA N N 26 119.799 119.799 122.593 -2.794 17927 5101 1 7 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.373 -0.380 17927 5102 1 7 . 1 1 26 26 ALA C C 26 179.719 179.719 178.498 1.221 17927 5103 1 7 . 1 1 26 26 ALA CA C 26 54.663 54.663 53.889 0.774 17927 5104 1 7 . 1 1 26 26 ALA CB C 26 18.323 18.323 19.529 -1.206 17927 5105 1 7 . 1 1 26 26 ALA H H 26 8.099 8.099 7.432 0.667 17927 5106 1 7 . 1 1 27 27 ASP N N 27 116.553 116.553 118.219 -1.666 17927 5107 1 7 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.411 0.062 17927 5108 1 7 . 1 1 27 27 ASP C C 27 176.915 176.915 177.364 -0.449 17927 5109 1 7 . 1 1 27 27 ASP CA C 27 56.251 56.251 55.535 0.716 17927 5110 1 7 . 1 1 27 27 ASP CB C 27 40.788 40.788 40.634 0.154 17927 5111 1 7 . 1 1 27 27 ASP H H 27 7.572 7.572 7.791 -0.219 17927 5112 1 7 . 1 1 28 28 LEU N N 28 118.950 118.950 119.921 -0.971 17927 5113 1 7 . 1 1 28 28 LEU HA H 28 4.233 4.233 4.080 0.153 17927 5114 1 7 . 1 1 28 28 LEU C C 28 175.542 175.542 176.557 -1.015 17927 5115 1 7 . 1 1 28 28 LEU CA C 28 53.706 53.706 53.926 -0.220 17927 5116 1 7 . 1 1 28 28 LEU CB C 28 41.049 41.049 40.800 0.249 17927 5117 1 7 . 1 1 28 28 LEU H H 28 7.363 7.363 7.695 -0.332 17927 5118 1 7 . 1 1 29 29 LYS N N 29 118.429 118.429 119.428 -0.999 17927 5119 1 7 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.573 -0.221 17927 5120 1 7 . 1 1 29 29 LYS C C 29 178.063 178.063 178.281 -0.218 17927 5121 1 7 . 1 1 29 29 LYS CA C 29 57.777 57.777 56.397 1.380 17927 5122 1 7 . 1 1 29 29 LYS CB C 29 33.440 33.440 33.076 0.364 17927 5123 1 7 . 1 1 29 29 LYS H H 29 6.780 6.780 7.094 -0.314 17927 5124 1 7 . 1 1 30 30 GLY N N 30 112.426 112.426 106.747 5.679 17927 5125 1 7 . 1 1 30 30 GLY C C 30 173.801 173.801 173.741 0.060 17927 5126 1 7 . 1 1 30 30 GLY CA C 30 44.611 44.611 45.646 -1.035 17927 5127 1 7 . 1 1 30 30 GLY H H 30 9.398 9.398 8.260 1.138 17927 5128 1 7 . 1 1 31 31 LYS N N 31 119.295 119.295 121.692 -2.397 17927 5129 1 7 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.410 -0.258 17927 5130 1 7 . 1 1 31 31 LYS C C 31 173.862 173.862 176.473 -2.611 17927 5131 1 7 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.466 0.722 17927 5132 1 7 . 1 1 31 31 LYS CB C 31 36.968 36.968 34.642 2.326 17927 5133 1 7 . 1 1 31 31 LYS H H 31 7.496 7.496 7.761 -0.265 17927 5134 1 7 . 1 1 32 32 TYR N N 32 116.984 116.984 119.506 -2.522 17927 5135 1 7 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.584 -0.427 17927 5136 1 7 . 1 1 32 32 TYR C C 32 175.226 175.226 175.953 -0.727 17927 5137 1 7 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.249 0.341 17927 5138 1 7 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.212 -0.092 17927 5139 1 7 . 1 1 32 32 TYR H H 32 7.521 7.521 8.660 -1.139 17927 5140 1 7 . 1 1 33 33 ILE N N 33 118.052 118.052 119.844 -1.792 17927 5141 1 7 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.599 0.308 17927 5142 1 7 . 1 1 33 33 ILE C C 33 174.308 174.308 174.427 -0.119 17927 5143 1 7 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.311 0.391 17927 5144 1 7 . 1 1 33 33 ILE CB C 33 41.616 41.616 40.378 1.238 17927 5145 1 7 . 1 1 33 33 ILE H H 33 8.467 8.467 8.845 -0.378 17927 5146 1 7 . 1 1 34 34 TYR N N 34 130.242 130.242 129.441 0.801 17927 5147 1 7 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.269 0.257 17927 5148 1 7 . 1 1 34 34 TYR C C 34 174.245 174.245 173.734 0.511 17927 5149 1 7 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.716 0.442 17927 5150 1 7 . 1 1 34 34 TYR CB C 34 40.133 40.133 40.594 -0.461 17927 5151 1 7 . 1 1 34 34 TYR H H 34 8.905 8.905 9.388 -0.483 17927 5152 1 7 . 1 1 35 35 ILE N N 35 128.697 128.697 130.124 -1.427 17927 5153 1 7 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.173 0.169 17927 5154 1 7 . 1 1 35 35 ILE C C 35 174.520 174.520 174.447 0.073 17927 5155 1 7 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.865 -0.116 17927 5156 1 7 . 1 1 35 35 ILE CB C 35 40.899 40.899 38.985 1.914 17927 5157 1 7 . 1 1 35 35 ILE H H 35 9.445 9.445 8.741 0.704 17927 5158 1 7 . 1 1 36 36 ASP N N 36 123.675 123.675 126.457 -2.782 17927 5159 1 7 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.636 -0.788 17927 5160 1 7 . 1 1 36 36 ASP C C 36 174.385 174.385 175.543 -1.158 17927 5161 1 7 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.478 -0.184 17927 5162 1 7 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.320 -2.542 17927 5163 1 7 . 1 1 36 36 ASP H H 36 8.875 8.875 8.497 0.378 17927 5164 1 7 . 1 1 37 37 VAL N N 37 127.159 127.159 119.492 7.667 17927 5165 1 7 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.932 0.027 17927 5166 1 7 . 1 1 37 37 VAL C C 37 175.046 175.046 175.621 -0.575 17927 5167 1 7 . 1 1 37 37 VAL CA C 37 62.245 62.245 61.635 0.610 17927 5168 1 7 . 1 1 37 37 VAL CB C 37 31.807 31.807 32.816 -1.009 17927 5169 1 7 . 1 1 37 37 VAL H H 37 8.603 8.603 8.051 0.552 17927 5170 1 7 . 1 1 38 38 TRP N N 38 124.161 124.161 127.059 -2.898 17927 5171 1 7 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.598 -0.361 17927 5172 1 7 . 1 1 38 38 TRP C C 38 171.995 171.995 173.920 -1.925 17927 5173 1 7 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.535 1.672 17927 5174 1 7 . 1 1 38 38 TRP CB C 38 33.187 33.187 31.613 1.574 17927 5175 1 7 . 1 1 38 38 TRP H H 38 8.562 8.562 8.699 -0.137 17927 5176 1 7 . 1 1 39 39 ALA N N 39 116.252 116.252 125.431 -9.179 17927 5177 1 7 . 1 1 39 39 ALA HA H 39 3.678 3.678 4.320 -0.642 17927 5178 1 7 . 1 1 39 39 ALA C C 39 178.664 178.664 176.543 2.121 17927 5179 1 7 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.488 0.978 17927 5180 1 7 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.586 0.755 17927 5181 1 7 . 1 1 39 39 ALA H H 39 6.757 6.757 7.964 -1.207 17927 5182 1 7 . 1 1 40 40 THR N N 40 114.321 114.321 115.818 -1.497 17927 5183 1 7 . 1 1 40 40 THR HA H 40 3.907 3.907 4.292 -0.385 17927 5184 1 7 . 1 1 40 40 THR C C 40 175.885 175.885 174.653 1.232 17927 5185 1 7 . 1 1 40 40 THR CA C 40 65.447 65.447 62.294 3.153 17927 5186 1 7 . 1 1 40 40 THR CB C 40 70.106 70.106 69.342 0.764 17927 5187 1 7 . 1 1 40 40 THR H H 40 9.639 9.639 8.772 0.867 17927 5188 1 7 . 1 1 41 41 TRP N N 41 114.483 114.483 120.770 -6.287 17927 5189 1 7 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.672 -0.109 17927 5190 1 7 . 1 1 41 41 TRP C C 41 176.189 176.189 175.545 0.644 17927 5191 1 7 . 1 1 41 41 TRP CA C 41 54.698 54.698 55.237 -0.539 17927 5192 1 7 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.287 1.690 17927 5193 1 7 . 1 1 41 41 TRP H H 41 6.401 6.401 7.451 -1.050 17927 5194 1 7 . 1 1 42 42 CYS N N 42 123.536 123.536 116.449 7.087 17927 5195 1 7 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.555 0.013 17927 5196 1 7 . 1 1 42 42 CYS C C 42 175.726 175.726 173.963 1.763 17927 5197 1 7 . 1 1 42 42 CYS CA C 42 58.700 58.700 55.609 3.091 17927 5198 1 7 . 1 1 42 42 CYS CB C 42 27.121 27.121 31.127 -4.006 17927 5199 1 7 . 1 1 42 42 CYS H H 42 6.883 6.883 6.891 -0.008 17927 5200 1 7 . 1 1 43 43 GLY N N 43 120.977 120.977 106.823 14.154 17927 5201 1 7 . 1 1 43 43 GLY CA C 43 49.204 49.204 46.129 3.075 17927 5202 1 7 . 1 1 43 43 GLY H H 43 9.653 9.653 8.753 0.900 17927 5203 1 7 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.334 0.153 17927 5204 1 7 . 1 1 44 44 PRO C C 44 179.956 179.956 178.508 1.448 17927 5205 1 7 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.017 0.625 17927 5206 1 7 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.512 1.065 17927 5207 1 7 . 1 1 45 45 CYS N N 45 113.925 113.925 115.869 -1.944 17927 5208 1 7 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.172 0.141 17927 5209 1 7 . 1 1 45 45 CYS C C 45 178.325 178.325 176.437 1.888 17927 5210 1 7 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.589 1.803 17927 5211 1 7 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.549 0.956 17927 5212 1 7 . 1 1 45 45 CYS H H 45 7.676 7.676 8.484 -0.808 17927 5213 1 7 . 1 1 46 46 ARG N N 46 120.336 120.336 119.633 0.703 17927 5214 1 7 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.265 -0.196 17927 5215 1 7 . 1 1 46 46 ARG C C 46 180.446 180.446 177.517 2.929 17927 5216 1 7 . 1 1 46 46 ARG CA C 46 59.785 59.785 57.590 2.195 17927 5217 1 7 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.785 0.083 17927 5218 1 7 . 1 1 46 46 ARG H H 46 8.109 8.109 7.791 0.318 17927 5219 1 7 . 1 1 47 47 GLY N N 47 105.408 105.408 107.584 -2.176 17927 5220 1 7 . 1 1 47 47 GLY C C 47 175.258 175.258 175.383 -0.125 17927 5221 1 7 . 1 1 47 47 GLY CA C 47 46.594 46.594 45.782 0.812 17927 5222 1 7 . 1 1 47 47 GLY H H 47 8.466 8.466 7.982 0.484 17927 5223 1 7 . 1 1 48 48 GLU N N 48 116.343 116.343 120.838 -4.495 17927 5224 1 7 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.541 -0.016 17927 5225 1 7 . 1 1 48 48 GLU C C 48 176.535 176.535 178.325 -1.790 17927 5226 1 7 . 1 1 48 48 GLU CA C 48 55.792 55.792 56.172 -0.380 17927 5227 1 7 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.202 1.780 17927 5228 1 7 . 1 1 48 48 GLU H H 48 7.050 7.050 7.781 -0.731 17927 5229 1 7 . 1 1 49 49 LEU N N 49 118.652 118.652 121.385 -2.733 17927 5230 1 7 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.104 0.048 17927 5231 1 7 . 1 1 49 49 LEU C C 49 176.832 176.832 176.391 0.441 17927 5232 1 7 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.289 -0.944 17927 5233 1 7 . 1 1 49 49 LEU CB C 49 38.496 38.496 38.909 -0.413 17927 5234 1 7 . 1 1 49 49 LEU H H 49 7.385 7.385 7.938 -0.553 17927 5235 1 7 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.244 0.009 17927 5236 1 7 . 1 1 50 50 PRO C C 50 179.744 179.744 178.158 1.586 17927 5237 1 7 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.015 0.544 17927 5238 1 7 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.738 0.023 17927 5239 1 7 . 1 1 51 51 ALA N N 51 120.418 120.418 120.039 0.379 17927 5240 1 7 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.251 -0.106 17927 5241 1 7 . 1 1 51 51 ALA C C 51 180.329 180.329 179.621 0.708 17927 5242 1 7 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.432 0.002 17927 5243 1 7 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.229 0.141 17927 5244 1 7 . 1 1 51 51 ALA H H 51 7.731 7.731 7.954 -0.223 17927 5245 1 7 . 1 1 52 52 LEU N N 52 121.506 121.506 119.975 1.531 17927 5246 1 7 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.926 0.062 17927 5247 1 7 . 1 1 52 52 LEU C C 52 177.944 177.944 178.474 -0.530 17927 5248 1 7 . 1 1 52 52 LEU CA C 52 58.327 58.327 58.191 0.136 17927 5249 1 7 . 1 1 52 52 LEU CB C 52 42.382 42.382 42.032 0.350 17927 5250 1 7 . 1 1 52 52 LEU H H 52 8.355 8.355 8.914 -0.559 17927 5251 1 7 . 1 1 53 53 LYS N N 53 119.732 119.732 118.702 1.030 17927 5252 1 7 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.879 0.024 17927 5253 1 7 . 1 1 53 53 LYS C C 53 179.030 179.030 179.006 0.024 17927 5254 1 7 . 1 1 53 53 LYS CA C 53 59.846 59.846 58.963 0.883 17927 5255 1 7 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.588 0.623 17927 5256 1 7 . 1 1 53 53 LYS H H 53 8.148 8.148 7.455 0.693 17927 5257 1 7 . 1 1 54 54 GLU N N 54 117.779 117.779 120.246 -2.467 17927 5258 1 7 . 1 1 54 54 GLU HA H 54 4.059 4.059 4.041 0.018 17927 5259 1 7 . 1 1 54 54 GLU C C 54 179.646 179.646 179.551 0.095 17927 5260 1 7 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.440 0.185 17927 5261 1 7 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.467 0.100 17927 5262 1 7 . 1 1 54 54 GLU H H 54 7.585 7.585 7.775 -0.190 17927 5263 1 7 . 1 1 55 55 LEU N N 55 120.581 120.581 120.103 0.478 17927 5264 1 7 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.161 0.032 17927 5265 1 7 . 1 1 55 55 LEU C C 55 178.557 178.557 178.672 -0.115 17927 5266 1 7 . 1 1 55 55 LEU CA C 55 58.235 58.235 58.172 0.063 17927 5267 1 7 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.797 1.214 17927 5268 1 7 . 1 1 55 55 LEU H H 55 8.096 8.096 8.147 -0.051 17927 5269 1 7 . 1 1 56 56 GLU N N 56 118.023 118.023 119.553 -1.530 17927 5270 1 7 . 1 1 56 56 GLU HA H 56 3.177 3.177 3.122 0.055 17927 5271 1 7 . 1 1 56 56 GLU C C 56 179.650 179.650 178.867 0.783 17927 5272 1 7 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.656 -0.785 17927 5273 1 7 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.405 -2.421 17927 5274 1 7 . 1 1 56 56 GLU H H 56 8.181 8.181 8.131 0.050 17927 5275 1 7 . 1 1 57 57 GLU N N 57 117.828 117.828 117.110 0.718 17927 5276 1 7 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.055 0.049 17927 5277 1 7 . 1 1 57 57 GLU C C 57 179.700 179.700 178.655 1.045 17927 5278 1 7 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.592 0.435 17927 5279 1 7 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.121 0.544 17927 5280 1 7 . 1 1 57 57 GLU H H 57 7.762 7.762 8.211 -0.449 17927 5281 1 7 . 1 1 58 58 LYS N N 58 120.896 120.896 118.546 2.350 17927 5282 1 7 . 1 1 58 58 LYS HA H 58 3.979 3.979 4.018 -0.039 17927 5283 1 7 . 1 1 58 58 LYS C C 58 178.715 178.715 179.019 -0.304 17927 5284 1 7 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.819 0.259 17927 5285 1 7 . 1 1 58 58 LYS CB C 58 32.980 32.980 33.030 -0.050 17927 5286 1 7 . 1 1 58 58 LYS H H 58 8.410 8.410 7.620 0.790 17927 5287 1 7 . 1 1 59 59 TYR N N 59 113.713 113.713 116.449 -2.736 17927 5288 1 7 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.572 -0.260 17927 5289 1 7 . 1 1 59 59 TYR C C 59 175.025 175.025 174.686 0.339 17927 5290 1 7 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.540 2.433 17927 5291 1 7 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.540 -1.106 17927 5292 1 7 . 1 1 59 59 TYR H H 59 8.102 8.102 8.478 -0.376 17927 5293 1 7 . 1 1 60 60 ALA N N 60 126.637 126.637 122.868 3.769 17927 5294 1 7 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.322 0.096 17927 5295 1 7 . 1 1 60 60 ALA C C 60 179.208 179.208 178.097 1.111 17927 5296 1 7 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.645 0.888 17927 5297 1 7 . 1 1 60 60 ALA CB C 60 18.589 18.589 18.730 -0.141 17927 5298 1 7 . 1 1 60 60 ALA H H 60 7.201 7.201 7.567 -0.366 17927 5299 1 7 . 1 1 61 61 GLY N N 61 111.816 111.816 111.160 0.656 17927 5300 1 7 . 1 1 61 61 GLY C C 61 174.698 174.698 175.064 -0.366 17927 5301 1 7 . 1 1 61 61 GLY CA C 61 45.904 45.904 46.340 -0.436 17927 5302 1 7 . 1 1 61 61 GLY H H 61 9.184 9.184 9.160 0.024 17927 5303 1 7 . 1 1 62 62 LYS N N 62 118.497 118.497 121.691 -3.194 17927 5304 1 7 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.301 0.578 17927 5305 1 7 . 1 1 62 62 LYS C C 62 179.019 179.019 177.252 1.767 17927 5306 1 7 . 1 1 62 62 LYS CA C 62 53.988 53.988 57.734 -3.746 17927 5307 1 7 . 1 1 62 62 LYS CB C 62 33.840 33.840 32.772 1.068 17927 5308 1 7 . 1 1 62 62 LYS H H 62 8.019 8.019 7.801 0.218 17927 5309 1 7 . 1 1 63 63 ASP N N 63 122.982 122.982 113.780 9.202 17927 5310 1 7 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.716 -0.189 17927 5311 1 7 . 1 1 63 63 ASP C C 63 174.065 174.065 174.431 -0.366 17927 5312 1 7 . 1 1 63 63 ASP CA C 63 55.055 55.055 53.680 1.375 17927 5313 1 7 . 1 1 63 63 ASP CB C 63 38.582 38.582 42.624 -4.042 17927 5314 1 7 . 1 1 63 63 ASP H H 63 8.709 8.709 8.363 0.346 17927 5315 1 7 . 1 1 64 64 ILE N N 64 122.219 122.219 119.442 2.777 17927 5316 1 7 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.560 0.047 17927 5317 1 7 . 1 1 64 64 ILE C C 64 174.627 174.627 173.429 1.198 17927 5318 1 7 . 1 1 64 64 ILE CA C 64 59.712 59.712 58.955 0.757 17927 5319 1 7 . 1 1 64 64 ILE CB C 64 42.133 42.133 40.746 1.387 17927 5320 1 7 . 1 1 64 64 ILE H H 64 8.678 8.678 7.596 1.082 17927 5321 1 7 . 1 1 65 65 HIS N N 65 125.584 125.584 125.227 0.357 17927 5322 1 7 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.914 0.129 17927 5323 1 7 . 1 1 65 65 HIS C C 65 174.153 174.153 173.757 0.396 17927 5324 1 7 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.188 0.771 17927 5325 1 7 . 1 1 65 65 HIS CB C 65 34.156 34.156 31.542 2.614 17927 5326 1 7 . 1 1 65 65 HIS H H 65 9.204 9.204 8.878 0.326 17927 5327 1 7 . 1 1 66 66 PHE N N 66 123.244 123.244 124.384 -1.140 17927 5328 1 7 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.913 0.297 17927 5329 1 7 . 1 1 66 66 PHE C C 66 175.463 175.463 174.778 0.685 17927 5330 1 7 . 1 1 66 66 PHE CA C 66 58.088 58.088 58.245 -0.157 17927 5331 1 7 . 1 1 66 66 PHE CB C 66 39.637 39.637 39.335 0.302 17927 5332 1 7 . 1 1 66 66 PHE H H 66 9.262 9.262 9.188 0.074 17927 5333 1 7 . 1 1 67 67 VAL N N 67 126.201 126.201 125.327 0.874 17927 5334 1 7 . 1 1 67 67 VAL HA H 67 4.834 4.834 4.894 -0.060 17927 5335 1 7 . 1 1 67 67 VAL C C 67 174.364 174.364 175.446 -1.082 17927 5336 1 7 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.540 0.184 17927 5337 1 7 . 1 1 67 67 VAL CB C 67 34.893 34.893 32.849 2.043 17927 5338 1 7 . 1 1 67 67 VAL H H 67 8.843 8.843 9.327 -0.484 17927 5339 1 7 . 1 1 68 68 SER N N 68 124.528 124.528 123.819 0.709 17927 5340 1 7 . 1 1 68 68 SER HA H 68 5.585 5.585 5.394 0.191 17927 5341 1 7 . 1 1 68 68 SER C C 68 172.858 172.858 172.958 -0.100 17927 5342 1 7 . 1 1 68 68 SER CA C 68 57.282 57.282 57.872 -0.590 17927 5343 1 7 . 1 1 68 68 SER CB C 68 65.032 65.032 63.838 1.194 17927 5344 1 7 . 1 1 68 68 SER H H 68 9.243 9.243 8.726 0.517 17927 5345 1 7 . 1 1 69 69 LEU N N 69 126.695 126.695 126.973 -0.278 17927 5346 1 7 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.642 -1.125 17927 5347 1 7 . 1 1 69 69 LEU C C 69 174.652 174.652 175.547 -0.895 17927 5348 1 7 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.862 -1.035 17927 5349 1 7 . 1 1 69 69 LEU CB C 69 43.895 43.895 46.236 -2.341 17927 5350 1 7 . 1 1 69 69 LEU H H 69 9.360 9.360 9.280 0.080 17927 5351 1 7 . 1 1 70 70 SER N N 70 116.379 116.379 121.214 -4.835 17927 5352 1 7 . 1 1 70 70 SER HA H 70 4.905 4.905 5.192 -0.287 17927 5353 1 7 . 1 1 70 70 SER C C 70 176.307 176.307 175.094 1.213 17927 5354 1 7 . 1 1 70 70 SER CA C 70 55.213 55.213 55.836 -0.623 17927 5355 1 7 . 1 1 70 70 SER CB C 70 63.519 63.519 64.077 -0.558 17927 5356 1 7 . 1 1 70 70 SER H H 70 7.981 7.981 8.897 -0.916 17927 5357 1 7 . 1 1 71 71 CYS N N 71 124.670 124.670 127.407 -2.737 17927 5358 1 7 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.381 0.577 17927 5359 1 7 . 1 1 71 71 CYS C C 71 173.996 173.996 174.228 -0.232 17927 5360 1 7 . 1 1 71 71 CYS CA C 71 55.483 55.483 58.407 -2.924 17927 5361 1 7 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.404 0.708 17927 5362 1 7 . 1 1 71 71 CYS H H 71 8.609 8.609 9.109 -0.500 17927 5363 1 7 . 1 1 72 72 ASP N N 72 122.398 122.398 122.647 -0.249 17927 5364 1 7 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.556 -0.265 17927 5365 1 7 . 1 1 72 72 ASP C C 72 176.653 176.653 176.022 0.631 17927 5366 1 7 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.838 0.944 17927 5367 1 7 . 1 1 72 72 ASP CB C 72 41.526 41.526 40.788 0.738 17927 5368 1 7 . 1 1 72 72 ASP H H 72 8.557 8.557 7.651 0.906 17927 5369 1 7 . 1 1 73 73 LYS HA H 73 4.065 4.065 3.982 0.083 17927 5370 1 7 . 1 1 73 73 LYS C C 73 176.545 176.545 176.183 0.362 17927 5371 1 7 . 1 1 73 73 LYS CA C 73 58.458 58.458 58.876 -0.418 17927 5372 1 7 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.768 -0.127 17927 5373 1 7 . 1 1 74 74 ASN N N 74 117.616 117.616 117.235 0.381 17927 5374 1 7 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.685 0.220 17927 5375 1 7 . 1 1 74 74 ASN C C 74 174.894 174.894 175.737 -0.843 17927 5376 1 7 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.437 -0.916 17927 5377 1 7 . 1 1 74 74 ASN CB C 74 38.109 38.109 37.122 0.987 17927 5378 1 7 . 1 1 74 74 ASN H H 74 8.625 8.625 8.014 0.611 17927 5379 1 7 . 1 1 75 75 LYS N N 75 126.797 126.797 123.404 3.393 17927 5380 1 7 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.737 -0.314 17927 5381 1 7 . 1 1 75 75 LYS C C 75 178.058 178.058 178.024 0.034 17927 5382 1 7 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.204 -0.031 17927 5383 1 7 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.314 0.977 17927 5384 1 7 . 1 1 75 75 LYS H H 75 8.588 8.588 8.185 0.403 17927 5385 1 7 . 1 1 76 76 LYS N N 76 117.875 117.875 119.238 -1.363 17927 5386 1 7 . 1 1 76 76 LYS HA H 76 4.200 4.200 4.275 -0.075 17927 5387 1 7 . 1 1 76 76 LYS C C 76 178.791 178.791 178.607 0.184 17927 5388 1 7 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.820 -1.212 17927 5389 1 7 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.822 -0.332 17927 5390 1 7 . 1 1 76 76 LYS H H 76 8.041 8.041 8.437 -0.396 17927 5391 1 7 . 1 1 77 77 ALA N N 77 121.567 121.567 120.906 0.661 17927 5392 1 7 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.131 -0.008 17927 5393 1 7 . 1 1 77 77 ALA C C 77 181.191 181.191 179.307 1.884 17927 5394 1 7 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.837 0.120 17927 5395 1 7 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.050 -0.291 17927 5396 1 7 . 1 1 77 77 ALA H H 77 7.366 7.366 8.300 -0.934 17927 5397 1 7 . 1 1 78 78 TRP N N 78 119.497 119.497 120.141 -0.644 17927 5398 1 7 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.235 -0.158 17927 5399 1 7 . 1 1 78 78 TRP C C 78 175.942 175.942 177.418 -1.476 17927 5400 1 7 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.168 2.593 17927 5401 1 7 . 1 1 78 78 TRP CB C 78 27.272 27.272 29.936 -2.664 17927 5402 1 7 . 1 1 78 78 TRP H H 78 7.187 7.187 7.988 -0.801 17927 5403 1 7 . 1 1 79 79 GLU N N 79 118.771 118.771 119.499 -0.728 17927 5404 1 7 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.570 -0.556 17927 5405 1 7 . 1 1 79 79 GLU C C 79 179.863 179.863 179.066 0.797 17927 5406 1 7 . 1 1 79 79 GLU CA C 79 59.110 59.110 60.313 -1.203 17927 5407 1 7 . 1 1 79 79 GLU CB C 79 30.220 30.220 29.195 1.025 17927 5408 1 7 . 1 1 79 79 GLU H H 79 8.813 8.813 8.425 0.388 17927 5409 1 7 . 1 1 80 80 ASN N N 80 115.964 115.964 117.663 -1.699 17927 5410 1 7 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.421 -0.082 17927 5411 1 7 . 1 1 80 80 ASN C C 80 176.749 176.749 177.668 -0.919 17927 5412 1 7 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.844 0.191 17927 5413 1 7 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.355 0.134 17927 5414 1 7 . 1 1 80 80 ASN H H 80 8.491 8.491 7.826 0.665 17927 5415 1 7 . 1 1 81 81 MET N N 81 119.670 119.670 121.536 -1.866 17927 5416 1 7 . 1 1 81 81 MET HA H 81 4.149 4.149 4.306 -0.157 17927 5417 1 7 . 1 1 81 81 MET C C 81 177.933 177.933 177.641 0.292 17927 5418 1 7 . 1 1 81 81 MET CA C 81 60.276 60.276 57.792 2.484 17927 5419 1 7 . 1 1 81 81 MET CB C 81 32.518 32.518 32.480 0.038 17927 5420 1 7 . 1 1 81 81 MET H H 81 7.667 7.667 7.782 -0.116 17927 5421 1 7 . 1 1 82 82 VAL N N 82 117.634 117.634 118.655 -1.021 17927 5422 1 7 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.414 -0.111 17927 5423 1 7 . 1 1 82 82 VAL C C 82 179.005 179.005 176.943 2.062 17927 5424 1 7 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.267 0.770 17927 5425 1 7 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.186 0.578 17927 5426 1 7 . 1 1 82 82 VAL H H 82 8.338 8.338 8.350 -0.012 17927 5427 1 7 . 1 1 83 83 THR N N 83 110.519 110.519 115.439 -4.920 17927 5428 1 7 . 1 1 83 83 THR HA H 83 3.983 3.983 3.969 0.014 17927 5429 1 7 . 1 1 83 83 THR C C 83 177.591 177.591 176.230 1.361 17927 5430 1 7 . 1 1 83 83 THR CA C 83 65.431 65.431 66.609 -1.178 17927 5431 1 7 . 1 1 83 83 THR CB C 83 69.156 69.156 68.676 0.480 17927 5432 1 7 . 1 1 83 83 THR H H 83 7.659 7.659 7.706 -0.047 17927 5433 1 7 . 1 1 84 84 LYS N N 84 123.927 123.927 121.156 2.771 17927 5434 1 7 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.172 -0.103 17927 5435 1 7 . 1 1 84 84 LYS C C 84 178.582 178.582 177.723 0.859 17927 5436 1 7 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.282 1.595 17927 5437 1 7 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.519 -0.196 17927 5438 1 7 . 1 1 84 84 LYS H H 84 8.665 8.665 7.729 0.936 17927 5439 1 7 . 1 1 85 85 ASP N N 85 116.280 116.280 117.128 -0.848 17927 5440 1 7 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.720 0.030 17927 5441 1 7 . 1 1 85 85 ASP C C 85 175.086 175.086 175.037 0.049 17927 5442 1 7 . 1 1 85 85 ASP CA C 85 54.693 54.693 54.333 0.360 17927 5443 1 7 . 1 1 85 85 ASP CB C 85 39.685 39.685 40.926 -1.241 17927 5444 1 7 . 1 1 85 85 ASP H H 85 8.179 8.179 8.230 -0.051 17927 5445 1 7 . 1 1 86 86 GLN N N 86 116.258 116.258 113.646 2.612 17927 5446 1 7 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.855 0.053 17927 5447 1 7 . 1 1 86 86 GLN C C 86 175.659 175.659 175.077 0.582 17927 5448 1 7 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.584 -0.413 17927 5449 1 7 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.217 0.073 17927 5450 1 7 . 1 1 86 86 GLN H H 86 7.431 7.431 7.391 0.040 17927 5451 1 7 . 1 1 87 87 LEU N N 87 117.031 117.031 119.805 -2.774 17927 5452 1 7 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.308 -0.218 17927 5453 1 7 . 1 1 87 87 LEU C C 87 178.225 178.225 176.105 2.120 17927 5454 1 7 . 1 1 87 87 LEU CA C 87 55.932 55.932 55.024 0.908 17927 5455 1 7 . 1 1 87 87 LEU CB C 87 41.202 41.202 41.089 0.113 17927 5456 1 7 . 1 1 87 87 LEU H H 87 7.736 7.736 7.897 -0.161 17927 5457 1 7 . 1 1 88 88 LYS N N 88 122.367 122.367 122.413 -0.046 17927 5458 1 7 . 1 1 88 88 LYS HA H 88 4.636 4.636 5.031 -0.395 17927 5459 1 7 . 1 1 88 88 LYS C C 88 177.538 177.538 176.922 0.616 17927 5460 1 7 . 1 1 88 88 LYS CA C 88 54.930 54.930 53.755 1.175 17927 5461 1 7 . 1 1 88 88 LYS CB C 88 33.316 33.316 35.128 -1.812 17927 5462 1 7 . 1 1 88 88 LYS H H 88 8.496 8.496 7.807 0.689 17927 5463 1 7 . 1 1 89 89 GLY N N 89 108.452 108.452 105.972 2.480 17927 5464 1 7 . 1 1 89 89 GLY C C 89 173.781 173.781 173.321 0.460 17927 5465 1 7 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.430 0.928 17927 5466 1 7 . 1 1 89 89 GLY H H 89 8.497 8.497 8.260 0.237 17927 5467 1 7 . 1 1 90 90 ILE N N 90 123.295 123.295 124.844 -1.549 17927 5468 1 7 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.226 0.145 17927 5469 1 7 . 1 1 90 90 ILE C C 90 175.606 175.606 174.545 1.061 17927 5470 1 7 . 1 1 90 90 ILE CA C 90 62.001 62.001 61.077 0.924 17927 5471 1 7 . 1 1 90 90 ILE CB C 90 38.036 38.036 37.751 0.285 17927 5472 1 7 . 1 1 90 90 ILE H H 90 8.728 8.728 8.128 0.600 17927 5473 1 7 . 1 1 91 91 GLN N N 91 128.632 128.632 125.576 3.056 17927 5474 1 7 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.812 -0.046 17927 5475 1 7 . 1 1 91 91 GLN C C 91 174.618 174.618 174.282 0.336 17927 5476 1 7 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.938 0.912 17927 5477 1 7 . 1 1 91 91 GLN CB C 91 28.341 28.341 30.897 -2.556 17927 5478 1 7 . 1 1 91 91 GLN H H 91 8.762 8.762 8.444 0.318 17927 5479 1 7 . 1 1 92 92 LEU N N 92 120.830 120.830 123.800 -2.970 17927 5480 1 7 . 1 1 92 92 LEU HA H 92 5.580 5.580 4.967 0.613 17927 5481 1 7 . 1 1 92 92 LEU C C 92 176.828 176.828 175.220 1.608 17927 5482 1 7 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.818 -1.017 17927 5483 1 7 . 1 1 92 92 LEU CB C 92 44.210 44.210 46.263 -2.053 17927 5484 1 7 . 1 1 92 92 LEU H H 92 9.011 9.011 9.279 -0.268 17927 5485 1 7 . 1 1 93 93 HIS N N 93 121.481 121.481 121.980 -0.499 17927 5486 1 7 . 1 1 93 93 HIS HA H 93 3.931 3.931 4.922 -0.991 17927 5487 1 7 . 1 1 93 93 HIS C C 93 173.590 173.590 173.129 0.461 17927 5488 1 7 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.575 1.008 17927 5489 1 7 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.302 -1.052 17927 5490 1 7 . 1 1 93 93 HIS H H 93 8.038 8.038 8.711 -0.673 17927 5491 1 7 . 1 1 94 94 MET N N 94 121.881 121.881 124.485 -2.604 17927 5492 1 7 . 1 1 94 94 MET HA H 94 3.866 3.866 3.602 0.264 17927 5493 1 7 . 1 1 94 94 MET C C 94 177.035 177.035 175.898 1.137 17927 5494 1 7 . 1 1 94 94 MET CA C 94 55.189 55.189 57.302 -2.113 17927 5495 1 7 . 1 1 94 94 MET CB C 94 33.993 33.993 33.749 0.244 17927 5496 1 7 . 1 1 94 94 MET H H 94 8.039 8.039 8.420 -0.381 17927 5497 1 7 . 1 1 95 95 GLY N N 95 104.041 104.041 105.100 -1.059 17927 5498 1 7 . 1 1 95 95 GLY C C 95 174.251 174.251 173.255 0.996 17927 5499 1 7 . 1 1 95 95 GLY CA C 95 46.580 46.580 45.298 1.282 17927 5500 1 7 . 1 1 95 95 GLY H H 95 5.666 5.666 7.425 -1.759 17927 5501 1 7 . 1 1 96 96 THR N N 96 114.114 114.114 119.021 -4.907 17927 5502 1 7 . 1 1 96 96 THR HA H 96 4.211 4.211 4.453 -0.242 17927 5503 1 7 . 1 1 96 96 THR C C 96 175.122 175.122 174.308 0.814 17927 5504 1 7 . 1 1 96 96 THR CA C 96 61.339 61.339 60.829 0.510 17927 5505 1 7 . 1 1 96 96 THR CB C 96 68.615 68.615 68.681 -0.066 17927 5506 1 7 . 1 1 96 96 THR H H 96 8.517 8.517 8.325 0.192 17927 5507 1 7 . 1 1 97 97 ASP N N 97 121.892 121.892 123.418 -1.526 17927 5508 1 7 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.817 -0.232 17927 5509 1 7 . 1 1 97 97 ASP C C 97 178.241 178.241 175.712 2.529 17927 5510 1 7 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.377 1.423 17927 5511 1 7 . 1 1 97 97 ASP CB C 97 43.129 43.129 39.306 3.823 17927 5512 1 7 . 1 1 97 97 ASP H H 97 7.563 7.563 8.362 -0.799 17927 5513 1 7 . 1 1 98 98 ARG N N 98 127.508 127.508 119.584 7.924 17927 5514 1 7 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.425 -0.033 17927 5515 1 7 . 1 1 98 98 ARG C C 98 176.724 176.724 177.337 -0.613 17927 5516 1 7 . 1 1 98 98 ARG CA C 98 55.939 55.939 56.547 -0.608 17927 5517 1 7 . 1 1 98 98 ARG CB C 98 30.291 30.291 29.209 1.081 17927 5518 1 7 . 1 1 98 98 ARG H H 98 9.225 9.225 7.407 1.818 17927 5519 1 7 . 1 1 99 99 THR N N 99 116.384 116.384 117.544 -1.160 17927 5520 1 7 . 1 1 99 99 THR HA H 99 3.987 3.987 4.042 -0.055 17927 5521 1 7 . 1 1 99 99 THR C C 99 176.969 176.969 175.633 1.336 17927 5522 1 7 . 1 1 99 99 THR CA C 99 67.714 67.714 66.044 1.670 17927 5523 1 7 . 1 1 99 99 THR CB C 99 68.777 68.777 68.557 0.220 17927 5524 1 7 . 1 1 99 99 THR H H 99 8.382 8.382 8.035 0.347 17927 5525 1 7 . 1 1 100 100 PHE N N 100 123.232 123.232 121.753 1.479 17927 5526 1 7 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.321 -0.148 17927 5527 1 7 . 1 1 100 100 PHE C C 100 177.010 177.010 176.685 0.325 17927 5528 1 7 . 1 1 100 100 PHE CA C 100 61.923 61.923 61.333 0.590 17927 5529 1 7 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.221 1.540 17927 5530 1 7 . 1 1 100 100 PHE H H 100 7.998 7.998 7.780 0.218 17927 5531 1 7 . 1 1 101 101 MET N N 101 115.968 115.968 118.901 -2.933 17927 5532 1 7 . 1 1 101 101 MET HA H 101 3.975 3.975 3.963 0.012 17927 5533 1 7 . 1 1 101 101 MET C C 101 178.763 178.763 178.152 0.611 17927 5534 1 7 . 1 1 101 101 MET CA C 101 58.552 58.552 59.794 -1.242 17927 5535 1 7 . 1 1 101 101 MET CB C 101 32.593 32.593 32.244 0.349 17927 5536 1 7 . 1 1 101 101 MET H H 101 7.828 7.828 7.862 -0.034 17927 5537 1 7 . 1 1 102 102 ASP N N 102 117.553 117.553 119.216 -1.663 17927 5538 1 7 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.358 0.164 17927 5539 1 7 . 1 1 102 102 ASP C C 102 179.503 179.503 179.051 0.452 17927 5540 1 7 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.744 -0.854 17927 5541 1 7 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.563 -0.637 17927 5542 1 7 . 1 1 102 102 ASP H H 102 8.828 8.828 8.172 0.656 17927 5543 1 7 . 1 1 103 103 ALA N N 103 122.984 122.984 123.094 -0.110 17927 5544 1 7 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.017 -0.031 17927 5545 1 7 . 1 1 103 103 ALA C C 103 178.782 178.782 178.500 0.282 17927 5546 1 7 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.568 0.527 17927 5547 1 7 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.216 0.347 17927 5548 1 7 . 1 1 103 103 ALA H H 103 7.567 7.567 7.789 -0.222 17927 5549 1 7 . 1 1 104 104 TYR N N 104 112.159 112.159 114.825 -2.666 17927 5550 1 7 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.591 -0.367 17927 5551 1 7 . 1 1 104 104 TYR C C 104 173.821 173.821 174.747 -0.926 17927 5552 1 7 . 1 1 104 104 TYR CA C 104 58.498 58.498 57.842 0.656 17927 5553 1 7 . 1 1 104 104 TYR CB C 104 38.393 38.393 38.505 -0.112 17927 5554 1 7 . 1 1 104 104 TYR H H 104 7.203 7.203 7.370 -0.167 17927 5555 1 7 . 1 1 105 105 LEU N N 105 119.433 119.433 116.426 3.007 17927 5556 1 7 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.880 0.105 17927 5557 1 7 . 1 1 105 105 LEU C C 105 176.721 176.721 175.891 0.830 17927 5558 1 7 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.413 0.372 17927 5559 1 7 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.456 -1.013 17927 5560 1 7 . 1 1 105 105 LEU H H 105 7.582 7.582 7.489 0.093 17927 5561 1 7 . 1 1 106 106 ILE N N 106 119.575 119.575 119.553 0.022 17927 5562 1 7 . 1 1 106 106 ILE HA H 106 4.002 4.002 3.880 0.122 17927 5563 1 7 . 1 1 106 106 ILE C C 106 175.459 175.459 174.944 0.515 17927 5564 1 7 . 1 1 106 106 ILE CA C 106 62.043 62.043 62.896 -0.853 17927 5565 1 7 . 1 1 106 106 ILE CB C 106 36.335 36.335 36.777 -0.442 17927 5566 1 7 . 1 1 106 106 ILE H H 106 8.774 8.774 8.127 0.647 17927 5567 1 7 . 1 1 107 107 ASN N N 107 126.514 126.514 125.934 0.580 17927 5568 1 7 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.765 0.098 17927 5569 1 7 . 1 1 107 107 ASN C C 107 174.584 174.584 175.583 -0.999 17927 5570 1 7 . 1 1 107 107 ASN CA C 107 53.112 53.112 53.530 -0.418 17927 5571 1 7 . 1 1 107 107 ASN CB C 107 38.977 38.977 40.289 -1.312 17927 5572 1 7 . 1 1 107 107 ASN H H 107 8.364 8.364 8.252 0.112 17927 5573 1 7 . 1 1 108 108 GLY N N 108 108.469 108.469 110.065 -1.596 17927 5574 1 7 . 1 1 108 108 GLY C C 108 171.245 171.245 174.163 -2.918 17927 5575 1 7 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.580 0.689 17927 5576 1 7 . 1 1 108 108 GLY H H 108 7.678 7.678 8.138 -0.460 17927 5577 1 7 . 1 1 109 109 ILE N N 109 112.817 112.817 121.051 -8.234 17927 5578 1 7 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.445 -0.039 17927 5579 1 7 . 1 1 109 109 ILE C C 109 173.498 173.498 174.523 -1.025 17927 5580 1 7 . 1 1 109 109 ILE CA C 109 58.384 58.384 57.796 0.588 17927 5581 1 7 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.166 2.156 17927 5582 1 7 . 1 1 109 109 ILE H H 109 7.868 7.868 7.696 0.172 17927 5583 1 7 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.457 0.285 17927 5584 1 7 . 1 1 110 110 PRO C C 110 175.715 175.715 175.534 0.181 17927 5585 1 7 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.063 0.214 17927 5586 1 7 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.984 3.384 17927 5587 1 7 . 1 1 111 111 ARG N N 111 122.358 122.358 119.621 2.737 17927 5588 1 7 . 1 1 111 111 ARG HA H 111 4.469 4.469 3.822 0.647 17927 5589 1 7 . 1 1 111 111 ARG C C 111 171.541 171.541 174.485 -2.944 17927 5590 1 7 . 1 1 111 111 ARG CA C 111 54.356 54.356 54.215 0.141 17927 5591 1 7 . 1 1 111 111 ARG CB C 111 33.430 33.430 32.952 0.478 17927 5592 1 7 . 1 1 111 111 ARG H H 111 7.732 7.732 8.366 -0.634 17927 5593 1 7 . 1 1 112 112 PHE N N 112 125.103 125.103 119.798 5.305 17927 5594 1 7 . 1 1 112 112 PHE HA H 112 5.773 5.773 4.922 0.851 17927 5595 1 7 . 1 1 112 112 PHE C C 112 175.097 175.097 175.010 0.087 17927 5596 1 7 . 1 1 112 112 PHE CA C 112 55.791 55.791 55.944 -0.153 17927 5597 1 7 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.971 0.957 17927 5598 1 7 . 1 1 112 112 PHE H H 112 8.929 8.929 8.065 0.864 17927 5599 1 7 . 1 1 113 113 ILE N N 113 123.778 123.778 122.286 1.492 17927 5600 1 7 . 1 1 113 113 ILE HA H 113 4.543 4.543 5.001 -0.458 17927 5601 1 7 . 1 1 113 113 ILE C C 113 173.197 173.197 173.931 -0.734 17927 5602 1 7 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.865 0.421 17927 5603 1 7 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.620 1.626 17927 5604 1 7 . 1 1 113 113 ILE H H 113 8.873 8.873 8.811 0.062 17927 5605 1 7 . 1 1 114 114 LEU N N 114 127.146 127.146 126.693 0.453 17927 5606 1 7 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.540 0.474 17927 5607 1 7 . 1 1 114 114 LEU C C 114 175.080 175.080 174.557 0.523 17927 5608 1 7 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.314 0.087 17927 5609 1 7 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.373 0.997 17927 5610 1 7 . 1 1 114 114 LEU H H 114 8.974 8.974 9.027 -0.053 17927 5611 1 7 . 1 1 115 115 LEU N N 115 128.323 128.323 124.796 3.527 17927 5612 1 7 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.129 0.303 17927 5613 1 7 . 1 1 115 115 LEU C C 115 176.660 176.660 175.762 0.898 17927 5614 1 7 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.790 -0.713 17927 5615 1 7 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.129 -1.545 17927 5616 1 7 . 1 1 115 115 LEU H H 115 9.874 9.874 9.284 0.590 17927 5617 1 7 . 1 1 116 116 ASP N N 116 119.834 119.834 122.376 -2.542 17927 5618 1 7 . 1 1 116 116 ASP HA H 116 4.935 4.935 5.016 -0.081 17927 5619 1 7 . 1 1 116 116 ASP C C 116 176.898 176.898 177.438 -0.540 17927 5620 1 7 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.822 -1.517 17927 5621 1 7 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.604 -1.576 17927 5622 1 7 . 1 1 116 116 ASP H H 116 9.357 9.357 8.874 0.483 17927 5623 1 7 . 1 1 117 117 ARG N N 117 113.356 113.356 120.209 -6.853 17927 5624 1 7 . 1 1 117 117 ARG HA H 117 3.717 3.717 4.115 -0.398 17927 5625 1 7 . 1 1 117 117 ARG C C 117 177.105 177.105 177.096 0.009 17927 5626 1 7 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.667 -1.482 17927 5627 1 7 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.941 0.496 17927 5628 1 7 . 1 1 117 117 ARG H H 117 7.697 7.697 8.267 -0.570 17927 5629 1 7 . 1 1 118 118 ASP N N 118 117.226 117.226 115.991 1.235 17927 5630 1 7 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.526 0.369 17927 5631 1 7 . 1 1 118 118 ASP C C 118 176.657 176.657 176.670 -0.013 17927 5632 1 7 . 1 1 118 118 ASP CA C 118 53.517 53.517 54.282 -0.765 17927 5633 1 7 . 1 1 118 118 ASP CB C 118 42.556 42.556 40.648 1.908 17927 5634 1 7 . 1 1 118 118 ASP H H 118 8.456 8.456 8.105 0.351 17927 5635 1 7 . 1 1 119 119 GLY N N 119 109.074 109.074 108.148 0.926 17927 5636 1 7 . 1 1 119 119 GLY C C 119 173.355 173.355 174.024 -0.669 17927 5637 1 7 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.539 0.717 17927 5638 1 7 . 1 1 119 119 GLY H H 119 8.183 8.183 8.420 -0.237 17927 5639 1 7 . 1 1 120 120 LYS N N 120 120.744 120.744 120.542 0.202 17927 5640 1 7 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.716 -0.183 17927 5641 1 7 . 1 1 120 120 LYS C C 120 177.229 177.229 176.421 0.808 17927 5642 1 7 . 1 1 120 120 LYS CA C 120 55.287 55.287 53.740 1.547 17927 5643 1 7 . 1 1 120 120 LYS CB C 120 32.581 32.581 32.995 -0.414 17927 5644 1 7 . 1 1 120 120 LYS H H 120 8.449 8.449 7.533 0.916 17927 5645 1 7 . 1 1 121 121 ILE N N 121 121.221 121.221 127.812 -6.591 17927 5646 1 7 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.845 0.041 17927 5647 1 7 . 1 1 121 121 ILE C C 121 177.819 177.819 176.416 1.403 17927 5648 1 7 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.611 0.304 17927 5649 1 7 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.304 2.086 17927 5650 1 7 . 1 1 121 121 ILE H H 121 8.715 8.715 9.046 -0.331 17927 5651 1 7 . 1 1 122 122 ILE N N 122 127.165 127.165 128.557 -1.392 17927 5652 1 7 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.320 0.021 17927 5653 1 7 . 1 1 122 122 ILE C C 122 176.978 176.978 176.734 0.244 17927 5654 1 7 . 1 1 122 122 ILE CA C 122 63.719 63.719 61.915 1.804 17927 5655 1 7 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.569 0.083 17927 5656 1 7 . 1 1 122 122 ILE H H 122 8.974 8.974 8.786 0.188 17927 5657 1 7 . 1 1 123 123 SER N N 123 111.227 111.227 115.193 -3.966 17927 5658 1 7 . 1 1 123 123 SER HA H 123 4.738 4.738 4.766 -0.028 17927 5659 1 7 . 1 1 123 123 SER C C 123 174.184 174.184 173.679 0.505 17927 5660 1 7 . 1 1 123 123 SER CA C 123 57.383 57.383 56.867 0.515 17927 5661 1 7 . 1 1 123 123 SER CB C 123 65.326 65.326 64.657 0.669 17927 5662 1 7 . 1 1 123 123 SER H H 123 7.850 7.850 8.316 -0.466 17927 5663 1 7 . 1 1 124 124 ALA N N 124 131.373 131.373 127.290 4.083 17927 5664 1 7 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.301 0.184 17927 5665 1 7 . 1 1 124 124 ALA C C 124 175.147 175.147 176.438 -1.291 17927 5666 1 7 . 1 1 124 124 ALA CA C 124 53.035 53.035 53.364 -0.329 17927 5667 1 7 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.169 -0.507 17927 5668 1 7 . 1 1 124 124 ALA H H 124 9.384 9.384 8.766 0.618 17927 5669 1 7 . 1 1 125 125 ASN N N 125 119.476 119.476 115.386 4.090 17927 5670 1 7 . 1 1 125 125 ASN HA H 125 5.056 5.056 4.807 0.249 17927 5671 1 7 . 1 1 125 125 ASN C C 125 173.593 173.593 174.158 -0.565 17927 5672 1 7 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.136 0.216 17927 5673 1 7 . 1 1 125 125 ASN CB C 125 38.304 38.304 38.825 -0.520 17927 5674 1 7 . 1 1 125 125 ASN H H 125 8.191 8.191 7.925 0.266 17927 5675 1 7 . 1 1 126 126 MET N N 126 122.705 122.705 122.313 0.392 17927 5676 1 7 . 1 1 126 126 MET HA H 126 4.585 4.585 4.922 -0.337 17927 5677 1 7 . 1 1 126 126 MET C C 126 175.215 175.215 175.809 -0.594 17927 5678 1 7 . 1 1 126 126 MET CA C 126 53.849 53.849 53.923 -0.074 17927 5679 1 7 . 1 1 126 126 MET CB C 126 31.312 31.312 34.294 -2.982 17927 5680 1 7 . 1 1 126 126 MET H H 126 8.376 8.376 9.050 -0.674 17927 5681 1 7 . 1 1 127 127 THR N N 127 111.016 111.016 111.245 -0.229 17927 5682 1 7 . 1 1 127 127 THR HA H 127 4.291 4.291 4.455 -0.164 17927 5683 1 7 . 1 1 127 127 THR C C 127 174.574 174.574 173.426 1.148 17927 5684 1 7 . 1 1 127 127 THR CA C 127 62.085 62.085 59.666 2.419 17927 5685 1 7 . 1 1 127 127 THR CB C 127 69.733 69.733 70.470 -0.737 17927 5686 1 7 . 1 1 127 127 THR H H 127 7.714 7.714 8.213 -0.499 17927 5687 1 7 . 1 1 128 128 ARG N N 128 118.722 118.722 121.855 -3.133 17927 5688 1 7 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.026 -0.718 17927 5689 1 7 . 1 1 128 128 ARG C C 128 176.978 176.978 175.878 1.100 17927 5690 1 7 . 1 1 128 128 ARG CA C 128 54.727 54.727 55.817 -1.090 17927 5691 1 7 . 1 1 128 128 ARG CB C 128 29.598 29.598 28.197 1.401 17927 5692 1 7 . 1 1 128 128 ARG H H 128 8.658 8.658 7.561 1.097 17927 5693 1 7 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.243 -0.310 17927 5694 1 7 . 1 1 129 129 PRO C C 129 175.794 175.794 177.223 -1.429 17927 5695 1 7 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.388 1.161 17927 5696 1 7 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.692 -0.014 17927 5697 1 7 . 1 1 130 130 SER N N 130 108.696 108.696 111.178 -2.482 17927 5698 1 7 . 1 1 130 130 SER HA H 130 3.988 3.988 4.325 -0.337 17927 5699 1 7 . 1 1 130 130 SER C C 130 174.445 174.445 174.242 0.203 17927 5700 1 7 . 1 1 130 130 SER CA C 130 58.911 58.911 59.934 -1.023 17927 5701 1 7 . 1 1 130 130 SER CB C 130 62.680 62.680 63.285 -0.605 17927 5702 1 7 . 1 1 130 130 SER H H 130 8.375 8.375 8.642 -0.267 17927 5703 1 7 . 1 1 131 131 ASP N N 131 126.377 126.377 122.218 4.159 17927 5704 1 7 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.883 -0.011 17927 5705 1 7 . 1 1 131 131 ASP C C 131 176.879 176.879 175.363 1.516 17927 5706 1 7 . 1 1 131 131 ASP CA C 131 51.195 51.195 51.201 -0.006 17927 5707 1 7 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.057 0.759 17927 5708 1 7 . 1 1 131 131 ASP H H 131 7.514 7.514 7.590 -0.076 17927 5709 1 7 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.117 0.275 17927 5710 1 7 . 1 1 132 132 PRO C C 132 178.097 178.097 178.005 0.092 17927 5711 1 7 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.693 0.386 17927 5712 1 7 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.164 0.245 17927 5713 1 7 . 1 1 133 133 LYS N N 133 116.306 116.306 116.495 -0.189 17927 5714 1 7 . 1 1 133 133 LYS HA H 133 3.958 3.958 3.947 0.011 17927 5715 1 7 . 1 1 133 133 LYS C C 133 179.532 179.532 178.802 0.730 17927 5716 1 7 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.251 -0.730 17927 5717 1 7 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.992 0.199 17927 5718 1 7 . 1 1 133 133 LYS H H 133 8.842 8.842 8.709 0.133 17927 5719 1 7 . 1 1 134 134 THR N N 134 120.833 120.833 116.357 4.476 17927 5720 1 7 . 1 1 134 134 THR HA H 134 3.147 3.147 3.660 -0.513 17927 5721 1 7 . 1 1 134 134 THR C C 134 173.356 173.356 175.031 -1.675 17927 5722 1 7 . 1 1 134 134 THR CA C 134 66.383 66.383 66.040 0.343 17927 5723 1 7 . 1 1 134 134 THR CB C 134 66.847 66.847 68.283 -1.436 17927 5724 1 7 . 1 1 134 134 THR H H 134 8.292 8.292 7.460 0.832 17927 5725 1 7 . 1 1 135 135 ALA N N 135 121.720 121.720 123.010 -1.290 17927 5726 1 7 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.149 0.434 17927 5727 1 7 . 1 1 135 135 ALA C C 135 178.902 178.902 179.335 -0.433 17927 5728 1 7 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.640 0.359 17927 5729 1 7 . 1 1 135 135 ALA CB C 135 17.775 17.775 17.846 -0.071 17927 5730 1 7 . 1 1 135 135 ALA H H 135 7.030 7.030 7.306 -0.276 17927 5731 1 7 . 1 1 136 136 GLU N N 136 114.623 114.623 117.635 -3.012 17927 5732 1 7 . 1 1 136 136 GLU HA H 136 3.922 3.922 3.750 0.172 17927 5733 1 7 . 1 1 136 136 GLU C C 136 179.199 179.199 178.785 0.414 17927 5734 1 7 . 1 1 136 136 GLU CA C 136 59.837 59.837 59.416 0.421 17927 5735 1 7 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.099 0.687 17927 5736 1 7 . 1 1 136 136 GLU H H 136 7.216 7.216 8.190 -0.974 17927 5737 1 7 . 1 1 137 137 LYS N N 137 120.789 120.789 119.632 1.157 17927 5738 1 7 . 1 1 137 137 LYS HA H 137 4.204 4.204 4.057 0.147 17927 5739 1 7 . 1 1 137 137 LYS C C 137 178.834 178.834 178.790 0.044 17927 5740 1 7 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.867 -1.524 17927 5741 1 7 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.953 -1.490 17927 5742 1 7 . 1 1 137 137 LYS H H 137 7.681 7.681 7.300 0.381 17927 5743 1 7 . 1 1 138 138 PHE N N 138 118.373 118.373 118.559 -0.186 17927 5744 1 7 . 1 1 138 138 PHE HA H 138 4.033 4.033 4.121 -0.088 17927 5745 1 7 . 1 1 138 138 PHE C C 138 178.027 178.027 177.897 0.130 17927 5746 1 7 . 1 1 138 138 PHE CA C 138 57.507 57.507 58.947 -1.440 17927 5747 1 7 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.329 -1.440 17927 5748 1 7 . 1 1 138 138 PHE H H 138 8.059 8.059 7.264 0.795 17927 5749 1 7 . 1 1 139 139 ASN N N 139 117.611 117.611 117.779 -0.168 17927 5750 1 7 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.438 -0.034 17927 5751 1 7 . 1 1 139 139 ASN C C 139 178.190 178.190 177.694 0.496 17927 5752 1 7 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.250 -0.026 17927 5753 1 7 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.734 -1.000 17927 5754 1 7 . 1 1 139 139 ASN H H 139 8.683 8.683 8.378 0.305 17927 5755 1 7 . 1 1 140 140 GLU N N 140 121.432 121.432 121.274 0.158 17927 5756 1 7 . 1 1 140 140 GLU HA H 140 4.005 4.005 3.994 0.011 17927 5757 1 7 . 1 1 140 140 GLU C C 140 179.751 179.751 179.019 0.732 17927 5758 1 7 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.482 -0.172 17927 5759 1 7 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.634 0.421 17927 5760 1 7 . 1 1 140 140 GLU H H 140 7.868 7.868 7.988 -0.120 17927 5761 1 7 . 1 1 141 141 LEU N N 141 119.968 119.968 118.572 1.396 17927 5762 1 7 . 1 1 141 141 LEU HA H 141 4.016 4.016 3.902 0.114 17927 5763 1 7 . 1 1 141 141 LEU C C 141 179.293 179.293 179.546 -0.253 17927 5764 1 7 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.420 0.016 17927 5765 1 7 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.805 -0.622 17927 5766 1 7 . 1 1 141 141 LEU H H 141 8.303 8.303 7.985 0.318 17927 5767 1 7 . 1 1 142 142 LEU N N 142 115.040 115.040 116.115 -1.075 17927 5768 1 7 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.177 0.207 17927 5769 1 7 . 1 1 142 142 LEU C C 142 178.002 178.002 177.642 0.360 17927 5770 1 7 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.708 -0.429 17927 5771 1 7 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.162 0.484 17927 5772 1 7 . 1 1 142 142 LEU H H 142 8.230 8.230 7.984 0.246 17927 5773 1 7 . 1 1 143 143 GLY N N 143 108.977 108.977 106.920 2.057 17927 5774 1 7 . 1 1 143 143 GLY C C 143 175.216 175.216 174.973 0.243 17927 5775 1 7 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.610 1.131 17927 5776 1 7 . 1 1 143 143 GLY H H 143 7.762 7.762 7.682 0.080 17927 5777 1 7 . 1 1 144 144 LEU N N 144 119.660 119.660 120.889 -1.229 17927 5778 1 7 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.531 -0.043 17927 5779 1 7 . 1 1 144 144 LEU C C 144 177.375 177.375 176.396 0.979 17927 5780 1 7 . 1 1 144 144 LEU CA C 144 54.525 54.525 53.985 0.540 17927 5781 1 7 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.167 0.606 17927 5782 1 7 . 1 1 144 144 LEU H H 144 8.241 8.241 8.193 0.048 17927 5783 1 7 . 1 1 145 145 GLU N N 145 119.959 119.959 119.201 0.758 17927 5784 1 7 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.116 0.125 17927 5785 1 7 . 1 1 145 145 GLU C C 145 177.075 177.075 177.503 -0.428 17927 5786 1 7 . 1 1 145 145 GLU CA C 145 56.799 56.799 58.169 -1.370 17927 5787 1 7 . 1 1 145 145 GLU CB C 145 30.168 30.168 29.866 0.301 17927 5788 1 7 . 1 1 145 145 GLU H H 145 8.410 8.410 7.945 0.465 17927 5789 1 7 . 1 1 146 146 GLY N N 146 109.412 109.412 113.579 -4.167 17927 5790 1 7 . 1 1 146 146 GLY C C 146 174.276 174.276 175.037 -0.761 17927 5791 1 7 . 1 1 146 146 GLY CA C 146 45.445 45.445 45.007 0.438 17927 5792 1 7 . 1 1 146 146 GLY H H 146 8.422 8.422 8.923 -0.501 17927 5793 1 7 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.602 0.054 17927 5794 1 7 . 1 1 151 151 HIS C C 151 173.990 173.990 174.413 -0.423 17927 5795 1 7 . 1 1 151 151 HIS CA C 151 56.044 56.044 56.151 -0.107 17927 5796 1 7 . 1 1 151 151 HIS CB C 151 30.076 30.076 30.429 -0.353 17927 5797 1 8 . 1 1 2 2 SER HA H 2 4.121 4.121 4.714 -0.593 17927 5798 1 8 . 1 1 2 2 SER CA C 2 57.293 57.293 58.299 -1.006 17927 5799 1 8 . 1 1 2 2 SER CB C 2 63.545 63.545 63.587 -0.042 17927 5800 1 8 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.457 -0.025 17927 5801 1 8 . 1 1 3 3 LEU C C 3 177.383 177.383 176.527 0.856 17927 5802 1 8 . 1 1 3 3 LEU CA C 3 55.575 55.575 56.264 -0.689 17927 5803 1 8 . 1 1 3 3 LEU CB C 3 42.584 42.584 42.155 0.429 17927 5804 1 8 . 1 1 4 4 ARG N N 4 122.080 122.080 120.735 1.345 17927 5805 1 8 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.325 0.059 17927 5806 1 8 . 1 1 4 4 ARG C C 4 176.410 176.410 176.065 0.345 17927 5807 1 8 . 1 1 4 4 ARG CA C 4 56.269 56.269 55.728 0.541 17927 5808 1 8 . 1 1 4 4 ARG CB C 4 30.842 30.842 30.315 0.527 17927 5809 1 8 . 1 1 4 4 ARG H H 4 8.410 8.410 8.360 0.050 17927 5810 1 8 . 1 1 5 5 SER N N 5 117.023 117.023 118.714 -1.691 17927 5811 1 8 . 1 1 5 5 SER HA H 5 4.423 4.423 4.558 -0.135 17927 5812 1 8 . 1 1 5 5 SER C C 5 175.039 175.039 175.024 0.015 17927 5813 1 8 . 1 1 5 5 SER CA C 5 58.605 58.605 58.816 -0.211 17927 5814 1 8 . 1 1 5 5 SER CB C 5 64.044 64.044 62.817 1.227 17927 5815 1 8 . 1 1 5 5 SER H H 5 8.292 8.292 8.320 -0.028 17927 5816 1 8 . 1 1 6 6 GLY N N 6 110.718 110.718 116.446 -5.728 17927 5817 1 8 . 1 1 6 6 GLY C C 6 173.654 173.654 173.267 0.387 17927 5818 1 8 . 1 1 6 6 GLY CA C 6 45.273 45.273 44.823 0.450 17927 5819 1 8 . 1 1 6 6 GLY H H 6 8.446 8.446 8.482 -0.036 17927 5820 1 8 . 1 1 7 7 ASN N N 7 119.287 119.287 120.981 -1.694 17927 5821 1 8 . 1 1 7 7 ASN HA H 7 5.024 5.024 5.154 -0.130 17927 5822 1 8 . 1 1 7 7 ASN C C 7 173.672 173.672 173.032 0.640 17927 5823 1 8 . 1 1 7 7 ASN CA C 7 51.357 51.357 50.978 0.379 17927 5824 1 8 . 1 1 7 7 ASN CB C 7 38.927 38.927 41.044 -2.117 17927 5825 1 8 . 1 1 7 7 ASN H H 7 8.273 8.273 8.373 -0.100 17927 5826 1 8 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.705 -0.258 17927 5827 1 8 . 1 1 8 8 PRO C C 8 176.899 176.899 175.908 0.991 17927 5828 1 8 . 1 1 8 8 PRO CA C 8 63.429 63.429 62.948 0.481 17927 5829 1 8 . 1 1 8 8 PRO CB C 8 32.216 32.216 31.439 0.777 17927 5830 1 8 . 1 1 9 9 SER N N 9 115.642 115.642 121.551 -5.909 17927 5831 1 8 . 1 1 9 9 SER HA H 9 4.415 4.415 4.568 -0.153 17927 5832 1 8 . 1 1 9 9 SER C C 9 174.714 174.714 174.968 -0.254 17927 5833 1 8 . 1 1 9 9 SER CA C 9 58.488 58.488 58.927 -0.439 17927 5834 1 8 . 1 1 9 9 SER CB C 9 64.048 64.048 62.607 1.441 17927 5835 1 8 . 1 1 9 9 SER H H 9 8.336 8.336 8.254 0.082 17927 5836 1 8 . 1 1 10 10 ALA N N 10 126.808 126.808 129.728 -2.920 17927 5837 1 8 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.481 -0.219 17927 5838 1 8 . 1 1 10 10 ALA C C 10 177.233 177.233 176.829 0.404 17927 5839 1 8 . 1 1 10 10 ALA CA C 10 53.230 53.230 54.636 -1.406 17927 5840 1 8 . 1 1 10 10 ALA CB C 10 19.187 19.187 17.916 1.271 17927 5841 1 8 . 1 1 10 10 ALA H H 10 8.137 8.137 9.185 -1.048 17927 5842 1 8 . 1 1 11 11 ALA N N 11 120.449 120.449 122.784 -2.335 17927 5843 1 8 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.341 -0.080 17927 5844 1 8 . 1 1 11 11 ALA C C 11 177.469 177.469 177.016 0.453 17927 5845 1 8 . 1 1 11 11 ALA CA C 11 52.475 52.475 51.764 0.711 17927 5846 1 8 . 1 1 11 11 ALA CB C 11 19.485 19.485 17.940 1.545 17927 5847 1 8 . 1 1 11 11 ALA H H 11 7.851 7.851 7.882 -0.031 17927 5848 1 8 . 1 1 12 12 SER N N 12 114.186 114.186 115.210 -1.024 17927 5849 1 8 . 1 1 12 12 SER HA H 12 4.312 4.312 3.984 0.328 17927 5850 1 8 . 1 1 12 12 SER C C 12 173.593 173.593 173.668 -0.075 17927 5851 1 8 . 1 1 12 12 SER CA C 12 58.099 58.099 58.995 -0.896 17927 5852 1 8 . 1 1 12 12 SER CB C 12 63.320 63.320 61.186 2.134 17927 5853 1 8 . 1 1 12 12 SER H H 12 7.990 7.990 8.385 -0.395 17927 5854 1 8 . 1 1 13 13 PHE N N 13 118.092 118.092 117.412 0.680 17927 5855 1 8 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.527 0.253 17927 5856 1 8 . 1 1 13 13 PHE C C 13 174.220 174.220 174.582 -0.362 17927 5857 1 8 . 1 1 13 13 PHE CA C 13 56.717 56.717 57.703 -0.986 17927 5858 1 8 . 1 1 13 13 PHE CB C 13 41.151 41.151 39.753 1.398 17927 5859 1 8 . 1 1 13 13 PHE H H 13 7.147 7.147 7.435 -0.288 17927 5860 1 8 . 1 1 14 14 SER N N 14 116.456 116.456 114.529 1.927 17927 5861 1 8 . 1 1 14 14 SER HA H 14 5.162 5.162 4.737 0.425 17927 5862 1 8 . 1 1 14 14 SER C C 14 172.626 172.626 172.802 -0.176 17927 5863 1 8 . 1 1 14 14 SER CA C 14 57.390 57.390 57.364 0.026 17927 5864 1 8 . 1 1 14 14 SER CB C 14 64.518 64.518 65.856 -1.338 17927 5865 1 8 . 1 1 14 14 SER H H 14 7.616 7.616 8.177 -0.561 17927 5866 1 8 . 1 1 15 15 TYR N N 15 122.384 122.384 121.455 0.929 17927 5867 1 8 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.829 0.377 17927 5868 1 8 . 1 1 15 15 TYR C C 15 172.543 172.543 173.394 -0.851 17927 5869 1 8 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.739 -0.793 17927 5870 1 8 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.312 0.915 17927 5871 1 8 . 1 1 15 15 TYR H H 15 8.558 8.558 9.172 -0.614 17927 5872 1 8 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.789 0.320 17927 5873 1 8 . 1 1 16 16 PRO C C 16 176.475 176.475 176.608 -0.133 17927 5874 1 8 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.474 -0.493 17927 5875 1 8 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.032 0.630 17927 5876 1 8 . 1 1 17 17 ASP N N 17 119.834 119.834 125.377 -5.543 17927 5877 1 8 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.940 0.799 17927 5878 1 8 . 1 1 17 17 ASP C C 17 180.740 180.740 178.328 2.412 17927 5879 1 8 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.323 -1.606 17927 5880 1 8 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.113 -0.552 17927 5881 1 8 . 1 1 17 17 ASP H H 17 8.643 8.643 8.852 -0.209 17927 5882 1 8 . 1 1 18 18 ILE N N 18 118.340 118.340 123.398 -5.058 17927 5883 1 8 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.800 0.651 17927 5884 1 8 . 1 1 18 18 ILE C C 18 175.742 175.742 177.010 -1.268 17927 5885 1 8 . 1 1 18 18 ILE CA C 18 61.894 61.894 64.700 -2.806 17927 5886 1 8 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.255 0.985 17927 5887 1 8 . 1 1 18 18 ILE H H 18 8.450 8.450 8.129 0.321 17927 5888 1 8 . 1 1 19 19 ASN N N 19 119.377 119.377 117.531 1.846 17927 5889 1 8 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.531 0.484 17927 5890 1 8 . 1 1 19 19 ASN C C 19 175.892 175.892 176.098 -0.206 17927 5891 1 8 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.993 -1.686 17927 5892 1 8 . 1 1 19 19 ASN CB C 19 39.825 39.825 38.793 1.032 17927 5893 1 8 . 1 1 19 19 ASN H H 19 8.376 8.376 8.519 -0.143 17927 5894 1 8 . 1 1 20 20 GLY N N 20 109.535 109.535 107.693 1.842 17927 5895 1 8 . 1 1 20 20 GLY C C 20 174.285 174.285 173.198 1.087 17927 5896 1 8 . 1 1 20 20 GLY CA C 20 45.793 45.793 44.879 0.914 17927 5897 1 8 . 1 1 20 20 GLY H H 20 8.539 8.539 8.482 0.057 17927 5898 1 8 . 1 1 21 21 LYS N N 21 124.675 124.675 121.062 3.613 17927 5899 1 8 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.623 -0.180 17927 5900 1 8 . 1 1 21 21 LYS C C 21 176.537 176.537 175.708 0.829 17927 5901 1 8 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.504 0.940 17927 5902 1 8 . 1 1 21 21 LYS CB C 21 32.754 32.754 33.838 -1.084 17927 5903 1 8 . 1 1 21 21 LYS H H 21 8.608 8.608 7.521 1.087 17927 5904 1 8 . 1 1 22 22 THR N N 22 120.666 120.666 124.097 -3.431 17927 5905 1 8 . 1 1 22 22 THR HA H 22 4.087 4.087 4.230 -0.143 17927 5906 1 8 . 1 1 22 22 THR C C 22 174.431 174.431 174.021 0.410 17927 5907 1 8 . 1 1 22 22 THR CA C 22 64.292 64.292 64.053 0.239 17927 5908 1 8 . 1 1 22 22 THR CB C 22 69.069 69.069 68.354 0.715 17927 5909 1 8 . 1 1 22 22 THR H H 22 8.595 8.595 8.885 -0.290 17927 5910 1 8 . 1 1 23 23 VAL N N 23 131.207 131.207 130.583 0.624 17927 5911 1 8 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.173 0.019 17927 5912 1 8 . 1 1 23 23 VAL C C 23 174.244 174.244 174.858 -0.614 17927 5913 1 8 . 1 1 23 23 VAL CA C 23 62.456 62.456 61.809 0.647 17927 5914 1 8 . 1 1 23 23 VAL CB C 23 33.791 33.791 32.724 1.067 17927 5915 1 8 . 1 1 23 23 VAL H H 23 8.937 8.937 8.720 0.217 17927 5916 1 8 . 1 1 24 24 SER N N 24 120.787 120.787 122.935 -2.148 17927 5917 1 8 . 1 1 24 24 SER HA H 24 5.407 5.407 5.046 0.361 17927 5918 1 8 . 1 1 24 24 SER C C 24 176.169 176.169 175.565 0.604 17927 5919 1 8 . 1 1 24 24 SER CA C 24 55.135 55.135 56.246 -1.111 17927 5920 1 8 . 1 1 24 24 SER CB C 24 65.646 65.646 65.022 0.624 17927 5921 1 8 . 1 1 24 24 SER H H 24 8.554 8.554 8.552 0.002 17927 5922 1 8 . 1 1 25 25 LEU N N 25 124.332 124.332 124.014 0.318 17927 5923 1 8 . 1 1 25 25 LEU HA H 25 3.687 3.687 3.679 0.008 17927 5924 1 8 . 1 1 25 25 LEU C C 25 179.364 179.364 177.417 1.947 17927 5925 1 8 . 1 1 25 25 LEU CA C 25 58.217 58.217 57.582 0.635 17927 5926 1 8 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.257 -0.719 17927 5927 1 8 . 1 1 25 25 LEU H H 25 7.811 7.811 8.339 -0.528 17927 5928 1 8 . 1 1 26 26 ALA N N 26 119.799 119.799 116.602 3.197 17927 5929 1 8 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.184 -0.191 17927 5930 1 8 . 1 1 26 26 ALA C C 26 179.719 179.719 177.042 2.677 17927 5931 1 8 . 1 1 26 26 ALA CA C 26 54.663 54.663 52.395 2.268 17927 5932 1 8 . 1 1 26 26 ALA CB C 26 18.323 18.323 18.334 -0.011 17927 5933 1 8 . 1 1 26 26 ALA H H 26 8.099 8.099 8.112 -0.013 17927 5934 1 8 . 1 1 27 27 ASP N N 27 116.553 116.553 119.067 -2.514 17927 5935 1 8 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.537 -0.064 17927 5936 1 8 . 1 1 27 27 ASP C C 27 176.915 176.915 177.019 -0.104 17927 5937 1 8 . 1 1 27 27 ASP CA C 27 56.251 56.251 55.419 0.832 17927 5938 1 8 . 1 1 27 27 ASP CB C 27 40.788 40.788 41.808 -1.020 17927 5939 1 8 . 1 1 27 27 ASP H H 27 7.572 7.572 7.959 -0.387 17927 5940 1 8 . 1 1 28 28 LEU N N 28 118.950 118.950 114.070 4.880 17927 5941 1 8 . 1 1 28 28 LEU HA H 28 4.233 4.233 4.554 -0.321 17927 5942 1 8 . 1 1 28 28 LEU C C 28 175.542 175.542 175.988 -0.446 17927 5943 1 8 . 1 1 28 28 LEU CA C 28 53.706 53.706 53.723 -0.017 17927 5944 1 8 . 1 1 28 28 LEU CB C 28 41.049 41.049 42.359 -1.310 17927 5945 1 8 . 1 1 28 28 LEU H H 28 7.363 7.363 7.239 0.124 17927 5946 1 8 . 1 1 29 29 LYS N N 29 118.429 118.429 121.515 -3.086 17927 5947 1 8 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.063 0.289 17927 5948 1 8 . 1 1 29 29 LYS C C 29 178.063 178.063 177.674 0.389 17927 5949 1 8 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.458 0.319 17927 5950 1 8 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.663 0.777 17927 5951 1 8 . 1 1 29 29 LYS H H 29 6.780 6.780 7.401 -0.621 17927 5952 1 8 . 1 1 30 30 GLY N N 30 112.426 112.426 113.789 -1.363 17927 5953 1 8 . 1 1 30 30 GLY C C 30 173.801 173.801 173.360 0.441 17927 5954 1 8 . 1 1 30 30 GLY CA C 30 44.611 44.611 45.046 -0.435 17927 5955 1 8 . 1 1 30 30 GLY H H 30 9.398 9.398 9.006 0.392 17927 5956 1 8 . 1 1 31 31 LYS N N 31 119.295 119.295 120.384 -1.089 17927 5957 1 8 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.539 -0.387 17927 5958 1 8 . 1 1 31 31 LYS C C 31 173.862 173.862 176.534 -2.672 17927 5959 1 8 . 1 1 31 31 LYS CA C 31 55.188 55.188 53.335 1.853 17927 5960 1 8 . 1 1 31 31 LYS CB C 31 36.968 36.968 34.349 2.619 17927 5961 1 8 . 1 1 31 31 LYS H H 31 7.496 7.496 7.213 0.283 17927 5962 1 8 . 1 1 32 32 TYR N N 32 116.984 116.984 121.974 -4.990 17927 5963 1 8 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.418 -0.261 17927 5964 1 8 . 1 1 32 32 TYR C C 32 175.226 175.226 175.334 -0.108 17927 5965 1 8 . 1 1 32 32 TYR CA C 32 60.590 60.590 59.170 1.420 17927 5966 1 8 . 1 1 32 32 TYR CB C 32 39.121 39.121 38.093 1.028 17927 5967 1 8 . 1 1 32 32 TYR H H 32 7.521 7.521 8.952 -1.431 17927 5968 1 8 . 1 1 33 33 ILE N N 33 118.052 118.052 125.034 -6.982 17927 5969 1 8 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.156 0.751 17927 5970 1 8 . 1 1 33 33 ILE C C 33 174.308 174.308 174.751 -0.443 17927 5971 1 8 . 1 1 33 33 ILE CA C 33 60.702 60.702 58.932 1.770 17927 5972 1 8 . 1 1 33 33 ILE CB C 33 41.616 41.616 37.203 4.413 17927 5973 1 8 . 1 1 33 33 ILE H H 33 8.467 8.467 8.346 0.121 17927 5974 1 8 . 1 1 34 34 TYR N N 34 130.242 130.242 130.091 0.151 17927 5975 1 8 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.057 0.469 17927 5976 1 8 . 1 1 34 34 TYR C C 34 174.245 174.245 174.028 0.217 17927 5977 1 8 . 1 1 34 34 TYR CA C 34 56.158 56.158 56.071 0.087 17927 5978 1 8 . 1 1 34 34 TYR CB C 34 40.133 40.133 40.159 -0.026 17927 5979 1 8 . 1 1 34 34 TYR H H 34 8.905 8.905 9.192 -0.287 17927 5980 1 8 . 1 1 35 35 ILE N N 35 128.697 128.697 129.927 -1.230 17927 5981 1 8 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.137 0.205 17927 5982 1 8 . 1 1 35 35 ILE C C 35 174.520 174.520 174.606 -0.086 17927 5983 1 8 . 1 1 35 35 ILE CA C 35 59.749 59.749 60.252 -0.503 17927 5984 1 8 . 1 1 35 35 ILE CB C 35 40.899 40.899 39.506 1.393 17927 5985 1 8 . 1 1 35 35 ILE H H 35 9.445 9.445 8.537 0.908 17927 5986 1 8 . 1 1 36 36 ASP N N 36 123.675 123.675 125.142 -1.467 17927 5987 1 8 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.999 -1.151 17927 5988 1 8 . 1 1 36 36 ASP C C 36 174.385 174.385 175.484 -1.099 17927 5989 1 8 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.467 -0.173 17927 5990 1 8 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.908 -3.131 17927 5991 1 8 . 1 1 36 36 ASP H H 36 8.875 8.875 8.806 0.069 17927 5992 1 8 . 1 1 37 37 VAL N N 37 127.159 127.159 118.781 8.378 17927 5993 1 8 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.708 0.251 17927 5994 1 8 . 1 1 37 37 VAL C C 37 175.046 175.046 175.638 -0.592 17927 5995 1 8 . 1 1 37 37 VAL CA C 37 62.245 62.245 61.063 1.182 17927 5996 1 8 . 1 1 37 37 VAL CB C 37 31.807 31.807 33.459 -1.652 17927 5997 1 8 . 1 1 37 37 VAL H H 37 8.603 8.603 8.007 0.596 17927 5998 1 8 . 1 1 38 38 TRP N N 38 124.161 124.161 125.290 -1.129 17927 5999 1 8 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.158 0.079 17927 6000 1 8 . 1 1 38 38 TRP C C 38 171.995 171.995 173.757 -1.762 17927 6001 1 8 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.723 1.484 17927 6002 1 8 . 1 1 38 38 TRP CB C 38 33.187 33.187 31.201 1.986 17927 6003 1 8 . 1 1 38 38 TRP H H 38 8.562 8.562 8.300 0.262 17927 6004 1 8 . 1 1 39 39 ALA N N 39 116.252 116.252 123.578 -7.326 17927 6005 1 8 . 1 1 39 39 ALA HA H 39 3.678 3.678 4.215 -0.537 17927 6006 1 8 . 1 1 39 39 ALA C C 39 178.664 178.664 175.622 3.042 17927 6007 1 8 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.155 1.311 17927 6008 1 8 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.255 1.086 17927 6009 1 8 . 1 1 39 39 ALA H H 39 6.757 6.757 7.971 -1.214 17927 6010 1 8 . 1 1 40 40 THR N N 40 114.321 114.321 115.148 -0.827 17927 6011 1 8 . 1 1 40 40 THR HA H 40 3.907 3.907 4.157 -0.250 17927 6012 1 8 . 1 1 40 40 THR C C 40 175.885 175.885 175.669 0.216 17927 6013 1 8 . 1 1 40 40 THR CA C 40 65.447 65.447 63.953 1.494 17927 6014 1 8 . 1 1 40 40 THR CB C 40 70.106 70.106 68.992 1.114 17927 6015 1 8 . 1 1 40 40 THR H H 40 9.639 9.639 8.422 1.217 17927 6016 1 8 . 1 1 41 41 TRP N N 41 114.483 114.483 121.189 -6.706 17927 6017 1 8 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.830 -0.267 17927 6018 1 8 . 1 1 41 41 TRP C C 41 176.189 176.189 175.856 0.333 17927 6019 1 8 . 1 1 41 41 TRP CA C 41 54.698 54.698 54.867 -0.169 17927 6020 1 8 . 1 1 41 41 TRP CB C 41 29.977 29.977 27.763 2.214 17927 6021 1 8 . 1 1 41 41 TRP H H 41 6.401 6.401 7.228 -0.827 17927 6022 1 8 . 1 1 42 42 CYS N N 42 123.536 123.536 115.565 7.971 17927 6023 1 8 . 1 1 42 42 CYS HA H 42 4.568 4.568 3.985 0.583 17927 6024 1 8 . 1 1 42 42 CYS C C 42 175.726 175.726 176.094 -0.368 17927 6025 1 8 . 1 1 42 42 CYS CA C 42 58.700 58.700 59.055 -0.355 17927 6026 1 8 . 1 1 42 42 CYS CB C 42 27.121 27.121 28.318 -1.197 17927 6027 1 8 . 1 1 42 42 CYS H H 42 6.883 6.883 6.979 -0.096 17927 6028 1 8 . 1 1 43 43 GLY N N 43 120.977 120.977 110.478 10.499 17927 6029 1 8 . 1 1 43 43 GLY CA C 43 49.204 49.204 46.602 2.602 17927 6030 1 8 . 1 1 43 43 GLY H H 43 9.653 9.653 7.889 1.764 17927 6031 1 8 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.349 0.138 17927 6032 1 8 . 1 1 44 44 PRO C C 44 179.956 179.956 178.361 1.595 17927 6033 1 8 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.088 0.554 17927 6034 1 8 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.574 1.004 17927 6035 1 8 . 1 1 45 45 CYS N N 45 113.925 113.925 117.232 -3.307 17927 6036 1 8 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.203 0.110 17927 6037 1 8 . 1 1 45 45 CYS C C 45 178.325 178.325 176.612 1.713 17927 6038 1 8 . 1 1 45 45 CYS CA C 45 63.392 63.392 60.991 2.401 17927 6039 1 8 . 1 1 45 45 CYS CB C 45 28.505 28.505 26.964 1.541 17927 6040 1 8 . 1 1 45 45 CYS H H 45 7.676 7.676 7.640 0.036 17927 6041 1 8 . 1 1 46 46 ARG N N 46 120.336 120.336 118.447 1.889 17927 6042 1 8 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.177 -0.108 17927 6043 1 8 . 1 1 46 46 ARG C C 46 180.446 180.446 177.751 2.695 17927 6044 1 8 . 1 1 46 46 ARG CA C 46 59.785 59.785 58.717 1.068 17927 6045 1 8 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.889 -0.021 17927 6046 1 8 . 1 1 46 46 ARG H H 46 8.109 8.109 7.943 0.166 17927 6047 1 8 . 1 1 47 47 GLY N N 47 105.408 105.408 105.123 0.285 17927 6048 1 8 . 1 1 47 47 GLY C C 47 175.258 175.258 175.113 0.145 17927 6049 1 8 . 1 1 47 47 GLY CA C 47 46.594 46.594 45.820 0.774 17927 6050 1 8 . 1 1 47 47 GLY H H 47 8.466 8.466 7.885 0.581 17927 6051 1 8 . 1 1 48 48 GLU N N 48 116.343 116.343 119.484 -3.141 17927 6052 1 8 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.469 0.056 17927 6053 1 8 . 1 1 48 48 GLU C C 48 176.535 176.535 178.046 -1.511 17927 6054 1 8 . 1 1 48 48 GLU CA C 48 55.792 55.792 56.946 -1.154 17927 6055 1 8 . 1 1 48 48 GLU CB C 48 30.982 30.982 30.254 0.728 17927 6056 1 8 . 1 1 48 48 GLU H H 48 7.050 7.050 7.755 -0.705 17927 6057 1 8 . 1 1 49 49 LEU N N 49 118.652 118.652 121.317 -2.665 17927 6058 1 8 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.196 -0.044 17927 6059 1 8 . 1 1 49 49 LEU C C 49 176.832 176.832 176.601 0.231 17927 6060 1 8 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.160 -0.815 17927 6061 1 8 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.070 -0.574 17927 6062 1 8 . 1 1 49 49 LEU H H 49 7.385 7.385 7.448 -0.063 17927 6063 1 8 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.218 0.035 17927 6064 1 8 . 1 1 50 50 PRO C C 50 179.744 179.744 178.113 1.631 17927 6065 1 8 . 1 1 50 50 PRO CA C 50 66.559 66.559 65.665 0.894 17927 6066 1 8 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.871 -0.109 17927 6067 1 8 . 1 1 51 51 ALA N N 51 120.418 120.418 119.564 0.854 17927 6068 1 8 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.323 -0.178 17927 6069 1 8 . 1 1 51 51 ALA C C 51 180.329 180.329 179.574 0.755 17927 6070 1 8 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.080 0.354 17927 6071 1 8 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.119 0.251 17927 6072 1 8 . 1 1 51 51 ALA H H 51 7.731 7.731 7.943 -0.212 17927 6073 1 8 . 1 1 52 52 LEU N N 52 121.506 121.506 119.473 2.033 17927 6074 1 8 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.798 0.190 17927 6075 1 8 . 1 1 52 52 LEU C C 52 177.944 177.944 178.029 -0.085 17927 6076 1 8 . 1 1 52 52 LEU CA C 52 58.327 58.327 57.902 0.425 17927 6077 1 8 . 1 1 52 52 LEU CB C 52 42.382 42.382 41.884 0.498 17927 6078 1 8 . 1 1 52 52 LEU H H 52 8.355 8.355 8.163 0.192 17927 6079 1 8 . 1 1 53 53 LYS N N 53 119.732 119.732 119.205 0.527 17927 6080 1 8 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.840 0.063 17927 6081 1 8 . 1 1 53 53 LYS C C 53 179.030 179.030 178.645 0.385 17927 6082 1 8 . 1 1 53 53 LYS CA C 53 59.846 59.846 60.064 -0.218 17927 6083 1 8 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.940 0.271 17927 6084 1 8 . 1 1 53 53 LYS H H 53 8.148 8.148 7.463 0.685 17927 6085 1 8 . 1 1 54 54 GLU N N 54 117.779 117.779 119.520 -1.741 17927 6086 1 8 . 1 1 54 54 GLU HA H 54 4.059 4.059 3.951 0.108 17927 6087 1 8 . 1 1 54 54 GLU C C 54 179.646 179.646 179.293 0.353 17927 6088 1 8 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.464 0.161 17927 6089 1 8 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.047 0.520 17927 6090 1 8 . 1 1 54 54 GLU H H 54 7.585 7.585 7.723 -0.138 17927 6091 1 8 . 1 1 55 55 LEU N N 55 120.581 120.581 119.825 0.756 17927 6092 1 8 . 1 1 55 55 LEU HA H 55 4.193 4.193 3.770 0.423 17927 6093 1 8 . 1 1 55 55 LEU C C 55 178.557 178.557 178.859 -0.302 17927 6094 1 8 . 1 1 55 55 LEU CA C 55 58.235 58.235 58.111 0.124 17927 6095 1 8 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.169 1.843 17927 6096 1 8 . 1 1 55 55 LEU H H 55 8.096 8.096 8.293 -0.197 17927 6097 1 8 . 1 1 56 56 GLU N N 56 118.023 118.023 118.733 -0.710 17927 6098 1 8 . 1 1 56 56 GLU HA H 56 3.177 3.177 4.395 -1.218 17927 6099 1 8 . 1 1 56 56 GLU C C 56 179.650 179.650 177.979 1.671 17927 6100 1 8 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.343 -0.472 17927 6101 1 8 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.856 -2.871 17927 6102 1 8 . 1 1 56 56 GLU H H 56 8.181 8.181 7.995 0.186 17927 6103 1 8 . 1 1 57 57 GLU N N 57 117.828 117.828 115.777 2.051 17927 6104 1 8 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.149 -0.045 17927 6105 1 8 . 1 1 57 57 GLU C C 57 179.700 179.700 178.017 1.683 17927 6106 1 8 . 1 1 57 57 GLU CA C 57 59.027 59.027 57.565 1.462 17927 6107 1 8 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.711 -0.046 17927 6108 1 8 . 1 1 57 57 GLU H H 57 7.762 7.762 8.367 -0.605 17927 6109 1 8 . 1 1 58 58 LYS N N 58 120.896 120.896 119.120 1.776 17927 6110 1 8 . 1 1 58 58 LYS HA H 58 3.979 3.979 3.926 0.053 17927 6111 1 8 . 1 1 58 58 LYS C C 58 178.715 178.715 178.329 0.386 17927 6112 1 8 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.667 0.411 17927 6113 1 8 . 1 1 58 58 LYS CB C 58 32.980 32.980 32.690 0.290 17927 6114 1 8 . 1 1 58 58 LYS H H 58 8.410 8.410 7.817 0.593 17927 6115 1 8 . 1 1 59 59 TYR N N 59 113.713 113.713 116.587 -2.874 17927 6116 1 8 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.615 -0.303 17927 6117 1 8 . 1 1 59 59 TYR C C 59 175.025 175.025 175.313 -0.288 17927 6118 1 8 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.602 2.371 17927 6119 1 8 . 1 1 59 59 TYR CB C 59 37.434 37.434 37.718 -0.284 17927 6120 1 8 . 1 1 59 59 TYR H H 59 8.102 8.102 8.220 -0.117 17927 6121 1 8 . 1 1 60 60 ALA N N 60 126.637 126.637 123.064 3.573 17927 6122 1 8 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.262 0.156 17927 6123 1 8 . 1 1 60 60 ALA C C 60 179.208 179.208 178.454 0.754 17927 6124 1 8 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.689 0.845 17927 6125 1 8 . 1 1 60 60 ALA CB C 60 18.589 18.589 18.752 -0.163 17927 6126 1 8 . 1 1 60 60 ALA H H 60 7.201 7.201 7.960 -0.759 17927 6127 1 8 . 1 1 61 61 GLY N N 61 111.816 111.816 110.900 0.916 17927 6128 1 8 . 1 1 61 61 GLY C C 61 174.698 174.698 175.082 -0.384 17927 6129 1 8 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.651 0.253 17927 6130 1 8 . 1 1 61 61 GLY H H 61 9.184 9.184 8.858 0.326 17927 6131 1 8 . 1 1 62 62 LYS N N 62 118.497 118.497 120.604 -2.107 17927 6132 1 8 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.620 0.259 17927 6133 1 8 . 1 1 62 62 LYS C C 62 179.019 179.019 176.007 3.012 17927 6134 1 8 . 1 1 62 62 LYS CA C 62 53.988 53.988 54.198 -0.210 17927 6135 1 8 . 1 1 62 62 LYS CB C 62 33.840 33.840 33.069 0.771 17927 6136 1 8 . 1 1 62 62 LYS H H 62 8.019 8.019 7.907 0.112 17927 6137 1 8 . 1 1 63 63 ASP N N 63 122.982 122.982 120.070 2.912 17927 6138 1 8 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.812 -0.285 17927 6139 1 8 . 1 1 63 63 ASP C C 63 174.065 174.065 174.626 -0.561 17927 6140 1 8 . 1 1 63 63 ASP CA C 63 55.055 55.055 53.945 1.110 17927 6141 1 8 . 1 1 63 63 ASP CB C 63 38.582 38.582 40.906 -2.324 17927 6142 1 8 . 1 1 63 63 ASP H H 63 8.709 8.709 8.547 0.162 17927 6143 1 8 . 1 1 64 64 ILE N N 64 122.219 122.219 119.037 3.182 17927 6144 1 8 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.570 0.037 17927 6145 1 8 . 1 1 64 64 ILE C C 64 174.627 174.627 174.563 0.064 17927 6146 1 8 . 1 1 64 64 ILE CA C 64 59.712 59.712 59.503 0.209 17927 6147 1 8 . 1 1 64 64 ILE CB C 64 42.133 42.133 41.601 0.532 17927 6148 1 8 . 1 1 64 64 ILE H H 64 8.678 8.678 7.471 1.207 17927 6149 1 8 . 1 1 65 65 HIS N N 65 125.584 125.584 121.288 4.296 17927 6150 1 8 . 1 1 65 65 HIS HA H 65 5.043 5.043 5.104 -0.061 17927 6151 1 8 . 1 1 65 65 HIS C C 65 174.153 174.153 173.790 0.363 17927 6152 1 8 . 1 1 65 65 HIS CA C 65 54.959 54.959 53.533 1.426 17927 6153 1 8 . 1 1 65 65 HIS CB C 65 34.156 34.156 33.046 1.110 17927 6154 1 8 . 1 1 65 65 HIS H H 65 9.204 9.204 8.925 0.279 17927 6155 1 8 . 1 1 66 66 PHE N N 66 123.244 123.244 121.803 1.441 17927 6156 1 8 . 1 1 66 66 PHE HA H 66 5.210 5.210 5.292 -0.082 17927 6157 1 8 . 1 1 66 66 PHE C C 66 175.463 175.463 174.592 0.871 17927 6158 1 8 . 1 1 66 66 PHE CA C 66 58.088 58.088 57.102 0.986 17927 6159 1 8 . 1 1 66 66 PHE CB C 66 39.637 39.637 39.786 -0.149 17927 6160 1 8 . 1 1 66 66 PHE H H 66 9.262 9.262 10.069 -0.807 17927 6161 1 8 . 1 1 67 67 VAL N N 67 126.201 126.201 125.237 0.964 17927 6162 1 8 . 1 1 67 67 VAL HA H 67 4.834 4.834 5.154 -0.320 17927 6163 1 8 . 1 1 67 67 VAL C C 67 174.364 174.364 176.112 -1.748 17927 6164 1 8 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.360 0.364 17927 6165 1 8 . 1 1 67 67 VAL CB C 67 34.893 34.893 32.680 2.213 17927 6166 1 8 . 1 1 67 67 VAL H H 67 8.843 8.843 9.158 -0.315 17927 6167 1 8 . 1 1 68 68 SER N N 68 124.528 124.528 124.191 0.337 17927 6168 1 8 . 1 1 68 68 SER HA H 68 5.585 5.585 5.445 0.140 17927 6169 1 8 . 1 1 68 68 SER C C 68 172.858 172.858 173.241 -0.383 17927 6170 1 8 . 1 1 68 68 SER CA C 68 57.282 57.282 57.557 -0.275 17927 6171 1 8 . 1 1 68 68 SER CB C 68 65.032 65.032 64.063 0.969 17927 6172 1 8 . 1 1 68 68 SER H H 68 9.243 9.243 8.947 0.296 17927 6173 1 8 . 1 1 69 69 LEU N N 69 126.695 126.695 124.962 1.733 17927 6174 1 8 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.632 -1.115 17927 6175 1 8 . 1 1 69 69 LEU C C 69 174.652 174.652 175.506 -0.854 17927 6176 1 8 . 1 1 69 69 LEU CA C 69 52.827 52.827 54.173 -1.347 17927 6177 1 8 . 1 1 69 69 LEU CB C 69 43.895 43.895 46.356 -2.461 17927 6178 1 8 . 1 1 69 69 LEU H H 69 9.360 9.360 9.019 0.341 17927 6179 1 8 . 1 1 70 70 SER N N 70 116.379 116.379 121.680 -5.301 17927 6180 1 8 . 1 1 70 70 SER HA H 70 4.905 4.905 5.148 -0.243 17927 6181 1 8 . 1 1 70 70 SER C C 70 176.307 176.307 174.974 1.333 17927 6182 1 8 . 1 1 70 70 SER CA C 70 55.213 55.213 55.697 -0.484 17927 6183 1 8 . 1 1 70 70 SER CB C 70 63.519 63.519 64.223 -0.704 17927 6184 1 8 . 1 1 70 70 SER H H 70 7.981 7.981 8.951 -0.970 17927 6185 1 8 . 1 1 71 71 CYS N N 71 124.670 124.670 125.383 -0.713 17927 6186 1 8 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.593 0.365 17927 6187 1 8 . 1 1 71 71 CYS C C 71 173.996 173.996 174.364 -0.368 17927 6188 1 8 . 1 1 71 71 CYS CA C 71 55.483 55.483 56.460 -0.977 17927 6189 1 8 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.125 0.987 17927 6190 1 8 . 1 1 71 71 CYS H H 71 8.609 8.609 8.983 -0.374 17927 6191 1 8 . 1 1 72 72 ASP N N 72 122.398 122.398 124.757 -2.359 17927 6192 1 8 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.745 -0.453 17927 6193 1 8 . 1 1 72 72 ASP C C 72 176.653 176.653 176.411 0.242 17927 6194 1 8 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.669 1.113 17927 6195 1 8 . 1 1 72 72 ASP CB C 72 41.526 41.526 40.624 0.902 17927 6196 1 8 . 1 1 72 72 ASP H H 72 8.557 8.557 7.595 0.962 17927 6197 1 8 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.016 0.049 17927 6198 1 8 . 1 1 73 73 LYS C C 73 176.545 176.545 176.496 0.049 17927 6199 1 8 . 1 1 73 73 LYS CA C 73 58.458 58.458 58.545 -0.087 17927 6200 1 8 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.888 -0.247 17927 6201 1 8 . 1 1 74 74 ASN N N 74 117.616 117.616 117.149 0.467 17927 6202 1 8 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.730 0.175 17927 6203 1 8 . 1 1 74 74 ASN C C 74 174.894 174.894 175.420 -0.526 17927 6204 1 8 . 1 1 74 74 ASN CA C 74 51.521 51.521 53.273 -1.752 17927 6205 1 8 . 1 1 74 74 ASN CB C 74 38.109 38.109 38.803 -0.694 17927 6206 1 8 . 1 1 74 74 ASN H H 74 8.625 8.625 8.127 0.498 17927 6207 1 8 . 1 1 75 75 LYS N N 75 126.797 126.797 127.991 -1.194 17927 6208 1 8 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.804 -0.381 17927 6209 1 8 . 1 1 75 75 LYS C C 75 178.058 178.058 177.998 0.060 17927 6210 1 8 . 1 1 75 75 LYS CA C 75 60.173 60.173 59.324 0.849 17927 6211 1 8 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.685 0.606 17927 6212 1 8 . 1 1 75 75 LYS H H 75 8.588 8.588 8.566 0.022 17927 6213 1 8 . 1 1 76 76 LYS N N 76 117.875 117.875 119.412 -1.537 17927 6214 1 8 . 1 1 76 76 LYS HA H 76 4.200 4.200 3.971 0.229 17927 6215 1 8 . 1 1 76 76 LYS C C 76 178.791 178.791 178.645 0.146 17927 6216 1 8 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.363 -0.755 17927 6217 1 8 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.695 -0.205 17927 6218 1 8 . 1 1 76 76 LYS H H 76 8.041 8.041 8.484 -0.443 17927 6219 1 8 . 1 1 77 77 ALA N N 77 121.567 121.567 120.265 1.302 17927 6220 1 8 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.197 -0.074 17927 6221 1 8 . 1 1 77 77 ALA C C 77 181.191 181.191 179.370 1.821 17927 6222 1 8 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.676 0.281 17927 6223 1 8 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.321 -0.562 17927 6224 1 8 . 1 1 77 77 ALA H H 77 7.366 7.366 8.607 -1.241 17927 6225 1 8 . 1 1 78 78 TRP N N 78 119.497 119.497 120.050 -0.553 17927 6226 1 8 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.290 -0.212 17927 6227 1 8 . 1 1 78 78 TRP C C 78 175.942 175.942 177.056 -1.114 17927 6228 1 8 . 1 1 78 78 TRP CA C 78 61.761 61.761 58.793 2.968 17927 6229 1 8 . 1 1 78 78 TRP CB C 78 27.272 27.272 30.377 -3.105 17927 6230 1 8 . 1 1 78 78 TRP H H 78 7.187 7.187 8.195 -1.008 17927 6231 1 8 . 1 1 79 79 GLU N N 79 118.771 118.771 118.732 0.039 17927 6232 1 8 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.603 -0.589 17927 6233 1 8 . 1 1 79 79 GLU C C 79 179.863 179.863 179.266 0.597 17927 6234 1 8 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.321 -0.211 17927 6235 1 8 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.321 1.899 17927 6236 1 8 . 1 1 79 79 GLU H H 79 8.813 8.813 8.520 0.293 17927 6237 1 8 . 1 1 80 80 ASN N N 80 115.964 115.964 118.303 -2.339 17927 6238 1 8 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.387 -0.048 17927 6239 1 8 . 1 1 80 80 ASN C C 80 176.749 176.749 177.670 -0.921 17927 6240 1 8 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.779 0.256 17927 6241 1 8 . 1 1 80 80 ASN CB C 80 38.489 38.489 37.942 0.547 17927 6242 1 8 . 1 1 80 80 ASN H H 80 8.491 8.491 7.922 0.569 17927 6243 1 8 . 1 1 81 81 MET N N 81 119.670 119.670 120.213 -0.543 17927 6244 1 8 . 1 1 81 81 MET HA H 81 4.149 4.149 4.287 -0.138 17927 6245 1 8 . 1 1 81 81 MET C C 81 177.933 177.933 178.175 -0.242 17927 6246 1 8 . 1 1 81 81 MET CA C 81 60.276 60.276 59.038 1.238 17927 6247 1 8 . 1 1 81 81 MET CB C 81 32.518 32.518 33.063 -0.545 17927 6248 1 8 . 1 1 81 81 MET H H 81 7.667 7.667 7.714 -0.047 17927 6249 1 8 . 1 1 82 82 VAL N N 82 117.634 117.634 118.712 -1.078 17927 6250 1 8 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.601 -0.298 17927 6251 1 8 . 1 1 82 82 VAL C C 82 179.005 179.005 177.487 1.518 17927 6252 1 8 . 1 1 82 82 VAL CA C 82 67.037 67.037 65.837 1.200 17927 6253 1 8 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.030 0.735 17927 6254 1 8 . 1 1 82 82 VAL H H 82 8.338 8.338 8.119 0.219 17927 6255 1 8 . 1 1 83 83 THR N N 83 110.519 110.519 115.276 -4.757 17927 6256 1 8 . 1 1 83 83 THR HA H 83 3.983 3.983 4.035 -0.052 17927 6257 1 8 . 1 1 83 83 THR C C 83 177.591 177.591 176.219 1.372 17927 6258 1 8 . 1 1 83 83 THR CA C 83 65.431 65.431 66.270 -0.839 17927 6259 1 8 . 1 1 83 83 THR CB C 83 69.156 69.156 68.654 0.502 17927 6260 1 8 . 1 1 83 83 THR H H 83 7.659 7.659 7.555 0.104 17927 6261 1 8 . 1 1 84 84 LYS N N 84 123.927 123.927 121.433 2.494 17927 6262 1 8 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.145 -0.076 17927 6263 1 8 . 1 1 84 84 LYS C C 84 178.582 178.582 177.825 0.757 17927 6264 1 8 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.588 1.289 17927 6265 1 8 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.760 -0.437 17927 6266 1 8 . 1 1 84 84 LYS H H 84 8.665 8.665 7.768 0.897 17927 6267 1 8 . 1 1 85 85 ASP N N 85 116.280 116.280 117.831 -1.551 17927 6268 1 8 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.628 0.122 17927 6269 1 8 . 1 1 85 85 ASP C C 85 175.086 175.086 175.357 -0.271 17927 6270 1 8 . 1 1 85 85 ASP CA C 85 54.693 54.693 54.525 0.168 17927 6271 1 8 . 1 1 85 85 ASP CB C 85 39.685 39.685 41.030 -1.345 17927 6272 1 8 . 1 1 85 85 ASP H H 85 8.179 8.179 8.159 0.020 17927 6273 1 8 . 1 1 86 86 GLN N N 86 116.258 116.258 112.703 3.555 17927 6274 1 8 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.875 0.033 17927 6275 1 8 . 1 1 86 86 GLN C C 86 175.659 175.659 174.959 0.700 17927 6276 1 8 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.653 -0.482 17927 6277 1 8 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.242 0.048 17927 6278 1 8 . 1 1 86 86 GLN H H 86 7.431 7.431 8.243 -0.812 17927 6279 1 8 . 1 1 87 87 LEU N N 87 117.031 117.031 119.962 -2.931 17927 6280 1 8 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.235 -0.145 17927 6281 1 8 . 1 1 87 87 LEU C C 87 178.225 178.225 176.600 1.625 17927 6282 1 8 . 1 1 87 87 LEU CA C 87 55.932 55.932 55.544 0.388 17927 6283 1 8 . 1 1 87 87 LEU CB C 87 41.202 41.202 40.221 0.981 17927 6284 1 8 . 1 1 87 87 LEU H H 87 7.736 7.736 7.574 0.162 17927 6285 1 8 . 1 1 88 88 LYS N N 88 122.367 122.367 122.000 0.367 17927 6286 1 8 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.992 -0.356 17927 6287 1 8 . 1 1 88 88 LYS C C 88 177.538 177.538 176.630 0.908 17927 6288 1 8 . 1 1 88 88 LYS CA C 88 54.930 54.930 53.683 1.247 17927 6289 1 8 . 1 1 88 88 LYS CB C 88 33.316 33.316 34.674 -1.358 17927 6290 1 8 . 1 1 88 88 LYS H H 88 8.496 8.496 7.781 0.715 17927 6291 1 8 . 1 1 89 89 GLY N N 89 108.452 108.452 104.539 3.913 17927 6292 1 8 . 1 1 89 89 GLY C C 89 173.781 173.781 173.140 0.641 17927 6293 1 8 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.335 1.023 17927 6294 1 8 . 1 1 89 89 GLY H H 89 8.497 8.497 8.098 0.399 17927 6295 1 8 . 1 1 90 90 ILE N N 90 123.295 123.295 122.975 0.320 17927 6296 1 8 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.043 0.328 17927 6297 1 8 . 1 1 90 90 ILE C C 90 175.606 175.606 174.248 1.358 17927 6298 1 8 . 1 1 90 90 ILE CA C 90 62.001 62.001 61.653 0.348 17927 6299 1 8 . 1 1 90 90 ILE CB C 90 38.036 38.036 37.510 0.526 17927 6300 1 8 . 1 1 90 90 ILE H H 90 8.728 8.728 7.920 0.808 17927 6301 1 8 . 1 1 91 91 GLN N N 91 128.632 128.632 126.087 2.545 17927 6302 1 8 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.701 0.065 17927 6303 1 8 . 1 1 91 91 GLN C C 91 174.618 174.618 173.926 0.692 17927 6304 1 8 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.592 1.258 17927 6305 1 8 . 1 1 91 91 GLN CB C 91 28.341 28.341 29.902 -1.561 17927 6306 1 8 . 1 1 91 91 GLN H H 91 8.762 8.762 8.158 0.604 17927 6307 1 8 . 1 1 92 92 LEU N N 92 120.830 120.830 124.797 -3.967 17927 6308 1 8 . 1 1 92 92 LEU HA H 92 5.580 5.580 4.897 0.683 17927 6309 1 8 . 1 1 92 92 LEU C C 92 176.828 176.828 175.915 0.913 17927 6310 1 8 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.957 -1.156 17927 6311 1 8 . 1 1 92 92 LEU CB C 92 44.210 44.210 44.214 -0.004 17927 6312 1 8 . 1 1 92 92 LEU H H 92 9.011 9.011 9.128 -0.117 17927 6313 1 8 . 1 1 93 93 HIS N N 93 121.481 121.481 123.642 -2.161 17927 6314 1 8 . 1 1 93 93 HIS HA H 93 3.931 3.931 4.908 -0.977 17927 6315 1 8 . 1 1 93 93 HIS C C 93 173.590 173.590 173.798 -0.208 17927 6316 1 8 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.656 0.928 17927 6317 1 8 . 1 1 93 93 HIS CB C 93 32.250 32.250 32.571 -0.320 17927 6318 1 8 . 1 1 93 93 HIS H H 93 8.038 8.038 9.039 -1.001 17927 6319 1 8 . 1 1 94 94 MET N N 94 121.881 121.881 127.195 -5.314 17927 6320 1 8 . 1 1 94 94 MET HA H 94 3.866 3.866 4.187 -0.321 17927 6321 1 8 . 1 1 94 94 MET C C 94 177.035 177.035 176.338 0.697 17927 6322 1 8 . 1 1 94 94 MET CA C 94 55.189 55.189 57.798 -2.609 17927 6323 1 8 . 1 1 94 94 MET CB C 94 33.993 33.993 33.774 0.219 17927 6324 1 8 . 1 1 94 94 MET H H 94 8.039 8.039 8.533 -0.494 17927 6325 1 8 . 1 1 95 95 GLY N N 95 104.041 104.041 106.054 -2.013 17927 6326 1 8 . 1 1 95 95 GLY C C 95 174.251 174.251 175.428 -1.177 17927 6327 1 8 . 1 1 95 95 GLY CA C 95 46.580 46.580 46.995 -0.415 17927 6328 1 8 . 1 1 95 95 GLY H H 95 5.666 5.666 8.093 -2.427 17927 6329 1 8 . 1 1 96 96 THR N N 96 114.114 114.114 117.551 -3.437 17927 6330 1 8 . 1 1 96 96 THR HA H 96 4.211 4.211 4.257 -0.046 17927 6331 1 8 . 1 1 96 96 THR C C 96 175.122 175.122 175.414 -0.292 17927 6332 1 8 . 1 1 96 96 THR CA C 96 61.339 61.339 63.891 -2.552 17927 6333 1 8 . 1 1 96 96 THR CB C 96 68.615 68.615 69.321 -0.706 17927 6334 1 8 . 1 1 96 96 THR H H 96 8.517 8.517 8.139 0.378 17927 6335 1 8 . 1 1 97 97 ASP N N 97 121.892 121.892 124.257 -2.365 17927 6336 1 8 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.953 -0.368 17927 6337 1 8 . 1 1 97 97 ASP C C 97 178.241 178.241 175.602 2.639 17927 6338 1 8 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.135 1.665 17927 6339 1 8 . 1 1 97 97 ASP CB C 97 43.129 43.129 39.540 3.589 17927 6340 1 8 . 1 1 97 97 ASP H H 97 7.563 7.563 7.837 -0.274 17927 6341 1 8 . 1 1 98 98 ARG N N 98 127.508 127.508 119.636 7.872 17927 6342 1 8 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.323 0.069 17927 6343 1 8 . 1 1 98 98 ARG C C 98 176.724 176.724 176.948 -0.224 17927 6344 1 8 . 1 1 98 98 ARG CA C 98 55.939 55.939 57.304 -1.365 17927 6345 1 8 . 1 1 98 98 ARG CB C 98 30.291 30.291 29.332 0.959 17927 6346 1 8 . 1 1 98 98 ARG H H 98 9.225 9.225 7.761 1.464 17927 6347 1 8 . 1 1 99 99 THR N N 99 116.384 116.384 116.022 0.362 17927 6348 1 8 . 1 1 99 99 THR HA H 99 3.987 3.987 4.167 -0.180 17927 6349 1 8 . 1 1 99 99 THR C C 99 176.969 176.969 175.189 1.780 17927 6350 1 8 . 1 1 99 99 THR CA C 99 67.714 67.714 66.790 0.924 17927 6351 1 8 . 1 1 99 99 THR CB C 99 68.777 68.777 68.213 0.564 17927 6352 1 8 . 1 1 99 99 THR H H 99 8.382 8.382 8.018 0.364 17927 6353 1 8 . 1 1 100 100 PHE N N 100 123.232 123.232 122.995 0.237 17927 6354 1 8 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.356 -0.183 17927 6355 1 8 . 1 1 100 100 PHE C C 100 177.010 177.010 176.237 0.773 17927 6356 1 8 . 1 1 100 100 PHE CA C 100 61.923 61.923 62.261 -0.338 17927 6357 1 8 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.450 1.312 17927 6358 1 8 . 1 1 100 100 PHE H H 100 7.998 7.998 7.710 0.288 17927 6359 1 8 . 1 1 101 101 MET N N 101 115.968 115.968 116.791 -0.823 17927 6360 1 8 . 1 1 101 101 MET HA H 101 3.975 3.975 4.202 -0.227 17927 6361 1 8 . 1 1 101 101 MET C C 101 178.763 178.763 177.776 0.987 17927 6362 1 8 . 1 1 101 101 MET CA C 101 58.552 58.552 57.671 0.881 17927 6363 1 8 . 1 1 101 101 MET CB C 101 32.593 32.593 31.670 0.923 17927 6364 1 8 . 1 1 101 101 MET H H 101 7.828 7.828 7.938 -0.110 17927 6365 1 8 . 1 1 102 102 ASP N N 102 117.553 117.553 121.048 -3.495 17927 6366 1 8 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.335 0.187 17927 6367 1 8 . 1 1 102 102 ASP C C 102 179.503 179.503 178.475 1.028 17927 6368 1 8 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.714 -0.824 17927 6369 1 8 . 1 1 102 102 ASP CB C 102 39.926 39.926 41.284 -1.358 17927 6370 1 8 . 1 1 102 102 ASP H H 102 8.828 8.828 7.807 1.021 17927 6371 1 8 . 1 1 103 103 ALA N N 103 122.984 122.984 122.026 0.958 17927 6372 1 8 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.033 -0.047 17927 6373 1 8 . 1 1 103 103 ALA C C 103 178.782 178.782 178.580 0.202 17927 6374 1 8 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.294 0.800 17927 6375 1 8 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.425 0.138 17927 6376 1 8 . 1 1 103 103 ALA H H 103 7.567 7.567 7.857 -0.290 17927 6377 1 8 . 1 1 104 104 TYR N N 104 112.159 112.159 114.294 -2.135 17927 6378 1 8 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.547 -0.323 17927 6379 1 8 . 1 1 104 104 TYR C C 104 173.821 173.821 174.755 -0.934 17927 6380 1 8 . 1 1 104 104 TYR CA C 104 58.498 58.498 57.875 0.623 17927 6381 1 8 . 1 1 104 104 TYR CB C 104 38.393 38.393 39.243 -0.850 17927 6382 1 8 . 1 1 104 104 TYR H H 104 7.203 7.203 7.405 -0.202 17927 6383 1 8 . 1 1 105 105 LEU N N 105 119.433 119.433 118.837 0.596 17927 6384 1 8 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.915 0.070 17927 6385 1 8 . 1 1 105 105 LEU C C 105 176.721 176.721 175.884 0.837 17927 6386 1 8 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.850 -0.065 17927 6387 1 8 . 1 1 105 105 LEU CB C 105 38.443 38.443 40.917 -2.474 17927 6388 1 8 . 1 1 105 105 LEU H H 105 7.582 7.582 7.644 -0.062 17927 6389 1 8 . 1 1 106 106 ILE N N 106 119.575 119.575 120.172 -0.597 17927 6390 1 8 . 1 1 106 106 ILE HA H 106 4.002 4.002 3.810 0.192 17927 6391 1 8 . 1 1 106 106 ILE C C 106 175.459 175.459 175.032 0.427 17927 6392 1 8 . 1 1 106 106 ILE CA C 106 62.043 62.043 62.599 -0.556 17927 6393 1 8 . 1 1 106 106 ILE CB C 106 36.335 36.335 36.220 0.115 17927 6394 1 8 . 1 1 106 106 ILE H H 106 8.774 8.774 7.889 0.885 17927 6395 1 8 . 1 1 107 107 ASN N N 107 126.514 126.514 125.850 0.664 17927 6396 1 8 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.844 0.019 17927 6397 1 8 . 1 1 107 107 ASN C C 107 174.584 174.584 174.740 -0.156 17927 6398 1 8 . 1 1 107 107 ASN CA C 107 53.112 53.112 52.358 0.754 17927 6399 1 8 . 1 1 107 107 ASN CB C 107 38.977 38.977 40.437 -1.460 17927 6400 1 8 . 1 1 107 107 ASN H H 107 8.364 8.364 7.885 0.479 17927 6401 1 8 . 1 1 108 108 GLY N N 108 108.469 108.469 108.472 -0.003 17927 6402 1 8 . 1 1 108 108 GLY C C 108 171.245 171.245 173.695 -2.450 17927 6403 1 8 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.890 0.379 17927 6404 1 8 . 1 1 108 108 GLY H H 108 7.678 7.678 8.561 -0.883 17927 6405 1 8 . 1 1 109 109 ILE N N 109 112.817 112.817 123.184 -10.367 17927 6406 1 8 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.080 0.326 17927 6407 1 8 . 1 1 109 109 ILE C C 109 173.498 173.498 174.368 -0.870 17927 6408 1 8 . 1 1 109 109 ILE CA C 109 58.384 58.384 59.607 -1.223 17927 6409 1 8 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.279 2.043 17927 6410 1 8 . 1 1 109 109 ILE H H 109 7.868 7.868 8.027 -0.159 17927 6411 1 8 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.665 0.077 17927 6412 1 8 . 1 1 110 110 PRO C C 110 175.715 175.715 175.381 0.334 17927 6413 1 8 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.006 0.271 17927 6414 1 8 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.653 3.715 17927 6415 1 8 . 1 1 111 111 ARG N N 111 122.358 122.358 121.838 0.520 17927 6416 1 8 . 1 1 111 111 ARG HA H 111 4.469 4.469 4.036 0.433 17927 6417 1 8 . 1 1 111 111 ARG C C 111 171.541 171.541 175.161 -3.620 17927 6418 1 8 . 1 1 111 111 ARG CA C 111 54.356 54.356 55.020 -0.664 17927 6419 1 8 . 1 1 111 111 ARG CB C 111 33.430 33.430 31.347 2.083 17927 6420 1 8 . 1 1 111 111 ARG H H 111 7.732 7.732 8.465 -0.733 17927 6421 1 8 . 1 1 112 112 PHE N N 112 125.103 125.103 119.407 5.696 17927 6422 1 8 . 1 1 112 112 PHE HA H 112 5.773 5.773 5.408 0.365 17927 6423 1 8 . 1 1 112 112 PHE C C 112 175.097 175.097 174.116 0.981 17927 6424 1 8 . 1 1 112 112 PHE CA C 112 55.791 55.791 55.471 0.320 17927 6425 1 8 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.861 1.067 17927 6426 1 8 . 1 1 112 112 PHE H H 112 8.929 8.929 7.428 1.501 17927 6427 1 8 . 1 1 113 113 ILE N N 113 123.778 123.778 121.731 2.047 17927 6428 1 8 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.757 -0.214 17927 6429 1 8 . 1 1 113 113 ILE C C 113 173.197 173.197 173.795 -0.598 17927 6430 1 8 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.574 0.712 17927 6431 1 8 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.610 1.636 17927 6432 1 8 . 1 1 113 113 ILE H H 113 8.873 8.873 8.858 0.015 17927 6433 1 8 . 1 1 114 114 LEU N N 114 127.146 127.146 125.903 1.243 17927 6434 1 8 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.233 0.781 17927 6435 1 8 . 1 1 114 114 LEU C C 114 175.080 175.080 174.487 0.593 17927 6436 1 8 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.463 -0.062 17927 6437 1 8 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.419 0.951 17927 6438 1 8 . 1 1 114 114 LEU H H 114 8.974 8.974 8.843 0.131 17927 6439 1 8 . 1 1 115 115 LEU N N 115 128.323 128.323 124.733 3.590 17927 6440 1 8 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.074 0.358 17927 6441 1 8 . 1 1 115 115 LEU C C 115 176.660 176.660 175.653 1.007 17927 6442 1 8 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.706 -0.629 17927 6443 1 8 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.411 -1.827 17927 6444 1 8 . 1 1 115 115 LEU H H 115 9.874 9.874 9.144 0.730 17927 6445 1 8 . 1 1 116 116 ASP N N 116 119.834 119.834 121.914 -2.080 17927 6446 1 8 . 1 1 116 116 ASP HA H 116 4.935 4.935 4.965 -0.030 17927 6447 1 8 . 1 1 116 116 ASP C C 116 176.898 176.898 177.536 -0.638 17927 6448 1 8 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.815 -1.510 17927 6449 1 8 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.598 -1.570 17927 6450 1 8 . 1 1 116 116 ASP H H 116 9.357 9.357 8.848 0.509 17927 6451 1 8 . 1 1 117 117 ARG N N 117 113.356 113.356 122.246 -8.890 17927 6452 1 8 . 1 1 117 117 ARG HA H 117 3.717 3.717 3.892 -0.175 17927 6453 1 8 . 1 1 117 117 ARG C C 117 177.105 177.105 178.096 -0.991 17927 6454 1 8 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.487 -1.302 17927 6455 1 8 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.755 0.682 17927 6456 1 8 . 1 1 117 117 ARG H H 117 7.697 7.697 8.332 -0.635 17927 6457 1 8 . 1 1 118 118 ASP N N 118 117.226 117.226 117.235 -0.009 17927 6458 1 8 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.459 0.436 17927 6459 1 8 . 1 1 118 118 ASP C C 118 176.657 176.657 176.604 0.053 17927 6460 1 8 . 1 1 118 118 ASP CA C 118 53.517 53.517 55.119 -1.602 17927 6461 1 8 . 1 1 118 118 ASP CB C 118 42.556 42.556 41.300 1.256 17927 6462 1 8 . 1 1 118 118 ASP H H 118 8.456 8.456 7.860 0.596 17927 6463 1 8 . 1 1 119 119 GLY N N 119 109.074 109.074 105.984 3.090 17927 6464 1 8 . 1 1 119 119 GLY C C 119 173.355 173.355 173.879 -0.524 17927 6465 1 8 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.072 1.184 17927 6466 1 8 . 1 1 119 119 GLY H H 119 8.183 8.183 8.335 -0.152 17927 6467 1 8 . 1 1 120 120 LYS N N 120 120.744 120.744 121.453 -0.709 17927 6468 1 8 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.671 -0.138 17927 6469 1 8 . 1 1 120 120 LYS C C 120 177.229 177.229 176.132 1.097 17927 6470 1 8 . 1 1 120 120 LYS CA C 120 55.287 55.287 54.649 0.638 17927 6471 1 8 . 1 1 120 120 LYS CB C 120 32.581 32.581 33.274 -0.693 17927 6472 1 8 . 1 1 120 120 LYS H H 120 8.449 8.449 7.523 0.926 17927 6473 1 8 . 1 1 121 121 ILE N N 121 121.221 121.221 127.498 -6.277 17927 6474 1 8 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.967 -0.081 17927 6475 1 8 . 1 1 121 121 ILE C C 121 177.819 177.819 176.830 0.989 17927 6476 1 8 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.468 0.447 17927 6477 1 8 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.208 2.182 17927 6478 1 8 . 1 1 121 121 ILE H H 121 8.715 8.715 9.014 -0.299 17927 6479 1 8 . 1 1 122 122 ILE N N 122 127.165 127.165 128.398 -1.233 17927 6480 1 8 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.149 0.192 17927 6481 1 8 . 1 1 122 122 ILE C C 122 176.978 176.978 176.576 0.402 17927 6482 1 8 . 1 1 122 122 ILE CA C 122 63.719 63.719 62.922 0.797 17927 6483 1 8 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.711 -0.059 17927 6484 1 8 . 1 1 122 122 ILE H H 122 8.974 8.974 8.642 0.332 17927 6485 1 8 . 1 1 123 123 SER N N 123 111.227 111.227 114.371 -3.144 17927 6486 1 8 . 1 1 123 123 SER HA H 123 4.738 4.738 4.741 -0.003 17927 6487 1 8 . 1 1 123 123 SER C C 123 174.184 174.184 173.790 0.394 17927 6488 1 8 . 1 1 123 123 SER CA C 123 57.383 57.383 57.052 0.331 17927 6489 1 8 . 1 1 123 123 SER CB C 123 65.326 65.326 65.600 -0.275 17927 6490 1 8 . 1 1 123 123 SER H H 123 7.850 7.850 8.164 -0.314 17927 6491 1 8 . 1 1 124 124 ALA N N 124 131.373 131.373 126.482 4.891 17927 6492 1 8 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.244 0.241 17927 6493 1 8 . 1 1 124 124 ALA C C 124 175.147 175.147 175.672 -0.525 17927 6494 1 8 . 1 1 124 124 ALA CA C 124 53.035 53.035 53.894 -0.859 17927 6495 1 8 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.018 -0.356 17927 6496 1 8 . 1 1 124 124 ALA H H 124 9.384 9.384 8.840 0.544 17927 6497 1 8 . 1 1 125 125 ASN N N 125 119.476 119.476 111.546 7.930 17927 6498 1 8 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.876 -0.820 17927 6499 1 8 . 1 1 125 125 ASN C C 125 173.593 173.593 174.134 -0.541 17927 6500 1 8 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.276 0.076 17927 6501 1 8 . 1 1 125 125 ASN CB C 125 38.304 38.304 41.100 -2.796 17927 6502 1 8 . 1 1 125 125 ASN H H 125 8.191 8.191 7.765 0.426 17927 6503 1 8 . 1 1 126 126 MET N N 126 122.705 122.705 122.265 0.440 17927 6504 1 8 . 1 1 126 126 MET HA H 126 4.585 4.585 4.936 -0.351 17927 6505 1 8 . 1 1 126 126 MET C C 126 175.215 175.215 175.749 -0.534 17927 6506 1 8 . 1 1 126 126 MET CA C 126 53.849 53.849 56.349 -2.500 17927 6507 1 8 . 1 1 126 126 MET CB C 126 31.312 31.312 35.255 -3.943 17927 6508 1 8 . 1 1 126 126 MET H H 126 8.376 8.376 9.238 -0.862 17927 6509 1 8 . 1 1 127 127 THR N N 127 111.016 111.016 109.693 1.323 17927 6510 1 8 . 1 1 127 127 THR HA H 127 4.291 4.291 4.180 0.111 17927 6511 1 8 . 1 1 127 127 THR C C 127 174.574 174.574 173.454 1.120 17927 6512 1 8 . 1 1 127 127 THR CA C 127 62.085 62.085 61.460 0.625 17927 6513 1 8 . 1 1 127 127 THR CB C 127 69.733 69.733 70.700 -0.966 17927 6514 1 8 . 1 1 127 127 THR H H 127 7.714 7.714 7.946 -0.232 17927 6515 1 8 . 1 1 128 128 ARG N N 128 118.722 118.722 121.318 -2.596 17927 6516 1 8 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.670 -1.362 17927 6517 1 8 . 1 1 128 128 ARG C C 128 176.978 176.978 174.725 2.253 17927 6518 1 8 . 1 1 128 128 ARG CA C 128 54.727 54.727 54.663 0.064 17927 6519 1 8 . 1 1 128 128 ARG CB C 128 29.598 29.598 32.532 -2.934 17927 6520 1 8 . 1 1 128 128 ARG H H 128 8.658 8.658 7.665 0.993 17927 6521 1 8 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.749 -0.816 17927 6522 1 8 . 1 1 129 129 PRO C C 129 175.794 175.794 177.275 -1.481 17927 6523 1 8 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.896 0.653 17927 6524 1 8 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.988 -0.311 17927 6525 1 8 . 1 1 130 130 SER N N 130 108.696 108.696 112.086 -3.390 17927 6526 1 8 . 1 1 130 130 SER HA H 130 3.988 3.988 4.536 -0.548 17927 6527 1 8 . 1 1 130 130 SER C C 130 174.445 174.445 174.181 0.264 17927 6528 1 8 . 1 1 130 130 SER CA C 130 58.911 58.911 56.894 2.017 17927 6529 1 8 . 1 1 130 130 SER CB C 130 62.680 62.680 63.182 -0.502 17927 6530 1 8 . 1 1 130 130 SER H H 130 8.375 8.375 8.733 -0.358 17927 6531 1 8 . 1 1 131 131 ASP N N 131 126.377 126.377 124.730 1.647 17927 6532 1 8 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.865 0.007 17927 6533 1 8 . 1 1 131 131 ASP C C 131 176.879 176.879 175.621 1.258 17927 6534 1 8 . 1 1 131 131 ASP CA C 131 51.195 51.195 52.739 -1.544 17927 6535 1 8 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.211 0.605 17927 6536 1 8 . 1 1 131 131 ASP H H 131 7.514 7.514 8.037 -0.523 17927 6537 1 8 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.119 0.273 17927 6538 1 8 . 1 1 132 132 PRO C C 132 178.097 178.097 178.217 -0.120 17927 6539 1 8 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.863 0.216 17927 6540 1 8 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.108 0.301 17927 6541 1 8 . 1 1 133 133 LYS N N 133 116.306 116.306 117.382 -1.076 17927 6542 1 8 . 1 1 133 133 LYS HA H 133 3.958 3.958 3.868 0.090 17927 6543 1 8 . 1 1 133 133 LYS C C 133 179.532 179.532 178.992 0.540 17927 6544 1 8 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.812 -1.291 17927 6545 1 8 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.984 0.207 17927 6546 1 8 . 1 1 133 133 LYS H H 133 8.842 8.842 8.627 0.215 17927 6547 1 8 . 1 1 134 134 THR N N 134 120.833 120.833 114.584 6.249 17927 6548 1 8 . 1 1 134 134 THR HA H 134 3.147 3.147 3.632 -0.485 17927 6549 1 8 . 1 1 134 134 THR C C 134 173.356 173.356 175.443 -2.087 17927 6550 1 8 . 1 1 134 134 THR CA C 134 66.383 66.383 65.433 0.950 17927 6551 1 8 . 1 1 134 134 THR CB C 134 66.847 66.847 68.047 -1.200 17927 6552 1 8 . 1 1 134 134 THR H H 134 8.292 8.292 7.432 0.860 17927 6553 1 8 . 1 1 135 135 ALA N N 135 121.720 121.720 123.748 -2.028 17927 6554 1 8 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.870 -0.287 17927 6555 1 8 . 1 1 135 135 ALA C C 135 178.902 178.902 180.309 -1.407 17927 6556 1 8 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.872 0.127 17927 6557 1 8 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.161 -0.386 17927 6558 1 8 . 1 1 135 135 ALA H H 135 7.030 7.030 7.368 -0.338 17927 6559 1 8 . 1 1 136 136 GLU N N 136 114.623 114.623 117.552 -2.929 17927 6560 1 8 . 1 1 136 136 GLU HA H 136 3.922 3.922 4.278 -0.356 17927 6561 1 8 . 1 1 136 136 GLU C C 136 179.199 179.199 178.544 0.655 17927 6562 1 8 . 1 1 136 136 GLU CA C 136 59.837 59.837 57.515 2.322 17927 6563 1 8 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.058 0.728 17927 6564 1 8 . 1 1 136 136 GLU H H 136 7.216 7.216 8.088 -0.872 17927 6565 1 8 . 1 1 137 137 LYS N N 137 120.789 120.789 121.707 -0.918 17927 6566 1 8 . 1 1 137 137 LYS HA H 137 4.204 4.204 4.117 0.087 17927 6567 1 8 . 1 1 137 137 LYS C C 137 178.834 178.834 178.714 0.120 17927 6568 1 8 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.205 -0.862 17927 6569 1 8 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.743 -1.280 17927 6570 1 8 . 1 1 137 137 LYS H H 137 7.681 7.681 7.451 0.230 17927 6571 1 8 . 1 1 138 138 PHE N N 138 118.373 118.373 117.983 0.390 17927 6572 1 8 . 1 1 138 138 PHE HA H 138 4.033 4.033 3.960 0.073 17927 6573 1 8 . 1 1 138 138 PHE C C 138 178.027 178.027 177.907 0.120 17927 6574 1 8 . 1 1 138 138 PHE CA C 138 57.507 57.507 59.921 -2.414 17927 6575 1 8 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.199 -1.310 17927 6576 1 8 . 1 1 138 138 PHE H H 138 8.059 8.059 7.933 0.126 17927 6577 1 8 . 1 1 139 139 ASN N N 139 117.611 117.611 117.637 -0.026 17927 6578 1 8 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.426 -0.022 17927 6579 1 8 . 1 1 139 139 ASN C C 139 178.190 178.190 177.931 0.259 17927 6580 1 8 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.393 -0.169 17927 6581 1 8 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.770 -1.036 17927 6582 1 8 . 1 1 139 139 ASN H H 139 8.683 8.683 7.832 0.851 17927 6583 1 8 . 1 1 140 140 GLU N N 140 121.432 121.432 121.163 0.269 17927 6584 1 8 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.005 -0.000 17927 6585 1 8 . 1 1 140 140 GLU C C 140 179.751 179.751 179.157 0.594 17927 6586 1 8 . 1 1 140 140 GLU CA C 140 59.310 59.310 58.955 0.356 17927 6587 1 8 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.493 0.562 17927 6588 1 8 . 1 1 140 140 GLU H H 140 7.868 7.868 7.590 0.279 17927 6589 1 8 . 1 1 141 141 LEU N N 141 119.968 119.968 118.534 1.434 17927 6590 1 8 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.022 -0.006 17927 6591 1 8 . 1 1 141 141 LEU C C 141 179.293 179.293 178.524 0.769 17927 6592 1 8 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.010 0.427 17927 6593 1 8 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.926 -0.743 17927 6594 1 8 . 1 1 141 141 LEU H H 141 8.303 8.303 8.101 0.202 17927 6595 1 8 . 1 1 142 142 LEU N N 142 115.040 115.040 116.374 -1.334 17927 6596 1 8 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.416 -0.032 17927 6597 1 8 . 1 1 142 142 LEU C C 142 178.002 178.002 177.557 0.445 17927 6598 1 8 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.029 0.250 17927 6599 1 8 . 1 1 142 142 LEU CB C 142 42.646 42.646 43.120 -0.474 17927 6600 1 8 . 1 1 142 142 LEU H H 142 8.230 8.230 7.669 0.561 17927 6601 1 8 . 1 1 143 143 GLY N N 143 108.977 108.977 106.530 2.447 17927 6602 1 8 . 1 1 143 143 GLY C C 143 175.216 175.216 174.151 1.065 17927 6603 1 8 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.267 1.474 17927 6604 1 8 . 1 1 143 143 GLY H H 143 7.762 7.762 7.673 0.089 17927 6605 1 8 . 1 1 144 144 LEU N N 144 119.660 119.660 119.069 0.591 17927 6606 1 8 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.548 -0.060 17927 6607 1 8 . 1 1 144 144 LEU C C 144 177.375 177.375 176.437 0.938 17927 6608 1 8 . 1 1 144 144 LEU CA C 144 54.525 54.525 55.508 -0.983 17927 6609 1 8 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.841 -0.068 17927 6610 1 8 . 1 1 144 144 LEU H H 144 8.241 8.241 8.192 0.049 17927 6611 1 8 . 1 1 145 145 GLU N N 145 119.959 119.959 119.835 0.124 17927 6612 1 8 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.014 0.227 17927 6613 1 8 . 1 1 145 145 GLU C C 145 177.075 177.075 176.513 0.562 17927 6614 1 8 . 1 1 145 145 GLU CA C 145 56.799 56.799 56.330 0.469 17927 6615 1 8 . 1 1 145 145 GLU CB C 145 30.168 30.168 28.958 1.210 17927 6616 1 8 . 1 1 145 145 GLU H H 145 8.410 8.410 7.643 0.767 17927 6617 1 8 . 1 1 146 146 GLY N N 146 109.412 109.412 114.476 -5.064 17927 6618 1 8 . 1 1 146 146 GLY C C 146 174.276 174.276 173.412 0.864 17927 6619 1 8 . 1 1 146 146 GLY CA C 146 45.445 45.445 44.042 1.403 17927 6620 1 8 . 1 1 146 146 GLY H H 146 8.422 8.422 8.574 -0.152 17927 6621 1 8 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.509 0.147 17927 6622 1 8 . 1 1 151 151 HIS C C 151 173.990 173.990 175.009 -1.019 17927 6623 1 8 . 1 1 151 151 HIS CA C 151 56.044 56.044 56.616 -0.572 17927 6624 1 8 . 1 1 151 151 HIS CB C 151 30.076 30.076 30.424 -0.348 17927 6625 1 9 . 1 1 2 2 SER HA H 2 4.121 4.121 5.242 -1.121 17927 6626 1 9 . 1 1 2 2 SER CA C 2 57.293 57.293 57.658 -0.365 17927 6627 1 9 . 1 1 2 2 SER CB C 2 63.545 63.545 63.925 -0.380 17927 6628 1 9 . 1 1 3 3 LEU HA H 3 4.432 4.432 5.002 -0.570 17927 6629 1 9 . 1 1 3 3 LEU C C 3 177.383 177.383 177.224 0.159 17927 6630 1 9 . 1 1 3 3 LEU CA C 3 55.575 55.575 53.670 1.905 17927 6631 1 9 . 1 1 3 3 LEU CB C 3 42.584 42.584 43.876 -1.292 17927 6632 1 9 . 1 1 4 4 ARG N N 4 122.080 122.080 120.049 2.031 17927 6633 1 9 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.467 -0.083 17927 6634 1 9 . 1 1 4 4 ARG C C 4 176.410 176.410 175.505 0.905 17927 6635 1 9 . 1 1 4 4 ARG CA C 4 56.269 56.269 57.077 -0.808 17927 6636 1 9 . 1 1 4 4 ARG CB C 4 30.842 30.842 30.197 0.645 17927 6637 1 9 . 1 1 4 4 ARG H H 4 8.410 8.410 8.691 -0.281 17927 6638 1 9 . 1 1 5 5 SER N N 5 117.023 117.023 112.218 4.805 17927 6639 1 9 . 1 1 5 5 SER HA H 5 4.423 4.423 4.640 -0.217 17927 6640 1 9 . 1 1 5 5 SER C C 5 175.039 175.039 173.723 1.316 17927 6641 1 9 . 1 1 5 5 SER CA C 5 58.605 58.605 58.213 0.392 17927 6642 1 9 . 1 1 5 5 SER CB C 5 64.044 64.044 63.384 0.660 17927 6643 1 9 . 1 1 5 5 SER H H 5 8.292 8.292 7.811 0.481 17927 6644 1 9 . 1 1 6 6 GLY N N 6 110.718 110.718 110.539 0.179 17927 6645 1 9 . 1 1 6 6 GLY C C 6 173.654 173.654 172.535 1.119 17927 6646 1 9 . 1 1 6 6 GLY CA C 6 45.273 45.273 45.239 0.034 17927 6647 1 9 . 1 1 6 6 GLY H H 6 8.446 8.446 7.426 1.020 17927 6648 1 9 . 1 1 7 7 ASN N N 7 119.287 119.287 120.175 -0.888 17927 6649 1 9 . 1 1 7 7 ASN HA H 7 5.024 5.024 5.195 -0.171 17927 6650 1 9 . 1 1 7 7 ASN C C 7 173.672 173.672 174.626 -0.954 17927 6651 1 9 . 1 1 7 7 ASN CA C 7 51.357 51.357 51.107 0.250 17927 6652 1 9 . 1 1 7 7 ASN CB C 7 38.927 38.927 38.913 0.014 17927 6653 1 9 . 1 1 7 7 ASN H H 7 8.273 8.273 8.516 -0.243 17927 6654 1 9 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.624 -0.177 17927 6655 1 9 . 1 1 8 8 PRO C C 8 176.899 176.899 176.862 0.037 17927 6656 1 9 . 1 1 8 8 PRO CA C 8 63.429 63.429 62.581 0.848 17927 6657 1 9 . 1 1 8 8 PRO CB C 8 32.216 32.216 32.871 -0.655 17927 6658 1 9 . 1 1 9 9 SER N N 9 115.642 115.642 114.702 0.940 17927 6659 1 9 . 1 1 9 9 SER HA H 9 4.415 4.415 4.702 -0.287 17927 6660 1 9 . 1 1 9 9 SER C C 9 174.714 174.714 174.691 0.023 17927 6661 1 9 . 1 1 9 9 SER CA C 9 58.488 58.488 57.654 0.834 17927 6662 1 9 . 1 1 9 9 SER CB C 9 64.048 64.048 64.588 -0.540 17927 6663 1 9 . 1 1 9 9 SER H H 9 8.336 8.336 8.253 0.083 17927 6664 1 9 . 1 1 10 10 ALA N N 10 126.808 126.808 122.647 4.161 17927 6665 1 9 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.731 -0.469 17927 6666 1 9 . 1 1 10 10 ALA C C 10 177.233 177.233 177.918 -0.685 17927 6667 1 9 . 1 1 10 10 ALA CA C 10 53.230 53.230 53.553 -0.323 17927 6668 1 9 . 1 1 10 10 ALA CB C 10 19.187 19.187 17.525 1.662 17927 6669 1 9 . 1 1 10 10 ALA H H 10 8.137 8.137 8.723 -0.586 17927 6670 1 9 . 1 1 11 11 ALA N N 11 120.449 120.449 119.295 1.154 17927 6671 1 9 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.676 -0.415 17927 6672 1 9 . 1 1 11 11 ALA C C 11 177.469 177.469 176.405 1.064 17927 6673 1 9 . 1 1 11 11 ALA CA C 11 52.475 52.475 52.270 0.205 17927 6674 1 9 . 1 1 11 11 ALA CB C 11 19.485 19.485 20.214 -0.729 17927 6675 1 9 . 1 1 11 11 ALA H H 11 7.851 7.851 7.480 0.371 17927 6676 1 9 . 1 1 12 12 SER N N 12 114.186 114.186 113.427 0.759 17927 6677 1 9 . 1 1 12 12 SER HA H 12 4.312 4.312 4.554 -0.242 17927 6678 1 9 . 1 1 12 12 SER C C 12 173.593 173.593 172.866 0.727 17927 6679 1 9 . 1 1 12 12 SER CA C 12 58.099 58.099 57.743 0.356 17927 6680 1 9 . 1 1 12 12 SER CB C 12 63.320 63.320 64.086 -0.766 17927 6681 1 9 . 1 1 12 12 SER H H 12 7.990 7.990 7.676 0.314 17927 6682 1 9 . 1 1 13 13 PHE N N 13 118.092 118.092 121.741 -3.649 17927 6683 1 9 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.762 0.018 17927 6684 1 9 . 1 1 13 13 PHE C C 13 174.220 174.220 173.798 0.422 17927 6685 1 9 . 1 1 13 13 PHE CA C 13 56.717 56.717 55.865 0.852 17927 6686 1 9 . 1 1 13 13 PHE CB C 13 41.151 41.151 40.849 0.302 17927 6687 1 9 . 1 1 13 13 PHE H H 13 7.147 7.147 7.280 -0.133 17927 6688 1 9 . 1 1 14 14 SER N N 14 116.456 116.456 113.470 2.986 17927 6689 1 9 . 1 1 14 14 SER HA H 14 5.162 5.162 5.146 0.016 17927 6690 1 9 . 1 1 14 14 SER C C 14 172.626 172.626 172.801 -0.175 17927 6691 1 9 . 1 1 14 14 SER CA C 14 57.390 57.390 57.459 -0.070 17927 6692 1 9 . 1 1 14 14 SER CB C 14 64.518 64.518 65.386 -0.868 17927 6693 1 9 . 1 1 14 14 SER H H 14 7.616 7.616 8.052 -0.436 17927 6694 1 9 . 1 1 15 15 TYR N N 15 122.384 122.384 122.524 -0.140 17927 6695 1 9 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.850 0.356 17927 6696 1 9 . 1 1 15 15 TYR C C 15 172.543 172.543 173.208 -0.665 17927 6697 1 9 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.471 -0.525 17927 6698 1 9 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.413 0.814 17927 6699 1 9 . 1 1 15 15 TYR H H 15 8.558 8.558 9.202 -0.644 17927 6700 1 9 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.847 0.262 17927 6701 1 9 . 1 1 16 16 PRO C C 16 176.475 176.475 176.594 -0.119 17927 6702 1 9 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.282 -0.301 17927 6703 1 9 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.046 0.616 17927 6704 1 9 . 1 1 17 17 ASP N N 17 119.834 119.834 125.591 -5.757 17927 6705 1 9 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.951 0.788 17927 6706 1 9 . 1 1 17 17 ASP C C 17 180.740 180.740 178.371 2.369 17927 6707 1 9 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.929 -2.212 17927 6708 1 9 . 1 1 17 17 ASP CB C 17 42.561 42.561 42.919 -0.358 17927 6709 1 9 . 1 1 17 17 ASP H H 17 8.643 8.643 8.939 -0.296 17927 6710 1 9 . 1 1 18 18 ILE N N 18 118.340 118.340 122.056 -3.716 17927 6711 1 9 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.810 0.641 17927 6712 1 9 . 1 1 18 18 ILE C C 18 175.742 175.742 176.914 -1.172 17927 6713 1 9 . 1 1 18 18 ILE CA C 18 61.894 61.894 64.658 -2.764 17927 6714 1 9 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.258 0.983 17927 6715 1 9 . 1 1 18 18 ILE H H 18 8.450 8.450 8.219 0.231 17927 6716 1 9 . 1 1 19 19 ASN N N 19 119.377 119.377 116.169 3.208 17927 6717 1 9 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.633 0.382 17927 6718 1 9 . 1 1 19 19 ASN C C 19 175.892 175.892 176.109 -0.217 17927 6719 1 9 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.074 -0.767 17927 6720 1 9 . 1 1 19 19 ASN CB C 19 39.825 39.825 38.517 1.308 17927 6721 1 9 . 1 1 19 19 ASN H H 19 8.376 8.376 8.630 -0.254 17927 6722 1 9 . 1 1 20 20 GLY N N 20 109.535 109.535 108.415 1.120 17927 6723 1 9 . 1 1 20 20 GLY C C 20 174.285 174.285 173.576 0.709 17927 6724 1 9 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.376 0.417 17927 6725 1 9 . 1 1 20 20 GLY H H 20 8.539 8.539 8.351 0.188 17927 6726 1 9 . 1 1 21 21 LYS N N 21 124.675 124.675 121.502 3.173 17927 6727 1 9 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.481 -0.038 17927 6728 1 9 . 1 1 21 21 LYS C C 21 176.537 176.537 175.876 0.661 17927 6729 1 9 . 1 1 21 21 LYS CA C 21 55.444 55.444 55.167 0.277 17927 6730 1 9 . 1 1 21 21 LYS CB C 21 32.754 32.754 32.916 -0.162 17927 6731 1 9 . 1 1 21 21 LYS H H 21 8.608 8.608 7.554 1.054 17927 6732 1 9 . 1 1 22 22 THR N N 22 120.666 120.666 124.619 -3.953 17927 6733 1 9 . 1 1 22 22 THR HA H 22 4.087 4.087 4.357 -0.270 17927 6734 1 9 . 1 1 22 22 THR C C 22 174.431 174.431 173.953 0.478 17927 6735 1 9 . 1 1 22 22 THR CA C 22 64.292 64.292 64.177 0.115 17927 6736 1 9 . 1 1 22 22 THR CB C 22 69.069 69.069 68.662 0.407 17927 6737 1 9 . 1 1 22 22 THR H H 22 8.595 8.595 8.671 -0.076 17927 6738 1 9 . 1 1 23 23 VAL N N 23 131.207 131.207 129.682 1.525 17927 6739 1 9 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.376 -0.184 17927 6740 1 9 . 1 1 23 23 VAL C C 23 174.244 174.244 174.656 -0.412 17927 6741 1 9 . 1 1 23 23 VAL CA C 23 62.456 62.456 60.518 1.938 17927 6742 1 9 . 1 1 23 23 VAL CB C 23 33.791 33.791 34.266 -0.475 17927 6743 1 9 . 1 1 23 23 VAL H H 23 8.937 8.937 9.057 -0.120 17927 6744 1 9 . 1 1 24 24 SER N N 24 120.787 120.787 122.393 -1.606 17927 6745 1 9 . 1 1 24 24 SER HA H 24 5.407 5.407 5.206 0.201 17927 6746 1 9 . 1 1 24 24 SER C C 24 176.169 176.169 173.892 2.277 17927 6747 1 9 . 1 1 24 24 SER CA C 24 55.135 55.135 56.048 -0.913 17927 6748 1 9 . 1 1 24 24 SER CB C 24 65.646 65.646 65.566 0.080 17927 6749 1 9 . 1 1 24 24 SER H H 24 8.554 8.554 8.880 -0.326 17927 6750 1 9 . 1 1 25 25 LEU N N 25 124.332 124.332 121.247 3.085 17927 6751 1 9 . 1 1 25 25 LEU HA H 25 3.687 3.687 4.284 -0.597 17927 6752 1 9 . 1 1 25 25 LEU C C 25 179.364 179.364 175.442 3.922 17927 6753 1 9 . 1 1 25 25 LEU CA C 25 58.217 58.217 53.616 4.601 17927 6754 1 9 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.044 -0.506 17927 6755 1 9 . 1 1 25 25 LEU H H 25 7.811 7.811 8.426 -0.615 17927 6756 1 9 . 1 1 26 26 ALA N N 26 119.799 119.799 120.641 -0.842 17927 6757 1 9 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.333 -0.340 17927 6758 1 9 . 1 1 26 26 ALA C C 26 179.719 179.719 178.798 0.921 17927 6759 1 9 . 1 1 26 26 ALA CA C 26 54.663 54.663 53.156 1.507 17927 6760 1 9 . 1 1 26 26 ALA CB C 26 18.323 18.323 19.712 -1.389 17927 6761 1 9 . 1 1 26 26 ALA H H 26 8.099 8.099 7.408 0.691 17927 6762 1 9 . 1 1 27 27 ASP N N 27 116.553 116.553 120.285 -3.732 17927 6763 1 9 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.395 0.078 17927 6764 1 9 . 1 1 27 27 ASP C C 27 176.915 176.915 176.594 0.321 17927 6765 1 9 . 1 1 27 27 ASP CA C 27 56.251 56.251 56.798 -0.548 17927 6766 1 9 . 1 1 27 27 ASP CB C 27 40.788 40.788 40.523 0.265 17927 6767 1 9 . 1 1 27 27 ASP H H 27 7.572 7.572 7.873 -0.301 17927 6768 1 9 . 1 1 28 28 LEU N N 28 118.950 118.950 117.105 1.845 17927 6769 1 9 . 1 1 28 28 LEU HA H 28 4.233 4.233 4.228 0.005 17927 6770 1 9 . 1 1 28 28 LEU C C 28 175.542 175.542 176.148 -0.606 17927 6771 1 9 . 1 1 28 28 LEU CA C 28 53.706 53.706 53.791 -0.085 17927 6772 1 9 . 1 1 28 28 LEU CB C 28 41.049 41.049 41.895 -0.846 17927 6773 1 9 . 1 1 28 28 LEU H H 28 7.363 7.363 7.395 -0.032 17927 6774 1 9 . 1 1 29 29 LYS N N 29 118.429 118.429 120.437 -2.008 17927 6775 1 9 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.270 0.082 17927 6776 1 9 . 1 1 29 29 LYS C C 29 178.063 178.063 178.092 -0.029 17927 6777 1 9 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.419 0.358 17927 6778 1 9 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.424 1.016 17927 6779 1 9 . 1 1 29 29 LYS H H 29 6.780 6.780 7.179 -0.399 17927 6780 1 9 . 1 1 30 30 GLY N N 30 112.426 112.426 110.864 1.562 17927 6781 1 9 . 1 1 30 30 GLY C C 30 173.801 173.801 173.645 0.156 17927 6782 1 9 . 1 1 30 30 GLY CA C 30 44.611 44.611 44.964 -0.353 17927 6783 1 9 . 1 1 30 30 GLY H H 30 9.398 9.398 8.678 0.720 17927 6784 1 9 . 1 1 31 31 LYS N N 31 119.295 119.295 118.994 0.301 17927 6785 1 9 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.597 -0.445 17927 6786 1 9 . 1 1 31 31 LYS C C 31 173.862 173.862 174.977 -1.115 17927 6787 1 9 . 1 1 31 31 LYS CA C 31 55.188 55.188 55.568 -0.380 17927 6788 1 9 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.427 1.541 17927 6789 1 9 . 1 1 31 31 LYS H H 31 7.496 7.496 7.508 -0.012 17927 6790 1 9 . 1 1 32 32 TYR N N 32 116.984 116.984 121.260 -4.276 17927 6791 1 9 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.471 -0.314 17927 6792 1 9 . 1 1 32 32 TYR C C 32 175.226 175.226 175.943 -0.717 17927 6793 1 9 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.588 0.002 17927 6794 1 9 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.042 0.079 17927 6795 1 9 . 1 1 32 32 TYR H H 32 7.521 7.521 8.125 -0.604 17927 6796 1 9 . 1 1 33 33 ILE N N 33 118.052 118.052 119.809 -1.757 17927 6797 1 9 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.430 0.477 17927 6798 1 9 . 1 1 33 33 ILE C C 33 174.308 174.308 174.441 -0.133 17927 6799 1 9 . 1 1 33 33 ILE CA C 33 60.702 60.702 59.106 1.596 17927 6800 1 9 . 1 1 33 33 ILE CB C 33 41.616 41.616 40.014 1.603 17927 6801 1 9 . 1 1 33 33 ILE H H 33 8.467 8.467 8.956 -0.489 17927 6802 1 9 . 1 1 34 34 TYR N N 34 130.242 130.242 128.818 1.424 17927 6803 1 9 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.197 0.329 17927 6804 1 9 . 1 1 34 34 TYR C C 34 174.245 174.245 173.474 0.771 17927 6805 1 9 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.800 0.358 17927 6806 1 9 . 1 1 34 34 TYR CB C 34 40.133 40.133 41.046 -0.913 17927 6807 1 9 . 1 1 34 34 TYR H H 34 8.905 8.905 9.325 -0.420 17927 6808 1 9 . 1 1 35 35 ILE N N 35 128.697 128.697 129.433 -0.736 17927 6809 1 9 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.229 0.113 17927 6810 1 9 . 1 1 35 35 ILE C C 35 174.520 174.520 174.262 0.258 17927 6811 1 9 . 1 1 35 35 ILE CA C 35 59.749 59.749 58.441 1.308 17927 6812 1 9 . 1 1 35 35 ILE CB C 35 40.899 40.899 37.889 3.010 17927 6813 1 9 . 1 1 35 35 ILE H H 35 9.445 9.445 8.101 1.344 17927 6814 1 9 . 1 1 36 36 ASP N N 36 123.675 123.675 127.386 -3.711 17927 6815 1 9 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.487 -0.638 17927 6816 1 9 . 1 1 36 36 ASP C C 36 174.385 174.385 174.845 -0.460 17927 6817 1 9 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.684 -0.391 17927 6818 1 9 . 1 1 36 36 ASP CB C 36 41.778 41.778 45.767 -3.990 17927 6819 1 9 . 1 1 36 36 ASP H H 36 8.875 8.875 8.298 0.577 17927 6820 1 9 . 1 1 37 37 VAL N N 37 127.159 127.159 122.295 4.864 17927 6821 1 9 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.728 0.231 17927 6822 1 9 . 1 1 37 37 VAL C C 37 175.046 175.046 175.374 -0.328 17927 6823 1 9 . 1 1 37 37 VAL CA C 37 62.245 62.245 60.988 1.257 17927 6824 1 9 . 1 1 37 37 VAL CB C 37 31.807 31.807 32.358 -0.550 17927 6825 1 9 . 1 1 37 37 VAL H H 37 8.603 8.603 7.955 0.648 17927 6826 1 9 . 1 1 38 38 TRP N N 38 124.161 124.161 126.045 -1.884 17927 6827 1 9 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.025 0.212 17927 6828 1 9 . 1 1 38 38 TRP C C 38 171.995 171.995 173.645 -1.650 17927 6829 1 9 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.429 1.778 17927 6830 1 9 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.363 2.824 17927 6831 1 9 . 1 1 38 38 TRP H H 38 8.562 8.562 8.391 0.171 17927 6832 1 9 . 1 1 39 39 ALA N N 39 116.252 116.252 126.452 -10.200 17927 6833 1 9 . 1 1 39 39 ALA HA H 39 3.678 3.678 4.018 -0.340 17927 6834 1 9 . 1 1 39 39 ALA C C 39 178.664 178.664 176.417 2.247 17927 6835 1 9 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.425 1.041 17927 6836 1 9 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.448 0.893 17927 6837 1 9 . 1 1 39 39 ALA H H 39 6.757 6.757 7.931 -1.174 17927 6838 1 9 . 1 1 40 40 THR N N 40 114.321 114.321 116.419 -2.098 17927 6839 1 9 . 1 1 40 40 THR HA H 40 3.907 3.907 4.627 -0.720 17927 6840 1 9 . 1 1 40 40 THR C C 40 175.885 175.885 175.045 0.840 17927 6841 1 9 . 1 1 40 40 THR CA C 40 65.447 65.447 63.721 1.726 17927 6842 1 9 . 1 1 40 40 THR CB C 40 70.106 70.106 69.599 0.507 17927 6843 1 9 . 1 1 40 40 THR H H 40 9.639 9.639 8.962 0.677 17927 6844 1 9 . 1 1 41 41 TRP N N 41 114.483 114.483 120.842 -6.359 17927 6845 1 9 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.861 -0.298 17927 6846 1 9 . 1 1 41 41 TRP C C 41 176.189 176.189 175.224 0.965 17927 6847 1 9 . 1 1 41 41 TRP CA C 41 54.698 54.698 55.607 -0.909 17927 6848 1 9 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.606 1.371 17927 6849 1 9 . 1 1 41 41 TRP H H 41 6.401 6.401 7.209 -0.808 17927 6850 1 9 . 1 1 42 42 CYS N N 42 123.536 123.536 118.153 5.383 17927 6851 1 9 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.513 0.055 17927 6852 1 9 . 1 1 42 42 CYS C C 42 175.726 175.726 175.136 0.590 17927 6853 1 9 . 1 1 42 42 CYS CA C 42 58.700 58.700 57.520 1.180 17927 6854 1 9 . 1 1 42 42 CYS CB C 42 27.121 27.121 30.122 -3.001 17927 6855 1 9 . 1 1 42 42 CYS H H 42 6.883 6.883 6.981 -0.098 17927 6856 1 9 . 1 1 43 43 GLY N N 43 120.977 120.977 109.726 11.251 17927 6857 1 9 . 1 1 43 43 GLY CA C 43 49.204 49.204 46.209 2.995 17927 6858 1 9 . 1 1 43 43 GLY H H 43 9.653 9.653 8.754 0.899 17927 6859 1 9 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.254 0.233 17927 6860 1 9 . 1 1 44 44 PRO C C 44 179.956 179.956 178.827 1.129 17927 6861 1 9 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.406 0.236 17927 6862 1 9 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.484 1.094 17927 6863 1 9 . 1 1 45 45 CYS N N 45 113.925 113.925 114.770 -0.845 17927 6864 1 9 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.186 0.127 17927 6865 1 9 . 1 1 45 45 CYS C C 45 178.325 178.325 176.043 2.282 17927 6866 1 9 . 1 1 45 45 CYS CA C 45 63.392 63.392 62.001 1.391 17927 6867 1 9 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.728 0.777 17927 6868 1 9 . 1 1 45 45 CYS H H 45 7.676 7.676 8.363 -0.687 17927 6869 1 9 . 1 1 46 46 ARG N N 46 120.336 120.336 119.013 1.323 17927 6870 1 9 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.222 -0.153 17927 6871 1 9 . 1 1 46 46 ARG C C 46 180.446 180.446 178.254 2.192 17927 6872 1 9 . 1 1 46 46 ARG CA C 46 59.785 59.785 58.672 1.113 17927 6873 1 9 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.846 0.022 17927 6874 1 9 . 1 1 46 46 ARG H H 46 8.109 8.109 7.702 0.407 17927 6875 1 9 . 1 1 47 47 GLY N N 47 105.408 105.408 107.761 -2.353 17927 6876 1 9 . 1 1 47 47 GLY C C 47 175.258 175.258 175.432 -0.174 17927 6877 1 9 . 1 1 47 47 GLY CA C 47 46.594 46.594 46.125 0.469 17927 6878 1 9 . 1 1 47 47 GLY H H 47 8.466 8.466 7.917 0.549 17927 6879 1 9 . 1 1 48 48 GLU N N 48 116.343 116.343 120.223 -3.880 17927 6880 1 9 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.526 -0.001 17927 6881 1 9 . 1 1 48 48 GLU C C 48 176.535 176.535 177.906 -1.371 17927 6882 1 9 . 1 1 48 48 GLU CA C 48 55.792 55.792 55.730 0.062 17927 6883 1 9 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.519 1.463 17927 6884 1 9 . 1 1 48 48 GLU H H 48 7.050 7.050 8.244 -1.194 17927 6885 1 9 . 1 1 49 49 LEU N N 49 118.652 118.652 121.653 -3.001 17927 6886 1 9 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.119 0.033 17927 6887 1 9 . 1 1 49 49 LEU C C 49 176.832 176.832 176.879 -0.047 17927 6888 1 9 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.513 -1.168 17927 6889 1 9 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.410 -0.914 17927 6890 1 9 . 1 1 49 49 LEU H H 49 7.385 7.385 7.306 0.079 17927 6891 1 9 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.147 0.106 17927 6892 1 9 . 1 1 50 50 PRO C C 50 179.744 179.744 178.287 1.457 17927 6893 1 9 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.111 0.448 17927 6894 1 9 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.762 0.000 17927 6895 1 9 . 1 1 51 51 ALA N N 51 120.418 120.418 119.836 0.582 17927 6896 1 9 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.275 -0.130 17927 6897 1 9 . 1 1 51 51 ALA C C 51 180.329 180.329 179.847 0.482 17927 6898 1 9 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.455 -0.021 17927 6899 1 9 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.387 -0.017 17927 6900 1 9 . 1 1 51 51 ALA H H 51 7.731 7.731 7.550 0.181 17927 6901 1 9 . 1 1 52 52 LEU N N 52 121.506 121.506 120.964 0.542 17927 6902 1 9 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.934 0.054 17927 6903 1 9 . 1 1 52 52 LEU C C 52 177.944 177.944 178.269 -0.325 17927 6904 1 9 . 1 1 52 52 LEU CA C 52 58.327 58.327 58.044 0.283 17927 6905 1 9 . 1 1 52 52 LEU CB C 52 42.382 42.382 42.141 0.241 17927 6906 1 9 . 1 1 52 52 LEU H H 52 8.355 8.355 8.576 -0.221 17927 6907 1 9 . 1 1 53 53 LYS N N 53 119.732 119.732 119.428 0.304 17927 6908 1 9 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.826 0.077 17927 6909 1 9 . 1 1 53 53 LYS C C 53 179.030 179.030 178.828 0.202 17927 6910 1 9 . 1 1 53 53 LYS CA C 53 59.846 59.846 59.921 -0.075 17927 6911 1 9 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.913 0.298 17927 6912 1 9 . 1 1 53 53 LYS H H 53 8.148 8.148 8.520 -0.372 17927 6913 1 9 . 1 1 54 54 GLU N N 54 117.779 117.779 119.693 -1.914 17927 6914 1 9 . 1 1 54 54 GLU HA H 54 4.059 4.059 3.990 0.069 17927 6915 1 9 . 1 1 54 54 GLU C C 54 179.646 179.646 179.092 0.554 17927 6916 1 9 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.580 0.045 17927 6917 1 9 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.565 0.002 17927 6918 1 9 . 1 1 54 54 GLU H H 54 7.585 7.585 7.610 -0.025 17927 6919 1 9 . 1 1 55 55 LEU N N 55 120.581 120.581 119.589 0.992 17927 6920 1 9 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.100 0.093 17927 6921 1 9 . 1 1 55 55 LEU C C 55 178.557 178.557 178.725 -0.168 17927 6922 1 9 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.845 0.390 17927 6923 1 9 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.779 1.232 17927 6924 1 9 . 1 1 55 55 LEU H H 55 8.096 8.096 7.803 0.293 17927 6925 1 9 . 1 1 56 56 GLU N N 56 118.023 118.023 119.508 -1.485 17927 6926 1 9 . 1 1 56 56 GLU HA H 56 3.177 3.177 2.463 0.714 17927 6927 1 9 . 1 1 56 56 GLU C C 56 179.650 179.650 178.826 0.824 17927 6928 1 9 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.317 -0.446 17927 6929 1 9 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.320 -2.335 17927 6930 1 9 . 1 1 56 56 GLU H H 56 8.181 8.181 8.515 -0.334 17927 6931 1 9 . 1 1 57 57 GLU N N 57 117.828 117.828 115.879 1.949 17927 6932 1 9 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.099 0.005 17927 6933 1 9 . 1 1 57 57 GLU C C 57 179.700 179.700 178.273 1.427 17927 6934 1 9 . 1 1 57 57 GLU CA C 57 59.027 59.027 57.884 1.143 17927 6935 1 9 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.546 0.119 17927 6936 1 9 . 1 1 57 57 GLU H H 57 7.762 7.762 8.232 -0.470 17927 6937 1 9 . 1 1 58 58 LYS N N 58 120.896 120.896 118.890 2.006 17927 6938 1 9 . 1 1 58 58 LYS HA H 58 3.979 3.979 4.041 -0.062 17927 6939 1 9 . 1 1 58 58 LYS C C 58 178.715 178.715 178.174 0.541 17927 6940 1 9 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.824 0.254 17927 6941 1 9 . 1 1 58 58 LYS CB C 58 32.980 32.980 33.057 -0.077 17927 6942 1 9 . 1 1 58 58 LYS H H 58 8.410 8.410 7.862 0.548 17927 6943 1 9 . 1 1 59 59 TYR N N 59 113.713 113.713 115.504 -1.791 17927 6944 1 9 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.545 -0.233 17927 6945 1 9 . 1 1 59 59 TYR C C 59 175.025 175.025 175.414 -0.389 17927 6946 1 9 . 1 1 59 59 TYR CA C 59 58.973 58.973 57.913 1.060 17927 6947 1 9 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.492 -1.058 17927 6948 1 9 . 1 1 59 59 TYR H H 59 8.102 8.102 8.495 -0.393 17927 6949 1 9 . 1 1 60 60 ALA N N 60 126.637 126.637 121.726 4.911 17927 6950 1 9 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.383 0.035 17927 6951 1 9 . 1 1 60 60 ALA C C 60 179.208 179.208 177.306 1.902 17927 6952 1 9 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.404 1.130 17927 6953 1 9 . 1 1 60 60 ALA CB C 60 18.589 18.589 19.171 -0.582 17927 6954 1 9 . 1 1 60 60 ALA H H 60 7.201 7.201 7.340 -0.139 17927 6955 1 9 . 1 1 61 61 GLY N N 61 111.816 111.816 108.033 3.783 17927 6956 1 9 . 1 1 61 61 GLY C C 61 174.698 174.698 174.639 0.059 17927 6957 1 9 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.724 0.180 17927 6958 1 9 . 1 1 61 61 GLY H H 61 9.184 9.184 8.787 0.397 17927 6959 1 9 . 1 1 62 62 LYS N N 62 118.497 118.497 120.100 -1.603 17927 6960 1 9 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.555 0.324 17927 6961 1 9 . 1 1 62 62 LYS C C 62 179.019 179.019 176.234 2.785 17927 6962 1 9 . 1 1 62 62 LYS CA C 62 53.988 53.988 54.222 -0.235 17927 6963 1 9 . 1 1 62 62 LYS CB C 62 33.840 33.840 33.494 0.346 17927 6964 1 9 . 1 1 62 62 LYS H H 62 8.019 8.019 7.343 0.676 17927 6965 1 9 . 1 1 63 63 ASP N N 63 122.982 122.982 121.575 1.407 17927 6966 1 9 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.731 -0.204 17927 6967 1 9 . 1 1 63 63 ASP C C 63 174.065 174.065 175.042 -0.977 17927 6968 1 9 . 1 1 63 63 ASP CA C 63 55.055 55.055 53.631 1.424 17927 6969 1 9 . 1 1 63 63 ASP CB C 63 38.582 38.582 39.779 -1.197 17927 6970 1 9 . 1 1 63 63 ASP H H 63 8.709 8.709 8.581 0.128 17927 6971 1 9 . 1 1 64 64 ILE N N 64 122.219 122.219 112.568 9.651 17927 6972 1 9 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.622 -0.015 17927 6973 1 9 . 1 1 64 64 ILE C C 64 174.627 174.627 173.842 0.785 17927 6974 1 9 . 1 1 64 64 ILE CA C 64 59.712 59.712 58.891 0.821 17927 6975 1 9 . 1 1 64 64 ILE CB C 64 42.133 42.133 41.470 0.663 17927 6976 1 9 . 1 1 64 64 ILE H H 64 8.678 8.678 7.307 1.371 17927 6977 1 9 . 1 1 65 65 HIS N N 65 125.584 125.584 120.297 5.287 17927 6978 1 9 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.962 0.081 17927 6979 1 9 . 1 1 65 65 HIS C C 65 174.153 174.153 173.785 0.368 17927 6980 1 9 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.609 0.350 17927 6981 1 9 . 1 1 65 65 HIS CB C 65 34.156 34.156 32.289 1.867 17927 6982 1 9 . 1 1 65 65 HIS H H 65 9.204 9.204 8.417 0.787 17927 6983 1 9 . 1 1 66 66 PHE N N 66 123.244 123.244 125.399 -2.155 17927 6984 1 9 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.632 0.578 17927 6985 1 9 . 1 1 66 66 PHE C C 66 175.463 175.463 174.848 0.615 17927 6986 1 9 . 1 1 66 66 PHE CA C 66 58.088 58.088 58.979 -0.891 17927 6987 1 9 . 1 1 66 66 PHE CB C 66 39.637 39.637 38.521 1.116 17927 6988 1 9 . 1 1 66 66 PHE H H 66 9.262 9.262 9.242 0.020 17927 6989 1 9 . 1 1 67 67 VAL N N 67 126.201 126.201 125.999 0.202 17927 6990 1 9 . 1 1 67 67 VAL HA H 67 4.834 4.834 4.807 0.027 17927 6991 1 9 . 1 1 67 67 VAL C C 67 174.364 174.364 175.136 -0.772 17927 6992 1 9 . 1 1 67 67 VAL CA C 67 60.724 60.724 61.242 -0.518 17927 6993 1 9 . 1 1 67 67 VAL CB C 67 34.893 34.893 32.712 2.181 17927 6994 1 9 . 1 1 67 67 VAL H H 67 8.843 8.843 9.213 -0.370 17927 6995 1 9 . 1 1 68 68 SER N N 68 124.528 124.528 122.969 1.559 17927 6996 1 9 . 1 1 68 68 SER HA H 68 5.585 5.585 5.355 0.230 17927 6997 1 9 . 1 1 68 68 SER C C 68 172.858 172.858 173.424 -0.566 17927 6998 1 9 . 1 1 68 68 SER CA C 68 57.282 57.282 57.682 -0.400 17927 6999 1 9 . 1 1 68 68 SER CB C 68 65.032 65.032 64.544 0.488 17927 7000 1 9 . 1 1 68 68 SER H H 68 9.243 9.243 8.396 0.847 17927 7001 1 9 . 1 1 69 69 LEU N N 69 126.695 126.695 125.307 1.388 17927 7002 1 9 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.451 -0.934 17927 7003 1 9 . 1 1 69 69 LEU C C 69 174.652 174.652 176.755 -2.103 17927 7004 1 9 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.725 -0.898 17927 7005 1 9 . 1 1 69 69 LEU CB C 69 43.895 43.895 44.625 -0.730 17927 7006 1 9 . 1 1 69 69 LEU H H 69 9.360 9.360 9.286 0.074 17927 7007 1 9 . 1 1 70 70 SER N N 70 116.379 116.379 119.671 -3.292 17927 7008 1 9 . 1 1 70 70 SER HA H 70 4.905 4.905 4.968 -0.063 17927 7009 1 9 . 1 1 70 70 SER C C 70 176.307 176.307 174.774 1.533 17927 7010 1 9 . 1 1 70 70 SER CA C 70 55.213 55.213 57.151 -1.938 17927 7011 1 9 . 1 1 70 70 SER CB C 70 63.519 63.519 63.764 -0.245 17927 7012 1 9 . 1 1 70 70 SER H H 70 7.981 7.981 8.827 -0.846 17927 7013 1 9 . 1 1 71 71 CYS N N 71 124.670 124.670 120.855 3.815 17927 7014 1 9 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.487 0.471 17927 7015 1 9 . 1 1 71 71 CYS C C 71 173.996 173.996 173.922 0.074 17927 7016 1 9 . 1 1 71 71 CYS CA C 71 55.483 55.483 57.093 -1.610 17927 7017 1 9 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.519 0.593 17927 7018 1 9 . 1 1 71 71 CYS H H 71 8.609 8.609 8.812 -0.203 17927 7019 1 9 . 1 1 72 72 ASP N N 72 122.398 122.398 123.427 -1.029 17927 7020 1 9 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.848 -0.556 17927 7021 1 9 . 1 1 72 72 ASP C C 72 176.653 176.653 176.145 0.508 17927 7022 1 9 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.027 1.755 17927 7023 1 9 . 1 1 72 72 ASP CB C 72 41.526 41.526 41.023 0.503 17927 7024 1 9 . 1 1 72 72 ASP H H 72 8.557 8.557 8.017 0.540 17927 7025 1 9 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.097 -0.032 17927 7026 1 9 . 1 1 73 73 LYS C C 73 176.545 176.545 176.343 0.202 17927 7027 1 9 . 1 1 73 73 LYS CA C 73 58.458 58.458 59.141 -0.683 17927 7028 1 9 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.212 0.429 17927 7029 1 9 . 1 1 74 74 ASN N N 74 117.616 117.616 118.281 -0.665 17927 7030 1 9 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.860 0.045 17927 7031 1 9 . 1 1 74 74 ASN C C 74 174.894 174.894 175.282 -0.388 17927 7032 1 9 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.146 -0.625 17927 7033 1 9 . 1 1 74 74 ASN CB C 74 38.109 38.109 37.206 0.903 17927 7034 1 9 . 1 1 74 74 ASN H H 74 8.625 8.625 7.982 0.643 17927 7035 1 9 . 1 1 75 75 LYS N N 75 126.797 126.797 124.911 1.886 17927 7036 1 9 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.797 -0.374 17927 7037 1 9 . 1 1 75 75 LYS C C 75 178.058 178.058 177.922 0.136 17927 7038 1 9 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.499 -0.327 17927 7039 1 9 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.408 0.883 17927 7040 1 9 . 1 1 75 75 LYS H H 75 8.588 8.588 7.883 0.705 17927 7041 1 9 . 1 1 76 76 LYS N N 76 117.875 117.875 119.905 -2.030 17927 7042 1 9 . 1 1 76 76 LYS HA H 76 4.200 4.200 3.913 0.287 17927 7043 1 9 . 1 1 76 76 LYS C C 76 178.791 178.791 178.324 0.467 17927 7044 1 9 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.866 -1.258 17927 7045 1 9 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.914 -0.424 17927 7046 1 9 . 1 1 76 76 LYS H H 76 8.041 8.041 8.565 -0.524 17927 7047 1 9 . 1 1 77 77 ALA N N 77 121.567 121.567 121.048 0.519 17927 7048 1 9 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.154 -0.031 17927 7049 1 9 . 1 1 77 77 ALA C C 77 181.191 181.191 179.513 1.678 17927 7050 1 9 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.614 0.343 17927 7051 1 9 . 1 1 77 77 ALA CB C 77 17.759 17.759 17.829 -0.070 17927 7052 1 9 . 1 1 77 77 ALA H H 77 7.366 7.366 8.260 -0.894 17927 7053 1 9 . 1 1 78 78 TRP N N 78 119.497 119.497 120.356 -0.859 17927 7054 1 9 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.191 -0.114 17927 7055 1 9 . 1 1 78 78 TRP C C 78 175.942 175.942 177.103 -1.161 17927 7056 1 9 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.089 2.672 17927 7057 1 9 . 1 1 78 78 TRP CB C 78 27.272 27.272 29.752 -2.480 17927 7058 1 9 . 1 1 78 78 TRP H H 78 7.187 7.187 7.906 -0.719 17927 7059 1 9 . 1 1 79 79 GLU N N 79 118.771 118.771 117.756 1.015 17927 7060 1 9 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.512 -0.498 17927 7061 1 9 . 1 1 79 79 GLU C C 79 179.863 179.863 179.233 0.630 17927 7062 1 9 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.248 -0.138 17927 7063 1 9 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.401 1.819 17927 7064 1 9 . 1 1 79 79 GLU H H 79 8.813 8.813 8.667 0.146 17927 7065 1 9 . 1 1 80 80 ASN N N 80 115.964 115.964 117.886 -1.922 17927 7066 1 9 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.419 -0.080 17927 7067 1 9 . 1 1 80 80 ASN C C 80 176.749 176.749 177.984 -1.235 17927 7068 1 9 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.763 0.272 17927 7069 1 9 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.293 0.196 17927 7070 1 9 . 1 1 80 80 ASN H H 80 8.491 8.491 7.931 0.560 17927 7071 1 9 . 1 1 81 81 MET N N 81 119.670 119.670 121.517 -1.847 17927 7072 1 9 . 1 1 81 81 MET HA H 81 4.149 4.149 4.191 -0.042 17927 7073 1 9 . 1 1 81 81 MET C C 81 177.933 177.933 177.607 0.326 17927 7074 1 9 . 1 1 81 81 MET CA C 81 60.276 60.276 59.074 1.202 17927 7075 1 9 . 1 1 81 81 MET CB C 81 32.518 32.518 32.811 -0.293 17927 7076 1 9 . 1 1 81 81 MET H H 81 7.667 7.667 7.590 0.077 17927 7077 1 9 . 1 1 82 82 VAL N N 82 117.634 117.634 118.261 -0.627 17927 7078 1 9 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.507 -0.204 17927 7079 1 9 . 1 1 82 82 VAL C C 82 179.005 179.005 176.834 2.171 17927 7080 1 9 . 1 1 82 82 VAL CA C 82 67.037 67.037 65.634 1.403 17927 7081 1 9 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.524 0.240 17927 7082 1 9 . 1 1 82 82 VAL H H 82 8.338 8.338 7.700 0.638 17927 7083 1 9 . 1 1 83 83 THR N N 83 110.519 110.519 110.949 -0.430 17927 7084 1 9 . 1 1 83 83 THR HA H 83 3.983 3.983 4.199 -0.216 17927 7085 1 9 . 1 1 83 83 THR C C 83 177.591 177.591 175.751 1.840 17927 7086 1 9 . 1 1 83 83 THR CA C 83 65.431 65.431 64.533 0.898 17927 7087 1 9 . 1 1 83 83 THR CB C 83 69.156 69.156 68.749 0.407 17927 7088 1 9 . 1 1 83 83 THR H H 83 7.659 7.659 7.844 -0.185 17927 7089 1 9 . 1 1 84 84 LYS N N 84 123.927 123.927 121.803 2.124 17927 7090 1 9 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.319 -0.250 17927 7091 1 9 . 1 1 84 84 LYS C C 84 178.582 178.582 177.899 0.683 17927 7092 1 9 . 1 1 84 84 LYS CA C 84 59.877 59.877 57.262 2.615 17927 7093 1 9 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.282 0.041 17927 7094 1 9 . 1 1 84 84 LYS H H 84 8.665 8.665 7.342 1.323 17927 7095 1 9 . 1 1 85 85 ASP N N 85 116.280 116.280 118.760 -2.480 17927 7096 1 9 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.610 0.140 17927 7097 1 9 . 1 1 85 85 ASP C C 85 175.086 175.086 175.038 0.048 17927 7098 1 9 . 1 1 85 85 ASP CA C 85 54.693 54.693 54.805 -0.112 17927 7099 1 9 . 1 1 85 85 ASP CB C 85 39.685 39.685 42.014 -2.329 17927 7100 1 9 . 1 1 85 85 ASP H H 85 8.179 8.179 8.226 -0.047 17927 7101 1 9 . 1 1 86 86 GLN N N 86 116.258 116.258 115.495 0.763 17927 7102 1 9 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.918 -0.010 17927 7103 1 9 . 1 1 86 86 GLN C C 86 175.659 175.659 174.333 1.326 17927 7104 1 9 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.244 -0.073 17927 7105 1 9 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.152 0.138 17927 7106 1 9 . 1 1 86 86 GLN H H 86 7.431 7.431 7.770 -0.339 17927 7107 1 9 . 1 1 87 87 LEU N N 87 117.031 117.031 122.545 -5.514 17927 7108 1 9 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.437 -0.347 17927 7109 1 9 . 1 1 87 87 LEU C C 87 178.225 178.225 176.108 2.117 17927 7110 1 9 . 1 1 87 87 LEU CA C 87 55.932 55.932 54.328 1.604 17927 7111 1 9 . 1 1 87 87 LEU CB C 87 41.202 41.202 43.173 -1.971 17927 7112 1 9 . 1 1 87 87 LEU H H 87 7.736 7.736 7.770 -0.034 17927 7113 1 9 . 1 1 88 88 LYS N N 88 122.367 122.367 122.816 -0.449 17927 7114 1 9 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.625 0.011 17927 7115 1 9 . 1 1 88 88 LYS C C 88 177.538 177.538 175.918 1.620 17927 7116 1 9 . 1 1 88 88 LYS CA C 88 54.930 54.930 54.342 0.588 17927 7117 1 9 . 1 1 88 88 LYS CB C 88 33.316 33.316 34.268 -0.952 17927 7118 1 9 . 1 1 88 88 LYS H H 88 8.496 8.496 7.949 0.547 17927 7119 1 9 . 1 1 89 89 GLY N N 89 108.452 108.452 108.184 0.268 17927 7120 1 9 . 1 1 89 89 GLY C C 89 173.781 173.781 173.533 0.248 17927 7121 1 9 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.675 0.683 17927 7122 1 9 . 1 1 89 89 GLY H H 89 8.497 8.497 8.092 0.405 17927 7123 1 9 . 1 1 90 90 ILE N N 90 123.295 123.295 124.662 -1.367 17927 7124 1 9 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.333 0.038 17927 7125 1 9 . 1 1 90 90 ILE C C 90 175.606 175.606 174.094 1.512 17927 7126 1 9 . 1 1 90 90 ILE CA C 90 62.001 62.001 60.899 1.102 17927 7127 1 9 . 1 1 90 90 ILE CB C 90 38.036 38.036 38.176 -0.140 17927 7128 1 9 . 1 1 90 90 ILE H H 90 8.728 8.728 8.000 0.728 17927 7129 1 9 . 1 1 91 91 GLN N N 91 128.632 128.632 126.438 2.194 17927 7130 1 9 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.451 0.315 17927 7131 1 9 . 1 1 91 91 GLN C C 91 174.618 174.618 174.625 -0.007 17927 7132 1 9 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.828 1.022 17927 7133 1 9 . 1 1 91 91 GLN CB C 91 28.341 28.341 29.887 -1.546 17927 7134 1 9 . 1 1 91 91 GLN H H 91 8.762 8.762 8.592 0.170 17927 7135 1 9 . 1 1 92 92 LEU N N 92 120.830 120.830 125.632 -4.802 17927 7136 1 9 . 1 1 92 92 LEU HA H 92 5.580 5.580 4.913 0.667 17927 7137 1 9 . 1 1 92 92 LEU C C 92 176.828 176.828 175.455 1.373 17927 7138 1 9 . 1 1 92 92 LEU CA C 92 52.801 52.801 54.202 -1.401 17927 7139 1 9 . 1 1 92 92 LEU CB C 92 44.210 44.210 44.688 -0.478 17927 7140 1 9 . 1 1 92 92 LEU H H 92 9.011 9.011 9.408 -0.397 17927 7141 1 9 . 1 1 93 93 HIS N N 93 121.481 121.481 122.269 -0.788 17927 7142 1 9 . 1 1 93 93 HIS HA H 93 3.931 3.931 4.998 -1.067 17927 7143 1 9 . 1 1 93 93 HIS C C 93 173.590 173.590 173.372 0.218 17927 7144 1 9 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.266 1.317 17927 7145 1 9 . 1 1 93 93 HIS CB C 93 32.250 32.250 32.984 -0.734 17927 7146 1 9 . 1 1 93 93 HIS H H 93 8.038 8.038 9.025 -0.987 17927 7147 1 9 . 1 1 94 94 MET N N 94 121.881 121.881 125.376 -3.495 17927 7148 1 9 . 1 1 94 94 MET HA H 94 3.866 3.866 3.663 0.203 17927 7149 1 9 . 1 1 94 94 MET C C 94 177.035 177.035 175.804 1.231 17927 7150 1 9 . 1 1 94 94 MET CA C 94 55.189 55.189 57.471 -2.281 17927 7151 1 9 . 1 1 94 94 MET CB C 94 33.993 33.993 33.116 0.877 17927 7152 1 9 . 1 1 94 94 MET H H 94 8.039 8.039 8.260 -0.221 17927 7153 1 9 . 1 1 95 95 GLY N N 95 104.041 104.041 104.998 -0.957 17927 7154 1 9 . 1 1 95 95 GLY C C 95 174.251 174.251 172.899 1.352 17927 7155 1 9 . 1 1 95 95 GLY CA C 95 46.580 46.580 44.922 1.657 17927 7156 1 9 . 1 1 95 95 GLY H H 95 5.666 5.666 7.690 -2.024 17927 7157 1 9 . 1 1 96 96 THR N N 96 114.114 114.114 116.870 -2.756 17927 7158 1 9 . 1 1 96 96 THR HA H 96 4.211 4.211 4.503 -0.292 17927 7159 1 9 . 1 1 96 96 THR C C 96 175.122 175.122 173.620 1.502 17927 7160 1 9 . 1 1 96 96 THR CA C 96 61.339 61.339 61.392 -0.053 17927 7161 1 9 . 1 1 96 96 THR CB C 96 68.615 68.615 68.949 -0.334 17927 7162 1 9 . 1 1 96 96 THR H H 96 8.517 8.517 8.130 0.387 17927 7163 1 9 . 1 1 97 97 ASP N N 97 121.892 121.892 124.187 -2.295 17927 7164 1 9 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.720 -0.135 17927 7165 1 9 . 1 1 97 97 ASP C C 97 178.241 178.241 176.735 1.506 17927 7166 1 9 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.599 1.201 17927 7167 1 9 . 1 1 97 97 ASP CB C 97 43.129 43.129 39.166 3.963 17927 7168 1 9 . 1 1 97 97 ASP H H 97 7.563 7.563 8.381 -0.818 17927 7169 1 9 . 1 1 98 98 ARG N N 98 127.508 127.508 121.356 6.152 17927 7170 1 9 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.238 0.154 17927 7171 1 9 . 1 1 98 98 ARG C C 98 176.724 176.724 177.302 -0.578 17927 7172 1 9 . 1 1 98 98 ARG CA C 98 55.939 55.939 57.182 -1.243 17927 7173 1 9 . 1 1 98 98 ARG CB C 98 30.291 30.291 29.439 0.852 17927 7174 1 9 . 1 1 98 98 ARG H H 98 9.225 9.225 7.897 1.328 17927 7175 1 9 . 1 1 99 99 THR N N 99 116.384 116.384 117.698 -1.314 17927 7176 1 9 . 1 1 99 99 THR HA H 99 3.987 3.987 4.061 -0.074 17927 7177 1 9 . 1 1 99 99 THR C C 99 176.969 176.969 176.488 0.481 17927 7178 1 9 . 1 1 99 99 THR CA C 99 67.714 67.714 66.947 0.767 17927 7179 1 9 . 1 1 99 99 THR CB C 99 68.777 68.777 68.499 0.278 17927 7180 1 9 . 1 1 99 99 THR H H 99 8.382 8.382 8.105 0.277 17927 7181 1 9 . 1 1 100 100 PHE N N 100 123.232 123.232 121.661 1.571 17927 7182 1 9 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.451 -0.278 17927 7183 1 9 . 1 1 100 100 PHE C C 100 177.010 177.010 176.432 0.578 17927 7184 1 9 . 1 1 100 100 PHE CA C 100 61.923 61.923 60.578 1.345 17927 7185 1 9 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.457 1.305 17927 7186 1 9 . 1 1 100 100 PHE H H 100 7.998 7.998 7.988 0.010 17927 7187 1 9 . 1 1 101 101 MET N N 101 115.968 115.968 119.367 -3.399 17927 7188 1 9 . 1 1 101 101 MET HA H 101 3.975 3.975 4.033 -0.058 17927 7189 1 9 . 1 1 101 101 MET C C 101 178.763 178.763 177.967 0.796 17927 7190 1 9 . 1 1 101 101 MET CA C 101 58.552 58.552 59.017 -0.465 17927 7191 1 9 . 1 1 101 101 MET CB C 101 32.593 32.593 31.619 0.974 17927 7192 1 9 . 1 1 101 101 MET H H 101 7.828 7.828 7.535 0.293 17927 7193 1 9 . 1 1 102 102 ASP N N 102 117.553 117.553 118.731 -1.178 17927 7194 1 9 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.537 -0.015 17927 7195 1 9 . 1 1 102 102 ASP C C 102 179.503 179.503 178.812 0.691 17927 7196 1 9 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.068 -0.178 17927 7197 1 9 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.835 -0.909 17927 7198 1 9 . 1 1 102 102 ASP H H 102 8.828 8.828 8.188 0.640 17927 7199 1 9 . 1 1 103 103 ALA N N 103 122.984 122.984 123.150 -0.166 17927 7200 1 9 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.069 -0.083 17927 7201 1 9 . 1 1 103 103 ALA C C 103 178.782 178.782 178.361 0.421 17927 7202 1 9 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.304 0.790 17927 7203 1 9 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.258 0.305 17927 7204 1 9 . 1 1 103 103 ALA H H 103 7.567 7.567 7.426 0.141 17927 7205 1 9 . 1 1 104 104 TYR N N 104 112.159 112.159 114.449 -2.290 17927 7206 1 9 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.379 -0.155 17927 7207 1 9 . 1 1 104 104 TYR C C 104 173.821 173.821 174.988 -1.167 17927 7208 1 9 . 1 1 104 104 TYR CA C 104 58.498 58.498 57.117 1.381 17927 7209 1 9 . 1 1 104 104 TYR CB C 104 38.393 38.393 39.202 -0.809 17927 7210 1 9 . 1 1 104 104 TYR H H 104 7.203 7.203 7.202 0.001 17927 7211 1 9 . 1 1 105 105 LEU N N 105 119.433 119.433 116.414 3.019 17927 7212 1 9 . 1 1 105 105 LEU HA H 105 3.985 3.985 4.005 -0.020 17927 7213 1 9 . 1 1 105 105 LEU C C 105 176.721 176.721 176.363 0.358 17927 7214 1 9 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.563 0.222 17927 7215 1 9 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.600 -1.157 17927 7216 1 9 . 1 1 105 105 LEU H H 105 7.582 7.582 7.726 -0.144 17927 7217 1 9 . 1 1 106 106 ILE N N 106 119.575 119.575 113.236 6.339 17927 7218 1 9 . 1 1 106 106 ILE HA H 106 4.002 4.002 4.363 -0.361 17927 7219 1 9 . 1 1 106 106 ILE C C 106 175.459 175.459 174.900 0.559 17927 7220 1 9 . 1 1 106 106 ILE CA C 106 62.043 62.043 59.670 2.373 17927 7221 1 9 . 1 1 106 106 ILE CB C 106 36.335 36.335 37.303 -0.969 17927 7222 1 9 . 1 1 106 106 ILE H H 106 8.774 8.774 8.159 0.615 17927 7223 1 9 . 1 1 107 107 ASN N N 107 126.514 126.514 119.096 7.418 17927 7224 1 9 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.528 0.335 17927 7225 1 9 . 1 1 107 107 ASN C C 107 174.584 174.584 175.959 -1.375 17927 7226 1 9 . 1 1 107 107 ASN CA C 107 53.112 53.112 54.107 -0.995 17927 7227 1 9 . 1 1 107 107 ASN CB C 107 38.977 38.977 37.822 1.155 17927 7228 1 9 . 1 1 107 107 ASN H H 107 8.364 8.364 8.142 0.222 17927 7229 1 9 . 1 1 108 108 GLY N N 108 108.469 108.469 108.682 -0.213 17927 7230 1 9 . 1 1 108 108 GLY C C 108 171.245 171.245 173.204 -1.959 17927 7231 1 9 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.537 0.732 17927 7232 1 9 . 1 1 108 108 GLY H H 108 7.678 7.678 7.955 -0.277 17927 7233 1 9 . 1 1 109 109 ILE N N 109 112.817 112.817 121.750 -8.933 17927 7234 1 9 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.520 -0.114 17927 7235 1 9 . 1 1 109 109 ILE C C 109 173.498 173.498 174.145 -0.647 17927 7236 1 9 . 1 1 109 109 ILE CA C 109 58.384 58.384 56.987 1.397 17927 7237 1 9 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.400 1.922 17927 7238 1 9 . 1 1 109 109 ILE H H 109 7.868 7.868 7.660 0.208 17927 7239 1 9 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.424 0.318 17927 7240 1 9 . 1 1 110 110 PRO C C 110 175.715 175.715 175.619 0.096 17927 7241 1 9 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.278 -0.001 17927 7242 1 9 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.570 3.798 17927 7243 1 9 . 1 1 111 111 ARG N N 111 122.358 122.358 119.999 2.359 17927 7244 1 9 . 1 1 111 111 ARG HA H 111 4.469 4.469 4.006 0.463 17927 7245 1 9 . 1 1 111 111 ARG C C 111 171.541 171.541 174.547 -3.006 17927 7246 1 9 . 1 1 111 111 ARG CA C 111 54.356 54.356 54.217 0.139 17927 7247 1 9 . 1 1 111 111 ARG CB C 111 33.430 33.430 33.483 -0.053 17927 7248 1 9 . 1 1 111 111 ARG H H 111 7.732 7.732 8.382 -0.650 17927 7249 1 9 . 1 1 112 112 PHE N N 112 125.103 125.103 120.050 5.053 17927 7250 1 9 . 1 1 112 112 PHE HA H 112 5.773 5.773 4.852 0.921 17927 7251 1 9 . 1 1 112 112 PHE C C 112 175.097 175.097 174.688 0.409 17927 7252 1 9 . 1 1 112 112 PHE CA C 112 55.791 55.791 55.836 -0.045 17927 7253 1 9 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.104 1.824 17927 7254 1 9 . 1 1 112 112 PHE H H 112 8.929 8.929 7.388 1.541 17927 7255 1 9 . 1 1 113 113 ILE N N 113 123.778 123.778 122.881 0.897 17927 7256 1 9 . 1 1 113 113 ILE HA H 113 4.543 4.543 5.040 -0.497 17927 7257 1 9 . 1 1 113 113 ILE C C 113 173.197 173.197 174.359 -1.162 17927 7258 1 9 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.569 0.717 17927 7259 1 9 . 1 1 113 113 ILE CB C 113 44.246 44.246 41.820 2.426 17927 7260 1 9 . 1 1 113 113 ILE H H 113 8.873 8.873 8.854 0.019 17927 7261 1 9 . 1 1 114 114 LEU N N 114 127.146 127.146 127.078 0.068 17927 7262 1 9 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.382 0.632 17927 7263 1 9 . 1 1 114 114 LEU C C 114 175.080 175.080 174.587 0.493 17927 7264 1 9 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.660 -0.259 17927 7265 1 9 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.533 0.837 17927 7266 1 9 . 1 1 114 114 LEU H H 114 8.974 8.974 8.828 0.146 17927 7267 1 9 . 1 1 115 115 LEU N N 115 128.323 128.323 124.900 3.423 17927 7268 1 9 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.191 0.241 17927 7269 1 9 . 1 1 115 115 LEU C C 115 176.660 176.660 175.763 0.897 17927 7270 1 9 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.742 -0.665 17927 7271 1 9 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.058 -1.474 17927 7272 1 9 . 1 1 115 115 LEU H H 115 9.874 9.874 9.361 0.513 17927 7273 1 9 . 1 1 116 116 ASP N N 116 119.834 119.834 122.279 -2.445 17927 7274 1 9 . 1 1 116 116 ASP HA H 116 4.935 4.935 4.733 0.202 17927 7275 1 9 . 1 1 116 116 ASP C C 116 176.898 176.898 177.299 -0.401 17927 7276 1 9 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.642 -1.337 17927 7277 1 9 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.532 -1.504 17927 7278 1 9 . 1 1 116 116 ASP H H 116 9.357 9.357 8.837 0.520 17927 7279 1 9 . 1 1 117 117 ARG N N 117 113.356 113.356 120.434 -7.078 17927 7280 1 9 . 1 1 117 117 ARG HA H 117 3.717 3.717 3.970 -0.253 17927 7281 1 9 . 1 1 117 117 ARG C C 117 177.105 177.105 177.473 -0.368 17927 7282 1 9 . 1 1 117 117 ARG CA C 117 58.185 58.185 60.010 -1.825 17927 7283 1 9 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.885 0.552 17927 7284 1 9 . 1 1 117 117 ARG H H 117 7.697 7.697 8.080 -0.383 17927 7285 1 9 . 1 1 118 118 ASP N N 118 117.226 117.226 116.296 0.930 17927 7286 1 9 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.519 0.376 17927 7287 1 9 . 1 1 118 118 ASP C C 118 176.657 176.657 176.278 0.379 17927 7288 1 9 . 1 1 118 118 ASP CA C 118 53.517 53.517 54.012 -0.495 17927 7289 1 9 . 1 1 118 118 ASP CB C 118 42.556 42.556 40.782 1.774 17927 7290 1 9 . 1 1 118 118 ASP H H 118 8.456 8.456 7.944 0.512 17927 7291 1 9 . 1 1 119 119 GLY N N 119 109.074 109.074 107.141 1.933 17927 7292 1 9 . 1 1 119 119 GLY C C 119 173.355 173.355 174.199 -0.844 17927 7293 1 9 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.389 0.867 17927 7294 1 9 . 1 1 119 119 GLY H H 119 8.183 8.183 8.362 -0.179 17927 7295 1 9 . 1 1 120 120 LYS N N 120 120.744 120.744 121.268 -0.524 17927 7296 1 9 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.463 0.070 17927 7297 1 9 . 1 1 120 120 LYS C C 120 177.229 177.229 176.478 0.751 17927 7298 1 9 . 1 1 120 120 LYS CA C 120 55.287 55.287 55.158 0.129 17927 7299 1 9 . 1 1 120 120 LYS CB C 120 32.581 32.581 32.745 -0.164 17927 7300 1 9 . 1 1 120 120 LYS H H 120 8.449 8.449 7.446 1.003 17927 7301 1 9 . 1 1 121 121 ILE N N 121 121.221 121.221 128.155 -6.934 17927 7302 1 9 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.788 0.098 17927 7303 1 9 . 1 1 121 121 ILE C C 121 177.819 177.819 176.292 1.527 17927 7304 1 9 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.880 0.035 17927 7305 1 9 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.378 2.012 17927 7306 1 9 . 1 1 121 121 ILE H H 121 8.715 8.715 8.828 -0.113 17927 7307 1 9 . 1 1 122 122 ILE N N 122 127.165 127.165 128.285 -1.120 17927 7308 1 9 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.293 0.048 17927 7309 1 9 . 1 1 122 122 ILE C C 122 176.978 176.978 176.676 0.302 17927 7310 1 9 . 1 1 122 122 ILE CA C 122 63.719 63.719 61.836 1.883 17927 7311 1 9 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.665 -0.013 17927 7312 1 9 . 1 1 122 122 ILE H H 122 8.974 8.974 8.671 0.303 17927 7313 1 9 . 1 1 123 123 SER N N 123 111.227 111.227 116.139 -4.912 17927 7314 1 9 . 1 1 123 123 SER HA H 123 4.738 4.738 4.751 -0.013 17927 7315 1 9 . 1 1 123 123 SER C C 123 174.184 174.184 173.722 0.462 17927 7316 1 9 . 1 1 123 123 SER CA C 123 57.383 57.383 57.005 0.378 17927 7317 1 9 . 1 1 123 123 SER CB C 123 65.326 65.326 65.000 0.326 17927 7318 1 9 . 1 1 123 123 SER H H 123 7.850 7.850 8.388 -0.538 17927 7319 1 9 . 1 1 124 124 ALA N N 124 131.373 131.373 127.483 3.890 17927 7320 1 9 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.116 0.369 17927 7321 1 9 . 1 1 124 124 ALA C C 124 175.147 175.147 175.649 -0.502 17927 7322 1 9 . 1 1 124 124 ALA CA C 124 53.035 53.035 54.077 -1.042 17927 7323 1 9 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.222 -0.560 17927 7324 1 9 . 1 1 124 124 ALA H H 124 9.384 9.384 8.934 0.450 17927 7325 1 9 . 1 1 125 125 ASN N N 125 119.476 119.476 110.674 8.802 17927 7326 1 9 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.529 -0.473 17927 7327 1 9 . 1 1 125 125 ASN C C 125 173.593 173.593 174.312 -0.719 17927 7328 1 9 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.084 0.268 17927 7329 1 9 . 1 1 125 125 ASN CB C 125 38.304 38.304 40.708 -2.404 17927 7330 1 9 . 1 1 125 125 ASN H H 125 8.191 8.191 7.611 0.580 17927 7331 1 9 . 1 1 126 126 MET N N 126 122.705 122.705 123.114 -0.409 17927 7332 1 9 . 1 1 126 126 MET HA H 126 4.585 4.585 4.624 -0.039 17927 7333 1 9 . 1 1 126 126 MET C C 126 175.215 175.215 175.469 -0.254 17927 7334 1 9 . 1 1 126 126 MET CA C 126 53.849 53.849 56.439 -2.590 17927 7335 1 9 . 1 1 126 126 MET CB C 126 31.312 31.312 33.888 -2.576 17927 7336 1 9 . 1 1 126 126 MET H H 126 8.376 8.376 9.397 -1.021 17927 7337 1 9 . 1 1 127 127 THR N N 127 111.016 111.016 110.354 0.662 17927 7338 1 9 . 1 1 127 127 THR HA H 127 4.291 4.291 4.066 0.225 17927 7339 1 9 . 1 1 127 127 THR C C 127 174.574 174.574 172.861 1.713 17927 7340 1 9 . 1 1 127 127 THR CA C 127 62.085 62.085 61.544 0.541 17927 7341 1 9 . 1 1 127 127 THR CB C 127 69.733 69.733 70.680 -0.947 17927 7342 1 9 . 1 1 127 127 THR H H 127 7.714 7.714 7.751 -0.037 17927 7343 1 9 . 1 1 128 128 ARG N N 128 118.722 118.722 120.655 -1.933 17927 7344 1 9 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.269 -0.961 17927 7345 1 9 . 1 1 128 128 ARG C C 128 176.978 176.978 174.151 2.827 17927 7346 1 9 . 1 1 128 128 ARG CA C 128 54.727 54.727 54.135 0.592 17927 7347 1 9 . 1 1 128 128 ARG CB C 128 29.598 29.598 31.453 -1.855 17927 7348 1 9 . 1 1 128 128 ARG H H 128 8.658 8.658 7.253 1.405 17927 7349 1 9 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.714 -0.781 17927 7350 1 9 . 1 1 129 129 PRO C C 129 175.794 175.794 177.419 -1.625 17927 7351 1 9 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.544 1.005 17927 7352 1 9 . 1 1 129 129 PRO CB C 129 31.677 31.677 32.107 -0.430 17927 7353 1 9 . 1 1 130 130 SER N N 130 108.696 108.696 112.597 -3.901 17927 7354 1 9 . 1 1 130 130 SER HA H 130 3.988 3.988 4.556 -0.568 17927 7355 1 9 . 1 1 130 130 SER C C 130 174.445 174.445 173.353 1.092 17927 7356 1 9 . 1 1 130 130 SER CA C 130 58.911 58.911 56.870 2.041 17927 7357 1 9 . 1 1 130 130 SER CB C 130 62.680 62.680 63.191 -0.511 17927 7358 1 9 . 1 1 130 130 SER H H 130 8.375 8.375 7.853 0.522 17927 7359 1 9 . 1 1 131 131 ASP N N 131 126.377 126.377 124.003 2.374 17927 7360 1 9 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.908 -0.036 17927 7361 1 9 . 1 1 131 131 ASP C C 131 176.879 176.879 175.206 1.673 17927 7362 1 9 . 1 1 131 131 ASP CA C 131 51.195 51.195 52.207 -1.012 17927 7363 1 9 . 1 1 131 131 ASP CB C 131 42.816 42.816 43.324 -0.508 17927 7364 1 9 . 1 1 131 131 ASP H H 131 7.514 7.514 7.793 -0.279 17927 7365 1 9 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.013 0.379 17927 7366 1 9 . 1 1 132 132 PRO C C 132 178.097 178.097 178.379 -0.282 17927 7367 1 9 . 1 1 132 132 PRO CA C 132 65.079 65.079 65.179 -0.100 17927 7368 1 9 . 1 1 132 132 PRO CB C 132 32.409 32.409 31.917 0.492 17927 7369 1 9 . 1 1 133 133 LYS N N 133 116.306 116.306 116.828 -0.522 17927 7370 1 9 . 1 1 133 133 LYS HA H 133 3.958 3.958 4.005 -0.047 17927 7371 1 9 . 1 1 133 133 LYS C C 133 179.532 179.532 179.041 0.491 17927 7372 1 9 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.084 -0.563 17927 7373 1 9 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.658 0.533 17927 7374 1 9 . 1 1 133 133 LYS H H 133 8.842 8.842 8.821 0.021 17927 7375 1 9 . 1 1 134 134 THR N N 134 120.833 120.833 115.641 5.192 17927 7376 1 9 . 1 1 134 134 THR HA H 134 3.147 3.147 3.621 -0.474 17927 7377 1 9 . 1 1 134 134 THR C C 134 173.356 173.356 175.077 -1.721 17927 7378 1 9 . 1 1 134 134 THR CA C 134 66.383 66.383 66.188 0.195 17927 7379 1 9 . 1 1 134 134 THR CB C 134 66.847 66.847 67.994 -1.147 17927 7380 1 9 . 1 1 134 134 THR H H 134 8.292 8.292 7.521 0.771 17927 7381 1 9 . 1 1 135 135 ALA N N 135 121.720 121.720 122.975 -1.255 17927 7382 1 9 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.272 0.311 17927 7383 1 9 . 1 1 135 135 ALA C C 135 178.902 178.902 179.203 -0.301 17927 7384 1 9 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.475 0.524 17927 7385 1 9 . 1 1 135 135 ALA CB C 135 17.775 17.775 17.813 -0.038 17927 7386 1 9 . 1 1 135 135 ALA H H 135 7.030 7.030 7.110 -0.080 17927 7387 1 9 . 1 1 136 136 GLU N N 136 114.623 114.623 119.171 -4.548 17927 7388 1 9 . 1 1 136 136 GLU HA H 136 3.922 3.922 3.849 0.073 17927 7389 1 9 . 1 1 136 136 GLU C C 136 179.199 179.199 178.919 0.280 17927 7390 1 9 . 1 1 136 136 GLU CA C 136 59.837 59.837 59.217 0.620 17927 7391 1 9 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.398 0.388 17927 7392 1 9 . 1 1 136 136 GLU H H 136 7.216 7.216 8.565 -1.349 17927 7393 1 9 . 1 1 137 137 LYS N N 137 120.789 120.789 119.798 0.991 17927 7394 1 9 . 1 1 137 137 LYS HA H 137 4.204 4.204 3.921 0.283 17927 7395 1 9 . 1 1 137 137 LYS C C 137 178.834 178.834 178.800 0.034 17927 7396 1 9 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.996 -1.653 17927 7397 1 9 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.798 -1.335 17927 7398 1 9 . 1 1 137 137 LYS H H 137 7.681 7.681 7.667 0.014 17927 7399 1 9 . 1 1 138 138 PHE N N 138 118.373 118.373 117.272 1.101 17927 7400 1 9 . 1 1 138 138 PHE HA H 138 4.033 4.033 4.123 -0.090 17927 7401 1 9 . 1 1 138 138 PHE C C 138 178.027 178.027 177.946 0.081 17927 7402 1 9 . 1 1 138 138 PHE CA C 138 57.507 57.507 59.584 -2.077 17927 7403 1 9 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.798 -1.909 17927 7404 1 9 . 1 1 138 138 PHE H H 138 8.059 8.059 7.083 0.976 17927 7405 1 9 . 1 1 139 139 ASN N N 139 117.611 117.611 117.616 -0.005 17927 7406 1 9 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.407 -0.003 17927 7407 1 9 . 1 1 139 139 ASN C C 139 178.190 178.190 177.849 0.341 17927 7408 1 9 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.193 0.031 17927 7409 1 9 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.880 -1.146 17927 7410 1 9 . 1 1 139 139 ASN H H 139 8.683 8.683 8.748 -0.065 17927 7411 1 9 . 1 1 140 140 GLU N N 140 121.432 121.432 120.634 0.798 17927 7412 1 9 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.007 -0.002 17927 7413 1 9 . 1 1 140 140 GLU C C 140 179.751 179.751 179.446 0.305 17927 7414 1 9 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.576 -0.266 17927 7415 1 9 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.725 0.330 17927 7416 1 9 . 1 1 140 140 GLU H H 140 7.868 7.868 8.475 -0.607 17927 7417 1 9 . 1 1 141 141 LEU N N 141 119.968 119.968 117.783 2.185 17927 7418 1 9 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.272 -0.256 17927 7419 1 9 . 1 1 141 141 LEU C C 141 179.293 179.293 178.424 0.869 17927 7420 1 9 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.778 -0.342 17927 7421 1 9 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.795 -0.612 17927 7422 1 9 . 1 1 141 141 LEU H H 141 8.303 8.303 7.790 0.513 17927 7423 1 9 . 1 1 142 142 LEU N N 142 115.040 115.040 119.509 -4.469 17927 7424 1 9 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.466 -0.082 17927 7425 1 9 . 1 1 142 142 LEU C C 142 178.002 178.002 177.510 0.492 17927 7426 1 9 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.387 -0.108 17927 7427 1 9 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.298 0.348 17927 7428 1 9 . 1 1 142 142 LEU H H 142 8.230 8.230 7.877 0.353 17927 7429 1 9 . 1 1 143 143 GLY N N 143 108.977 108.977 106.166 2.811 17927 7430 1 9 . 1 1 143 143 GLY C C 143 175.216 175.216 174.278 0.938 17927 7431 1 9 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.335 1.406 17927 7432 1 9 . 1 1 143 143 GLY H H 143 7.762 7.762 7.745 0.017 17927 7433 1 9 . 1 1 144 144 LEU N N 144 119.660 119.660 120.350 -0.690 17927 7434 1 9 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.444 0.044 17927 7435 1 9 . 1 1 144 144 LEU C C 144 177.375 177.375 176.999 0.376 17927 7436 1 9 . 1 1 144 144 LEU CA C 144 54.525 54.525 56.082 -1.557 17927 7437 1 9 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.693 0.080 17927 7438 1 9 . 1 1 144 144 LEU H H 144 8.241 8.241 8.131 0.110 17927 7439 1 9 . 1 1 145 145 GLU N N 145 119.959 119.959 116.149 3.810 17927 7440 1 9 . 1 1 145 145 GLU HA H 145 4.241 4.241 3.867 0.374 17927 7441 1 9 . 1 1 145 145 GLU C C 145 177.075 177.075 176.658 0.417 17927 7442 1 9 . 1 1 145 145 GLU CA C 145 56.799 56.799 58.825 -2.026 17927 7443 1 9 . 1 1 145 145 GLU CB C 145 30.168 30.168 28.454 1.714 17927 7444 1 9 . 1 1 145 145 GLU H H 145 8.410 8.410 8.124 0.286 17927 7445 1 9 . 1 1 146 146 GLY N N 146 109.412 109.412 106.178 3.234 17927 7446 1 9 . 1 1 146 146 GLY C C 146 174.276 174.276 173.710 0.566 17927 7447 1 9 . 1 1 146 146 GLY CA C 146 45.445 45.445 44.413 1.032 17927 7448 1 9 . 1 1 146 146 GLY H H 146 8.422 8.422 8.080 0.342 17927 7449 1 9 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.420 0.236 17927 7450 1 9 . 1 1 151 151 HIS C C 151 173.990 173.990 173.192 0.798 17927 7451 1 9 . 1 1 151 151 HIS CA C 151 56.044 56.044 56.474 -0.430 17927 7452 1 9 . 1 1 151 151 HIS CB C 151 30.076 30.076 30.515 -0.439 17927 7453 1 10 . 1 1 2 2 SER HA H 2 4.121 4.121 4.100 0.021 17927 7454 1 10 . 1 1 2 2 SER CA C 2 57.293 57.293 60.300 -3.007 17927 7455 1 10 . 1 1 2 2 SER CB C 2 63.545 63.545 62.198 1.347 17927 7456 1 10 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.506 -0.074 17927 7457 1 10 . 1 1 3 3 LEU C C 3 177.383 177.383 176.206 1.177 17927 7458 1 10 . 1 1 3 3 LEU CA C 3 55.575 55.575 54.925 0.650 17927 7459 1 10 . 1 1 3 3 LEU CB C 3 42.584 42.584 41.689 0.895 17927 7460 1 10 . 1 1 4 4 ARG N N 4 122.080 122.080 121.826 0.254 17927 7461 1 10 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.095 0.289 17927 7462 1 10 . 1 1 4 4 ARG C C 4 176.410 176.410 175.227 1.183 17927 7463 1 10 . 1 1 4 4 ARG CA C 4 56.269 56.269 56.745 -0.476 17927 7464 1 10 . 1 1 4 4 ARG CB C 4 30.842 30.842 29.336 1.506 17927 7465 1 10 . 1 1 4 4 ARG H H 4 8.410 8.410 8.364 0.046 17927 7466 1 10 . 1 1 5 5 SER N N 5 117.023 117.023 119.162 -2.139 17927 7467 1 10 . 1 1 5 5 SER HA H 5 4.423 4.423 4.664 -0.241 17927 7468 1 10 . 1 1 5 5 SER C C 5 175.039 175.039 174.003 1.036 17927 7469 1 10 . 1 1 5 5 SER CA C 5 58.605 58.605 58.421 0.184 17927 7470 1 10 . 1 1 5 5 SER CB C 5 64.044 64.044 63.001 1.043 17927 7471 1 10 . 1 1 5 5 SER H H 5 8.292 8.292 8.605 -0.313 17927 7472 1 10 . 1 1 6 6 GLY N N 6 110.718 110.718 112.486 -1.768 17927 7473 1 10 . 1 1 6 6 GLY C C 6 173.654 173.654 172.274 1.380 17927 7474 1 10 . 1 1 6 6 GLY CA C 6 45.273 45.273 45.155 0.118 17927 7475 1 10 . 1 1 6 6 GLY H H 6 8.446 8.446 8.259 0.187 17927 7476 1 10 . 1 1 7 7 ASN N N 7 119.287 119.287 120.520 -1.233 17927 7477 1 10 . 1 1 7 7 ASN HA H 7 5.024 5.024 4.883 0.141 17927 7478 1 10 . 1 1 7 7 ASN C C 7 173.672 173.672 173.690 -0.018 17927 7479 1 10 . 1 1 7 7 ASN CA C 7 51.357 51.357 52.401 -1.044 17927 7480 1 10 . 1 1 7 7 ASN CB C 7 38.927 38.927 38.607 0.320 17927 7481 1 10 . 1 1 7 7 ASN H H 7 8.273 8.273 8.362 -0.089 17927 7482 1 10 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.719 -0.272 17927 7483 1 10 . 1 1 8 8 PRO C C 8 176.899 176.899 176.570 0.329 17927 7484 1 10 . 1 1 8 8 PRO CA C 8 63.429 63.429 62.783 0.646 17927 7485 1 10 . 1 1 8 8 PRO CB C 8 32.216 32.216 32.554 -0.338 17927 7486 1 10 . 1 1 9 9 SER N N 9 115.642 115.642 114.191 1.451 17927 7487 1 10 . 1 1 9 9 SER HA H 9 4.415 4.415 4.535 -0.120 17927 7488 1 10 . 1 1 9 9 SER C C 9 174.714 174.714 173.972 0.742 17927 7489 1 10 . 1 1 9 9 SER CA C 9 58.488 58.488 57.282 1.206 17927 7490 1 10 . 1 1 9 9 SER CB C 9 64.048 64.048 66.352 -2.304 17927 7491 1 10 . 1 1 9 9 SER H H 9 8.336 8.336 8.435 -0.099 17927 7492 1 10 . 1 1 10 10 ALA N N 10 126.808 126.808 124.672 2.136 17927 7493 1 10 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.359 -0.097 17927 7494 1 10 . 1 1 10 10 ALA C C 10 177.233 177.233 176.492 0.741 17927 7495 1 10 . 1 1 10 10 ALA CA C 10 53.230 53.230 51.871 1.359 17927 7496 1 10 . 1 1 10 10 ALA CB C 10 19.187 19.187 17.243 1.944 17927 7497 1 10 . 1 1 10 10 ALA H H 10 8.137 8.137 8.424 -0.287 17927 7498 1 10 . 1 1 11 11 ALA N N 11 120.449 120.449 126.536 -6.087 17927 7499 1 10 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.656 -0.395 17927 7500 1 10 . 1 1 11 11 ALA C C 11 177.469 177.469 176.384 1.085 17927 7501 1 10 . 1 1 11 11 ALA CA C 11 52.475 52.475 51.949 0.526 17927 7502 1 10 . 1 1 11 11 ALA CB C 11 19.485 19.485 20.161 -0.676 17927 7503 1 10 . 1 1 11 11 ALA H H 11 7.851 7.851 7.842 0.009 17927 7504 1 10 . 1 1 12 12 SER N N 12 114.186 114.186 117.789 -3.603 17927 7505 1 10 . 1 1 12 12 SER HA H 12 4.312 4.312 4.112 0.200 17927 7506 1 10 . 1 1 12 12 SER C C 12 173.593 173.593 173.671 -0.078 17927 7507 1 10 . 1 1 12 12 SER CA C 12 58.099 58.099 58.671 -0.572 17927 7508 1 10 . 1 1 12 12 SER CB C 12 63.320 63.320 62.771 0.549 17927 7509 1 10 . 1 1 12 12 SER H H 12 7.990 7.990 8.719 -0.729 17927 7510 1 10 . 1 1 13 13 PHE N N 13 118.092 118.092 119.874 -1.782 17927 7511 1 10 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.789 -0.009 17927 7512 1 10 . 1 1 13 13 PHE C C 13 174.220 174.220 174.214 0.006 17927 7513 1 10 . 1 1 13 13 PHE CA C 13 56.717 56.717 56.174 0.543 17927 7514 1 10 . 1 1 13 13 PHE CB C 13 41.151 41.151 40.786 0.365 17927 7515 1 10 . 1 1 13 13 PHE H H 13 7.147 7.147 7.937 -0.790 17927 7516 1 10 . 1 1 14 14 SER N N 14 116.456 116.456 115.626 0.830 17927 7517 1 10 . 1 1 14 14 SER HA H 14 5.162 5.162 4.864 0.298 17927 7518 1 10 . 1 1 14 14 SER C C 14 172.626 172.626 172.671 -0.045 17927 7519 1 10 . 1 1 14 14 SER CA C 14 57.390 57.390 57.327 0.063 17927 7520 1 10 . 1 1 14 14 SER CB C 14 64.518 64.518 64.094 0.424 17927 7521 1 10 . 1 1 14 14 SER H H 14 7.616 7.616 8.189 -0.573 17927 7522 1 10 . 1 1 15 15 TYR N N 15 122.384 122.384 123.485 -1.101 17927 7523 1 10 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.998 0.208 17927 7524 1 10 . 1 1 15 15 TYR C C 15 172.543 172.543 173.424 -0.881 17927 7525 1 10 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.367 -0.421 17927 7526 1 10 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.915 0.312 17927 7527 1 10 . 1 1 15 15 TYR H H 15 8.558 8.558 9.323 -0.765 17927 7528 1 10 . 1 1 16 16 PRO HA H 16 5.109 5.109 5.144 -0.035 17927 7529 1 10 . 1 1 16 16 PRO C C 16 176.475 176.475 176.359 0.116 17927 7530 1 10 . 1 1 16 16 PRO CA C 16 61.981 61.981 61.971 0.010 17927 7531 1 10 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.439 0.223 17927 7532 1 10 . 1 1 17 17 ASP N N 17 119.834 119.834 124.635 -4.801 17927 7533 1 10 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.943 0.796 17927 7534 1 10 . 1 1 17 17 ASP C C 17 180.740 180.740 178.465 2.275 17927 7535 1 10 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.885 -2.168 17927 7536 1 10 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.591 -1.030 17927 7537 1 10 . 1 1 17 17 ASP H H 17 8.643 8.643 8.864 -0.221 17927 7538 1 10 . 1 1 18 18 ILE N N 18 118.340 118.340 124.086 -5.746 17927 7539 1 10 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.950 0.501 17927 7540 1 10 . 1 1 18 18 ILE C C 18 175.742 175.742 176.083 -0.341 17927 7541 1 10 . 1 1 18 18 ILE CA C 18 61.894 61.894 63.780 -1.886 17927 7542 1 10 . 1 1 18 18 ILE CB C 18 39.240 39.240 37.857 1.383 17927 7543 1 10 . 1 1 18 18 ILE H H 18 8.450 8.450 8.647 -0.197 17927 7544 1 10 . 1 1 19 19 ASN N N 19 119.377 119.377 117.074 2.303 17927 7545 1 10 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.681 0.334 17927 7546 1 10 . 1 1 19 19 ASN C C 19 175.892 175.892 175.705 0.187 17927 7547 1 10 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.058 -0.751 17927 7548 1 10 . 1 1 19 19 ASN CB C 19 39.825 39.825 39.412 0.413 17927 7549 1 10 . 1 1 19 19 ASN H H 19 8.376 8.376 8.882 -0.506 17927 7550 1 10 . 1 1 20 20 GLY N N 20 109.535 109.535 108.606 0.929 17927 7551 1 10 . 1 1 20 20 GLY C C 20 174.285 174.285 173.168 1.117 17927 7552 1 10 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.076 0.717 17927 7553 1 10 . 1 1 20 20 GLY H H 20 8.539 8.539 8.460 0.079 17927 7554 1 10 . 1 1 21 21 LYS N N 21 124.675 124.675 120.755 3.920 17927 7555 1 10 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.591 -0.148 17927 7556 1 10 . 1 1 21 21 LYS C C 21 176.537 176.537 176.005 0.532 17927 7557 1 10 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.346 1.098 17927 7558 1 10 . 1 1 21 21 LYS CB C 21 32.754 32.754 34.048 -1.294 17927 7559 1 10 . 1 1 21 21 LYS H H 21 8.608 8.608 7.591 1.017 17927 7560 1 10 . 1 1 22 22 THR N N 22 120.666 120.666 123.810 -3.144 17927 7561 1 10 . 1 1 22 22 THR HA H 22 4.087 4.087 4.131 -0.044 17927 7562 1 10 . 1 1 22 22 THR C C 22 174.431 174.431 173.857 0.574 17927 7563 1 10 . 1 1 22 22 THR CA C 22 64.292 64.292 63.872 0.420 17927 7564 1 10 . 1 1 22 22 THR CB C 22 69.069 69.069 68.631 0.438 17927 7565 1 10 . 1 1 22 22 THR H H 22 8.595 8.595 8.805 -0.210 17927 7566 1 10 . 1 1 23 23 VAL N N 23 131.207 131.207 130.397 0.810 17927 7567 1 10 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.298 -0.106 17927 7568 1 10 . 1 1 23 23 VAL C C 23 174.244 174.244 174.548 -0.304 17927 7569 1 10 . 1 1 23 23 VAL CA C 23 62.456 62.456 61.379 1.077 17927 7570 1 10 . 1 1 23 23 VAL CB C 23 33.791 33.791 33.652 0.139 17927 7571 1 10 . 1 1 23 23 VAL H H 23 8.937 8.937 9.000 -0.063 17927 7572 1 10 . 1 1 24 24 SER N N 24 120.787 120.787 121.988 -1.201 17927 7573 1 10 . 1 1 24 24 SER HA H 24 5.407 5.407 5.196 0.211 17927 7574 1 10 . 1 1 24 24 SER C C 24 176.169 176.169 174.988 1.181 17927 7575 1 10 . 1 1 24 24 SER CA C 24 55.135 55.135 56.097 -0.962 17927 7576 1 10 . 1 1 24 24 SER CB C 24 65.646 65.646 65.593 0.054 17927 7577 1 10 . 1 1 24 24 SER H H 24 8.554 8.554 8.529 0.025 17927 7578 1 10 . 1 1 25 25 LEU N N 25 124.332 124.332 124.193 0.139 17927 7579 1 10 . 1 1 25 25 LEU HA H 25 3.687 3.687 3.587 0.100 17927 7580 1 10 . 1 1 25 25 LEU C C 25 179.364 179.364 176.957 2.407 17927 7581 1 10 . 1 1 25 25 LEU CA C 25 58.217 58.217 57.462 0.756 17927 7582 1 10 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.933 -1.395 17927 7583 1 10 . 1 1 25 25 LEU H H 25 7.811 7.811 7.935 -0.124 17927 7584 1 10 . 1 1 26 26 ALA N N 26 119.799 119.799 115.904 3.895 17927 7585 1 10 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.072 -0.079 17927 7586 1 10 . 1 1 26 26 ALA C C 26 179.719 179.719 177.001 2.718 17927 7587 1 10 . 1 1 26 26 ALA CA C 26 54.663 54.663 52.939 1.724 17927 7588 1 10 . 1 1 26 26 ALA CB C 26 18.323 18.323 18.040 0.283 17927 7589 1 10 . 1 1 26 26 ALA H H 26 8.099 8.099 8.090 0.009 17927 7590 1 10 . 1 1 27 27 ASP N N 27 116.553 116.553 118.502 -1.949 17927 7591 1 10 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.634 -0.161 17927 7592 1 10 . 1 1 27 27 ASP C C 27 176.915 176.915 176.660 0.255 17927 7593 1 10 . 1 1 27 27 ASP CA C 27 56.251 56.251 54.891 1.360 17927 7594 1 10 . 1 1 27 27 ASP CB C 27 40.788 40.788 42.095 -1.307 17927 7595 1 10 . 1 1 27 27 ASP H H 27 7.572 7.572 7.761 -0.189 17927 7596 1 10 . 1 1 28 28 LEU N N 28 118.950 118.950 118.280 0.670 17927 7597 1 10 . 1 1 28 28 LEU HA H 28 4.233 4.233 3.941 0.292 17927 7598 1 10 . 1 1 28 28 LEU C C 28 175.542 175.542 176.422 -0.880 17927 7599 1 10 . 1 1 28 28 LEU CA C 28 53.706 53.706 54.106 -0.400 17927 7600 1 10 . 1 1 28 28 LEU CB C 28 41.049 41.049 42.521 -1.472 17927 7601 1 10 . 1 1 28 28 LEU H H 28 7.363 7.363 7.330 0.033 17927 7602 1 10 . 1 1 29 29 LYS N N 29 118.429 118.429 121.392 -2.963 17927 7603 1 10 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.159 0.193 17927 7604 1 10 . 1 1 29 29 LYS C C 29 178.063 178.063 177.723 0.340 17927 7605 1 10 . 1 1 29 29 LYS CA C 29 57.777 57.777 58.196 -0.419 17927 7606 1 10 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.313 1.127 17927 7607 1 10 . 1 1 29 29 LYS H H 29 6.780 6.780 7.546 -0.766 17927 7608 1 10 . 1 1 30 30 GLY N N 30 112.426 112.426 113.287 -0.861 17927 7609 1 10 . 1 1 30 30 GLY C C 30 173.801 173.801 173.433 0.368 17927 7610 1 10 . 1 1 30 30 GLY CA C 30 44.611 44.611 44.832 -0.221 17927 7611 1 10 . 1 1 30 30 GLY H H 30 9.398 9.398 9.003 0.395 17927 7612 1 10 . 1 1 31 31 LYS N N 31 119.295 119.295 119.965 -0.670 17927 7613 1 10 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.392 -0.240 17927 7614 1 10 . 1 1 31 31 LYS C C 31 173.862 173.862 175.374 -1.512 17927 7615 1 10 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.798 0.390 17927 7616 1 10 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.037 1.931 17927 7617 1 10 . 1 1 31 31 LYS H H 31 7.496 7.496 7.387 0.109 17927 7618 1 10 . 1 1 32 32 TYR N N 32 116.984 116.984 121.451 -4.467 17927 7619 1 10 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.525 -0.368 17927 7620 1 10 . 1 1 32 32 TYR C C 32 175.226 175.226 175.750 -0.524 17927 7621 1 10 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.425 0.165 17927 7622 1 10 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.063 0.058 17927 7623 1 10 . 1 1 32 32 TYR H H 32 7.521 7.521 8.068 -0.547 17927 7624 1 10 . 1 1 33 33 ILE N N 33 118.052 118.052 120.095 -2.043 17927 7625 1 10 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.590 0.317 17927 7626 1 10 . 1 1 33 33 ILE C C 33 174.308 174.308 174.195 0.113 17927 7627 1 10 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.342 0.360 17927 7628 1 10 . 1 1 33 33 ILE CB C 33 41.616 41.616 41.132 0.484 17927 7629 1 10 . 1 1 33 33 ILE H H 33 8.467 8.467 8.878 -0.411 17927 7630 1 10 . 1 1 34 34 TYR N N 34 130.242 130.242 128.022 2.220 17927 7631 1 10 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.158 0.368 17927 7632 1 10 . 1 1 34 34 TYR C C 34 174.245 174.245 173.346 0.899 17927 7633 1 10 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.965 0.193 17927 7634 1 10 . 1 1 34 34 TYR CB C 34 40.133 40.133 42.057 -1.924 17927 7635 1 10 . 1 1 34 34 TYR H H 34 8.905 8.905 9.239 -0.334 17927 7636 1 10 . 1 1 35 35 ILE N N 35 128.697 128.697 128.768 -0.071 17927 7637 1 10 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.107 0.235 17927 7638 1 10 . 1 1 35 35 ILE C C 35 174.520 174.520 174.121 0.399 17927 7639 1 10 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.481 0.268 17927 7640 1 10 . 1 1 35 35 ILE CB C 35 40.899 40.899 39.125 1.774 17927 7641 1 10 . 1 1 35 35 ILE H H 35 9.445 9.445 8.431 1.014 17927 7642 1 10 . 1 1 36 36 ASP N N 36 123.675 123.675 126.125 -2.450 17927 7643 1 10 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.467 -0.619 17927 7644 1 10 . 1 1 36 36 ASP C C 36 174.385 174.385 175.506 -1.121 17927 7645 1 10 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.480 -0.186 17927 7646 1 10 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.207 -2.429 17927 7647 1 10 . 1 1 36 36 ASP H H 36 8.875 8.875 8.214 0.661 17927 7648 1 10 . 1 1 37 37 VAL N N 37 127.159 127.159 119.073 8.086 17927 7649 1 10 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.746 0.213 17927 7650 1 10 . 1 1 37 37 VAL C C 37 175.046 175.046 175.969 -0.923 17927 7651 1 10 . 1 1 37 37 VAL CA C 37 62.245 62.245 61.057 1.188 17927 7652 1 10 . 1 1 37 37 VAL CB C 37 31.807 31.807 32.544 -0.737 17927 7653 1 10 . 1 1 37 37 VAL H H 37 8.603 8.603 7.958 0.645 17927 7654 1 10 . 1 1 38 38 TRP N N 38 124.161 124.161 126.434 -2.273 17927 7655 1 10 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.202 0.035 17927 7656 1 10 . 1 1 38 38 TRP C C 38 171.995 171.995 173.648 -1.653 17927 7657 1 10 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.440 1.767 17927 7658 1 10 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.472 2.715 17927 7659 1 10 . 1 1 38 38 TRP H H 38 8.562 8.562 8.214 0.348 17927 7660 1 10 . 1 1 39 39 ALA N N 39 116.252 116.252 125.974 -9.722 17927 7661 1 10 . 1 1 39 39 ALA HA H 39 3.678 3.678 3.291 0.387 17927 7662 1 10 . 1 1 39 39 ALA C C 39 178.664 178.664 175.135 3.529 17927 7663 1 10 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.537 0.929 17927 7664 1 10 . 1 1 39 39 ALA CB C 39 22.341 22.341 20.916 1.425 17927 7665 1 10 . 1 1 39 39 ALA H H 39 6.757 6.757 7.696 -0.939 17927 7666 1 10 . 1 1 40 40 THR N N 40 114.321 114.321 113.315 1.006 17927 7667 1 10 . 1 1 40 40 THR HA H 40 3.907 3.907 4.678 -0.771 17927 7668 1 10 . 1 1 40 40 THR C C 40 175.885 175.885 175.419 0.466 17927 7669 1 10 . 1 1 40 40 THR CA C 40 65.447 65.447 62.685 2.762 17927 7670 1 10 . 1 1 40 40 THR CB C 40 70.106 70.106 70.261 -0.155 17927 7671 1 10 . 1 1 40 40 THR H H 40 9.639 9.639 8.763 0.876 17927 7672 1 10 . 1 1 41 41 TRP N N 41 114.483 114.483 120.958 -6.475 17927 7673 1 10 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.559 0.004 17927 7674 1 10 . 1 1 41 41 TRP C C 41 176.189 176.189 176.625 -0.436 17927 7675 1 10 . 1 1 41 41 TRP CA C 41 54.698 54.698 57.975 -3.277 17927 7676 1 10 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.690 1.287 17927 7677 1 10 . 1 1 41 41 TRP H H 41 6.401 6.401 7.662 -1.261 17927 7678 1 10 . 1 1 42 42 CYS N N 42 123.536 123.536 117.719 5.817 17927 7679 1 10 . 1 1 42 42 CYS HA H 42 4.568 4.568 3.743 0.825 17927 7680 1 10 . 1 1 42 42 CYS C C 42 175.726 175.726 175.751 -0.025 17927 7681 1 10 . 1 1 42 42 CYS CA C 42 58.700 58.700 60.837 -2.137 17927 7682 1 10 . 1 1 42 42 CYS CB C 42 27.121 27.121 27.877 -0.756 17927 7683 1 10 . 1 1 42 42 CYS H H 42 6.883 6.883 7.454 -0.571 17927 7684 1 10 . 1 1 43 43 GLY N N 43 120.977 120.977 107.690 13.287 17927 7685 1 10 . 1 1 43 43 GLY CA C 43 49.204 49.204 45.139 4.065 17927 7686 1 10 . 1 1 43 43 GLY H H 43 9.653 9.653 7.552 2.101 17927 7687 1 10 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.356 0.131 17927 7688 1 10 . 1 1 44 44 PRO C C 44 179.956 179.956 177.820 2.136 17927 7689 1 10 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.138 0.504 17927 7690 1 10 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.495 1.083 17927 7691 1 10 . 1 1 45 45 CYS N N 45 113.925 113.925 114.949 -1.024 17927 7692 1 10 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.131 0.182 17927 7693 1 10 . 1 1 45 45 CYS C C 45 178.325 178.325 175.452 2.873 17927 7694 1 10 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.243 2.149 17927 7695 1 10 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.347 1.158 17927 7696 1 10 . 1 1 45 45 CYS H H 45 7.676 7.676 7.626 0.050 17927 7697 1 10 . 1 1 46 46 ARG N N 46 120.336 120.336 116.952 3.384 17927 7698 1 10 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.348 -0.279 17927 7699 1 10 . 1 1 46 46 ARG C C 46 180.446 180.446 178.464 1.982 17927 7700 1 10 . 1 1 46 46 ARG CA C 46 59.785 59.785 57.950 1.835 17927 7701 1 10 . 1 1 46 46 ARG CB C 46 29.868 29.868 30.210 -0.342 17927 7702 1 10 . 1 1 46 46 ARG H H 46 8.109 8.109 8.009 0.100 17927 7703 1 10 . 1 1 47 47 GLY N N 47 105.408 105.408 108.209 -2.801 17927 7704 1 10 . 1 1 47 47 GLY C C 47 175.258 175.258 175.291 -0.033 17927 7705 1 10 . 1 1 47 47 GLY CA C 47 46.594 46.594 46.007 0.587 17927 7706 1 10 . 1 1 47 47 GLY H H 47 8.466 8.466 7.779 0.687 17927 7707 1 10 . 1 1 48 48 GLU N N 48 116.343 116.343 120.148 -3.805 17927 7708 1 10 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.467 0.058 17927 7709 1 10 . 1 1 48 48 GLU C C 48 176.535 176.535 177.303 -0.768 17927 7710 1 10 . 1 1 48 48 GLU CA C 48 55.792 55.792 55.982 -0.190 17927 7711 1 10 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.622 1.360 17927 7712 1 10 . 1 1 48 48 GLU H H 48 7.050 7.050 8.382 -1.332 17927 7713 1 10 . 1 1 49 49 LEU N N 49 118.652 118.652 122.844 -4.192 17927 7714 1 10 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.338 -0.186 17927 7715 1 10 . 1 1 49 49 LEU C C 49 176.832 176.832 175.385 1.447 17927 7716 1 10 . 1 1 49 49 LEU CA C 49 59.345 59.345 59.752 -0.407 17927 7717 1 10 . 1 1 49 49 LEU CB C 49 38.496 38.496 40.226 -1.730 17927 7718 1 10 . 1 1 49 49 LEU H H 49 7.385 7.385 7.162 0.223 17927 7719 1 10 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.194 0.059 17927 7720 1 10 . 1 1 50 50 PRO C C 50 179.744 179.744 178.087 1.657 17927 7721 1 10 . 1 1 50 50 PRO CA C 50 66.559 66.559 65.728 0.831 17927 7722 1 10 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.608 0.154 17927 7723 1 10 . 1 1 51 51 ALA N N 51 120.418 120.418 119.114 1.304 17927 7724 1 10 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.219 -0.074 17927 7725 1 10 . 1 1 51 51 ALA C C 51 180.329 180.329 179.257 1.072 17927 7726 1 10 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.507 -0.073 17927 7727 1 10 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.633 -0.263 17927 7728 1 10 . 1 1 51 51 ALA H H 51 7.731 7.731 7.057 0.674 17927 7729 1 10 . 1 1 52 52 LEU N N 52 121.506 121.506 120.520 0.986 17927 7730 1 10 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.954 0.034 17927 7731 1 10 . 1 1 52 52 LEU C C 52 177.944 177.944 178.411 -0.467 17927 7732 1 10 . 1 1 52 52 LEU CA C 52 58.327 58.327 58.066 0.261 17927 7733 1 10 . 1 1 52 52 LEU CB C 52 42.382 42.382 42.097 0.285 17927 7734 1 10 . 1 1 52 52 LEU H H 52 8.355 8.355 8.022 0.333 17927 7735 1 10 . 1 1 53 53 LYS N N 53 119.732 119.732 119.302 0.430 17927 7736 1 10 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.856 0.047 17927 7737 1 10 . 1 1 53 53 LYS C C 53 179.030 179.030 179.015 0.015 17927 7738 1 10 . 1 1 53 53 LYS CA C 53 59.846 59.846 59.837 0.009 17927 7739 1 10 . 1 1 53 53 LYS CB C 53 32.211 32.211 32.004 0.207 17927 7740 1 10 . 1 1 53 53 LYS H H 53 8.148 8.148 8.584 -0.436 17927 7741 1 10 . 1 1 54 54 GLU N N 54 117.779 117.779 119.455 -1.676 17927 7742 1 10 . 1 1 54 54 GLU HA H 54 4.059 4.059 3.977 0.082 17927 7743 1 10 . 1 1 54 54 GLU C C 54 179.646 179.646 178.959 0.687 17927 7744 1 10 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.621 0.004 17927 7745 1 10 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.489 0.078 17927 7746 1 10 . 1 1 54 54 GLU H H 54 7.585 7.585 7.662 -0.077 17927 7747 1 10 . 1 1 55 55 LEU N N 55 120.581 120.581 120.419 0.162 17927 7748 1 10 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.126 0.067 17927 7749 1 10 . 1 1 55 55 LEU C C 55 178.557 178.557 178.499 0.058 17927 7750 1 10 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.788 0.448 17927 7751 1 10 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.903 1.108 17927 7752 1 10 . 1 1 55 55 LEU H H 55 8.096 8.096 7.654 0.442 17927 7753 1 10 . 1 1 56 56 GLU N N 56 118.023 118.023 119.115 -1.092 17927 7754 1 10 . 1 1 56 56 GLU HA H 56 3.177 3.177 1.880 1.297 17927 7755 1 10 . 1 1 56 56 GLU C C 56 179.650 179.650 178.825 0.825 17927 7756 1 10 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.219 -0.348 17927 7757 1 10 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.093 -2.107 17927 7758 1 10 . 1 1 56 56 GLU H H 56 8.181 8.181 8.241 -0.060 17927 7759 1 10 . 1 1 57 57 GLU N N 57 117.828 117.828 117.365 0.463 17927 7760 1 10 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.032 0.072 17927 7761 1 10 . 1 1 57 57 GLU C C 57 179.700 179.700 178.245 1.455 17927 7762 1 10 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.061 0.966 17927 7763 1 10 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.629 0.036 17927 7764 1 10 . 1 1 57 57 GLU H H 57 7.762 7.762 8.257 -0.495 17927 7765 1 10 . 1 1 58 58 LYS N N 58 120.896 120.896 118.532 2.364 17927 7766 1 10 . 1 1 58 58 LYS HA H 58 3.979 3.979 4.089 -0.110 17927 7767 1 10 . 1 1 58 58 LYS C C 58 178.715 178.715 178.626 0.089 17927 7768 1 10 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.914 0.164 17927 7769 1 10 . 1 1 58 58 LYS CB C 58 32.980 32.980 33.028 -0.048 17927 7770 1 10 . 1 1 58 58 LYS H H 58 8.410 8.410 7.648 0.762 17927 7771 1 10 . 1 1 59 59 TYR N N 59 113.713 113.713 116.854 -3.141 17927 7772 1 10 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.597 -0.285 17927 7773 1 10 . 1 1 59 59 TYR C C 59 175.025 175.025 175.065 -0.040 17927 7774 1 10 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.919 2.054 17927 7775 1 10 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.349 -0.915 17927 7776 1 10 . 1 1 59 59 TYR H H 59 8.102 8.102 8.246 -0.144 17927 7777 1 10 . 1 1 60 60 ALA N N 60 126.637 126.637 122.500 4.137 17927 7778 1 10 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.504 -0.086 17927 7779 1 10 . 1 1 60 60 ALA C C 60 179.208 179.208 177.704 1.504 17927 7780 1 10 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.260 1.274 17927 7781 1 10 . 1 1 60 60 ALA CB C 60 18.589 18.589 19.131 -0.542 17927 7782 1 10 . 1 1 60 60 ALA H H 60 7.201 7.201 7.546 -0.345 17927 7783 1 10 . 1 1 61 61 GLY N N 61 111.816 111.816 110.641 1.175 17927 7784 1 10 . 1 1 61 61 GLY C C 61 174.698 174.698 174.815 -0.117 17927 7785 1 10 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.687 0.217 17927 7786 1 10 . 1 1 61 61 GLY H H 61 9.184 9.184 9.142 0.042 17927 7787 1 10 . 1 1 62 62 LYS N N 62 118.497 118.497 120.508 -2.011 17927 7788 1 10 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.440 0.439 17927 7789 1 10 . 1 1 62 62 LYS C C 62 179.019 179.019 176.605 2.414 17927 7790 1 10 . 1 1 62 62 LYS CA C 62 53.988 53.988 54.309 -0.321 17927 7791 1 10 . 1 1 62 62 LYS CB C 62 33.840 33.840 32.824 1.016 17927 7792 1 10 . 1 1 62 62 LYS H H 62 8.019 8.019 7.528 0.491 17927 7793 1 10 . 1 1 63 63 ASP N N 63 122.982 122.982 120.925 2.057 17927 7794 1 10 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.663 -0.136 17927 7795 1 10 . 1 1 63 63 ASP C C 63 174.065 174.065 174.359 -0.294 17927 7796 1 10 . 1 1 63 63 ASP CA C 63 55.055 55.055 53.902 1.153 17927 7797 1 10 . 1 1 63 63 ASP CB C 63 38.582 38.582 39.950 -1.368 17927 7798 1 10 . 1 1 63 63 ASP H H 63 8.709 8.709 8.588 0.121 17927 7799 1 10 . 1 1 64 64 ILE N N 64 122.219 122.219 117.563 4.656 17927 7800 1 10 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.425 0.182 17927 7801 1 10 . 1 1 64 64 ILE C C 64 174.627 174.627 173.441 1.186 17927 7802 1 10 . 1 1 64 64 ILE CA C 64 59.712 59.712 59.919 -0.207 17927 7803 1 10 . 1 1 64 64 ILE CB C 64 42.133 42.133 40.902 1.231 17927 7804 1 10 . 1 1 64 64 ILE H H 64 8.678 8.678 7.102 1.576 17927 7805 1 10 . 1 1 65 65 HIS N N 65 125.584 125.584 127.162 -1.578 17927 7806 1 10 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.941 0.102 17927 7807 1 10 . 1 1 65 65 HIS C C 65 174.153 174.153 173.807 0.346 17927 7808 1 10 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.444 0.515 17927 7809 1 10 . 1 1 65 65 HIS CB C 65 34.156 34.156 30.748 3.408 17927 7810 1 10 . 1 1 65 65 HIS H H 65 9.204 9.204 8.800 0.404 17927 7811 1 10 . 1 1 66 66 PHE N N 66 123.244 123.244 125.645 -2.401 17927 7812 1 10 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.574 0.636 17927 7813 1 10 . 1 1 66 66 PHE C C 66 175.463 175.463 174.742 0.721 17927 7814 1 10 . 1 1 66 66 PHE CA C 66 58.088 58.088 58.860 -0.772 17927 7815 1 10 . 1 1 66 66 PHE CB C 66 39.637 39.637 38.557 1.080 17927 7816 1 10 . 1 1 66 66 PHE H H 66 9.262 9.262 9.199 0.063 17927 7817 1 10 . 1 1 67 67 VAL N N 67 126.201 126.201 126.362 -0.161 17927 7818 1 10 . 1 1 67 67 VAL HA H 67 4.834 4.834 4.846 -0.012 17927 7819 1 10 . 1 1 67 67 VAL C C 67 174.364 174.364 175.314 -0.950 17927 7820 1 10 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.959 -0.235 17927 7821 1 10 . 1 1 67 67 VAL CB C 67 34.893 34.893 32.772 2.121 17927 7822 1 10 . 1 1 67 67 VAL H H 67 8.843 8.843 9.236 -0.393 17927 7823 1 10 . 1 1 68 68 SER N N 68 124.528 124.528 122.638 1.890 17927 7824 1 10 . 1 1 68 68 SER HA H 68 5.585 5.585 5.570 0.015 17927 7825 1 10 . 1 1 68 68 SER C C 68 172.858 172.858 173.182 -0.324 17927 7826 1 10 . 1 1 68 68 SER CA C 68 57.282 57.282 56.733 0.550 17927 7827 1 10 . 1 1 68 68 SER CB C 68 65.032 65.032 64.803 0.229 17927 7828 1 10 . 1 1 68 68 SER H H 68 9.243 9.243 8.996 0.247 17927 7829 1 10 . 1 1 69 69 LEU N N 69 126.695 126.695 124.454 2.241 17927 7830 1 10 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.540 -1.023 17927 7831 1 10 . 1 1 69 69 LEU C C 69 174.652 174.652 175.149 -0.497 17927 7832 1 10 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.941 -1.114 17927 7833 1 10 . 1 1 69 69 LEU CB C 69 43.895 43.895 46.374 -2.479 17927 7834 1 10 . 1 1 69 69 LEU H H 69 9.360 9.360 9.090 0.270 17927 7835 1 10 . 1 1 70 70 SER N N 70 116.379 116.379 121.193 -4.814 17927 7836 1 10 . 1 1 70 70 SER HA H 70 4.905 4.905 5.098 -0.193 17927 7837 1 10 . 1 1 70 70 SER C C 70 176.307 176.307 174.943 1.364 17927 7838 1 10 . 1 1 70 70 SER CA C 70 55.213 55.213 55.840 -0.627 17927 7839 1 10 . 1 1 70 70 SER CB C 70 63.519 63.519 63.406 0.113 17927 7840 1 10 . 1 1 70 70 SER H H 70 7.981 7.981 9.272 -1.291 17927 7841 1 10 . 1 1 71 71 CYS N N 71 124.670 124.670 128.423 -3.753 17927 7842 1 10 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.440 0.518 17927 7843 1 10 . 1 1 71 71 CYS C C 71 173.996 173.996 174.678 -0.682 17927 7844 1 10 . 1 1 71 71 CYS CA C 71 55.483 55.483 58.555 -3.072 17927 7845 1 10 . 1 1 71 71 CYS CB C 71 28.112 28.112 26.553 1.559 17927 7846 1 10 . 1 1 71 71 CYS H H 71 8.609 8.609 8.940 -0.331 17927 7847 1 10 . 1 1 72 72 ASP N N 72 122.398 122.398 122.910 -0.512 17927 7848 1 10 . 1 1 72 72 ASP HA H 72 4.292 4.292 5.001 -0.709 17927 7849 1 10 . 1 1 72 72 ASP C C 72 176.653 176.653 176.009 0.644 17927 7850 1 10 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.427 1.355 17927 7851 1 10 . 1 1 72 72 ASP CB C 72 41.526 41.526 42.137 -0.611 17927 7852 1 10 . 1 1 72 72 ASP H H 72 8.557 8.557 7.543 1.014 17927 7853 1 10 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.291 -0.226 17927 7854 1 10 . 1 1 73 73 LYS C C 73 176.545 176.545 176.494 0.051 17927 7855 1 10 . 1 1 73 73 LYS CA C 73 58.458 58.458 57.552 0.906 17927 7856 1 10 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.634 0.007 17927 7857 1 10 . 1 1 74 74 ASN N N 74 117.616 117.616 120.724 -3.108 17927 7858 1 10 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.969 -0.064 17927 7859 1 10 . 1 1 74 74 ASN C C 74 174.894 174.894 174.688 0.206 17927 7860 1 10 . 1 1 74 74 ASN CA C 74 51.521 51.521 51.784 -0.263 17927 7861 1 10 . 1 1 74 74 ASN CB C 74 38.109 38.109 37.091 1.018 17927 7862 1 10 . 1 1 74 74 ASN H H 74 8.625 8.625 8.828 -0.203 17927 7863 1 10 . 1 1 75 75 LYS N N 75 126.797 126.797 123.187 3.610 17927 7864 1 10 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.725 -0.302 17927 7865 1 10 . 1 1 75 75 LYS C C 75 178.058 178.058 177.720 0.338 17927 7866 1 10 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.832 -0.659 17927 7867 1 10 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.419 0.872 17927 7868 1 10 . 1 1 75 75 LYS H H 75 8.588 8.588 7.560 1.028 17927 7869 1 10 . 1 1 76 76 LYS N N 76 117.875 117.875 118.793 -0.918 17927 7870 1 10 . 1 1 76 76 LYS HA H 76 4.200 4.200 3.984 0.216 17927 7871 1 10 . 1 1 76 76 LYS C C 76 178.791 178.791 178.501 0.290 17927 7872 1 10 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.191 -0.583 17927 7873 1 10 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.543 -0.053 17927 7874 1 10 . 1 1 76 76 LYS H H 76 8.041 8.041 8.347 -0.306 17927 7875 1 10 . 1 1 77 77 ALA N N 77 121.567 121.567 121.531 0.036 17927 7876 1 10 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.139 -0.016 17927 7877 1 10 . 1 1 77 77 ALA C C 77 181.191 181.191 179.601 1.590 17927 7878 1 10 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.785 0.172 17927 7879 1 10 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.157 -0.398 17927 7880 1 10 . 1 1 77 77 ALA H H 77 7.366 7.366 7.696 -0.330 17927 7881 1 10 . 1 1 78 78 TRP N N 78 119.497 119.497 120.576 -1.079 17927 7882 1 10 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.110 -0.033 17927 7883 1 10 . 1 1 78 78 TRP C C 78 175.942 175.942 177.421 -1.479 17927 7884 1 10 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.364 2.397 17927 7885 1 10 . 1 1 78 78 TRP CB C 78 27.272 27.272 29.657 -2.385 17927 7886 1 10 . 1 1 78 78 TRP H H 78 7.187 7.187 8.526 -1.339 17927 7887 1 10 . 1 1 79 79 GLU N N 79 118.771 118.771 117.528 1.243 17927 7888 1 10 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.554 -0.540 17927 7889 1 10 . 1 1 79 79 GLU C C 79 179.863 179.863 179.201 0.662 17927 7890 1 10 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.455 -0.345 17927 7891 1 10 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.492 1.728 17927 7892 1 10 . 1 1 79 79 GLU H H 79 8.813 8.813 8.792 0.021 17927 7893 1 10 . 1 1 80 80 ASN N N 80 115.964 115.964 116.605 -0.641 17927 7894 1 10 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.469 -0.130 17927 7895 1 10 . 1 1 80 80 ASN C C 80 176.749 176.749 177.578 -0.829 17927 7896 1 10 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.565 0.470 17927 7897 1 10 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.145 0.344 17927 7898 1 10 . 1 1 80 80 ASN H H 80 8.491 8.491 7.750 0.741 17927 7899 1 10 . 1 1 81 81 MET N N 81 119.670 119.670 120.660 -0.990 17927 7900 1 10 . 1 1 81 81 MET HA H 81 4.149 4.149 4.146 0.003 17927 7901 1 10 . 1 1 81 81 MET C C 81 177.933 177.933 177.444 0.489 17927 7902 1 10 . 1 1 81 81 MET CA C 81 60.276 60.276 58.942 1.334 17927 7903 1 10 . 1 1 81 81 MET CB C 81 32.518 32.518 32.697 -0.179 17927 7904 1 10 . 1 1 81 81 MET H H 81 7.667 7.667 7.539 0.128 17927 7905 1 10 . 1 1 82 82 VAL N N 82 117.634 117.634 119.560 -1.926 17927 7906 1 10 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.471 -0.168 17927 7907 1 10 . 1 1 82 82 VAL C C 82 179.005 179.005 177.411 1.594 17927 7908 1 10 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.384 0.653 17927 7909 1 10 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.390 0.375 17927 7910 1 10 . 1 1 82 82 VAL H H 82 8.338 8.338 8.156 0.182 17927 7911 1 10 . 1 1 83 83 THR N N 83 110.519 110.519 114.594 -4.075 17927 7912 1 10 . 1 1 83 83 THR HA H 83 3.983 3.983 3.976 0.007 17927 7913 1 10 . 1 1 83 83 THR C C 83 177.591 177.591 176.275 1.316 17927 7914 1 10 . 1 1 83 83 THR CA C 83 65.431 65.431 66.318 -0.887 17927 7915 1 10 . 1 1 83 83 THR CB C 83 69.156 69.156 68.330 0.826 17927 7916 1 10 . 1 1 83 83 THR H H 83 7.659 7.659 7.693 -0.034 17927 7917 1 10 . 1 1 84 84 LYS N N 84 123.927 123.927 120.941 2.986 17927 7918 1 10 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.181 -0.112 17927 7919 1 10 . 1 1 84 84 LYS C C 84 178.582 178.582 177.663 0.919 17927 7920 1 10 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.420 1.457 17927 7921 1 10 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.872 -0.549 17927 7922 1 10 . 1 1 84 84 LYS H H 84 8.665 8.665 7.475 1.190 17927 7923 1 10 . 1 1 85 85 ASP N N 85 116.280 116.280 117.096 -0.816 17927 7924 1 10 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.747 0.003 17927 7925 1 10 . 1 1 85 85 ASP C C 85 175.086 175.086 175.049 0.037 17927 7926 1 10 . 1 1 85 85 ASP CA C 85 54.693 54.693 54.498 0.195 17927 7927 1 10 . 1 1 85 85 ASP CB C 85 39.685 39.685 40.662 -0.977 17927 7928 1 10 . 1 1 85 85 ASP H H 85 8.179 8.179 8.237 -0.058 17927 7929 1 10 . 1 1 86 86 GLN N N 86 116.258 116.258 113.315 2.943 17927 7930 1 10 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.856 0.052 17927 7931 1 10 . 1 1 86 86 GLN C C 86 175.659 175.659 174.899 0.760 17927 7932 1 10 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.309 -0.139 17927 7933 1 10 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.114 0.176 17927 7934 1 10 . 1 1 86 86 GLN H H 86 7.431 7.431 7.667 -0.236 17927 7935 1 10 . 1 1 87 87 LEU N N 87 117.031 117.031 121.034 -4.003 17927 7936 1 10 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.360 -0.270 17927 7937 1 10 . 1 1 87 87 LEU C C 87 178.225 178.225 176.361 1.864 17927 7938 1 10 . 1 1 87 87 LEU CA C 87 55.932 55.932 55.010 0.922 17927 7939 1 10 . 1 1 87 87 LEU CB C 87 41.202 41.202 40.483 0.720 17927 7940 1 10 . 1 1 87 87 LEU H H 87 7.736 7.736 7.962 -0.226 17927 7941 1 10 . 1 1 88 88 LYS N N 88 122.367 122.367 123.196 -0.829 17927 7942 1 10 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.613 0.023 17927 7943 1 10 . 1 1 88 88 LYS C C 88 177.538 177.538 176.556 0.982 17927 7944 1 10 . 1 1 88 88 LYS CA C 88 54.930 54.930 54.168 0.762 17927 7945 1 10 . 1 1 88 88 LYS CB C 88 33.316 33.316 33.959 -0.643 17927 7946 1 10 . 1 1 88 88 LYS H H 88 8.496 8.496 7.933 0.563 17927 7947 1 10 . 1 1 89 89 GLY N N 89 108.452 108.452 106.457 1.995 17927 7948 1 10 . 1 1 89 89 GLY C C 89 173.781 173.781 173.302 0.479 17927 7949 1 10 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.533 0.825 17927 7950 1 10 . 1 1 89 89 GLY H H 89 8.497 8.497 7.975 0.522 17927 7951 1 10 . 1 1 90 90 ILE N N 90 123.295 123.295 123.158 0.137 17927 7952 1 10 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.407 -0.036 17927 7953 1 10 . 1 1 90 90 ILE C C 90 175.606 175.606 174.162 1.444 17927 7954 1 10 . 1 1 90 90 ILE CA C 90 62.001 62.001 60.679 1.322 17927 7955 1 10 . 1 1 90 90 ILE CB C 90 38.036 38.036 38.702 -0.666 17927 7956 1 10 . 1 1 90 90 ILE H H 90 8.728 8.728 7.871 0.857 17927 7957 1 10 . 1 1 91 91 GLN N N 91 128.632 128.632 126.680 1.952 17927 7958 1 10 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.652 0.114 17927 7959 1 10 . 1 1 91 91 GLN C C 91 174.618 174.618 174.732 -0.114 17927 7960 1 10 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.187 1.663 17927 7961 1 10 . 1 1 91 91 GLN CB C 91 28.341 28.341 29.221 -0.880 17927 7962 1 10 . 1 1 91 91 GLN H H 91 8.762 8.762 9.715 -0.953 17927 7963 1 10 . 1 1 92 92 LEU N N 92 120.830 120.830 124.589 -3.759 17927 7964 1 10 . 1 1 92 92 LEU HA H 92 5.580 5.580 5.165 0.415 17927 7965 1 10 . 1 1 92 92 LEU C C 92 176.828 176.828 176.383 0.445 17927 7966 1 10 . 1 1 92 92 LEU CA C 92 52.801 52.801 54.021 -1.220 17927 7967 1 10 . 1 1 92 92 LEU CB C 92 44.210 44.210 43.910 0.300 17927 7968 1 10 . 1 1 92 92 LEU H H 92 9.011 9.011 9.223 -0.212 17927 7969 1 10 . 1 1 93 93 HIS N N 93 121.481 121.481 124.934 -3.453 17927 7970 1 10 . 1 1 93 93 HIS HA H 93 3.931 3.931 5.025 -1.094 17927 7971 1 10 . 1 1 93 93 HIS C C 93 173.590 173.590 173.635 -0.045 17927 7972 1 10 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.575 1.008 17927 7973 1 10 . 1 1 93 93 HIS CB C 93 32.250 32.250 32.933 -0.683 17927 7974 1 10 . 1 1 93 93 HIS H H 93 8.038 8.038 8.642 -0.604 17927 7975 1 10 . 1 1 94 94 MET N N 94 121.881 121.881 124.856 -2.975 17927 7976 1 10 . 1 1 94 94 MET HA H 94 3.866 3.866 4.395 -0.529 17927 7977 1 10 . 1 1 94 94 MET C C 94 177.035 177.035 175.957 1.078 17927 7978 1 10 . 1 1 94 94 MET CA C 94 55.189 55.189 57.573 -2.384 17927 7979 1 10 . 1 1 94 94 MET CB C 94 33.993 33.993 34.130 -0.137 17927 7980 1 10 . 1 1 94 94 MET H H 94 8.039 8.039 8.537 -0.498 17927 7981 1 10 . 1 1 95 95 GLY N N 95 104.041 104.041 105.331 -1.290 17927 7982 1 10 . 1 1 95 95 GLY C C 95 174.251 174.251 173.238 1.013 17927 7983 1 10 . 1 1 95 95 GLY CA C 95 46.580 46.580 44.901 1.679 17927 7984 1 10 . 1 1 95 95 GLY H H 95 5.666 5.666 7.628 -1.962 17927 7985 1 10 . 1 1 96 96 THR N N 96 114.114 114.114 118.008 -3.894 17927 7986 1 10 . 1 1 96 96 THR HA H 96 4.211 4.211 4.455 -0.244 17927 7987 1 10 . 1 1 96 96 THR C C 96 175.122 175.122 173.544 1.578 17927 7988 1 10 . 1 1 96 96 THR CA C 96 61.339 61.339 60.782 0.557 17927 7989 1 10 . 1 1 96 96 THR CB C 96 68.615 68.615 68.769 -0.154 17927 7990 1 10 . 1 1 96 96 THR H H 96 8.517 8.517 8.355 0.162 17927 7991 1 10 . 1 1 97 97 ASP N N 97 121.892 121.892 121.090 0.802 17927 7992 1 10 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.661 -0.076 17927 7993 1 10 . 1 1 97 97 ASP C C 97 178.241 178.241 176.340 1.901 17927 7994 1 10 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.683 1.117 17927 7995 1 10 . 1 1 97 97 ASP CB C 97 43.129 43.129 42.198 0.931 17927 7996 1 10 . 1 1 97 97 ASP H H 97 7.563 7.563 7.966 -0.403 17927 7997 1 10 . 1 1 98 98 ARG N N 98 127.508 127.508 124.560 2.948 17927 7998 1 10 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.595 -0.203 17927 7999 1 10 . 1 1 98 98 ARG C C 98 176.724 176.724 176.217 0.507 17927 8000 1 10 . 1 1 98 98 ARG CA C 98 55.939 55.939 56.476 -0.537 17927 8001 1 10 . 1 1 98 98 ARG CB C 98 30.291 30.291 29.408 0.883 17927 8002 1 10 . 1 1 98 98 ARG H H 98 9.225 9.225 8.564 0.661 17927 8003 1 10 . 1 1 99 99 THR N N 99 116.384 116.384 118.050 -1.666 17927 8004 1 10 . 1 1 99 99 THR HA H 99 3.987 3.987 4.162 -0.175 17927 8005 1 10 . 1 1 99 99 THR C C 99 176.969 176.969 175.734 1.235 17927 8006 1 10 . 1 1 99 99 THR CA C 99 67.714 67.714 66.916 0.798 17927 8007 1 10 . 1 1 99 99 THR CB C 99 68.777 68.777 68.512 0.265 17927 8008 1 10 . 1 1 99 99 THR H H 99 8.382 8.382 8.361 0.021 17927 8009 1 10 . 1 1 100 100 PHE N N 100 123.232 123.232 122.120 1.112 17927 8010 1 10 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.335 -0.162 17927 8011 1 10 . 1 1 100 100 PHE C C 100 177.010 177.010 176.058 0.952 17927 8012 1 10 . 1 1 100 100 PHE CA C 100 61.923 61.923 61.136 0.787 17927 8013 1 10 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.471 1.291 17927 8014 1 10 . 1 1 100 100 PHE H H 100 7.998 7.998 8.519 -0.521 17927 8015 1 10 . 1 1 101 101 MET N N 101 115.968 115.968 116.236 -0.268 17927 8016 1 10 . 1 1 101 101 MET HA H 101 3.975 3.975 4.176 -0.201 17927 8017 1 10 . 1 1 101 101 MET C C 101 178.763 178.763 177.297 1.466 17927 8018 1 10 . 1 1 101 101 MET CA C 101 58.552 58.552 57.357 1.195 17927 8019 1 10 . 1 1 101 101 MET CB C 101 32.593 32.593 31.232 1.361 17927 8020 1 10 . 1 1 101 101 MET H H 101 7.828 7.828 8.251 -0.423 17927 8021 1 10 . 1 1 102 102 ASP N N 102 117.553 117.553 121.080 -3.527 17927 8022 1 10 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.338 0.184 17927 8023 1 10 . 1 1 102 102 ASP C C 102 179.503 179.503 178.325 1.178 17927 8024 1 10 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.662 -0.772 17927 8025 1 10 . 1 1 102 102 ASP CB C 102 39.926 39.926 41.150 -1.224 17927 8026 1 10 . 1 1 102 102 ASP H H 102 8.828 8.828 7.778 1.050 17927 8027 1 10 . 1 1 103 103 ALA N N 103 122.984 122.984 121.120 1.864 17927 8028 1 10 . 1 1 103 103 ALA HA H 103 3.986 3.986 3.976 0.010 17927 8029 1 10 . 1 1 103 103 ALA C C 103 178.782 178.782 177.647 1.135 17927 8030 1 10 . 1 1 103 103 ALA CA C 103 55.094 55.094 53.911 1.183 17927 8031 1 10 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.191 0.372 17927 8032 1 10 . 1 1 103 103 ALA H H 103 7.567 7.567 7.329 0.238 17927 8033 1 10 . 1 1 104 104 TYR N N 104 112.159 112.159 113.750 -1.591 17927 8034 1 10 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.470 -0.246 17927 8035 1 10 . 1 1 104 104 TYR C C 104 173.821 173.821 174.533 -0.712 17927 8036 1 10 . 1 1 104 104 TYR CA C 104 58.498 58.498 56.178 2.320 17927 8037 1 10 . 1 1 104 104 TYR CB C 104 38.393 38.393 39.308 -0.915 17927 8038 1 10 . 1 1 104 104 TYR H H 104 7.203 7.203 7.214 -0.011 17927 8039 1 10 . 1 1 105 105 LEU N N 105 119.433 119.433 118.289 1.144 17927 8040 1 10 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.910 0.075 17927 8041 1 10 . 1 1 105 105 LEU C C 105 176.721 176.721 176.079 0.642 17927 8042 1 10 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.968 -0.183 17927 8043 1 10 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.606 -1.163 17927 8044 1 10 . 1 1 105 105 LEU H H 105 7.582 7.582 7.739 -0.157 17927 8045 1 10 . 1 1 106 106 ILE N N 106 119.575 119.575 118.897 0.678 17927 8046 1 10 . 1 1 106 106 ILE HA H 106 4.002 4.002 3.715 0.287 17927 8047 1 10 . 1 1 106 106 ILE C C 106 175.459 175.459 175.687 -0.228 17927 8048 1 10 . 1 1 106 106 ILE CA C 106 62.043 62.043 63.040 -0.997 17927 8049 1 10 . 1 1 106 106 ILE CB C 106 36.335 36.335 36.366 -0.031 17927 8050 1 10 . 1 1 106 106 ILE H H 106 8.774 8.774 8.076 0.698 17927 8051 1 10 . 1 1 107 107 ASN N N 107 126.514 126.514 125.365 1.149 17927 8052 1 10 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.619 0.244 17927 8053 1 10 . 1 1 107 107 ASN C C 107 174.584 174.584 175.607 -1.023 17927 8054 1 10 . 1 1 107 107 ASN CA C 107 53.112 53.112 54.630 -1.518 17927 8055 1 10 . 1 1 107 107 ASN CB C 107 38.977 38.977 38.960 0.017 17927 8056 1 10 . 1 1 107 107 ASN H H 107 8.364 8.364 8.168 0.196 17927 8057 1 10 . 1 1 108 108 GLY N N 108 108.469 108.469 106.414 2.055 17927 8058 1 10 . 1 1 108 108 GLY C C 108 171.245 171.245 172.363 -1.118 17927 8059 1 10 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.001 1.268 17927 8060 1 10 . 1 1 108 108 GLY H H 108 7.678 7.678 7.783 -0.105 17927 8061 1 10 . 1 1 109 109 ILE N N 109 112.817 112.817 117.633 -4.816 17927 8062 1 10 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.633 -0.227 17927 8063 1 10 . 1 1 109 109 ILE C C 109 173.498 173.498 173.735 -0.237 17927 8064 1 10 . 1 1 109 109 ILE CA C 109 58.384 58.384 57.659 0.725 17927 8065 1 10 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.812 1.510 17927 8066 1 10 . 1 1 109 109 ILE H H 109 7.868 7.868 8.118 -0.250 17927 8067 1 10 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.549 0.193 17927 8068 1 10 . 1 1 110 110 PRO C C 110 175.715 175.715 176.130 -0.415 17927 8069 1 10 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.501 -0.224 17927 8070 1 10 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.390 3.978 17927 8071 1 10 . 1 1 111 111 ARG N N 111 122.358 122.358 122.587 -0.229 17927 8072 1 10 . 1 1 111 111 ARG HA H 111 4.469 4.469 3.796 0.673 17927 8073 1 10 . 1 1 111 111 ARG C C 111 171.541 171.541 175.047 -3.506 17927 8074 1 10 . 1 1 111 111 ARG CA C 111 54.356 54.356 55.314 -0.958 17927 8075 1 10 . 1 1 111 111 ARG CB C 111 33.430 33.430 32.097 1.333 17927 8076 1 10 . 1 1 111 111 ARG H H 111 7.732 7.732 8.444 -0.712 17927 8077 1 10 . 1 1 112 112 PHE N N 112 125.103 125.103 117.099 8.004 17927 8078 1 10 . 1 1 112 112 PHE HA H 112 5.773 5.773 4.943 0.830 17927 8079 1 10 . 1 1 112 112 PHE C C 112 175.097 175.097 174.108 0.989 17927 8080 1 10 . 1 1 112 112 PHE CA C 112 55.791 55.791 55.869 -0.078 17927 8081 1 10 . 1 1 112 112 PHE CB C 112 40.928 40.928 40.103 0.825 17927 8082 1 10 . 1 1 112 112 PHE H H 112 8.929 8.929 7.681 1.248 17927 8083 1 10 . 1 1 113 113 ILE N N 113 123.778 123.778 122.689 1.089 17927 8084 1 10 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.997 -0.454 17927 8085 1 10 . 1 1 113 113 ILE C C 113 173.197 173.197 173.799 -0.602 17927 8086 1 10 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.636 0.650 17927 8087 1 10 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.413 1.833 17927 8088 1 10 . 1 1 113 113 ILE H H 113 8.873 8.873 8.483 0.390 17927 8089 1 10 . 1 1 114 114 LEU N N 114 127.146 127.146 126.849 0.297 17927 8090 1 10 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.289 0.725 17927 8091 1 10 . 1 1 114 114 LEU C C 114 175.080 175.080 174.447 0.633 17927 8092 1 10 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.425 -0.024 17927 8093 1 10 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.594 0.775 17927 8094 1 10 . 1 1 114 114 LEU H H 114 8.974 8.974 8.906 0.068 17927 8095 1 10 . 1 1 115 115 LEU N N 115 128.323 128.323 124.515 3.808 17927 8096 1 10 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.139 0.293 17927 8097 1 10 . 1 1 115 115 LEU C C 115 176.660 176.660 175.575 1.085 17927 8098 1 10 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.782 -0.705 17927 8099 1 10 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.235 -1.651 17927 8100 1 10 . 1 1 115 115 LEU H H 115 9.874 9.874 9.293 0.581 17927 8101 1 10 . 1 1 116 116 ASP N N 116 119.834 119.834 122.275 -2.441 17927 8102 1 10 . 1 1 116 116 ASP HA H 116 4.935 4.935 5.019 -0.084 17927 8103 1 10 . 1 1 116 116 ASP C C 116 176.898 176.898 177.475 -0.577 17927 8104 1 10 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.861 -1.556 17927 8105 1 10 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.762 -1.734 17927 8106 1 10 . 1 1 116 116 ASP H H 116 9.357 9.357 8.819 0.538 17927 8107 1 10 . 1 1 117 117 ARG N N 117 113.356 113.356 121.529 -8.173 17927 8108 1 10 . 1 1 117 117 ARG HA H 117 3.717 3.717 3.979 -0.262 17927 8109 1 10 . 1 1 117 117 ARG C C 117 177.105 177.105 178.033 -0.928 17927 8110 1 10 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.732 -1.547 17927 8111 1 10 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.949 0.488 17927 8112 1 10 . 1 1 117 117 ARG H H 117 7.697 7.697 8.467 -0.770 17927 8113 1 10 . 1 1 118 118 ASP N N 118 117.226 117.226 115.957 1.269 17927 8114 1 10 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.597 0.298 17927 8115 1 10 . 1 1 118 118 ASP C C 118 176.657 176.657 177.011 -0.354 17927 8116 1 10 . 1 1 118 118 ASP CA C 118 53.517 53.517 54.903 -1.385 17927 8117 1 10 . 1 1 118 118 ASP CB C 118 42.556 42.556 40.700 1.856 17927 8118 1 10 . 1 1 118 118 ASP H H 118 8.456 8.456 8.389 0.067 17927 8119 1 10 . 1 1 119 119 GLY N N 119 109.074 109.074 108.304 0.770 17927 8120 1 10 . 1 1 119 119 GLY C C 119 173.355 173.355 174.085 -0.730 17927 8121 1 10 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.509 0.747 17927 8122 1 10 . 1 1 119 119 GLY H H 119 8.183 8.183 8.235 -0.052 17927 8123 1 10 . 1 1 120 120 LYS N N 120 120.744 120.744 121.046 -0.302 17927 8124 1 10 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.613 -0.080 17927 8125 1 10 . 1 1 120 120 LYS C C 120 177.229 177.229 176.313 0.916 17927 8126 1 10 . 1 1 120 120 LYS CA C 120 55.287 55.287 54.682 0.605 17927 8127 1 10 . 1 1 120 120 LYS CB C 120 32.581 32.581 33.131 -0.550 17927 8128 1 10 . 1 1 120 120 LYS H H 120 8.449 8.449 7.558 0.891 17927 8129 1 10 . 1 1 121 121 ILE N N 121 121.221 121.221 127.645 -6.424 17927 8130 1 10 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.974 -0.088 17927 8131 1 10 . 1 1 121 121 ILE C C 121 177.819 177.819 176.779 1.040 17927 8132 1 10 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.424 0.491 17927 8133 1 10 . 1 1 121 121 ILE CB C 121 39.390 39.390 36.975 2.415 17927 8134 1 10 . 1 1 121 121 ILE H H 121 8.715 8.715 8.952 -0.237 17927 8135 1 10 . 1 1 122 122 ILE N N 122 127.165 127.165 128.739 -1.574 17927 8136 1 10 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.114 0.227 17927 8137 1 10 . 1 1 122 122 ILE C C 122 176.978 176.978 176.663 0.315 17927 8138 1 10 . 1 1 122 122 ILE CA C 122 63.719 63.719 63.097 0.622 17927 8139 1 10 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.694 -0.042 17927 8140 1 10 . 1 1 122 122 ILE H H 122 8.974 8.974 8.622 0.352 17927 8141 1 10 . 1 1 123 123 SER N N 123 111.227 111.227 114.523 -3.296 17927 8142 1 10 . 1 1 123 123 SER HA H 123 4.738 4.738 4.754 -0.016 17927 8143 1 10 . 1 1 123 123 SER C C 123 174.184 174.184 173.849 0.335 17927 8144 1 10 . 1 1 123 123 SER CA C 123 57.383 57.383 57.056 0.327 17927 8145 1 10 . 1 1 123 123 SER CB C 123 65.326 65.326 64.967 0.359 17927 8146 1 10 . 1 1 123 123 SER H H 123 7.850 7.850 8.141 -0.291 17927 8147 1 10 . 1 1 124 124 ALA N N 124 131.373 131.373 127.330 4.043 17927 8148 1 10 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.168 0.317 17927 8149 1 10 . 1 1 124 124 ALA C C 124 175.147 175.147 175.602 -0.455 17927 8150 1 10 . 1 1 124 124 ALA CA C 124 53.035 53.035 54.003 -0.968 17927 8151 1 10 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.119 -0.457 17927 8152 1 10 . 1 1 124 124 ALA H H 124 9.384 9.384 8.740 0.644 17927 8153 1 10 . 1 1 125 125 ASN N N 125 119.476 119.476 113.491 5.985 17927 8154 1 10 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.462 -0.406 17927 8155 1 10 . 1 1 125 125 ASN C C 125 173.593 173.593 174.063 -0.470 17927 8156 1 10 . 1 1 125 125 ASN CA C 125 52.352 52.352 51.902 0.450 17927 8157 1 10 . 1 1 125 125 ASN CB C 125 38.304 38.304 39.321 -1.017 17927 8158 1 10 . 1 1 125 125 ASN H H 125 8.191 8.191 7.911 0.280 17927 8159 1 10 . 1 1 126 126 MET N N 126 122.705 122.705 123.133 -0.428 17927 8160 1 10 . 1 1 126 126 MET HA H 126 4.585 4.585 4.887 -0.302 17927 8161 1 10 . 1 1 126 126 MET C C 126 175.215 175.215 174.792 0.423 17927 8162 1 10 . 1 1 126 126 MET CA C 126 53.849 53.849 55.041 -1.192 17927 8163 1 10 . 1 1 126 126 MET CB C 126 31.312 31.312 35.044 -3.732 17927 8164 1 10 . 1 1 126 126 MET H H 126 8.376 8.376 9.325 -0.949 17927 8165 1 10 . 1 1 127 127 THR N N 127 111.016 111.016 111.280 -0.264 17927 8166 1 10 . 1 1 127 127 THR HA H 127 4.291 4.291 4.056 0.235 17927 8167 1 10 . 1 1 127 127 THR C C 127 174.574 174.574 173.272 1.302 17927 8168 1 10 . 1 1 127 127 THR CA C 127 62.085 62.085 59.948 2.137 17927 8169 1 10 . 1 1 127 127 THR CB C 127 69.733 69.733 70.781 -1.048 17927 8170 1 10 . 1 1 127 127 THR H H 127 7.714 7.714 8.054 -0.340 17927 8171 1 10 . 1 1 128 128 ARG N N 128 118.722 118.722 125.404 -6.682 17927 8172 1 10 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.964 -1.656 17927 8173 1 10 . 1 1 128 128 ARG C C 128 176.978 176.978 176.523 0.455 17927 8174 1 10 . 1 1 128 128 ARG CA C 128 54.727 54.727 54.726 0.001 17927 8175 1 10 . 1 1 128 128 ARG CB C 128 29.598 29.598 31.006 -1.408 17927 8176 1 10 . 1 1 128 128 ARG H H 128 8.658 8.658 8.488 0.170 17927 8177 1 10 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.250 -0.317 17927 8178 1 10 . 1 1 129 129 PRO C C 129 175.794 175.794 177.433 -1.639 17927 8179 1 10 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.264 1.285 17927 8180 1 10 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.477 0.200 17927 8181 1 10 . 1 1 130 130 SER N N 130 108.696 108.696 111.666 -2.970 17927 8182 1 10 . 1 1 130 130 SER HA H 130 3.988 3.988 4.289 -0.301 17927 8183 1 10 . 1 1 130 130 SER C C 130 174.445 174.445 174.579 -0.134 17927 8184 1 10 . 1 1 130 130 SER CA C 130 58.911 58.911 59.942 -1.031 17927 8185 1 10 . 1 1 130 130 SER CB C 130 62.680 62.680 62.987 -0.307 17927 8186 1 10 . 1 1 130 130 SER H H 130 8.375 8.375 8.261 0.114 17927 8187 1 10 . 1 1 131 131 ASP N N 131 126.377 126.377 121.927 4.450 17927 8188 1 10 . 1 1 131 131 ASP HA H 131 4.872 4.872 5.004 -0.132 17927 8189 1 10 . 1 1 131 131 ASP C C 131 176.879 176.879 174.901 1.978 17927 8190 1 10 . 1 1 131 131 ASP CA C 131 51.195 51.195 50.936 0.259 17927 8191 1 10 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.438 0.378 17927 8192 1 10 . 1 1 131 131 ASP H H 131 7.514 7.514 7.972 -0.458 17927 8193 1 10 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.230 0.162 17927 8194 1 10 . 1 1 132 132 PRO C C 132 178.097 178.097 178.301 -0.204 17927 8195 1 10 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.517 0.562 17927 8196 1 10 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.159 0.250 17927 8197 1 10 . 1 1 133 133 LYS N N 133 116.306 116.306 118.020 -1.714 17927 8198 1 10 . 1 1 133 133 LYS HA H 133 3.958 3.958 3.828 0.130 17927 8199 1 10 . 1 1 133 133 LYS C C 133 179.532 179.532 178.733 0.799 17927 8200 1 10 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.375 -0.854 17927 8201 1 10 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.963 0.228 17927 8202 1 10 . 1 1 133 133 LYS H H 133 8.842 8.842 8.758 0.084 17927 8203 1 10 . 1 1 134 134 THR N N 134 120.833 120.833 112.914 7.919 17927 8204 1 10 . 1 1 134 134 THR HA H 134 3.147 3.147 3.443 -0.296 17927 8205 1 10 . 1 1 134 134 THR C C 134 173.356 173.356 175.029 -1.673 17927 8206 1 10 . 1 1 134 134 THR CA C 134 66.383 66.383 65.305 1.078 17927 8207 1 10 . 1 1 134 134 THR CB C 134 66.847 66.847 67.866 -1.019 17927 8208 1 10 . 1 1 134 134 THR H H 134 8.292 8.292 7.666 0.626 17927 8209 1 10 . 1 1 135 135 ALA N N 135 121.720 121.720 123.728 -2.008 17927 8210 1 10 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.323 0.260 17927 8211 1 10 . 1 1 135 135 ALA C C 135 178.902 178.902 179.428 -0.526 17927 8212 1 10 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.613 0.386 17927 8213 1 10 . 1 1 135 135 ALA CB C 135 17.775 17.775 17.856 -0.081 17927 8214 1 10 . 1 1 135 135 ALA H H 135 7.030 7.030 7.197 -0.167 17927 8215 1 10 . 1 1 136 136 GLU N N 136 114.623 114.623 117.304 -2.681 17927 8216 1 10 . 1 1 136 136 GLU HA H 136 3.922 3.922 3.904 0.018 17927 8217 1 10 . 1 1 136 136 GLU C C 136 179.199 179.199 178.992 0.207 17927 8218 1 10 . 1 1 136 136 GLU CA C 136 59.837 59.837 59.181 0.656 17927 8219 1 10 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.037 0.749 17927 8220 1 10 . 1 1 136 136 GLU H H 136 7.216 7.216 7.775 -0.559 17927 8221 1 10 . 1 1 137 137 LYS N N 137 120.789 120.789 119.807 0.982 17927 8222 1 10 . 1 1 137 137 LYS HA H 137 4.204 4.204 4.027 0.177 17927 8223 1 10 . 1 1 137 137 LYS C C 137 178.834 178.834 178.968 -0.134 17927 8224 1 10 . 1 1 137 137 LYS CA C 137 57.343 57.343 59.099 -1.756 17927 8225 1 10 . 1 1 137 137 LYS CB C 137 30.463 30.463 32.148 -1.685 17927 8226 1 10 . 1 1 137 137 LYS H H 137 7.681 7.681 7.390 0.291 17927 8227 1 10 . 1 1 138 138 PHE N N 138 118.373 118.373 118.551 -0.178 17927 8228 1 10 . 1 1 138 138 PHE HA H 138 4.033 4.033 4.111 -0.078 17927 8229 1 10 . 1 1 138 138 PHE C C 138 178.027 178.027 177.883 0.144 17927 8230 1 10 . 1 1 138 138 PHE CA C 138 57.507 57.507 59.488 -1.981 17927 8231 1 10 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.708 -1.819 17927 8232 1 10 . 1 1 138 138 PHE H H 138 8.059 8.059 7.739 0.320 17927 8233 1 10 . 1 1 139 139 ASN N N 139 117.611 117.611 117.832 -0.221 17927 8234 1 10 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.447 -0.043 17927 8235 1 10 . 1 1 139 139 ASN C C 139 178.190 178.190 177.643 0.547 17927 8236 1 10 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.461 -0.237 17927 8237 1 10 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.751 -1.016 17927 8238 1 10 . 1 1 139 139 ASN H H 139 8.683 8.683 8.632 0.051 17927 8239 1 10 . 1 1 140 140 GLU N N 140 121.432 121.432 121.138 0.294 17927 8240 1 10 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.113 -0.108 17927 8241 1 10 . 1 1 140 140 GLU C C 140 179.751 179.751 179.069 0.682 17927 8242 1 10 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.277 0.033 17927 8243 1 10 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.665 0.390 17927 8244 1 10 . 1 1 140 140 GLU H H 140 7.868 7.868 7.640 0.228 17927 8245 1 10 . 1 1 141 141 LEU N N 141 119.968 119.968 118.889 1.079 17927 8246 1 10 . 1 1 141 141 LEU HA H 141 4.016 4.016 3.891 0.125 17927 8247 1 10 . 1 1 141 141 LEU C C 141 179.293 179.293 179.716 -0.423 17927 8248 1 10 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.636 -0.200 17927 8249 1 10 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.446 -0.263 17927 8250 1 10 . 1 1 141 141 LEU H H 141 8.303 8.303 8.410 -0.107 17927 8251 1 10 . 1 1 142 142 LEU N N 142 115.040 115.040 116.560 -1.520 17927 8252 1 10 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.298 0.086 17927 8253 1 10 . 1 1 142 142 LEU C C 142 178.002 178.002 176.970 1.032 17927 8254 1 10 . 1 1 142 142 LEU CA C 142 55.279 55.279 56.097 -0.818 17927 8255 1 10 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.378 0.268 17927 8256 1 10 . 1 1 142 142 LEU H H 142 8.230 8.230 8.113 0.117 17927 8257 1 10 . 1 1 143 143 GLY N N 143 108.977 108.977 104.965 4.012 17927 8258 1 10 . 1 1 143 143 GLY C C 143 175.216 175.216 174.460 0.756 17927 8259 1 10 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.516 1.225 17927 8260 1 10 . 1 1 143 143 GLY H H 143 7.762 7.762 7.474 0.288 17927 8261 1 10 . 1 1 144 144 LEU N N 144 119.660 119.660 120.203 -0.543 17927 8262 1 10 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.188 0.300 17927 8263 1 10 . 1 1 144 144 LEU C C 144 177.375 177.375 176.908 0.467 17927 8264 1 10 . 1 1 144 144 LEU CA C 144 54.525 54.525 57.326 -2.801 17927 8265 1 10 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.294 0.479 17927 8266 1 10 . 1 1 144 144 LEU H H 144 8.241 8.241 8.311 -0.070 17927 8267 1 10 . 1 1 145 145 GLU N N 145 119.959 119.959 115.682 4.277 17927 8268 1 10 . 1 1 145 145 GLU HA H 145 4.241 4.241 3.760 0.481 17927 8269 1 10 . 1 1 145 145 GLU C C 145 177.075 177.075 178.157 -1.082 17927 8270 1 10 . 1 1 145 145 GLU CA C 145 56.799 56.799 56.991 -0.192 17927 8271 1 10 . 1 1 145 145 GLU CB C 145 30.168 30.168 29.300 0.868 17927 8272 1 10 . 1 1 145 145 GLU H H 145 8.410 8.410 7.499 0.911 17927 8273 1 10 . 1 1 146 146 GLY N N 146 109.412 109.412 108.117 1.295 17927 8274 1 10 . 1 1 146 146 GLY C C 146 174.276 174.276 174.552 -0.276 17927 8275 1 10 . 1 1 146 146 GLY CA C 146 45.445 45.445 44.732 0.713 17927 8276 1 10 . 1 1 146 146 GLY H H 146 8.422 8.422 7.762 0.660 17927 8277 1 10 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.629 0.027 17927 8278 1 10 . 1 1 151 151 HIS C C 151 173.990 173.990 173.245 0.745 17927 8279 1 10 . 1 1 151 151 HIS CA C 151 56.044 56.044 54.761 1.283 17927 8280 1 10 . 1 1 151 151 HIS CB C 151 30.076 30.076 30.309 -0.233 17927 8281 1 11 . 1 1 2 2 SER HA H 2 4.121 4.121 4.761 -0.640 17927 8282 1 11 . 1 1 2 2 SER CA C 2 57.293 57.293 57.445 -0.152 17927 8283 1 11 . 1 1 2 2 SER CB C 2 63.545 63.545 64.950 -1.405 17927 8284 1 11 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.410 0.022 17927 8285 1 11 . 1 1 3 3 LEU C C 3 177.383 177.383 177.139 0.244 17927 8286 1 11 . 1 1 3 3 LEU CA C 3 55.575 55.575 54.961 0.614 17927 8287 1 11 . 1 1 3 3 LEU CB C 3 42.584 42.584 41.025 1.559 17927 8288 1 11 . 1 1 4 4 ARG N N 4 122.080 122.080 125.750 -3.670 17927 8289 1 11 . 1 1 4 4 ARG HA H 4 4.384 4.384 3.999 0.385 17927 8290 1 11 . 1 1 4 4 ARG C C 4 176.410 176.410 175.709 0.701 17927 8291 1 11 . 1 1 4 4 ARG CA C 4 56.269 56.269 58.541 -2.272 17927 8292 1 11 . 1 1 4 4 ARG CB C 4 30.842 30.842 30.697 0.145 17927 8293 1 11 . 1 1 4 4 ARG H H 4 8.410 8.410 8.048 0.362 17927 8294 1 11 . 1 1 5 5 SER N N 5 117.023 117.023 113.445 3.578 17927 8295 1 11 . 1 1 5 5 SER HA H 5 4.423 4.423 4.552 -0.129 17927 8296 1 11 . 1 1 5 5 SER C C 5 175.039 175.039 174.350 0.689 17927 8297 1 11 . 1 1 5 5 SER CA C 5 58.605 58.605 58.045 0.560 17927 8298 1 11 . 1 1 5 5 SER CB C 5 64.044 64.044 62.505 1.539 17927 8299 1 11 . 1 1 5 5 SER H H 5 8.292 8.292 7.964 0.328 17927 8300 1 11 . 1 1 6 6 GLY N N 6 110.718 110.718 112.643 -1.925 17927 8301 1 11 . 1 1 6 6 GLY C C 6 173.654 173.654 173.550 0.104 17927 8302 1 11 . 1 1 6 6 GLY CA C 6 45.273 45.273 44.646 0.627 17927 8303 1 11 . 1 1 6 6 GLY H H 6 8.446 8.446 8.583 -0.137 17927 8304 1 11 . 1 1 7 7 ASN N N 7 119.287 119.287 117.010 2.277 17927 8305 1 11 . 1 1 7 7 ASN HA H 7 5.024 5.024 4.556 0.468 17927 8306 1 11 . 1 1 7 7 ASN C C 7 173.672 173.672 172.598 1.074 17927 8307 1 11 . 1 1 7 7 ASN CA C 7 51.357 51.357 53.896 -2.539 17927 8308 1 11 . 1 1 7 7 ASN CB C 7 38.927 38.927 37.473 1.454 17927 8309 1 11 . 1 1 7 7 ASN H H 7 8.273 8.273 7.853 0.420 17927 8310 1 11 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.453 -0.006 17927 8311 1 11 . 1 1 8 8 PRO C C 8 176.899 176.899 177.417 -0.518 17927 8312 1 11 . 1 1 8 8 PRO CA C 8 63.429 63.429 63.779 -0.350 17927 8313 1 11 . 1 1 8 8 PRO CB C 8 32.216 32.216 31.622 0.594 17927 8314 1 11 . 1 1 9 9 SER N N 9 115.642 115.642 121.981 -6.339 17927 8315 1 11 . 1 1 9 9 SER HA H 9 4.415 4.415 4.378 0.037 17927 8316 1 11 . 1 1 9 9 SER C C 9 174.714 174.714 176.423 -1.709 17927 8317 1 11 . 1 1 9 9 SER CA C 9 58.488 58.488 60.600 -2.112 17927 8318 1 11 . 1 1 9 9 SER CB C 9 64.048 64.048 63.231 0.817 17927 8319 1 11 . 1 1 9 9 SER H H 9 8.336 8.336 8.832 -0.496 17927 8320 1 11 . 1 1 10 10 ALA N N 10 126.808 126.808 123.418 3.390 17927 8321 1 11 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.958 -0.696 17927 8322 1 11 . 1 1 10 10 ALA C C 10 177.233 177.233 177.632 -0.399 17927 8323 1 11 . 1 1 10 10 ALA CA C 10 53.230 53.230 54.109 -0.879 17927 8324 1 11 . 1 1 10 10 ALA CB C 10 19.187 19.187 18.788 0.399 17927 8325 1 11 . 1 1 10 10 ALA H H 10 8.137 8.137 8.120 0.017 17927 8326 1 11 . 1 1 11 11 ALA N N 11 120.449 120.449 117.969 2.480 17927 8327 1 11 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.918 -0.657 17927 8328 1 11 . 1 1 11 11 ALA C C 11 177.469 177.469 176.533 0.936 17927 8329 1 11 . 1 1 11 11 ALA CA C 11 52.475 52.475 51.906 0.570 17927 8330 1 11 . 1 1 11 11 ALA CB C 11 19.485 19.485 20.443 -0.958 17927 8331 1 11 . 1 1 11 11 ALA H H 11 7.851 7.851 7.717 0.134 17927 8332 1 11 . 1 1 12 12 SER N N 12 114.186 114.186 114.381 -0.195 17927 8333 1 11 . 1 1 12 12 SER HA H 12 4.312 4.312 4.498 -0.186 17927 8334 1 11 . 1 1 12 12 SER C C 12 173.593 173.593 174.321 -0.728 17927 8335 1 11 . 1 1 12 12 SER CA C 12 58.099 58.099 57.230 0.869 17927 8336 1 11 . 1 1 12 12 SER CB C 12 63.320 63.320 64.329 -1.009 17927 8337 1 11 . 1 1 12 12 SER H H 12 7.990 7.990 7.503 0.487 17927 8338 1 11 . 1 1 13 13 PHE N N 13 118.092 118.092 120.772 -2.680 17927 8339 1 11 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.473 0.307 17927 8340 1 11 . 1 1 13 13 PHE C C 13 174.220 174.220 173.579 0.641 17927 8341 1 11 . 1 1 13 13 PHE CA C 13 56.717 56.717 56.651 0.066 17927 8342 1 11 . 1 1 13 13 PHE CB C 13 41.151 41.151 39.574 1.577 17927 8343 1 11 . 1 1 13 13 PHE H H 13 7.147 7.147 7.509 -0.362 17927 8344 1 11 . 1 1 14 14 SER N N 14 116.456 116.456 115.750 0.706 17927 8345 1 11 . 1 1 14 14 SER HA H 14 5.162 5.162 4.862 0.300 17927 8346 1 11 . 1 1 14 14 SER C C 14 172.626 172.626 172.878 -0.252 17927 8347 1 11 . 1 1 14 14 SER CA C 14 57.390 57.390 57.617 -0.227 17927 8348 1 11 . 1 1 14 14 SER CB C 14 64.518 64.518 65.453 -0.935 17927 8349 1 11 . 1 1 14 14 SER H H 14 7.616 7.616 7.865 -0.249 17927 8350 1 11 . 1 1 15 15 TYR N N 15 122.384 122.384 124.067 -1.683 17927 8351 1 11 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.886 0.320 17927 8352 1 11 . 1 1 15 15 TYR C C 15 172.543 172.543 173.250 -0.707 17927 8353 1 11 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.104 -0.158 17927 8354 1 11 . 1 1 15 15 TYR CB C 15 43.227 43.227 41.882 1.345 17927 8355 1 11 . 1 1 15 15 TYR H H 15 8.558 8.558 9.305 -0.747 17927 8356 1 11 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.791 0.318 17927 8357 1 11 . 1 1 16 16 PRO C C 16 176.475 176.475 176.672 -0.197 17927 8358 1 11 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.502 -0.521 17927 8359 1 11 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.036 0.626 17927 8360 1 11 . 1 1 17 17 ASP N N 17 119.834 119.834 125.401 -5.567 17927 8361 1 11 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.998 0.741 17927 8362 1 11 . 1 1 17 17 ASP C C 17 180.740 180.740 178.183 2.557 17927 8363 1 11 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.795 -2.078 17927 8364 1 11 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.564 -1.003 17927 8365 1 11 . 1 1 17 17 ASP H H 17 8.643 8.643 8.943 -0.300 17927 8366 1 11 . 1 1 18 18 ILE N N 18 118.340 118.340 123.051 -4.711 17927 8367 1 11 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.970 0.481 17927 8368 1 11 . 1 1 18 18 ILE C C 18 175.742 175.742 177.077 -1.335 17927 8369 1 11 . 1 1 18 18 ILE CA C 18 61.894 61.894 64.227 -2.333 17927 8370 1 11 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.312 0.928 17927 8371 1 11 . 1 1 18 18 ILE H H 18 8.450 8.450 8.641 -0.191 17927 8372 1 11 . 1 1 19 19 ASN N N 19 119.377 119.377 117.520 1.857 17927 8373 1 11 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.622 0.393 17927 8374 1 11 . 1 1 19 19 ASN C C 19 175.892 175.892 175.861 0.031 17927 8375 1 11 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.324 -1.017 17927 8376 1 11 . 1 1 19 19 ASN CB C 19 39.825 39.825 38.634 1.191 17927 8377 1 11 . 1 1 19 19 ASN H H 19 8.376 8.376 8.811 -0.435 17927 8378 1 11 . 1 1 20 20 GLY N N 20 109.535 109.535 108.644 0.891 17927 8379 1 11 . 1 1 20 20 GLY C C 20 174.285 174.285 173.318 0.967 17927 8380 1 11 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.205 0.588 17927 8381 1 11 . 1 1 20 20 GLY H H 20 8.539 8.539 8.409 0.130 17927 8382 1 11 . 1 1 21 21 LYS N N 21 124.675 124.675 121.040 3.635 17927 8383 1 11 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.592 -0.149 17927 8384 1 11 . 1 1 21 21 LYS C C 21 176.537 176.537 175.656 0.881 17927 8385 1 11 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.416 1.028 17927 8386 1 11 . 1 1 21 21 LYS CB C 21 32.754 32.754 34.065 -1.310 17927 8387 1 11 . 1 1 21 21 LYS H H 21 8.608 8.608 7.556 1.052 17927 8388 1 11 . 1 1 22 22 THR N N 22 120.666 120.666 123.895 -3.229 17927 8389 1 11 . 1 1 22 22 THR HA H 22 4.087 4.087 4.200 -0.113 17927 8390 1 11 . 1 1 22 22 THR C C 22 174.431 174.431 174.041 0.390 17927 8391 1 11 . 1 1 22 22 THR CA C 22 64.292 64.292 63.342 0.950 17927 8392 1 11 . 1 1 22 22 THR CB C 22 69.069 69.069 68.644 0.425 17927 8393 1 11 . 1 1 22 22 THR H H 22 8.595 8.595 8.836 -0.241 17927 8394 1 11 . 1 1 23 23 VAL N N 23 131.207 131.207 130.035 1.172 17927 8395 1 11 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.193 -0.001 17927 8396 1 11 . 1 1 23 23 VAL C C 23 174.244 174.244 175.036 -0.792 17927 8397 1 11 . 1 1 23 23 VAL CA C 23 62.456 62.456 61.894 0.562 17927 8398 1 11 . 1 1 23 23 VAL CB C 23 33.791 33.791 31.637 2.154 17927 8399 1 11 . 1 1 23 23 VAL H H 23 8.937 8.937 8.937 -0.000 17927 8400 1 11 . 1 1 24 24 SER N N 24 120.787 120.787 122.850 -2.063 17927 8401 1 11 . 1 1 24 24 SER HA H 24 5.407 5.407 4.979 0.428 17927 8402 1 11 . 1 1 24 24 SER C C 24 176.169 176.169 174.996 1.173 17927 8403 1 11 . 1 1 24 24 SER CA C 24 55.135 55.135 56.262 -1.127 17927 8404 1 11 . 1 1 24 24 SER CB C 24 65.646 65.646 66.191 -0.544 17927 8405 1 11 . 1 1 24 24 SER H H 24 8.554 8.554 8.271 0.283 17927 8406 1 11 . 1 1 25 25 LEU N N 25 124.332 124.332 121.570 2.762 17927 8407 1 11 . 1 1 25 25 LEU HA H 25 3.687 3.687 3.656 0.031 17927 8408 1 11 . 1 1 25 25 LEU C C 25 179.364 179.364 177.781 1.583 17927 8409 1 11 . 1 1 25 25 LEU CA C 25 58.217 58.217 56.701 1.516 17927 8410 1 11 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.506 -0.968 17927 8411 1 11 . 1 1 25 25 LEU H H 25 7.811 7.811 7.974 -0.163 17927 8412 1 11 . 1 1 26 26 ALA N N 26 119.799 119.799 117.040 2.759 17927 8413 1 11 . 1 1 26 26 ALA HA H 26 3.993 3.993 3.969 0.024 17927 8414 1 11 . 1 1 26 26 ALA C C 26 179.719 179.719 177.838 1.881 17927 8415 1 11 . 1 1 26 26 ALA CA C 26 54.663 54.663 53.744 0.919 17927 8416 1 11 . 1 1 26 26 ALA CB C 26 18.323 18.323 18.507 -0.184 17927 8417 1 11 . 1 1 26 26 ALA H H 26 8.099 8.099 8.056 0.043 17927 8418 1 11 . 1 1 27 27 ASP N N 27 116.553 116.553 118.278 -1.725 17927 8419 1 11 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.443 0.030 17927 8420 1 11 . 1 1 27 27 ASP C C 27 176.915 176.915 177.671 -0.756 17927 8421 1 11 . 1 1 27 27 ASP CA C 27 56.251 56.251 56.097 0.154 17927 8422 1 11 . 1 1 27 27 ASP CB C 27 40.788 40.788 41.029 -0.241 17927 8423 1 11 . 1 1 27 27 ASP H H 27 7.572 7.572 7.495 0.077 17927 8424 1 11 . 1 1 28 28 LEU N N 28 118.950 118.950 116.959 1.991 17927 8425 1 11 . 1 1 28 28 LEU HA H 28 4.233 4.233 3.932 0.301 17927 8426 1 11 . 1 1 28 28 LEU C C 28 175.542 175.542 176.886 -1.344 17927 8427 1 11 . 1 1 28 28 LEU CA C 28 53.706 53.706 54.219 -0.513 17927 8428 1 11 . 1 1 28 28 LEU CB C 28 41.049 41.049 42.004 -0.955 17927 8429 1 11 . 1 1 28 28 LEU H H 28 7.363 7.363 7.216 0.147 17927 8430 1 11 . 1 1 29 29 LYS N N 29 118.429 118.429 120.479 -2.050 17927 8431 1 11 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.142 0.210 17927 8432 1 11 . 1 1 29 29 LYS C C 29 178.063 178.063 177.452 0.611 17927 8433 1 11 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.839 -0.062 17927 8434 1 11 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.599 0.841 17927 8435 1 11 . 1 1 29 29 LYS H H 29 6.780 6.780 7.240 -0.460 17927 8436 1 11 . 1 1 30 30 GLY N N 30 112.426 112.426 114.030 -1.604 17927 8437 1 11 . 1 1 30 30 GLY C C 30 173.801 173.801 173.391 0.410 17927 8438 1 11 . 1 1 30 30 GLY CA C 30 44.611 44.611 44.975 -0.364 17927 8439 1 11 . 1 1 30 30 GLY H H 30 9.398 9.398 9.043 0.355 17927 8440 1 11 . 1 1 31 31 LYS N N 31 119.295 119.295 119.159 0.136 17927 8441 1 11 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.553 -0.401 17927 8442 1 11 . 1 1 31 31 LYS C C 31 173.862 173.862 175.939 -2.077 17927 8443 1 11 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.836 0.352 17927 8444 1 11 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.517 1.452 17927 8445 1 11 . 1 1 31 31 LYS H H 31 7.496 7.496 7.369 0.127 17927 8446 1 11 . 1 1 32 32 TYR N N 32 116.984 116.984 122.311 -5.327 17927 8447 1 11 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.446 -0.289 17927 8448 1 11 . 1 1 32 32 TYR C C 32 175.226 175.226 175.908 -0.682 17927 8449 1 11 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.685 -0.095 17927 8450 1 11 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.460 -0.339 17927 8451 1 11 . 1 1 32 32 TYR H H 32 7.521 7.521 8.238 -0.717 17927 8452 1 11 . 1 1 33 33 ILE N N 33 118.052 118.052 120.796 -2.744 17927 8453 1 11 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.561 0.346 17927 8454 1 11 . 1 1 33 33 ILE C C 33 174.308 174.308 174.230 0.078 17927 8455 1 11 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.479 0.223 17927 8456 1 11 . 1 1 33 33 ILE CB C 33 41.616 41.616 40.716 0.900 17927 8457 1 11 . 1 1 33 33 ILE H H 33 8.467 8.467 9.002 -0.535 17927 8458 1 11 . 1 1 34 34 TYR N N 34 130.242 130.242 129.277 0.965 17927 8459 1 11 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.292 0.234 17927 8460 1 11 . 1 1 34 34 TYR C C 34 174.245 174.245 173.563 0.682 17927 8461 1 11 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.663 0.496 17927 8462 1 11 . 1 1 34 34 TYR CB C 34 40.133 40.133 40.486 -0.353 17927 8463 1 11 . 1 1 34 34 TYR H H 34 8.905 8.905 9.315 -0.410 17927 8464 1 11 . 1 1 35 35 ILE N N 35 128.697 128.697 129.634 -0.937 17927 8465 1 11 . 1 1 35 35 ILE HA H 35 5.342 5.342 4.757 0.585 17927 8466 1 11 . 1 1 35 35 ILE C C 35 174.520 174.520 174.447 0.073 17927 8467 1 11 . 1 1 35 35 ILE CA C 35 59.749 59.749 60.110 -0.361 17927 8468 1 11 . 1 1 35 35 ILE CB C 35 40.899 40.899 39.308 1.591 17927 8469 1 11 . 1 1 35 35 ILE H H 35 9.445 9.445 8.438 1.007 17927 8470 1 11 . 1 1 36 36 ASP N N 36 123.675 123.675 125.970 -2.295 17927 8471 1 11 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.830 -0.982 17927 8472 1 11 . 1 1 36 36 ASP C C 36 174.385 174.385 175.798 -1.413 17927 8473 1 11 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.670 -0.376 17927 8474 1 11 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.248 -2.470 17927 8475 1 11 . 1 1 36 36 ASP H H 36 8.875 8.875 8.900 -0.025 17927 8476 1 11 . 1 1 37 37 VAL N N 37 127.159 127.159 119.015 8.144 17927 8477 1 11 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.947 0.012 17927 8478 1 11 . 1 1 37 37 VAL C C 37 175.046 175.046 175.750 -0.704 17927 8479 1 11 . 1 1 37 37 VAL CA C 37 62.245 62.245 61.200 1.045 17927 8480 1 11 . 1 1 37 37 VAL CB C 37 31.807 31.807 32.931 -1.124 17927 8481 1 11 . 1 1 37 37 VAL H H 37 8.603 8.603 8.007 0.596 17927 8482 1 11 . 1 1 38 38 TRP N N 38 124.161 124.161 125.371 -1.210 17927 8483 1 11 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.084 0.153 17927 8484 1 11 . 1 1 38 38 TRP C C 38 171.995 171.995 173.286 -1.291 17927 8485 1 11 . 1 1 38 38 TRP CA C 38 55.207 55.207 54.108 1.099 17927 8486 1 11 . 1 1 38 38 TRP CB C 38 33.187 33.187 31.191 1.996 17927 8487 1 11 . 1 1 38 38 TRP H H 38 8.562 8.562 8.695 -0.133 17927 8488 1 11 . 1 1 39 39 ALA N N 39 116.252 116.252 124.388 -8.136 17927 8489 1 11 . 1 1 39 39 ALA HA H 39 3.678 3.678 3.375 0.303 17927 8490 1 11 . 1 1 39 39 ALA C C 39 178.664 178.664 174.831 3.833 17927 8491 1 11 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.378 1.088 17927 8492 1 11 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.039 1.302 17927 8493 1 11 . 1 1 39 39 ALA H H 39 6.757 6.757 8.169 -1.412 17927 8494 1 11 . 1 1 40 40 THR N N 40 114.321 114.321 113.165 1.156 17927 8495 1 11 . 1 1 40 40 THR HA H 40 3.907 3.907 4.610 -0.703 17927 8496 1 11 . 1 1 40 40 THR C C 40 175.885 175.885 175.769 0.116 17927 8497 1 11 . 1 1 40 40 THR CA C 40 65.447 65.447 62.731 2.716 17927 8498 1 11 . 1 1 40 40 THR CB C 40 70.106 70.106 69.261 0.845 17927 8499 1 11 . 1 1 40 40 THR H H 40 9.639 9.639 7.819 1.820 17927 8500 1 11 . 1 1 41 41 TRP N N 41 114.483 114.483 121.329 -6.846 17927 8501 1 11 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.889 -0.326 17927 8502 1 11 . 1 1 41 41 TRP C C 41 176.189 176.189 174.967 1.222 17927 8503 1 11 . 1 1 41 41 TRP CA C 41 54.698 54.698 55.411 -0.713 17927 8504 1 11 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.786 1.191 17927 8505 1 11 . 1 1 41 41 TRP H H 41 6.401 6.401 7.254 -0.853 17927 8506 1 11 . 1 1 42 42 CYS N N 42 123.536 123.536 119.983 3.553 17927 8507 1 11 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.612 -0.044 17927 8508 1 11 . 1 1 42 42 CYS C C 42 175.726 175.726 175.149 0.577 17927 8509 1 11 . 1 1 42 42 CYS CA C 42 58.700 58.700 57.967 0.733 17927 8510 1 11 . 1 1 42 42 CYS CB C 42 27.121 27.121 30.234 -3.113 17927 8511 1 11 . 1 1 42 42 CYS H H 42 6.883 6.883 7.166 -0.283 17927 8512 1 11 . 1 1 43 43 GLY N N 43 120.977 120.977 110.572 10.405 17927 8513 1 11 . 1 1 43 43 GLY CA C 43 49.204 49.204 45.811 3.393 17927 8514 1 11 . 1 1 43 43 GLY H H 43 9.653 9.653 8.815 0.838 17927 8515 1 11 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.310 0.177 17927 8516 1 11 . 1 1 44 44 PRO C C 44 179.956 179.956 178.749 1.207 17927 8517 1 11 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.004 0.638 17927 8518 1 11 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.138 1.440 17927 8519 1 11 . 1 1 45 45 CYS N N 45 113.925 113.925 116.224 -2.299 17927 8520 1 11 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.273 0.040 17927 8521 1 11 . 1 1 45 45 CYS C C 45 178.325 178.325 176.887 1.438 17927 8522 1 11 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.500 1.892 17927 8523 1 11 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.329 1.176 17927 8524 1 11 . 1 1 45 45 CYS H H 45 7.676 7.676 8.225 -0.549 17927 8525 1 11 . 1 1 46 46 ARG N N 46 120.336 120.336 121.084 -0.748 17927 8526 1 11 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.200 -0.131 17927 8527 1 11 . 1 1 46 46 ARG C C 46 180.446 180.446 177.832 2.614 17927 8528 1 11 . 1 1 46 46 ARG CA C 46 59.785 59.785 57.841 1.944 17927 8529 1 11 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.693 0.175 17927 8530 1 11 . 1 1 46 46 ARG H H 46 8.109 8.109 8.203 -0.094 17927 8531 1 11 . 1 1 47 47 GLY N N 47 105.408 105.408 107.539 -2.131 17927 8532 1 11 . 1 1 47 47 GLY C C 47 175.258 175.258 174.987 0.271 17927 8533 1 11 . 1 1 47 47 GLY CA C 47 46.594 46.594 46.118 0.476 17927 8534 1 11 . 1 1 47 47 GLY H H 47 8.466 8.466 7.929 0.537 17927 8535 1 11 . 1 1 48 48 GLU N N 48 116.343 116.343 118.921 -2.578 17927 8536 1 11 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.584 -0.059 17927 8537 1 11 . 1 1 48 48 GLU C C 48 176.535 176.535 178.151 -1.616 17927 8538 1 11 . 1 1 48 48 GLU CA C 48 55.792 55.792 55.601 0.191 17927 8539 1 11 . 1 1 48 48 GLU CB C 48 30.982 30.982 30.055 0.927 17927 8540 1 11 . 1 1 48 48 GLU H H 48 7.050 7.050 7.792 -0.742 17927 8541 1 11 . 1 1 49 49 LEU N N 49 118.652 118.652 122.911 -4.259 17927 8542 1 11 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.176 -0.024 17927 8543 1 11 . 1 1 49 49 LEU C C 49 176.832 176.832 176.170 0.662 17927 8544 1 11 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.205 -0.859 17927 8545 1 11 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.292 -0.796 17927 8546 1 11 . 1 1 49 49 LEU H H 49 7.385 7.385 7.794 -0.409 17927 8547 1 11 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.139 0.114 17927 8548 1 11 . 1 1 50 50 PRO C C 50 179.744 179.744 178.305 1.439 17927 8549 1 11 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.366 0.193 17927 8550 1 11 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.997 -0.235 17927 8551 1 11 . 1 1 51 51 ALA N N 51 120.418 120.418 118.591 1.827 17927 8552 1 11 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.106 0.039 17927 8553 1 11 . 1 1 51 51 ALA C C 51 180.329 180.329 179.395 0.934 17927 8554 1 11 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.403 0.031 17927 8555 1 11 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.410 -0.040 17927 8556 1 11 . 1 1 51 51 ALA H H 51 7.731 7.731 7.949 -0.218 17927 8557 1 11 . 1 1 52 52 LEU N N 52 121.506 121.506 120.307 1.199 17927 8558 1 11 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.929 0.059 17927 8559 1 11 . 1 1 52 52 LEU C C 52 177.944 177.944 178.302 -0.358 17927 8560 1 11 . 1 1 52 52 LEU CA C 52 58.327 58.327 58.128 0.199 17927 8561 1 11 . 1 1 52 52 LEU CB C 52 42.382 42.382 42.111 0.271 17927 8562 1 11 . 1 1 52 52 LEU H H 52 8.355 8.355 8.370 -0.015 17927 8563 1 11 . 1 1 53 53 LYS N N 53 119.732 119.732 118.028 1.704 17927 8564 1 11 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.902 0.001 17927 8565 1 11 . 1 1 53 53 LYS C C 53 179.030 179.030 178.807 0.223 17927 8566 1 11 . 1 1 53 53 LYS CA C 53 59.846 59.846 59.202 0.644 17927 8567 1 11 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.794 0.417 17927 8568 1 11 . 1 1 53 53 LYS H H 53 8.148 8.148 8.250 -0.102 17927 8569 1 11 . 1 1 54 54 GLU N N 54 117.779 117.779 120.093 -2.314 17927 8570 1 11 . 1 1 54 54 GLU HA H 54 4.059 4.059 4.213 -0.154 17927 8571 1 11 . 1 1 54 54 GLU C C 54 179.646 179.646 179.099 0.547 17927 8572 1 11 . 1 1 54 54 GLU CA C 54 59.625 59.625 58.714 0.911 17927 8573 1 11 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.360 0.207 17927 8574 1 11 . 1 1 54 54 GLU H H 54 7.585 7.585 7.676 -0.091 17927 8575 1 11 . 1 1 55 55 LEU N N 55 120.581 120.581 120.230 0.351 17927 8576 1 11 . 1 1 55 55 LEU HA H 55 4.193 4.193 3.812 0.381 17927 8577 1 11 . 1 1 55 55 LEU C C 55 178.557 178.557 178.415 0.142 17927 8578 1 11 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.764 0.471 17927 8579 1 11 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.527 1.484 17927 8580 1 11 . 1 1 55 55 LEU H H 55 8.096 8.096 7.949 0.147 17927 8581 1 11 . 1 1 56 56 GLU N N 56 118.023 118.023 118.823 -0.800 17927 8582 1 11 . 1 1 56 56 GLU HA H 56 3.177 3.177 3.697 -0.520 17927 8583 1 11 . 1 1 56 56 GLU C C 56 179.650 179.650 178.496 1.154 17927 8584 1 11 . 1 1 56 56 GLU CA C 56 58.871 58.871 58.772 0.099 17927 8585 1 11 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.089 -2.104 17927 8586 1 11 . 1 1 56 56 GLU H H 56 8.181 8.181 7.283 0.898 17927 8587 1 11 . 1 1 57 57 GLU N N 57 117.828 117.828 117.941 -0.113 17927 8588 1 11 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.015 0.089 17927 8589 1 11 . 1 1 57 57 GLU C C 57 179.700 179.700 178.464 1.236 17927 8590 1 11 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.292 0.735 17927 8591 1 11 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.500 0.165 17927 8592 1 11 . 1 1 57 57 GLU H H 57 7.762 7.762 7.912 -0.150 17927 8593 1 11 . 1 1 58 58 LYS N N 58 120.896 120.896 118.957 1.939 17927 8594 1 11 . 1 1 58 58 LYS HA H 58 3.979 3.979 4.015 -0.036 17927 8595 1 11 . 1 1 58 58 LYS C C 58 178.715 178.715 177.506 1.209 17927 8596 1 11 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.148 0.930 17927 8597 1 11 . 1 1 58 58 LYS CB C 58 32.980 32.980 33.095 -0.115 17927 8598 1 11 . 1 1 58 58 LYS H H 58 8.410 8.410 7.497 0.913 17927 8599 1 11 . 1 1 59 59 TYR N N 59 113.713 113.713 116.774 -3.061 17927 8600 1 11 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.634 -0.322 17927 8601 1 11 . 1 1 59 59 TYR C C 59 175.025 175.025 174.941 0.084 17927 8602 1 11 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.389 2.583 17927 8603 1 11 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.672 -1.238 17927 8604 1 11 . 1 1 59 59 TYR H H 59 8.102 8.102 7.619 0.483 17927 8605 1 11 . 1 1 60 60 ALA N N 60 126.637 126.637 123.305 3.332 17927 8606 1 11 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.726 -0.308 17927 8607 1 11 . 1 1 60 60 ALA C C 60 179.208 179.208 177.594 1.614 17927 8608 1 11 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.120 1.414 17927 8609 1 11 . 1 1 60 60 ALA CB C 60 18.589 18.589 18.303 0.286 17927 8610 1 11 . 1 1 60 60 ALA H H 60 7.201 7.201 7.653 -0.452 17927 8611 1 11 . 1 1 61 61 GLY N N 61 111.816 111.816 111.363 0.453 17927 8612 1 11 . 1 1 61 61 GLY C C 61 174.698 174.698 175.526 -0.828 17927 8613 1 11 . 1 1 61 61 GLY CA C 61 45.904 45.904 46.204 -0.300 17927 8614 1 11 . 1 1 61 61 GLY H H 61 9.184 9.184 8.980 0.204 17927 8615 1 11 . 1 1 62 62 LYS N N 62 118.497 118.497 120.414 -1.917 17927 8616 1 11 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.195 0.684 17927 8617 1 11 . 1 1 62 62 LYS C C 62 179.019 179.019 176.691 2.328 17927 8618 1 11 . 1 1 62 62 LYS CA C 62 53.988 53.988 58.464 -4.476 17927 8619 1 11 . 1 1 62 62 LYS CB C 62 33.840 33.840 32.825 1.015 17927 8620 1 11 . 1 1 62 62 LYS H H 62 8.019 8.019 7.775 0.244 17927 8621 1 11 . 1 1 63 63 ASP N N 63 122.982 122.982 115.634 7.348 17927 8622 1 11 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.838 -0.311 17927 8623 1 11 . 1 1 63 63 ASP C C 63 174.065 174.065 173.981 0.084 17927 8624 1 11 . 1 1 63 63 ASP CA C 63 55.055 55.055 54.085 0.970 17927 8625 1 11 . 1 1 63 63 ASP CB C 63 38.582 38.582 41.968 -3.386 17927 8626 1 11 . 1 1 63 63 ASP H H 63 8.709 8.709 8.379 0.330 17927 8627 1 11 . 1 1 64 64 ILE N N 64 122.219 122.219 118.711 3.508 17927 8628 1 11 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.467 0.140 17927 8629 1 11 . 1 1 64 64 ILE C C 64 174.627 174.627 174.262 0.365 17927 8630 1 11 . 1 1 64 64 ILE CA C 64 59.712 59.712 60.035 -0.323 17927 8631 1 11 . 1 1 64 64 ILE CB C 64 42.133 42.133 41.475 0.658 17927 8632 1 11 . 1 1 64 64 ILE H H 64 8.678 8.678 7.394 1.284 17927 8633 1 11 . 1 1 65 65 HIS N N 65 125.584 125.584 124.365 1.219 17927 8634 1 11 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.924 0.119 17927 8635 1 11 . 1 1 65 65 HIS C C 65 174.153 174.153 174.243 -0.090 17927 8636 1 11 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.306 0.653 17927 8637 1 11 . 1 1 65 65 HIS CB C 65 34.156 34.156 30.638 3.518 17927 8638 1 11 . 1 1 65 65 HIS H H 65 9.204 9.204 8.891 0.313 17927 8639 1 11 . 1 1 66 66 PHE N N 66 123.244 123.244 125.628 -2.384 17927 8640 1 11 . 1 1 66 66 PHE HA H 66 5.210 5.210 5.053 0.157 17927 8641 1 11 . 1 1 66 66 PHE C C 66 175.463 175.463 174.984 0.479 17927 8642 1 11 . 1 1 66 66 PHE CA C 66 58.088 58.088 57.789 0.299 17927 8643 1 11 . 1 1 66 66 PHE CB C 66 39.637 39.637 38.603 1.034 17927 8644 1 11 . 1 1 66 66 PHE H H 66 9.262 9.262 9.760 -0.498 17927 8645 1 11 . 1 1 67 67 VAL N N 67 126.201 126.201 126.476 -0.275 17927 8646 1 11 . 1 1 67 67 VAL HA H 67 4.834 4.834 5.160 -0.326 17927 8647 1 11 . 1 1 67 67 VAL C C 67 174.364 174.364 175.854 -1.490 17927 8648 1 11 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.807 -0.083 17927 8649 1 11 . 1 1 67 67 VAL CB C 67 34.893 34.893 32.793 2.100 17927 8650 1 11 . 1 1 67 67 VAL H H 67 8.843 8.843 9.250 -0.407 17927 8651 1 11 . 1 1 68 68 SER N N 68 124.528 124.528 124.521 0.007 17927 8652 1 11 . 1 1 68 68 SER HA H 68 5.585 5.585 5.103 0.482 17927 8653 1 11 . 1 1 68 68 SER C C 68 172.858 172.858 172.846 0.012 17927 8654 1 11 . 1 1 68 68 SER CA C 68 57.282 57.282 57.743 -0.461 17927 8655 1 11 . 1 1 68 68 SER CB C 68 65.032 65.032 63.012 2.020 17927 8656 1 11 . 1 1 68 68 SER H H 68 9.243 9.243 8.756 0.487 17927 8657 1 11 . 1 1 69 69 LEU N N 69 126.695 126.695 128.684 -1.989 17927 8658 1 11 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.445 -0.928 17927 8659 1 11 . 1 1 69 69 LEU C C 69 174.652 174.652 175.480 -0.828 17927 8660 1 11 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.663 -0.837 17927 8661 1 11 . 1 1 69 69 LEU CB C 69 43.895 43.895 45.495 -1.601 17927 8662 1 11 . 1 1 69 69 LEU H H 69 9.360 9.360 9.140 0.220 17927 8663 1 11 . 1 1 70 70 SER N N 70 116.379 116.379 122.305 -5.926 17927 8664 1 11 . 1 1 70 70 SER HA H 70 4.905 4.905 5.117 -0.212 17927 8665 1 11 . 1 1 70 70 SER C C 70 176.307 176.307 174.523 1.784 17927 8666 1 11 . 1 1 70 70 SER CA C 70 55.213 55.213 56.273 -1.060 17927 8667 1 11 . 1 1 70 70 SER CB C 70 63.519 63.519 64.162 -0.643 17927 8668 1 11 . 1 1 70 70 SER H H 70 7.981 7.981 8.772 -0.791 17927 8669 1 11 . 1 1 71 71 CYS N N 71 124.670 124.670 128.271 -3.601 17927 8670 1 11 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.510 0.448 17927 8671 1 11 . 1 1 71 71 CYS C C 71 173.996 173.996 174.278 -0.282 17927 8672 1 11 . 1 1 71 71 CYS CA C 71 55.483 55.483 57.030 -1.547 17927 8673 1 11 . 1 1 71 71 CYS CB C 71 28.112 28.112 26.397 1.715 17927 8674 1 11 . 1 1 71 71 CYS H H 71 8.609 8.609 9.102 -0.493 17927 8675 1 11 . 1 1 72 72 ASP N N 72 122.398 122.398 123.175 -0.777 17927 8676 1 11 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.811 -0.519 17927 8677 1 11 . 1 1 72 72 ASP C C 72 176.653 176.653 176.939 -0.286 17927 8678 1 11 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.215 1.567 17927 8679 1 11 . 1 1 72 72 ASP CB C 72 41.526 41.526 42.000 -0.474 17927 8680 1 11 . 1 1 72 72 ASP H H 72 8.557 8.557 7.574 0.983 17927 8681 1 11 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.217 -0.152 17927 8682 1 11 . 1 1 73 73 LYS C C 73 176.545 176.545 176.225 0.320 17927 8683 1 11 . 1 1 73 73 LYS CA C 73 58.458 58.458 57.554 0.904 17927 8684 1 11 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.662 -0.021 17927 8685 1 11 . 1 1 74 74 ASN N N 74 117.616 117.616 120.266 -2.650 17927 8686 1 11 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.944 -0.039 17927 8687 1 11 . 1 1 74 74 ASN C C 74 174.894 174.894 174.626 0.268 17927 8688 1 11 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.491 -0.970 17927 8689 1 11 . 1 1 74 74 ASN CB C 74 38.109 38.109 38.322 -0.213 17927 8690 1 11 . 1 1 74 74 ASN H H 74 8.625 8.625 8.795 -0.170 17927 8691 1 11 . 1 1 75 75 LYS N N 75 126.797 126.797 125.144 1.653 17927 8692 1 11 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.561 -0.138 17927 8693 1 11 . 1 1 75 75 LYS C C 75 178.058 178.058 177.842 0.216 17927 8694 1 11 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.582 -0.409 17927 8695 1 11 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.236 1.055 17927 8696 1 11 . 1 1 75 75 LYS H H 75 8.588 8.588 8.077 0.511 17927 8697 1 11 . 1 1 76 76 LYS N N 76 117.875 117.875 120.166 -2.291 17927 8698 1 11 . 1 1 76 76 LYS HA H 76 4.200 4.200 3.828 0.372 17927 8699 1 11 . 1 1 76 76 LYS C C 76 178.791 178.791 178.257 0.534 17927 8700 1 11 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.980 -1.372 17927 8701 1 11 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.847 -0.357 17927 8702 1 11 . 1 1 76 76 LYS H H 76 8.041 8.041 8.702 -0.661 17927 8703 1 11 . 1 1 77 77 ALA N N 77 121.567 121.567 120.879 0.688 17927 8704 1 11 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.150 -0.027 17927 8705 1 11 . 1 1 77 77 ALA C C 77 181.191 181.191 179.601 1.590 17927 8706 1 11 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.697 0.260 17927 8707 1 11 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.120 -0.361 17927 8708 1 11 . 1 1 77 77 ALA H H 77 7.366 7.366 8.089 -0.723 17927 8709 1 11 . 1 1 78 78 TRP N N 78 119.497 119.497 120.327 -0.830 17927 8710 1 11 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.162 -0.085 17927 8711 1 11 . 1 1 78 78 TRP C C 78 175.942 175.942 177.311 -1.369 17927 8712 1 11 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.244 2.517 17927 8713 1 11 . 1 1 78 78 TRP CB C 78 27.272 27.272 29.963 -2.691 17927 8714 1 11 . 1 1 78 78 TRP H H 78 7.187 7.187 8.268 -1.081 17927 8715 1 11 . 1 1 79 79 GLU N N 79 118.771 118.771 118.325 0.446 17927 8716 1 11 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.590 -0.576 17927 8717 1 11 . 1 1 79 79 GLU C C 79 179.863 179.863 179.108 0.755 17927 8718 1 11 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.596 -0.486 17927 8719 1 11 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.606 1.614 17927 8720 1 11 . 1 1 79 79 GLU H H 79 8.813 8.813 8.694 0.119 17927 8721 1 11 . 1 1 80 80 ASN N N 80 115.964 115.964 116.060 -0.096 17927 8722 1 11 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.509 -0.170 17927 8723 1 11 . 1 1 80 80 ASN C C 80 176.749 176.749 177.596 -0.847 17927 8724 1 11 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.053 0.982 17927 8725 1 11 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.258 0.231 17927 8726 1 11 . 1 1 80 80 ASN H H 80 8.491 8.491 7.904 0.587 17927 8727 1 11 . 1 1 81 81 MET N N 81 119.670 119.670 120.286 -0.616 17927 8728 1 11 . 1 1 81 81 MET HA H 81 4.149 4.149 4.244 -0.095 17927 8729 1 11 . 1 1 81 81 MET C C 81 177.933 177.933 177.518 0.415 17927 8730 1 11 . 1 1 81 81 MET CA C 81 60.276 60.276 57.491 2.785 17927 8731 1 11 . 1 1 81 81 MET CB C 81 32.518 32.518 32.343 0.175 17927 8732 1 11 . 1 1 81 81 MET H H 81 7.667 7.667 7.673 -0.006 17927 8733 1 11 . 1 1 82 82 VAL N N 82 117.634 117.634 118.819 -1.185 17927 8734 1 11 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.524 -0.221 17927 8735 1 11 . 1 1 82 82 VAL C C 82 179.005 179.005 177.480 1.525 17927 8736 1 11 . 1 1 82 82 VAL CA C 82 67.037 67.037 65.901 1.136 17927 8737 1 11 . 1 1 82 82 VAL CB C 82 31.765 31.765 30.763 1.002 17927 8738 1 11 . 1 1 82 82 VAL H H 82 8.338 8.338 8.296 0.042 17927 8739 1 11 . 1 1 83 83 THR N N 83 110.519 110.519 114.838 -4.319 17927 8740 1 11 . 1 1 83 83 THR HA H 83 3.983 3.983 3.987 -0.004 17927 8741 1 11 . 1 1 83 83 THR C C 83 177.591 177.591 175.920 1.671 17927 8742 1 11 . 1 1 83 83 THR CA C 83 65.431 65.431 65.872 -0.441 17927 8743 1 11 . 1 1 83 83 THR CB C 83 69.156 69.156 68.601 0.555 17927 8744 1 11 . 1 1 83 83 THR H H 83 7.659 7.659 7.599 0.060 17927 8745 1 11 . 1 1 84 84 LYS N N 84 123.927 123.927 119.655 4.272 17927 8746 1 11 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.227 -0.158 17927 8747 1 11 . 1 1 84 84 LYS C C 84 178.582 178.582 177.816 0.766 17927 8748 1 11 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.208 1.669 17927 8749 1 11 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.781 -0.458 17927 8750 1 11 . 1 1 84 84 LYS H H 84 8.665 8.665 7.481 1.184 17927 8751 1 11 . 1 1 85 85 ASP N N 85 116.280 116.280 117.291 -1.011 17927 8752 1 11 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.556 0.194 17927 8753 1 11 . 1 1 85 85 ASP C C 85 175.086 175.086 175.723 -0.637 17927 8754 1 11 . 1 1 85 85 ASP CA C 85 54.693 54.693 56.123 -1.430 17927 8755 1 11 . 1 1 85 85 ASP CB C 85 39.685 39.685 41.399 -1.714 17927 8756 1 11 . 1 1 85 85 ASP H H 85 8.179 8.179 8.306 -0.127 17927 8757 1 11 . 1 1 86 86 GLN N N 86 116.258 116.258 115.692 0.566 17927 8758 1 11 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.909 -0.001 17927 8759 1 11 . 1 1 86 86 GLN C C 86 175.659 175.659 174.555 1.104 17927 8760 1 11 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.133 0.039 17927 8761 1 11 . 1 1 86 86 GLN CB C 86 26.290 26.290 25.991 0.299 17927 8762 1 11 . 1 1 86 86 GLN H H 86 7.431 7.431 7.907 -0.476 17927 8763 1 11 . 1 1 87 87 LEU N N 87 117.031 117.031 120.020 -2.989 17927 8764 1 11 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.489 -0.399 17927 8765 1 11 . 1 1 87 87 LEU C C 87 178.225 178.225 176.599 1.626 17927 8766 1 11 . 1 1 87 87 LEU CA C 87 55.932 55.932 54.310 1.622 17927 8767 1 11 . 1 1 87 87 LEU CB C 87 41.202 41.202 42.356 -1.154 17927 8768 1 11 . 1 1 87 87 LEU H H 87 7.736 7.736 7.605 0.131 17927 8769 1 11 . 1 1 88 88 LYS N N 88 122.367 122.367 124.165 -1.798 17927 8770 1 11 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.418 0.218 17927 8771 1 11 . 1 1 88 88 LYS C C 88 177.538 177.538 176.703 0.835 17927 8772 1 11 . 1 1 88 88 LYS CA C 88 54.930 54.930 55.005 -0.075 17927 8773 1 11 . 1 1 88 88 LYS CB C 88 33.316 33.316 33.556 -0.240 17927 8774 1 11 . 1 1 88 88 LYS H H 88 8.496 8.496 8.476 0.020 17927 8775 1 11 . 1 1 89 89 GLY N N 89 108.452 108.452 105.635 2.817 17927 8776 1 11 . 1 1 89 89 GLY C C 89 173.781 173.781 173.631 0.150 17927 8777 1 11 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.332 1.026 17927 8778 1 11 . 1 1 89 89 GLY H H 89 8.497 8.497 8.216 0.281 17927 8779 1 11 . 1 1 90 90 ILE N N 90 123.295 123.295 123.210 0.085 17927 8780 1 11 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.235 0.136 17927 8781 1 11 . 1 1 90 90 ILE C C 90 175.606 175.606 174.502 1.104 17927 8782 1 11 . 1 1 90 90 ILE CA C 90 62.001 62.001 59.963 2.038 17927 8783 1 11 . 1 1 90 90 ILE CB C 90 38.036 38.036 36.325 1.711 17927 8784 1 11 . 1 1 90 90 ILE H H 90 8.728 8.728 8.146 0.582 17927 8785 1 11 . 1 1 91 91 GLN N N 91 128.632 128.632 125.785 2.847 17927 8786 1 11 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.983 -0.217 17927 8787 1 11 . 1 1 91 91 GLN C C 91 174.618 174.618 174.355 0.263 17927 8788 1 11 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.782 1.068 17927 8789 1 11 . 1 1 91 91 GLN CB C 91 28.341 28.341 32.094 -3.753 17927 8790 1 11 . 1 1 91 91 GLN H H 91 8.762 8.762 8.158 0.604 17927 8791 1 11 . 1 1 92 92 LEU N N 92 120.830 120.830 115.552 5.278 17927 8792 1 11 . 1 1 92 92 LEU HA H 92 5.580 5.580 5.382 0.198 17927 8793 1 11 . 1 1 92 92 LEU C C 92 176.828 176.828 175.044 1.784 17927 8794 1 11 . 1 1 92 92 LEU CA C 92 52.801 52.801 54.314 -1.513 17927 8795 1 11 . 1 1 92 92 LEU CB C 92 44.210 44.210 45.948 -1.738 17927 8796 1 11 . 1 1 92 92 LEU H H 92 9.011 9.011 9.247 -0.236 17927 8797 1 11 . 1 1 93 93 HIS N N 93 121.481 121.481 120.275 1.206 17927 8798 1 11 . 1 1 93 93 HIS HA H 93 3.931 3.931 5.083 -1.152 17927 8799 1 11 . 1 1 93 93 HIS C C 93 173.590 173.590 173.120 0.470 17927 8800 1 11 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.644 0.939 17927 8801 1 11 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.839 -1.589 17927 8802 1 11 . 1 1 93 93 HIS H H 93 8.038 8.038 8.985 -0.947 17927 8803 1 11 . 1 1 94 94 MET N N 94 121.881 121.881 123.490 -1.609 17927 8804 1 11 . 1 1 94 94 MET HA H 94 3.866 3.866 4.368 -0.502 17927 8805 1 11 . 1 1 94 94 MET C C 94 177.035 177.035 176.721 0.314 17927 8806 1 11 . 1 1 94 94 MET CA C 94 55.189 55.189 56.815 -1.626 17927 8807 1 11 . 1 1 94 94 MET CB C 94 33.993 33.993 34.476 -0.483 17927 8808 1 11 . 1 1 94 94 MET H H 94 8.039 8.039 8.482 -0.443 17927 8809 1 11 . 1 1 95 95 GLY N N 95 104.041 104.041 106.518 -2.477 17927 8810 1 11 . 1 1 95 95 GLY C C 95 174.251 174.251 175.420 -1.169 17927 8811 1 11 . 1 1 95 95 GLY CA C 95 46.580 46.580 46.853 -0.273 17927 8812 1 11 . 1 1 95 95 GLY H H 95 5.666 5.666 7.731 -2.065 17927 8813 1 11 . 1 1 96 96 THR N N 96 114.114 114.114 117.070 -2.956 17927 8814 1 11 . 1 1 96 96 THR HA H 96 4.211 4.211 4.277 -0.066 17927 8815 1 11 . 1 1 96 96 THR C C 96 175.122 175.122 175.811 -0.689 17927 8816 1 11 . 1 1 96 96 THR CA C 96 61.339 61.339 64.138 -2.799 17927 8817 1 11 . 1 1 96 96 THR CB C 96 68.615 68.615 68.971 -0.356 17927 8818 1 11 . 1 1 96 96 THR H H 96 8.517 8.517 7.920 0.597 17927 8819 1 11 . 1 1 97 97 ASP N N 97 121.892 121.892 123.575 -1.683 17927 8820 1 11 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.852 -0.267 17927 8821 1 11 . 1 1 97 97 ASP C C 97 178.241 178.241 176.232 2.009 17927 8822 1 11 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.562 1.238 17927 8823 1 11 . 1 1 97 97 ASP CB C 97 43.129 43.129 39.422 3.707 17927 8824 1 11 . 1 1 97 97 ASP H H 97 7.563 7.563 8.301 -0.738 17927 8825 1 11 . 1 1 98 98 ARG N N 98 127.508 127.508 118.887 8.621 17927 8826 1 11 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.274 0.118 17927 8827 1 11 . 1 1 98 98 ARG C C 98 176.724 176.724 177.343 -0.619 17927 8828 1 11 . 1 1 98 98 ARG CA C 98 55.939 55.939 58.049 -2.110 17927 8829 1 11 . 1 1 98 98 ARG CB C 98 30.291 30.291 29.067 1.224 17927 8830 1 11 . 1 1 98 98 ARG H H 98 9.225 9.225 7.674 1.551 17927 8831 1 11 . 1 1 99 99 THR N N 99 116.384 116.384 117.426 -1.042 17927 8832 1 11 . 1 1 99 99 THR HA H 99 3.987 3.987 4.074 -0.087 17927 8833 1 11 . 1 1 99 99 THR C C 99 176.969 176.969 175.919 1.050 17927 8834 1 11 . 1 1 99 99 THR CA C 99 67.714 67.714 67.094 0.620 17927 8835 1 11 . 1 1 99 99 THR CB C 99 68.777 68.777 68.320 0.457 17927 8836 1 11 . 1 1 99 99 THR H H 99 8.382 8.382 8.189 0.193 17927 8837 1 11 . 1 1 100 100 PHE N N 100 123.232 123.232 122.166 1.066 17927 8838 1 11 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.495 -0.322 17927 8839 1 11 . 1 1 100 100 PHE C C 100 177.010 177.010 176.101 0.909 17927 8840 1 11 . 1 1 100 100 PHE CA C 100 61.923 61.923 60.493 1.430 17927 8841 1 11 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.635 1.127 17927 8842 1 11 . 1 1 100 100 PHE H H 100 7.998 7.998 8.212 -0.214 17927 8843 1 11 . 1 1 101 101 MET N N 101 115.968 115.968 118.177 -2.209 17927 8844 1 11 . 1 1 101 101 MET HA H 101 3.975 3.975 4.249 -0.274 17927 8845 1 11 . 1 1 101 101 MET C C 101 178.763 178.763 177.651 1.112 17927 8846 1 11 . 1 1 101 101 MET CA C 101 58.552 58.552 57.992 0.560 17927 8847 1 11 . 1 1 101 101 MET CB C 101 32.593 32.593 31.896 0.697 17927 8848 1 11 . 1 1 101 101 MET H H 101 7.828 7.828 7.784 0.044 17927 8849 1 11 . 1 1 102 102 ASP N N 102 117.553 117.553 121.963 -4.410 17927 8850 1 11 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.352 0.170 17927 8851 1 11 . 1 1 102 102 ASP C C 102 179.503 179.503 179.057 0.446 17927 8852 1 11 . 1 1 102 102 ASP CA C 102 56.890 56.890 58.513 -1.623 17927 8853 1 11 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.338 -0.412 17927 8854 1 11 . 1 1 102 102 ASP H H 102 8.828 8.828 8.393 0.435 17927 8855 1 11 . 1 1 103 103 ALA N N 103 122.984 122.984 121.803 1.181 17927 8856 1 11 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.050 -0.064 17927 8857 1 11 . 1 1 103 103 ALA C C 103 178.782 178.782 178.166 0.616 17927 8858 1 11 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.385 0.710 17927 8859 1 11 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.204 0.359 17927 8860 1 11 . 1 1 103 103 ALA H H 103 7.567 7.567 7.567 -0.000 17927 8861 1 11 . 1 1 104 104 TYR N N 104 112.159 112.159 114.276 -2.117 17927 8862 1 11 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.570 -0.346 17927 8863 1 11 . 1 1 104 104 TYR C C 104 173.821 173.821 174.924 -1.103 17927 8864 1 11 . 1 1 104 104 TYR CA C 104 58.498 58.498 57.719 0.779 17927 8865 1 11 . 1 1 104 104 TYR CB C 104 38.393 38.393 39.280 -0.887 17927 8866 1 11 . 1 1 104 104 TYR H H 104 7.203 7.203 7.230 -0.027 17927 8867 1 11 . 1 1 105 105 LEU N N 105 119.433 119.433 117.592 1.841 17927 8868 1 11 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.940 0.045 17927 8869 1 11 . 1 1 105 105 LEU C C 105 176.721 176.721 176.239 0.482 17927 8870 1 11 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.698 0.087 17927 8871 1 11 . 1 1 105 105 LEU CB C 105 38.443 38.443 38.892 -0.449 17927 8872 1 11 . 1 1 105 105 LEU H H 105 7.582 7.582 7.819 -0.237 17927 8873 1 11 . 1 1 106 106 ILE N N 106 119.575 119.575 121.244 -1.669 17927 8874 1 11 . 1 1 106 106 ILE HA H 106 4.002 4.002 3.792 0.210 17927 8875 1 11 . 1 1 106 106 ILE C C 106 175.459 175.459 176.201 -0.742 17927 8876 1 11 . 1 1 106 106 ILE CA C 106 62.043 62.043 62.805 -0.762 17927 8877 1 11 . 1 1 106 106 ILE CB C 106 36.335 36.335 35.707 0.628 17927 8878 1 11 . 1 1 106 106 ILE H H 106 8.774 8.774 8.029 0.745 17927 8879 1 11 . 1 1 107 107 ASN N N 107 126.514 126.514 122.815 3.699 17927 8880 1 11 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.803 0.060 17927 8881 1 11 . 1 1 107 107 ASN C C 107 174.584 174.584 175.339 -0.755 17927 8882 1 11 . 1 1 107 107 ASN CA C 107 53.112 53.112 53.765 -0.653 17927 8883 1 11 . 1 1 107 107 ASN CB C 107 38.977 38.977 39.911 -0.934 17927 8884 1 11 . 1 1 107 107 ASN H H 107 8.364 8.364 8.101 0.263 17927 8885 1 11 . 1 1 108 108 GLY N N 108 108.469 108.469 108.971 -0.502 17927 8886 1 11 . 1 1 108 108 GLY C C 108 171.245 171.245 172.218 -0.973 17927 8887 1 11 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.392 0.877 17927 8888 1 11 . 1 1 108 108 GLY H H 108 7.678 7.678 7.834 -0.156 17927 8889 1 11 . 1 1 109 109 ILE N N 109 112.817 112.817 123.653 -10.836 17927 8890 1 11 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.275 0.131 17927 8891 1 11 . 1 1 109 109 ILE C C 109 173.498 173.498 174.068 -0.570 17927 8892 1 11 . 1 1 109 109 ILE CA C 109 58.384 58.384 57.930 0.454 17927 8893 1 11 . 1 1 109 109 ILE CB C 109 40.322 40.322 39.288 1.034 17927 8894 1 11 . 1 1 109 109 ILE H H 109 7.868 7.868 8.224 -0.356 17927 8895 1 11 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.644 0.098 17927 8896 1 11 . 1 1 110 110 PRO C C 110 175.715 175.715 175.189 0.526 17927 8897 1 11 . 1 1 110 110 PRO CA C 110 62.277 62.277 61.968 0.309 17927 8898 1 11 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.597 3.771 17927 8899 1 11 . 1 1 111 111 ARG N N 111 122.358 122.358 120.962 1.396 17927 8900 1 11 . 1 1 111 111 ARG HA H 111 4.469 4.469 3.819 0.650 17927 8901 1 11 . 1 1 111 111 ARG C C 111 171.541 171.541 174.747 -3.206 17927 8902 1 11 . 1 1 111 111 ARG CA C 111 54.356 54.356 54.217 0.139 17927 8903 1 11 . 1 1 111 111 ARG CB C 111 33.430 33.430 32.315 1.115 17927 8904 1 11 . 1 1 111 111 ARG H H 111 7.732 7.732 8.488 -0.756 17927 8905 1 11 . 1 1 112 112 PHE N N 112 125.103 125.103 121.321 3.782 17927 8906 1 11 . 1 1 112 112 PHE HA H 112 5.773 5.773 5.017 0.756 17927 8907 1 11 . 1 1 112 112 PHE C C 112 175.097 175.097 175.358 -0.261 17927 8908 1 11 . 1 1 112 112 PHE CA C 112 55.791 55.791 55.767 0.025 17927 8909 1 11 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.297 1.631 17927 8910 1 11 . 1 1 112 112 PHE H H 112 8.929 8.929 7.672 1.257 17927 8911 1 11 . 1 1 113 113 ILE N N 113 123.778 123.778 122.720 1.058 17927 8912 1 11 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.901 -0.358 17927 8913 1 11 . 1 1 113 113 ILE C C 113 173.197 173.197 174.100 -0.903 17927 8914 1 11 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.763 0.523 17927 8915 1 11 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.558 1.688 17927 8916 1 11 . 1 1 113 113 ILE H H 113 8.873 8.873 8.795 0.078 17927 8917 1 11 . 1 1 114 114 LEU N N 114 127.146 127.146 126.020 1.126 17927 8918 1 11 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.536 0.478 17927 8919 1 11 . 1 1 114 114 LEU C C 114 175.080 175.080 174.638 0.442 17927 8920 1 11 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.491 -0.090 17927 8921 1 11 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.691 0.679 17927 8922 1 11 . 1 1 114 114 LEU H H 114 8.974 8.974 9.037 -0.063 17927 8923 1 11 . 1 1 115 115 LEU N N 115 128.323 128.323 124.831 3.492 17927 8924 1 11 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.167 0.265 17927 8925 1 11 . 1 1 115 115 LEU C C 115 176.660 176.660 175.471 1.189 17927 8926 1 11 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.996 -0.919 17927 8927 1 11 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.559 -1.975 17927 8928 1 11 . 1 1 115 115 LEU H H 115 9.874 9.874 9.372 0.502 17927 8929 1 11 . 1 1 116 116 ASP N N 116 119.834 119.834 121.063 -1.229 17927 8930 1 11 . 1 1 116 116 ASP HA H 116 4.935 4.935 4.781 0.154 17927 8931 1 11 . 1 1 116 116 ASP C C 116 176.898 176.898 177.252 -0.354 17927 8932 1 11 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.344 -1.039 17927 8933 1 11 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.750 -1.722 17927 8934 1 11 . 1 1 116 116 ASP H H 116 9.357 9.357 8.877 0.480 17927 8935 1 11 . 1 1 117 117 ARG N N 117 113.356 113.356 122.361 -9.005 17927 8936 1 11 . 1 1 117 117 ARG HA H 117 3.717 3.717 3.929 -0.212 17927 8937 1 11 . 1 1 117 117 ARG C C 117 177.105 177.105 177.851 -0.746 17927 8938 1 11 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.193 -1.008 17927 8939 1 11 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.939 0.498 17927 8940 1 11 . 1 1 117 117 ARG H H 117 7.697 7.697 7.974 -0.277 17927 8941 1 11 . 1 1 118 118 ASP N N 118 117.226 117.226 117.544 -0.318 17927 8942 1 11 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.425 0.470 17927 8943 1 11 . 1 1 118 118 ASP C C 118 176.657 176.657 176.880 -0.223 17927 8944 1 11 . 1 1 118 118 ASP CA C 118 53.517 53.517 55.741 -2.224 17927 8945 1 11 . 1 1 118 118 ASP CB C 118 42.556 42.556 41.292 1.264 17927 8946 1 11 . 1 1 118 118 ASP H H 118 8.456 8.456 8.501 -0.045 17927 8947 1 11 . 1 1 119 119 GLY N N 119 109.074 109.074 106.464 2.610 17927 8948 1 11 . 1 1 119 119 GLY C C 119 173.355 173.355 173.281 0.074 17927 8949 1 11 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.137 1.119 17927 8950 1 11 . 1 1 119 119 GLY H H 119 8.183 8.183 8.324 -0.141 17927 8951 1 11 . 1 1 120 120 LYS N N 120 120.744 120.744 119.975 0.769 17927 8952 1 11 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.868 -0.335 17927 8953 1 11 . 1 1 120 120 LYS C C 120 177.229 177.229 176.147 1.082 17927 8954 1 11 . 1 1 120 120 LYS CA C 120 55.287 55.287 53.616 1.671 17927 8955 1 11 . 1 1 120 120 LYS CB C 120 32.581 32.581 33.738 -1.157 17927 8956 1 11 . 1 1 120 120 LYS H H 120 8.449 8.449 7.490 0.959 17927 8957 1 11 . 1 1 121 121 ILE N N 121 121.221 121.221 127.567 -6.346 17927 8958 1 11 . 1 1 121 121 ILE HA H 121 3.886 3.886 4.000 -0.114 17927 8959 1 11 . 1 1 121 121 ILE C C 121 177.819 177.819 176.567 1.252 17927 8960 1 11 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.483 0.432 17927 8961 1 11 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.375 2.015 17927 8962 1 11 . 1 1 121 121 ILE H H 121 8.715 8.715 9.079 -0.364 17927 8963 1 11 . 1 1 122 122 ILE N N 122 127.165 127.165 128.432 -1.267 17927 8964 1 11 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.317 0.024 17927 8965 1 11 . 1 1 122 122 ILE C C 122 176.978 176.978 176.673 0.305 17927 8966 1 11 . 1 1 122 122 ILE CA C 122 63.719 63.719 61.906 1.813 17927 8967 1 11 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.516 0.136 17927 8968 1 11 . 1 1 122 122 ILE H H 122 8.974 8.974 8.799 0.175 17927 8969 1 11 . 1 1 123 123 SER N N 123 111.227 111.227 115.371 -4.144 17927 8970 1 11 . 1 1 123 123 SER HA H 123 4.738 4.738 4.769 -0.031 17927 8971 1 11 . 1 1 123 123 SER C C 123 174.184 174.184 173.777 0.407 17927 8972 1 11 . 1 1 123 123 SER CA C 123 57.383 57.383 57.183 0.200 17927 8973 1 11 . 1 1 123 123 SER CB C 123 65.326 65.326 64.905 0.421 17927 8974 1 11 . 1 1 123 123 SER H H 123 7.850 7.850 8.270 -0.420 17927 8975 1 11 . 1 1 124 124 ALA N N 124 131.373 131.373 127.863 3.510 17927 8976 1 11 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.292 0.193 17927 8977 1 11 . 1 1 124 124 ALA C C 124 175.147 175.147 177.060 -1.913 17927 8978 1 11 . 1 1 124 124 ALA CA C 124 53.035 53.035 53.691 -0.655 17927 8979 1 11 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.075 -0.413 17927 8980 1 11 . 1 1 124 124 ALA H H 124 9.384 9.384 8.731 0.653 17927 8981 1 11 . 1 1 125 125 ASN N N 125 119.476 119.476 115.571 3.905 17927 8982 1 11 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.085 -0.029 17927 8983 1 11 . 1 1 125 125 ASN C C 125 173.593 173.593 174.067 -0.474 17927 8984 1 11 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.976 -0.624 17927 8985 1 11 . 1 1 125 125 ASN CB C 125 38.304 38.304 39.627 -1.323 17927 8986 1 11 . 1 1 125 125 ASN H H 125 8.191 8.191 7.840 0.351 17927 8987 1 11 . 1 1 126 126 MET N N 126 122.705 122.705 124.637 -1.932 17927 8988 1 11 . 1 1 126 126 MET HA H 126 4.585 4.585 4.967 -0.382 17927 8989 1 11 . 1 1 126 126 MET C C 126 175.215 175.215 175.044 0.171 17927 8990 1 11 . 1 1 126 126 MET CA C 126 53.849 53.849 55.123 -1.274 17927 8991 1 11 . 1 1 126 126 MET CB C 126 31.312 31.312 34.856 -3.544 17927 8992 1 11 . 1 1 126 126 MET H H 126 8.376 8.376 9.113 -0.737 17927 8993 1 11 . 1 1 127 127 THR N N 127 111.016 111.016 112.162 -1.146 17927 8994 1 11 . 1 1 127 127 THR HA H 127 4.291 4.291 4.332 -0.041 17927 8995 1 11 . 1 1 127 127 THR C C 127 174.574 174.574 173.152 1.422 17927 8996 1 11 . 1 1 127 127 THR CA C 127 62.085 62.085 60.294 1.791 17927 8997 1 11 . 1 1 127 127 THR CB C 127 69.733 69.733 69.960 -0.227 17927 8998 1 11 . 1 1 127 127 THR H H 127 7.714 7.714 8.286 -0.572 17927 8999 1 11 . 1 1 128 128 ARG N N 128 118.722 118.722 124.289 -5.567 17927 9000 1 11 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.459 -1.151 17927 9001 1 11 . 1 1 128 128 ARG C C 128 176.978 176.978 176.017 0.961 17927 9002 1 11 . 1 1 128 128 ARG CA C 128 54.727 54.727 55.928 -1.201 17927 9003 1 11 . 1 1 128 128 ARG CB C 128 29.598 29.598 28.376 1.222 17927 9004 1 11 . 1 1 128 128 ARG H H 128 8.658 8.658 7.784 0.874 17927 9005 1 11 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.353 -0.420 17927 9006 1 11 . 1 1 129 129 PRO C C 129 175.794 175.794 177.340 -1.546 17927 9007 1 11 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.491 1.058 17927 9008 1 11 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.542 0.135 17927 9009 1 11 . 1 1 130 130 SER N N 130 108.696 108.696 111.303 -2.607 17927 9010 1 11 . 1 1 130 130 SER HA H 130 3.988 3.988 4.302 -0.314 17927 9011 1 11 . 1 1 130 130 SER C C 130 174.445 174.445 174.376 0.069 17927 9012 1 11 . 1 1 130 130 SER CA C 130 58.911 58.911 59.928 -1.017 17927 9013 1 11 . 1 1 130 130 SER CB C 130 62.680 62.680 63.075 -0.395 17927 9014 1 11 . 1 1 130 130 SER H H 130 8.375 8.375 8.184 0.191 17927 9015 1 11 . 1 1 131 131 ASP N N 131 126.377 126.377 121.792 4.585 17927 9016 1 11 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.902 -0.030 17927 9017 1 11 . 1 1 131 131 ASP C C 131 176.879 176.879 175.120 1.759 17927 9018 1 11 . 1 1 131 131 ASP CA C 131 51.195 51.195 51.193 0.002 17927 9019 1 11 . 1 1 131 131 ASP CB C 131 42.816 42.816 41.940 0.876 17927 9020 1 11 . 1 1 131 131 ASP H H 131 7.514 7.514 7.622 -0.108 17927 9021 1 11 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.242 0.150 17927 9022 1 11 . 1 1 132 132 PRO C C 132 178.097 178.097 177.810 0.287 17927 9023 1 11 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.619 0.460 17927 9024 1 11 . 1 1 132 132 PRO CB C 132 32.409 32.409 31.988 0.421 17927 9025 1 11 . 1 1 133 133 LYS N N 133 116.306 116.306 117.089 -0.783 17927 9026 1 11 . 1 1 133 133 LYS HA H 133 3.958 3.958 4.174 -0.216 17927 9027 1 11 . 1 1 133 133 LYS C C 133 179.532 179.532 178.966 0.566 17927 9028 1 11 . 1 1 133 133 LYS CA C 133 58.521 58.521 58.716 -0.195 17927 9029 1 11 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.287 0.904 17927 9030 1 11 . 1 1 133 133 LYS H H 133 8.842 8.842 7.791 1.051 17927 9031 1 11 . 1 1 134 134 THR N N 134 120.833 120.833 116.364 4.469 17927 9032 1 11 . 1 1 134 134 THR HA H 134 3.147 3.147 3.616 -0.469 17927 9033 1 11 . 1 1 134 134 THR C C 134 173.356 173.356 175.479 -2.123 17927 9034 1 11 . 1 1 134 134 THR CA C 134 66.383 66.383 66.244 0.139 17927 9035 1 11 . 1 1 134 134 THR CB C 134 66.847 66.847 68.172 -1.325 17927 9036 1 11 . 1 1 134 134 THR H H 134 8.292 8.292 8.528 -0.236 17927 9037 1 11 . 1 1 135 135 ALA N N 135 121.720 121.720 123.466 -1.746 17927 9038 1 11 . 1 1 135 135 ALA HA H 135 3.583 3.583 4.027 -0.444 17927 9039 1 11 . 1 1 135 135 ALA C C 135 178.902 178.902 179.511 -0.609 17927 9040 1 11 . 1 1 135 135 ALA CA C 135 54.999 54.999 55.101 -0.102 17927 9041 1 11 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.112 -0.337 17927 9042 1 11 . 1 1 135 135 ALA H H 135 7.030 7.030 7.341 -0.311 17927 9043 1 11 . 1 1 136 136 GLU N N 136 114.623 114.623 118.531 -3.908 17927 9044 1 11 . 1 1 136 136 GLU HA H 136 3.922 3.922 3.864 0.058 17927 9045 1 11 . 1 1 136 136 GLU C C 136 179.199 179.199 178.905 0.294 17927 9046 1 11 . 1 1 136 136 GLU CA C 136 59.837 59.837 59.373 0.464 17927 9047 1 11 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.464 0.322 17927 9048 1 11 . 1 1 136 136 GLU H H 136 7.216 7.216 8.458 -1.242 17927 9049 1 11 . 1 1 137 137 LYS N N 137 120.789 120.789 119.716 1.073 17927 9050 1 11 . 1 1 137 137 LYS HA H 137 4.204 4.204 3.895 0.309 17927 9051 1 11 . 1 1 137 137 LYS C C 137 178.834 178.834 178.876 -0.042 17927 9052 1 11 . 1 1 137 137 LYS CA C 137 57.343 57.343 59.086 -1.743 17927 9053 1 11 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.785 -1.322 17927 9054 1 11 . 1 1 137 137 LYS H H 137 7.681 7.681 7.938 -0.257 17927 9055 1 11 . 1 1 138 138 PHE N N 138 118.373 118.373 116.417 1.956 17927 9056 1 11 . 1 1 138 138 PHE HA H 138 4.033 4.033 3.902 0.131 17927 9057 1 11 . 1 1 138 138 PHE C C 138 178.027 178.027 177.727 0.300 17927 9058 1 11 . 1 1 138 138 PHE CA C 138 57.507 57.507 60.166 -2.659 17927 9059 1 11 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.328 -1.439 17927 9060 1 11 . 1 1 138 138 PHE H H 138 8.059 8.059 7.168 0.891 17927 9061 1 11 . 1 1 139 139 ASN N N 139 117.611 117.611 116.585 1.026 17927 9062 1 11 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.598 -0.194 17927 9063 1 11 . 1 1 139 139 ASN C C 139 178.190 178.190 177.413 0.777 17927 9064 1 11 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.020 0.204 17927 9065 1 11 . 1 1 139 139 ASN CB C 139 36.734 36.734 38.219 -1.485 17927 9066 1 11 . 1 1 139 139 ASN H H 139 8.683 8.683 8.028 0.655 17927 9067 1 11 . 1 1 140 140 GLU N N 140 121.432 121.432 122.028 -0.596 17927 9068 1 11 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.049 -0.044 17927 9069 1 11 . 1 1 140 140 GLU C C 140 179.751 179.751 179.142 0.609 17927 9070 1 11 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.636 -0.326 17927 9071 1 11 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.730 0.325 17927 9072 1 11 . 1 1 140 140 GLU H H 140 7.868 7.868 8.630 -0.762 17927 9073 1 11 . 1 1 141 141 LEU N N 141 119.968 119.968 119.952 0.016 17927 9074 1 11 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.092 -0.076 17927 9075 1 11 . 1 1 141 141 LEU C C 141 179.293 179.293 178.572 0.721 17927 9076 1 11 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.038 0.398 17927 9077 1 11 . 1 1 141 141 LEU CB C 141 41.183 41.183 42.045 -0.862 17927 9078 1 11 . 1 1 141 141 LEU H H 141 8.303 8.303 7.751 0.552 17927 9079 1 11 . 1 1 142 142 LEU N N 142 115.040 115.040 116.062 -1.022 17927 9080 1 11 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.368 0.016 17927 9081 1 11 . 1 1 142 142 LEU C C 142 178.002 178.002 177.783 0.219 17927 9082 1 11 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.151 0.128 17927 9083 1 11 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.189 0.457 17927 9084 1 11 . 1 1 142 142 LEU H H 142 8.230 8.230 7.634 0.596 17927 9085 1 11 . 1 1 143 143 GLY N N 143 108.977 108.977 106.882 2.095 17927 9086 1 11 . 1 1 143 143 GLY C C 143 175.216 175.216 174.472 0.744 17927 9087 1 11 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.706 1.035 17927 9088 1 11 . 1 1 143 143 GLY H H 143 7.762 7.762 7.699 0.063 17927 9089 1 11 . 1 1 144 144 LEU N N 144 119.660 119.660 120.168 -0.508 17927 9090 1 11 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.666 -0.178 17927 9091 1 11 . 1 1 144 144 LEU C C 144 177.375 177.375 176.037 1.338 17927 9092 1 11 . 1 1 144 144 LEU CA C 144 54.525 54.525 54.384 0.141 17927 9093 1 11 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.259 0.514 17927 9094 1 11 . 1 1 144 144 LEU H H 144 8.241 8.241 8.384 -0.143 17927 9095 1 11 . 1 1 145 145 GLU N N 145 119.959 119.959 119.372 0.587 17927 9096 1 11 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.300 -0.059 17927 9097 1 11 . 1 1 145 145 GLU C C 145 177.075 177.075 176.904 0.171 17927 9098 1 11 . 1 1 145 145 GLU CA C 145 56.799 56.799 56.292 0.507 17927 9099 1 11 . 1 1 145 145 GLU CB C 145 30.168 30.168 29.493 0.675 17927 9100 1 11 . 1 1 145 145 GLU H H 145 8.410 8.410 8.083 0.327 17927 9101 1 11 . 1 1 146 146 GLY N N 146 109.412 109.412 107.642 1.770 17927 9102 1 11 . 1 1 146 146 GLY C C 146 174.276 174.276 174.717 -0.441 17927 9103 1 11 . 1 1 146 146 GLY CA C 146 45.445 45.445 44.812 0.633 17927 9104 1 11 . 1 1 146 146 GLY H H 146 8.422 8.422 8.416 0.006 17927 9105 1 11 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.692 -0.036 17927 9106 1 11 . 1 1 151 151 HIS C C 151 173.990 173.990 173.848 0.142 17927 9107 1 11 . 1 1 151 151 HIS CA C 151 56.044 56.044 55.118 0.926 17927 9108 1 11 . 1 1 151 151 HIS CB C 151 30.076 30.076 30.484 -0.408 17927 9109 1 12 . 1 1 2 2 SER HA H 2 4.121 4.121 4.267 -0.146 17927 9110 1 12 . 1 1 2 2 SER CA C 2 57.293 57.293 61.581 -4.288 17927 9111 1 12 . 1 1 2 2 SER CB C 2 63.545 63.545 63.277 0.268 17927 9112 1 12 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.831 -0.399 17927 9113 1 12 . 1 1 3 3 LEU C C 3 177.383 177.383 177.244 0.139 17927 9114 1 12 . 1 1 3 3 LEU CA C 3 55.575 55.575 53.991 1.584 17927 9115 1 12 . 1 1 3 3 LEU CB C 3 42.584 42.584 40.655 1.929 17927 9116 1 12 . 1 1 4 4 ARG N N 4 122.080 122.080 120.819 1.261 17927 9117 1 12 . 1 1 4 4 ARG HA H 4 4.384 4.384 3.831 0.553 17927 9118 1 12 . 1 1 4 4 ARG C C 4 176.410 176.410 175.872 0.538 17927 9119 1 12 . 1 1 4 4 ARG CA C 4 56.269 56.269 58.636 -2.367 17927 9120 1 12 . 1 1 4 4 ARG CB C 4 30.842 30.842 27.943 2.899 17927 9121 1 12 . 1 1 4 4 ARG H H 4 8.410 8.410 7.906 0.504 17927 9122 1 12 . 1 1 5 5 SER N N 5 117.023 117.023 115.981 1.042 17927 9123 1 12 . 1 1 5 5 SER HA H 5 4.423 4.423 4.749 -0.326 17927 9124 1 12 . 1 1 5 5 SER C C 5 175.039 175.039 174.403 0.636 17927 9125 1 12 . 1 1 5 5 SER CA C 5 58.605 58.605 57.817 0.788 17927 9126 1 12 . 1 1 5 5 SER CB C 5 64.044 64.044 64.471 -0.427 17927 9127 1 12 . 1 1 5 5 SER H H 5 8.292 8.292 8.180 0.112 17927 9128 1 12 . 1 1 6 6 GLY N N 6 110.718 110.718 111.484 -0.766 17927 9129 1 12 . 1 1 6 6 GLY C C 6 173.654 173.654 172.252 1.402 17927 9130 1 12 . 1 1 6 6 GLY CA C 6 45.273 45.273 45.474 -0.201 17927 9131 1 12 . 1 1 6 6 GLY H H 6 8.446 8.446 8.417 0.029 17927 9132 1 12 . 1 1 7 7 ASN N N 7 119.287 119.287 120.715 -1.428 17927 9133 1 12 . 1 1 7 7 ASN HA H 7 5.024 5.024 5.092 -0.068 17927 9134 1 12 . 1 1 7 7 ASN C C 7 173.672 173.672 173.472 0.200 17927 9135 1 12 . 1 1 7 7 ASN CA C 7 51.357 51.357 51.226 0.131 17927 9136 1 12 . 1 1 7 7 ASN CB C 7 38.927 38.927 41.238 -2.311 17927 9137 1 12 . 1 1 7 7 ASN H H 7 8.273 8.273 7.597 0.676 17927 9138 1 12 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.332 0.115 17927 9139 1 12 . 1 1 8 8 PRO C C 8 176.899 176.899 176.621 0.278 17927 9140 1 12 . 1 1 8 8 PRO CA C 8 63.429 63.429 63.935 -0.506 17927 9141 1 12 . 1 1 8 8 PRO CB C 8 32.216 32.216 31.827 0.389 17927 9142 1 12 . 1 1 9 9 SER N N 9 115.642 115.642 109.934 5.708 17927 9143 1 12 . 1 1 9 9 SER HA H 9 4.415 4.415 4.231 0.184 17927 9144 1 12 . 1 1 9 9 SER C C 9 174.714 174.714 174.789 -0.075 17927 9145 1 12 . 1 1 9 9 SER CA C 9 58.488 58.488 59.242 -0.754 17927 9146 1 12 . 1 1 9 9 SER CB C 9 64.048 64.048 62.835 1.213 17927 9147 1 12 . 1 1 9 9 SER H H 9 8.336 8.336 7.832 0.504 17927 9148 1 12 . 1 1 10 10 ALA N N 10 126.808 126.808 124.337 2.471 17927 9149 1 12 . 1 1 10 10 ALA HA H 10 4.262 4.262 5.107 -0.845 17927 9150 1 12 . 1 1 10 10 ALA C C 10 177.233 177.233 177.215 0.018 17927 9151 1 12 . 1 1 10 10 ALA CA C 10 53.230 53.230 51.267 1.963 17927 9152 1 12 . 1 1 10 10 ALA CB C 10 19.187 19.187 18.447 0.740 17927 9153 1 12 . 1 1 10 10 ALA H H 10 8.137 8.137 8.453 -0.316 17927 9154 1 12 . 1 1 11 11 ALA N N 11 120.449 120.449 127.722 -7.273 17927 9155 1 12 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.279 -0.018 17927 9156 1 12 . 1 1 11 11 ALA C C 11 177.469 177.469 176.650 0.819 17927 9157 1 12 . 1 1 11 11 ALA CA C 11 52.475 52.475 51.804 0.671 17927 9158 1 12 . 1 1 11 11 ALA CB C 11 19.485 19.485 17.457 2.028 17927 9159 1 12 . 1 1 11 11 ALA H H 11 7.851 7.851 8.350 -0.499 17927 9160 1 12 . 1 1 12 12 SER N N 12 114.186 114.186 112.614 1.572 17927 9161 1 12 . 1 1 12 12 SER HA H 12 4.312 4.312 3.888 0.424 17927 9162 1 12 . 1 1 12 12 SER C C 12 173.593 173.593 173.478 0.115 17927 9163 1 12 . 1 1 12 12 SER CA C 12 58.099 58.099 58.716 -0.617 17927 9164 1 12 . 1 1 12 12 SER CB C 12 63.320 63.320 62.564 0.756 17927 9165 1 12 . 1 1 12 12 SER H H 12 7.990 7.990 8.422 -0.432 17927 9166 1 12 . 1 1 13 13 PHE N N 13 118.092 118.092 116.887 1.205 17927 9167 1 12 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.411 0.369 17927 9168 1 12 . 1 1 13 13 PHE C C 13 174.220 174.220 174.688 -0.468 17927 9169 1 12 . 1 1 13 13 PHE CA C 13 56.717 56.717 57.132 -0.415 17927 9170 1 12 . 1 1 13 13 PHE CB C 13 41.151 41.151 39.454 1.697 17927 9171 1 12 . 1 1 13 13 PHE H H 13 7.147 7.147 7.425 -0.278 17927 9172 1 12 . 1 1 14 14 SER N N 14 116.456 116.456 117.692 -1.236 17927 9173 1 12 . 1 1 14 14 SER HA H 14 5.162 5.162 4.966 0.196 17927 9174 1 12 . 1 1 14 14 SER C C 14 172.626 172.626 172.657 -0.031 17927 9175 1 12 . 1 1 14 14 SER CA C 14 57.390 57.390 56.968 0.422 17927 9176 1 12 . 1 1 14 14 SER CB C 14 64.518 64.518 64.324 0.194 17927 9177 1 12 . 1 1 14 14 SER H H 14 7.616 7.616 7.823 -0.207 17927 9178 1 12 . 1 1 15 15 TYR N N 15 122.384 122.384 124.826 -2.442 17927 9179 1 12 . 1 1 15 15 TYR HA H 15 5.206 5.206 5.002 0.204 17927 9180 1 12 . 1 1 15 15 TYR C C 15 172.543 172.543 173.627 -1.084 17927 9181 1 12 . 1 1 15 15 TYR CA C 15 55.946 55.946 55.954 -0.008 17927 9182 1 12 . 1 1 15 15 TYR CB C 15 43.227 43.227 41.889 1.338 17927 9183 1 12 . 1 1 15 15 TYR H H 15 8.558 8.558 9.222 -0.664 17927 9184 1 12 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.840 0.269 17927 9185 1 12 . 1 1 16 16 PRO C C 16 176.475 176.475 176.549 -0.074 17927 9186 1 12 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.361 -0.381 17927 9187 1 12 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.002 0.660 17927 9188 1 12 . 1 1 17 17 ASP N N 17 119.834 119.834 125.066 -5.232 17927 9189 1 12 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.779 0.960 17927 9190 1 12 . 1 1 17 17 ASP C C 17 180.740 180.740 178.364 2.376 17927 9191 1 12 . 1 1 17 17 ASP CA C 17 51.717 51.717 54.310 -2.593 17927 9192 1 12 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.215 -0.654 17927 9193 1 12 . 1 1 17 17 ASP H H 17 8.643 8.643 8.875 -0.232 17927 9194 1 12 . 1 1 18 18 ILE N N 18 118.340 118.340 124.507 -6.167 17927 9195 1 12 . 1 1 18 18 ILE HA H 18 4.451 4.451 4.067 0.384 17927 9196 1 12 . 1 1 18 18 ILE C C 18 175.742 175.742 176.482 -0.740 17927 9197 1 12 . 1 1 18 18 ILE CA C 18 61.894 61.894 63.589 -1.695 17927 9198 1 12 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.518 0.722 17927 9199 1 12 . 1 1 18 18 ILE H H 18 8.450 8.450 8.622 -0.172 17927 9200 1 12 . 1 1 19 19 ASN N N 19 119.377 119.377 117.457 1.920 17927 9201 1 12 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.695 0.320 17927 9202 1 12 . 1 1 19 19 ASN C C 19 175.892 175.892 175.734 0.158 17927 9203 1 12 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.080 -0.773 17927 9204 1 12 . 1 1 19 19 ASN CB C 19 39.825 39.825 39.549 0.276 17927 9205 1 12 . 1 1 19 19 ASN H H 19 8.376 8.376 8.983 -0.607 17927 9206 1 12 . 1 1 20 20 GLY N N 20 109.535 109.535 108.632 0.903 17927 9207 1 12 . 1 1 20 20 GLY C C 20 174.285 174.285 173.187 1.098 17927 9208 1 12 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.074 0.719 17927 9209 1 12 . 1 1 20 20 GLY H H 20 8.539 8.539 8.437 0.102 17927 9210 1 12 . 1 1 21 21 LYS N N 21 124.675 124.675 120.871 3.804 17927 9211 1 12 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.618 -0.175 17927 9212 1 12 . 1 1 21 21 LYS C C 21 176.537 176.537 175.912 0.625 17927 9213 1 12 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.264 1.180 17927 9214 1 12 . 1 1 21 21 LYS CB C 21 32.754 32.754 33.999 -1.245 17927 9215 1 12 . 1 1 21 21 LYS H H 21 8.608 8.608 7.598 1.010 17927 9216 1 12 . 1 1 22 22 THR N N 22 120.666 120.666 124.896 -4.230 17927 9217 1 12 . 1 1 22 22 THR HA H 22 4.087 4.087 4.143 -0.056 17927 9218 1 12 . 1 1 22 22 THR C C 22 174.431 174.431 173.695 0.736 17927 9219 1 12 . 1 1 22 22 THR CA C 22 64.292 64.292 63.863 0.429 17927 9220 1 12 . 1 1 22 22 THR CB C 22 69.069 69.069 68.820 0.249 17927 9221 1 12 . 1 1 22 22 THR H H 22 8.595 8.595 8.816 -0.221 17927 9222 1 12 . 1 1 23 23 VAL N N 23 131.207 131.207 129.970 1.237 17927 9223 1 12 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.422 -0.230 17927 9224 1 12 . 1 1 23 23 VAL C C 23 174.244 174.244 174.542 -0.298 17927 9225 1 12 . 1 1 23 23 VAL CA C 23 62.456 62.456 60.405 2.051 17927 9226 1 12 . 1 1 23 23 VAL CB C 23 33.791 33.791 33.689 0.102 17927 9227 1 12 . 1 1 23 23 VAL H H 23 8.937 8.937 9.048 -0.111 17927 9228 1 12 . 1 1 24 24 SER N N 24 120.787 120.787 121.767 -0.980 17927 9229 1 12 . 1 1 24 24 SER HA H 24 5.407 5.407 5.329 0.078 17927 9230 1 12 . 1 1 24 24 SER C C 24 176.169 176.169 175.070 1.099 17927 9231 1 12 . 1 1 24 24 SER CA C 24 55.135 55.135 56.165 -1.030 17927 9232 1 12 . 1 1 24 24 SER CB C 24 65.646 65.646 66.241 -0.595 17927 9233 1 12 . 1 1 24 24 SER H H 24 8.554 8.554 8.532 0.022 17927 9234 1 12 . 1 1 25 25 LEU N N 25 124.332 124.332 121.705 2.627 17927 9235 1 12 . 1 1 25 25 LEU HA H 25 3.687 3.687 3.662 0.025 17927 9236 1 12 . 1 1 25 25 LEU C C 25 179.364 179.364 177.781 1.583 17927 9237 1 12 . 1 1 25 25 LEU CA C 25 58.217 58.217 57.464 0.753 17927 9238 1 12 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.234 -0.696 17927 9239 1 12 . 1 1 25 25 LEU H H 25 7.811 7.811 8.230 -0.419 17927 9240 1 12 . 1 1 26 26 ALA N N 26 119.799 119.799 117.445 2.354 17927 9241 1 12 . 1 1 26 26 ALA HA H 26 3.993 3.993 3.913 0.080 17927 9242 1 12 . 1 1 26 26 ALA C C 26 179.719 179.719 177.712 2.007 17927 9243 1 12 . 1 1 26 26 ALA CA C 26 54.663 54.663 53.873 0.790 17927 9244 1 12 . 1 1 26 26 ALA CB C 26 18.323 18.323 18.346 -0.023 17927 9245 1 12 . 1 1 26 26 ALA H H 26 8.099 8.099 8.167 -0.068 17927 9246 1 12 . 1 1 27 27 ASP N N 27 116.553 116.553 117.481 -0.928 17927 9247 1 12 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.466 0.007 17927 9248 1 12 . 1 1 27 27 ASP C C 27 176.915 176.915 177.301 -0.386 17927 9249 1 12 . 1 1 27 27 ASP CA C 27 56.251 56.251 55.784 0.467 17927 9250 1 12 . 1 1 27 27 ASP CB C 27 40.788 40.788 41.031 -0.243 17927 9251 1 12 . 1 1 27 27 ASP H H 27 7.572 7.572 7.595 -0.023 17927 9252 1 12 . 1 1 28 28 LEU N N 28 118.950 118.950 116.980 1.970 17927 9253 1 12 . 1 1 28 28 LEU HA H 28 4.233 4.233 3.427 0.806 17927 9254 1 12 . 1 1 28 28 LEU C C 28 175.542 175.542 176.350 -0.808 17927 9255 1 12 . 1 1 28 28 LEU CA C 28 53.706 53.706 54.343 -0.637 17927 9256 1 12 . 1 1 28 28 LEU CB C 28 41.049 41.049 42.414 -1.365 17927 9257 1 12 . 1 1 28 28 LEU H H 28 7.363 7.363 7.109 0.254 17927 9258 1 12 . 1 1 29 29 LYS N N 29 118.429 118.429 120.198 -1.769 17927 9259 1 12 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.090 0.262 17927 9260 1 12 . 1 1 29 29 LYS C C 29 178.063 178.063 177.830 0.233 17927 9261 1 12 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.617 0.160 17927 9262 1 12 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.863 0.577 17927 9263 1 12 . 1 1 29 29 LYS H H 29 6.780 6.780 7.522 -0.742 17927 9264 1 12 . 1 1 30 30 GLY N N 30 112.426 112.426 112.834 -0.408 17927 9265 1 12 . 1 1 30 30 GLY C C 30 173.801 173.801 173.606 0.195 17927 9266 1 12 . 1 1 30 30 GLY CA C 30 44.611 44.611 45.213 -0.602 17927 9267 1 12 . 1 1 30 30 GLY H H 30 9.398 9.398 8.756 0.642 17927 9268 1 12 . 1 1 31 31 LYS N N 31 119.295 119.295 118.790 0.505 17927 9269 1 12 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.534 -0.382 17927 9270 1 12 . 1 1 31 31 LYS C C 31 173.862 173.862 175.286 -1.424 17927 9271 1 12 . 1 1 31 31 LYS CA C 31 55.188 55.188 55.072 0.116 17927 9272 1 12 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.179 1.789 17927 9273 1 12 . 1 1 31 31 LYS H H 31 7.496 7.496 7.340 0.156 17927 9274 1 12 . 1 1 32 32 TYR N N 32 116.984 116.984 121.067 -4.083 17927 9275 1 12 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.543 -0.386 17927 9276 1 12 . 1 1 32 32 TYR C C 32 175.226 175.226 176.047 -0.821 17927 9277 1 12 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.398 0.192 17927 9278 1 12 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.095 0.026 17927 9279 1 12 . 1 1 32 32 TYR H H 32 7.521 7.521 8.201 -0.680 17927 9280 1 12 . 1 1 33 33 ILE N N 33 118.052 118.052 120.405 -2.353 17927 9281 1 12 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.678 0.229 17927 9282 1 12 . 1 1 33 33 ILE C C 33 174.308 174.308 174.483 -0.175 17927 9283 1 12 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.275 0.427 17927 9284 1 12 . 1 1 33 33 ILE CB C 33 41.616 41.616 41.546 0.070 17927 9285 1 12 . 1 1 33 33 ILE H H 33 8.467 8.467 9.396 -0.929 17927 9286 1 12 . 1 1 34 34 TYR N N 34 130.242 130.242 126.750 3.492 17927 9287 1 12 . 1 1 34 34 TYR HA H 34 5.526 5.526 4.932 0.594 17927 9288 1 12 . 1 1 34 34 TYR C C 34 174.245 174.245 173.102 1.143 17927 9289 1 12 . 1 1 34 34 TYR CA C 34 56.158 56.158 56.465 -0.307 17927 9290 1 12 . 1 1 34 34 TYR CB C 34 40.133 40.133 41.767 -1.634 17927 9291 1 12 . 1 1 34 34 TYR H H 34 8.905 8.905 9.340 -0.435 17927 9292 1 12 . 1 1 35 35 ILE N N 35 128.697 128.697 129.077 -0.380 17927 9293 1 12 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.269 0.073 17927 9294 1 12 . 1 1 35 35 ILE C C 35 174.520 174.520 174.662 -0.142 17927 9295 1 12 . 1 1 35 35 ILE CA C 35 59.749 59.749 58.264 1.485 17927 9296 1 12 . 1 1 35 35 ILE CB C 35 40.899 40.899 38.175 2.724 17927 9297 1 12 . 1 1 35 35 ILE H H 35 9.445 9.445 8.574 0.871 17927 9298 1 12 . 1 1 36 36 ASP N N 36 123.675 123.675 128.111 -4.436 17927 9299 1 12 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.317 -0.469 17927 9300 1 12 . 1 1 36 36 ASP C C 36 174.385 174.385 175.519 -1.134 17927 9301 1 12 . 1 1 36 36 ASP CA C 36 51.294 51.294 52.436 -1.142 17927 9302 1 12 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.362 -2.584 17927 9303 1 12 . 1 1 36 36 ASP H H 36 8.875 8.875 8.714 0.161 17927 9304 1 12 . 1 1 37 37 VAL N N 37 127.159 127.159 120.748 6.411 17927 9305 1 12 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.663 0.296 17927 9306 1 12 . 1 1 37 37 VAL C C 37 175.046 175.046 175.357 -0.311 17927 9307 1 12 . 1 1 37 37 VAL CA C 37 62.245 62.245 61.122 1.123 17927 9308 1 12 . 1 1 37 37 VAL CB C 37 31.807 31.807 32.225 -0.418 17927 9309 1 12 . 1 1 37 37 VAL H H 37 8.603 8.603 7.934 0.669 17927 9310 1 12 . 1 1 38 38 TRP N N 38 124.161 124.161 127.407 -3.246 17927 9311 1 12 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.108 0.129 17927 9312 1 12 . 1 1 38 38 TRP C C 38 171.995 171.995 173.603 -1.608 17927 9313 1 12 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.330 1.877 17927 9314 1 12 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.167 3.020 17927 9315 1 12 . 1 1 38 38 TRP H H 38 8.562 8.562 8.334 0.228 17927 9316 1 12 . 1 1 39 39 ALA N N 39 116.252 116.252 125.542 -9.290 17927 9317 1 12 . 1 1 39 39 ALA HA H 39 3.678 3.678 3.879 -0.201 17927 9318 1 12 . 1 1 39 39 ALA C C 39 178.664 178.664 174.817 3.847 17927 9319 1 12 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.342 1.124 17927 9320 1 12 . 1 1 39 39 ALA CB C 39 22.341 22.341 20.991 1.350 17927 9321 1 12 . 1 1 39 39 ALA H H 39 6.757 6.757 7.835 -1.078 17927 9322 1 12 . 1 1 40 40 THR N N 40 114.321 114.321 113.661 0.660 17927 9323 1 12 . 1 1 40 40 THR HA H 40 3.907 3.907 4.626 -0.719 17927 9324 1 12 . 1 1 40 40 THR C C 40 175.885 175.885 176.290 -0.405 17927 9325 1 12 . 1 1 40 40 THR CA C 40 65.447 65.447 62.986 2.461 17927 9326 1 12 . 1 1 40 40 THR CB C 40 70.106 70.106 69.786 0.320 17927 9327 1 12 . 1 1 40 40 THR H H 40 9.639 9.639 8.650 0.989 17927 9328 1 12 . 1 1 41 41 TRP N N 41 114.483 114.483 122.524 -8.041 17927 9329 1 12 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.715 -0.152 17927 9330 1 12 . 1 1 41 41 TRP C C 41 176.189 176.189 175.931 0.258 17927 9331 1 12 . 1 1 41 41 TRP CA C 41 54.698 54.698 57.311 -2.613 17927 9332 1 12 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.055 1.922 17927 9333 1 12 . 1 1 41 41 TRP H H 41 6.401 6.401 7.715 -1.314 17927 9334 1 12 . 1 1 42 42 CYS N N 42 123.536 123.536 116.155 7.381 17927 9335 1 12 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.411 0.157 17927 9336 1 12 . 1 1 42 42 CYS C C 42 175.726 175.726 176.382 -0.656 17927 9337 1 12 . 1 1 42 42 CYS CA C 42 58.700 58.700 57.810 0.890 17927 9338 1 12 . 1 1 42 42 CYS CB C 42 27.121 27.121 28.026 -0.905 17927 9339 1 12 . 1 1 42 42 CYS H H 42 6.883 6.883 7.108 -0.225 17927 9340 1 12 . 1 1 43 43 GLY N N 43 120.977 120.977 111.080 9.897 17927 9341 1 12 . 1 1 43 43 GLY CA C 43 49.204 49.204 46.516 2.688 17927 9342 1 12 . 1 1 43 43 GLY H H 43 9.653 9.653 7.595 2.058 17927 9343 1 12 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.293 0.194 17927 9344 1 12 . 1 1 44 44 PRO C C 44 179.956 179.956 178.159 1.797 17927 9345 1 12 . 1 1 44 44 PRO CA C 44 65.642 65.642 64.991 0.651 17927 9346 1 12 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.395 1.183 17927 9347 1 12 . 1 1 45 45 CYS N N 45 113.925 113.925 117.394 -3.469 17927 9348 1 12 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.658 -0.345 17927 9349 1 12 . 1 1 45 45 CYS C C 45 178.325 178.325 176.733 1.592 17927 9350 1 12 . 1 1 45 45 CYS CA C 45 63.392 63.392 60.429 2.963 17927 9351 1 12 . 1 1 45 45 CYS CB C 45 28.505 28.505 26.962 1.543 17927 9352 1 12 . 1 1 45 45 CYS H H 45 7.676 7.676 7.612 0.064 17927 9353 1 12 . 1 1 46 46 ARG N N 46 120.336 120.336 118.565 1.771 17927 9354 1 12 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.320 -0.251 17927 9355 1 12 . 1 1 46 46 ARG C C 46 180.446 180.446 177.950 2.496 17927 9356 1 12 . 1 1 46 46 ARG CA C 46 59.785 59.785 56.678 3.107 17927 9357 1 12 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.009 0.859 17927 9358 1 12 . 1 1 46 46 ARG H H 46 8.109 8.109 7.942 0.167 17927 9359 1 12 . 1 1 47 47 GLY N N 47 105.408 105.408 107.255 -1.847 17927 9360 1 12 . 1 1 47 47 GLY C C 47 175.258 175.258 174.994 0.264 17927 9361 1 12 . 1 1 47 47 GLY CA C 47 46.594 46.594 45.785 0.810 17927 9362 1 12 . 1 1 47 47 GLY H H 47 8.466 8.466 8.177 0.289 17927 9363 1 12 . 1 1 48 48 GLU N N 48 116.343 116.343 120.429 -4.086 17927 9364 1 12 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.281 0.244 17927 9365 1 12 . 1 1 48 48 GLU C C 48 176.535 176.535 177.624 -1.089 17927 9366 1 12 . 1 1 48 48 GLU CA C 48 55.792 55.792 57.169 -1.377 17927 9367 1 12 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.138 1.844 17927 9368 1 12 . 1 1 48 48 GLU H H 48 7.050 7.050 7.761 -0.711 17927 9369 1 12 . 1 1 49 49 LEU N N 49 118.652 118.652 121.537 -2.885 17927 9370 1 12 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.092 0.060 17927 9371 1 12 . 1 1 49 49 LEU C C 49 176.832 176.832 176.525 0.307 17927 9372 1 12 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.569 -1.224 17927 9373 1 12 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.200 -0.704 17927 9374 1 12 . 1 1 49 49 LEU H H 49 7.385 7.385 7.663 -0.278 17927 9375 1 12 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.173 0.080 17927 9376 1 12 . 1 1 50 50 PRO C C 50 179.744 179.744 178.091 1.653 17927 9377 1 12 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.149 0.410 17927 9378 1 12 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.944 -0.182 17927 9379 1 12 . 1 1 51 51 ALA N N 51 120.418 120.418 118.680 1.738 17927 9380 1 12 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.185 -0.040 17927 9381 1 12 . 1 1 51 51 ALA C C 51 180.329 180.329 179.881 0.448 17927 9382 1 12 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.484 -0.050 17927 9383 1 12 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.290 0.080 17927 9384 1 12 . 1 1 51 51 ALA H H 51 7.731 7.731 7.965 -0.234 17927 9385 1 12 . 1 1 52 52 LEU N N 52 121.506 121.506 120.989 0.517 17927 9386 1 12 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.897 0.091 17927 9387 1 12 . 1 1 52 52 LEU C C 52 177.944 177.944 178.158 -0.214 17927 9388 1 12 . 1 1 52 52 LEU CA C 52 58.327 58.327 58.079 0.248 17927 9389 1 12 . 1 1 52 52 LEU CB C 52 42.382 42.382 42.044 0.338 17927 9390 1 12 . 1 1 52 52 LEU H H 52 8.355 8.355 8.285 0.070 17927 9391 1 12 . 1 1 53 53 LYS N N 53 119.732 119.732 119.746 -0.014 17927 9392 1 12 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.786 0.117 17927 9393 1 12 . 1 1 53 53 LYS C C 53 179.030 179.030 179.145 -0.115 17927 9394 1 12 . 1 1 53 53 LYS CA C 53 59.846 59.846 60.293 -0.447 17927 9395 1 12 . 1 1 53 53 LYS CB C 53 32.211 32.211 32.277 -0.066 17927 9396 1 12 . 1 1 53 53 LYS H H 53 8.148 8.148 7.562 0.586 17927 9397 1 12 . 1 1 54 54 GLU N N 54 117.779 117.779 118.861 -1.082 17927 9398 1 12 . 1 1 54 54 GLU HA H 54 4.059 4.059 4.010 0.050 17927 9399 1 12 . 1 1 54 54 GLU C C 54 179.646 179.646 179.280 0.366 17927 9400 1 12 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.417 0.208 17927 9401 1 12 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.140 0.427 17927 9402 1 12 . 1 1 54 54 GLU H H 54 7.585 7.585 8.038 -0.453 17927 9403 1 12 . 1 1 55 55 LEU N N 55 120.581 120.581 119.938 0.643 17927 9404 1 12 . 1 1 55 55 LEU HA H 55 4.193 4.193 3.983 0.210 17927 9405 1 12 . 1 1 55 55 LEU C C 55 178.557 178.557 178.808 -0.251 17927 9406 1 12 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.751 0.485 17927 9407 1 12 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.737 1.274 17927 9408 1 12 . 1 1 55 55 LEU H H 55 8.096 8.096 7.591 0.505 17927 9409 1 12 . 1 1 56 56 GLU N N 56 118.023 118.023 119.153 -1.130 17927 9410 1 12 . 1 1 56 56 GLU HA H 56 3.177 3.177 3.604 -0.427 17927 9411 1 12 . 1 1 56 56 GLU C C 56 179.650 179.650 178.963 0.687 17927 9412 1 12 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.355 -0.484 17927 9413 1 12 . 1 1 56 56 GLU CB C 56 26.985 26.985 28.939 -1.954 17927 9414 1 12 . 1 1 56 56 GLU H H 56 8.181 8.181 7.847 0.334 17927 9415 1 12 . 1 1 57 57 GLU N N 57 117.828 117.828 118.071 -0.243 17927 9416 1 12 . 1 1 57 57 GLU HA H 57 4.104 4.104 3.969 0.135 17927 9417 1 12 . 1 1 57 57 GLU C C 57 179.700 179.700 179.521 0.179 17927 9418 1 12 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.859 0.168 17927 9419 1 12 . 1 1 57 57 GLU CB C 57 29.665 29.665 28.990 0.675 17927 9420 1 12 . 1 1 57 57 GLU H H 57 7.762 7.762 8.518 -0.756 17927 9421 1 12 . 1 1 58 58 LYS N N 58 120.896 120.896 120.107 0.789 17927 9422 1 12 . 1 1 58 58 LYS HA H 58 3.979 3.979 3.845 0.134 17927 9423 1 12 . 1 1 58 58 LYS C C 58 178.715 178.715 178.893 -0.178 17927 9424 1 12 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.917 0.161 17927 9425 1 12 . 1 1 58 58 LYS CB C 58 32.980 32.980 32.649 0.331 17927 9426 1 12 . 1 1 58 58 LYS H H 58 8.410 8.410 7.714 0.696 17927 9427 1 12 . 1 1 59 59 TYR N N 59 113.713 113.713 115.737 -2.024 17927 9428 1 12 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.571 -0.259 17927 9429 1 12 . 1 1 59 59 TYR C C 59 175.025 175.025 174.607 0.418 17927 9430 1 12 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.232 2.741 17927 9431 1 12 . 1 1 59 59 TYR CB C 59 37.434 37.434 37.793 -0.359 17927 9432 1 12 . 1 1 59 59 TYR H H 59 8.102 8.102 8.056 0.046 17927 9433 1 12 . 1 1 60 60 ALA N N 60 126.637 126.637 123.336 3.301 17927 9434 1 12 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.302 0.116 17927 9435 1 12 . 1 1 60 60 ALA C C 60 179.208 179.208 178.004 1.204 17927 9436 1 12 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.422 1.112 17927 9437 1 12 . 1 1 60 60 ALA CB C 60 18.589 18.589 18.670 -0.081 17927 9438 1 12 . 1 1 60 60 ALA H H 60 7.201 7.201 7.777 -0.576 17927 9439 1 12 . 1 1 61 61 GLY N N 61 111.816 111.816 110.233 1.583 17927 9440 1 12 . 1 1 61 61 GLY C C 61 174.698 174.698 174.154 0.544 17927 9441 1 12 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.621 0.283 17927 9442 1 12 . 1 1 61 61 GLY H H 61 9.184 9.184 8.799 0.385 17927 9443 1 12 . 1 1 62 62 LYS N N 62 118.497 118.497 119.840 -1.343 17927 9444 1 12 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.584 0.295 17927 9445 1 12 . 1 1 62 62 LYS C C 62 179.019 179.019 175.972 3.047 17927 9446 1 12 . 1 1 62 62 LYS CA C 62 53.988 53.988 53.736 0.252 17927 9447 1 12 . 1 1 62 62 LYS CB C 62 33.840 33.840 34.067 -0.227 17927 9448 1 12 . 1 1 62 62 LYS H H 62 8.019 8.019 7.639 0.380 17927 9449 1 12 . 1 1 63 63 ASP N N 63 122.982 122.982 121.466 1.516 17927 9450 1 12 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.690 -0.163 17927 9451 1 12 . 1 1 63 63 ASP C C 63 174.065 174.065 174.742 -0.677 17927 9452 1 12 . 1 1 63 63 ASP CA C 63 55.055 55.055 54.066 0.988 17927 9453 1 12 . 1 1 63 63 ASP CB C 63 38.582 38.582 39.965 -1.383 17927 9454 1 12 . 1 1 63 63 ASP H H 63 8.709 8.709 8.586 0.123 17927 9455 1 12 . 1 1 64 64 ILE N N 64 122.219 122.219 119.514 2.705 17927 9456 1 12 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.615 -0.008 17927 9457 1 12 . 1 1 64 64 ILE C C 64 174.627 174.627 173.622 1.005 17927 9458 1 12 . 1 1 64 64 ILE CA C 64 59.712 59.712 60.276 -0.564 17927 9459 1 12 . 1 1 64 64 ILE CB C 64 42.133 42.133 41.340 0.793 17927 9460 1 12 . 1 1 64 64 ILE H H 64 8.678 8.678 7.515 1.163 17927 9461 1 12 . 1 1 65 65 HIS N N 65 125.584 125.584 128.573 -2.989 17927 9462 1 12 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.923 0.120 17927 9463 1 12 . 1 1 65 65 HIS C C 65 174.153 174.153 173.750 0.403 17927 9464 1 12 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.611 0.348 17927 9465 1 12 . 1 1 65 65 HIS CB C 65 34.156 34.156 30.545 3.611 17927 9466 1 12 . 1 1 65 65 HIS H H 65 9.204 9.204 9.110 0.094 17927 9467 1 12 . 1 1 66 66 PHE N N 66 123.244 123.244 126.108 -2.864 17927 9468 1 12 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.824 0.386 17927 9469 1 12 . 1 1 66 66 PHE C C 66 175.463 175.463 174.618 0.845 17927 9470 1 12 . 1 1 66 66 PHE CA C 66 58.088 58.088 58.980 -0.892 17927 9471 1 12 . 1 1 66 66 PHE CB C 66 39.637 39.637 38.347 1.290 17927 9472 1 12 . 1 1 66 66 PHE H H 66 9.262 9.262 8.986 0.277 17927 9473 1 12 . 1 1 67 67 VAL N N 67 126.201 126.201 125.416 0.785 17927 9474 1 12 . 1 1 67 67 VAL HA H 67 4.834 4.834 5.246 -0.412 17927 9475 1 12 . 1 1 67 67 VAL C C 67 174.364 174.364 175.377 -1.013 17927 9476 1 12 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.374 0.350 17927 9477 1 12 . 1 1 67 67 VAL CB C 67 34.893 34.893 34.645 0.248 17927 9478 1 12 . 1 1 67 67 VAL H H 67 8.843 8.843 9.258 -0.415 17927 9479 1 12 . 1 1 68 68 SER N N 68 124.528 124.528 122.516 2.012 17927 9480 1 12 . 1 1 68 68 SER HA H 68 5.585 5.585 5.480 0.105 17927 9481 1 12 . 1 1 68 68 SER C C 68 172.858 172.858 173.272 -0.414 17927 9482 1 12 . 1 1 68 68 SER CA C 68 57.282 57.282 56.433 0.849 17927 9483 1 12 . 1 1 68 68 SER CB C 68 65.032 65.032 64.624 0.408 17927 9484 1 12 . 1 1 68 68 SER H H 68 9.243 9.243 8.632 0.611 17927 9485 1 12 . 1 1 69 69 LEU N N 69 126.695 126.695 125.435 1.260 17927 9486 1 12 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.504 -0.987 17927 9487 1 12 . 1 1 69 69 LEU C C 69 174.652 174.652 176.842 -2.190 17927 9488 1 12 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.482 -0.655 17927 9489 1 12 . 1 1 69 69 LEU CB C 69 43.895 43.895 44.194 -0.299 17927 9490 1 12 . 1 1 69 69 LEU H H 69 9.360 9.360 9.042 0.318 17927 9491 1 12 . 1 1 70 70 SER N N 70 116.379 116.379 117.411 -1.032 17927 9492 1 12 . 1 1 70 70 SER HA H 70 4.905 4.905 5.046 -0.141 17927 9493 1 12 . 1 1 70 70 SER C C 70 176.307 176.307 174.935 1.372 17927 9494 1 12 . 1 1 70 70 SER CA C 70 55.213 55.213 55.976 -0.763 17927 9495 1 12 . 1 1 70 70 SER CB C 70 63.519 63.519 63.908 -0.389 17927 9496 1 12 . 1 1 70 70 SER H H 70 7.981 7.981 8.964 -0.983 17927 9497 1 12 . 1 1 71 71 CYS N N 71 124.670 124.670 127.672 -3.002 17927 9498 1 12 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.369 0.589 17927 9499 1 12 . 1 1 71 71 CYS C C 71 173.996 173.996 174.276 -0.280 17927 9500 1 12 . 1 1 71 71 CYS CA C 71 55.483 55.483 58.273 -2.790 17927 9501 1 12 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.324 0.788 17927 9502 1 12 . 1 1 71 71 CYS H H 71 8.609 8.609 8.943 -0.334 17927 9503 1 12 . 1 1 72 72 ASP N N 72 122.398 122.398 122.496 -0.098 17927 9504 1 12 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.679 -0.387 17927 9505 1 12 . 1 1 72 72 ASP C C 72 176.653 176.653 176.534 0.119 17927 9506 1 12 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.331 1.450 17927 9507 1 12 . 1 1 72 72 ASP CB C 72 41.526 41.526 41.276 0.250 17927 9508 1 12 . 1 1 72 72 ASP H H 72 8.557 8.557 7.271 1.286 17927 9509 1 12 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.332 -0.267 17927 9510 1 12 . 1 1 73 73 LYS C C 73 176.545 176.545 176.465 0.080 17927 9511 1 12 . 1 1 73 73 LYS CA C 73 58.458 58.458 57.992 0.466 17927 9512 1 12 . 1 1 73 73 LYS CB C 73 32.641 32.641 33.036 -0.395 17927 9513 1 12 . 1 1 74 74 ASN N N 74 117.616 117.616 119.630 -2.014 17927 9514 1 12 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.702 0.203 17927 9515 1 12 . 1 1 74 74 ASN C C 74 174.894 174.894 175.430 -0.536 17927 9516 1 12 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.958 -1.437 17927 9517 1 12 . 1 1 74 74 ASN CB C 74 38.109 38.109 36.673 1.436 17927 9518 1 12 . 1 1 74 74 ASN H H 74 8.625 8.625 8.431 0.194 17927 9519 1 12 . 1 1 75 75 LYS N N 75 126.797 126.797 124.085 2.712 17927 9520 1 12 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.686 -0.263 17927 9521 1 12 . 1 1 75 75 LYS C C 75 178.058 178.058 178.022 0.036 17927 9522 1 12 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.410 -0.237 17927 9523 1 12 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.261 1.030 17927 9524 1 12 . 1 1 75 75 LYS H H 75 8.588 8.588 8.374 0.214 17927 9525 1 12 . 1 1 76 76 LYS N N 76 117.875 117.875 119.753 -1.878 17927 9526 1 12 . 1 1 76 76 LYS HA H 76 4.200 4.200 3.907 0.293 17927 9527 1 12 . 1 1 76 76 LYS C C 76 178.791 178.791 178.308 0.483 17927 9528 1 12 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.876 -1.268 17927 9529 1 12 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.968 -0.478 17927 9530 1 12 . 1 1 76 76 LYS H H 76 8.041 8.041 8.533 -0.492 17927 9531 1 12 . 1 1 77 77 ALA N N 77 121.567 121.567 121.566 0.001 17927 9532 1 12 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.125 -0.002 17927 9533 1 12 . 1 1 77 77 ALA C C 77 181.191 181.191 179.574 1.617 17927 9534 1 12 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.774 0.183 17927 9535 1 12 . 1 1 77 77 ALA CB C 77 17.759 17.759 17.802 -0.043 17927 9536 1 12 . 1 1 77 77 ALA H H 77 7.366 7.366 8.276 -0.910 17927 9537 1 12 . 1 1 78 78 TRP N N 78 119.497 119.497 120.046 -0.549 17927 9538 1 12 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.148 -0.071 17927 9539 1 12 . 1 1 78 78 TRP C C 78 175.942 175.942 177.498 -1.556 17927 9540 1 12 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.171 2.590 17927 9541 1 12 . 1 1 78 78 TRP CB C 78 27.272 27.272 29.823 -2.551 17927 9542 1 12 . 1 1 78 78 TRP H H 78 7.187 7.187 8.228 -1.041 17927 9543 1 12 . 1 1 79 79 GLU N N 79 118.771 118.771 117.942 0.829 17927 9544 1 12 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.464 -0.450 17927 9545 1 12 . 1 1 79 79 GLU C C 79 179.863 179.863 179.306 0.557 17927 9546 1 12 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.369 -0.259 17927 9547 1 12 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.445 1.775 17927 9548 1 12 . 1 1 79 79 GLU H H 79 8.813 8.813 8.604 0.209 17927 9549 1 12 . 1 1 80 80 ASN N N 80 115.964 115.964 118.050 -2.086 17927 9550 1 12 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.343 -0.004 17927 9551 1 12 . 1 1 80 80 ASN C C 80 176.749 176.749 177.565 -0.816 17927 9552 1 12 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.815 0.220 17927 9553 1 12 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.128 0.361 17927 9554 1 12 . 1 1 80 80 ASN H H 80 8.491 8.491 8.129 0.362 17927 9555 1 12 . 1 1 81 81 MET N N 81 119.670 119.670 121.082 -1.412 17927 9556 1 12 . 1 1 81 81 MET HA H 81 4.149 4.149 4.141 0.008 17927 9557 1 12 . 1 1 81 81 MET C C 81 177.933 177.933 178.015 -0.082 17927 9558 1 12 . 1 1 81 81 MET CA C 81 60.276 60.276 59.275 1.001 17927 9559 1 12 . 1 1 81 81 MET CB C 81 32.518 32.518 32.764 -0.246 17927 9560 1 12 . 1 1 81 81 MET H H 81 7.667 7.667 7.626 0.041 17927 9561 1 12 . 1 1 82 82 VAL N N 82 117.634 117.634 119.067 -1.433 17927 9562 1 12 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.563 -0.260 17927 9563 1 12 . 1 1 82 82 VAL C C 82 179.005 179.005 177.573 1.432 17927 9564 1 12 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.419 0.618 17927 9565 1 12 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.111 0.654 17927 9566 1 12 . 1 1 82 82 VAL H H 82 8.338 8.338 7.621 0.717 17927 9567 1 12 . 1 1 83 83 THR N N 83 110.519 110.519 115.552 -5.033 17927 9568 1 12 . 1 1 83 83 THR HA H 83 3.983 3.983 3.982 0.001 17927 9569 1 12 . 1 1 83 83 THR C C 83 177.591 177.591 176.264 1.327 17927 9570 1 12 . 1 1 83 83 THR CA C 83 65.431 65.431 66.706 -1.275 17927 9571 1 12 . 1 1 83 83 THR CB C 83 69.156 69.156 68.570 0.586 17927 9572 1 12 . 1 1 83 83 THR H H 83 7.659 7.659 7.597 0.062 17927 9573 1 12 . 1 1 84 84 LYS N N 84 123.927 123.927 120.932 2.995 17927 9574 1 12 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.118 -0.049 17927 9575 1 12 . 1 1 84 84 LYS C C 84 178.582 178.582 177.409 1.173 17927 9576 1 12 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.480 1.397 17927 9577 1 12 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.448 -0.125 17927 9578 1 12 . 1 1 84 84 LYS H H 84 8.665 8.665 7.848 0.817 17927 9579 1 12 . 1 1 85 85 ASP N N 85 116.280 116.280 116.901 -0.621 17927 9580 1 12 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.731 0.019 17927 9581 1 12 . 1 1 85 85 ASP C C 85 175.086 175.086 175.382 -0.296 17927 9582 1 12 . 1 1 85 85 ASP CA C 85 54.693 54.693 54.797 -0.104 17927 9583 1 12 . 1 1 85 85 ASP CB C 85 39.685 39.685 40.932 -1.247 17927 9584 1 12 . 1 1 85 85 ASP H H 85 8.179 8.179 8.129 0.050 17927 9585 1 12 . 1 1 86 86 GLN N N 86 116.258 116.258 113.527 2.731 17927 9586 1 12 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.834 0.074 17927 9587 1 12 . 1 1 86 86 GLN C C 86 175.659 175.659 174.852 0.807 17927 9588 1 12 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.464 -0.293 17927 9589 1 12 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.228 0.062 17927 9590 1 12 . 1 1 86 86 GLN H H 86 7.431 7.431 7.522 -0.091 17927 9591 1 12 . 1 1 87 87 LEU N N 87 117.031 117.031 120.080 -3.049 17927 9592 1 12 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.177 -0.087 17927 9593 1 12 . 1 1 87 87 LEU C C 87 178.225 178.225 176.262 1.963 17927 9594 1 12 . 1 1 87 87 LEU CA C 87 55.932 55.932 55.888 0.044 17927 9595 1 12 . 1 1 87 87 LEU CB C 87 41.202 41.202 41.400 -0.198 17927 9596 1 12 . 1 1 87 87 LEU H H 87 7.736 7.736 7.552 0.184 17927 9597 1 12 . 1 1 88 88 LYS N N 88 122.367 122.367 123.520 -1.153 17927 9598 1 12 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.816 -0.180 17927 9599 1 12 . 1 1 88 88 LYS C C 88 177.538 177.538 176.361 1.177 17927 9600 1 12 . 1 1 88 88 LYS CA C 88 54.930 54.930 54.110 0.820 17927 9601 1 12 . 1 1 88 88 LYS CB C 88 33.316 33.316 35.609 -2.293 17927 9602 1 12 . 1 1 88 88 LYS H H 88 8.496 8.496 8.138 0.358 17927 9603 1 12 . 1 1 89 89 GLY N N 89 108.452 108.452 106.805 1.647 17927 9604 1 12 . 1 1 89 89 GLY C C 89 173.781 173.781 173.258 0.523 17927 9605 1 12 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.448 0.910 17927 9606 1 12 . 1 1 89 89 GLY H H 89 8.497 8.497 8.037 0.460 17927 9607 1 12 . 1 1 90 90 ILE N N 90 123.295 123.295 122.829 0.466 17927 9608 1 12 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.331 0.040 17927 9609 1 12 . 1 1 90 90 ILE C C 90 175.606 175.606 174.702 0.904 17927 9610 1 12 . 1 1 90 90 ILE CA C 90 62.001 62.001 61.095 0.906 17927 9611 1 12 . 1 1 90 90 ILE CB C 90 38.036 38.036 37.989 0.047 17927 9612 1 12 . 1 1 90 90 ILE H H 90 8.728 8.728 7.893 0.835 17927 9613 1 12 . 1 1 91 91 GLN N N 91 128.632 128.632 125.910 2.722 17927 9614 1 12 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.806 -0.040 17927 9615 1 12 . 1 1 91 91 GLN C C 91 174.618 174.618 174.285 0.333 17927 9616 1 12 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.712 1.139 17927 9617 1 12 . 1 1 91 91 GLN CB C 91 28.341 28.341 29.874 -1.533 17927 9618 1 12 . 1 1 91 91 GLN H H 91 8.762 8.762 9.874 -1.112 17927 9619 1 12 . 1 1 92 92 LEU N N 92 120.830 120.830 124.322 -3.492 17927 9620 1 12 . 1 1 92 92 LEU HA H 92 5.580 5.580 4.998 0.582 17927 9621 1 12 . 1 1 92 92 LEU C C 92 176.828 176.828 176.015 0.813 17927 9622 1 12 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.709 -0.908 17927 9623 1 12 . 1 1 92 92 LEU CB C 92 44.210 44.210 44.393 -0.183 17927 9624 1 12 . 1 1 92 92 LEU H H 92 9.011 9.011 9.073 -0.062 17927 9625 1 12 . 1 1 93 93 HIS N N 93 121.481 121.481 122.403 -0.922 17927 9626 1 12 . 1 1 93 93 HIS HA H 93 3.931 3.931 4.883 -0.952 17927 9627 1 12 . 1 1 93 93 HIS C C 93 173.590 173.590 173.137 0.453 17927 9628 1 12 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.655 0.928 17927 9629 1 12 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.003 -0.753 17927 9630 1 12 . 1 1 93 93 HIS H H 93 8.038 8.038 8.553 -0.515 17927 9631 1 12 . 1 1 94 94 MET N N 94 121.881 121.881 124.254 -2.373 17927 9632 1 12 . 1 1 94 94 MET HA H 94 3.866 3.866 3.717 0.149 17927 9633 1 12 . 1 1 94 94 MET C C 94 177.035 177.035 175.954 1.081 17927 9634 1 12 . 1 1 94 94 MET CA C 94 55.189 55.189 56.977 -1.788 17927 9635 1 12 . 1 1 94 94 MET CB C 94 33.993 33.993 33.656 0.337 17927 9636 1 12 . 1 1 94 94 MET H H 94 8.039 8.039 8.477 -0.438 17927 9637 1 12 . 1 1 95 95 GLY N N 95 104.041 104.041 105.360 -1.319 17927 9638 1 12 . 1 1 95 95 GLY C C 95 174.251 174.251 173.946 0.305 17927 9639 1 12 . 1 1 95 95 GLY CA C 95 46.580 46.580 45.250 1.330 17927 9640 1 12 . 1 1 95 95 GLY H H 95 5.666 5.666 7.620 -1.954 17927 9641 1 12 . 1 1 96 96 THR N N 96 114.114 114.114 117.668 -3.554 17927 9642 1 12 . 1 1 96 96 THR HA H 96 4.211 4.211 4.474 -0.263 17927 9643 1 12 . 1 1 96 96 THR C C 96 175.122 175.122 174.040 1.082 17927 9644 1 12 . 1 1 96 96 THR CA C 96 61.339 61.339 62.144 -0.805 17927 9645 1 12 . 1 1 96 96 THR CB C 96 68.615 68.615 70.136 -1.521 17927 9646 1 12 . 1 1 96 96 THR H H 96 8.517 8.517 8.162 0.355 17927 9647 1 12 . 1 1 97 97 ASP N N 97 121.892 121.892 123.748 -1.856 17927 9648 1 12 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.800 -0.215 17927 9649 1 12 . 1 1 97 97 ASP C C 97 178.241 178.241 176.629 1.612 17927 9650 1 12 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.053 1.746 17927 9651 1 12 . 1 1 97 97 ASP CB C 97 43.129 43.129 38.893 4.236 17927 9652 1 12 . 1 1 97 97 ASP H H 97 7.563 7.563 8.393 -0.830 17927 9653 1 12 . 1 1 98 98 ARG N N 98 127.508 127.508 119.887 7.621 17927 9654 1 12 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.176 0.216 17927 9655 1 12 . 1 1 98 98 ARG C C 98 176.724 176.724 177.498 -0.774 17927 9656 1 12 . 1 1 98 98 ARG CA C 98 55.939 55.939 58.654 -2.715 17927 9657 1 12 . 1 1 98 98 ARG CB C 98 30.291 30.291 30.036 0.255 17927 9658 1 12 . 1 1 98 98 ARG H H 98 9.225 9.225 7.844 1.381 17927 9659 1 12 . 1 1 99 99 THR N N 99 116.384 116.384 116.796 -0.412 17927 9660 1 12 . 1 1 99 99 THR HA H 99 3.987 3.987 3.974 0.013 17927 9661 1 12 . 1 1 99 99 THR C C 99 176.969 176.969 176.459 0.510 17927 9662 1 12 . 1 1 99 99 THR CA C 99 67.714 67.714 66.569 1.145 17927 9663 1 12 . 1 1 99 99 THR CB C 99 68.777 68.777 68.434 0.343 17927 9664 1 12 . 1 1 99 99 THR H H 99 8.382 8.382 8.269 0.113 17927 9665 1 12 . 1 1 100 100 PHE N N 100 123.232 123.232 121.047 2.185 17927 9666 1 12 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.402 -0.229 17927 9667 1 12 . 1 1 100 100 PHE C C 100 177.010 177.010 176.646 0.364 17927 9668 1 12 . 1 1 100 100 PHE CA C 100 61.923 61.923 60.986 0.937 17927 9669 1 12 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.358 1.404 17927 9670 1 12 . 1 1 100 100 PHE H H 100 7.998 7.998 7.598 0.400 17927 9671 1 12 . 1 1 101 101 MET N N 101 115.968 115.968 117.433 -1.465 17927 9672 1 12 . 1 1 101 101 MET HA H 101 3.975 3.975 4.152 -0.177 17927 9673 1 12 . 1 1 101 101 MET C C 101 178.763 178.763 177.599 1.164 17927 9674 1 12 . 1 1 101 101 MET CA C 101 58.552 58.552 58.673 -0.121 17927 9675 1 12 . 1 1 101 101 MET CB C 101 32.593 32.593 32.442 0.151 17927 9676 1 12 . 1 1 101 101 MET H H 101 7.828 7.828 7.958 -0.130 17927 9677 1 12 . 1 1 102 102 ASP N N 102 117.553 117.553 120.931 -3.378 17927 9678 1 12 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.495 0.026 17927 9679 1 12 . 1 1 102 102 ASP C C 102 179.503 179.503 178.404 1.099 17927 9680 1 12 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.553 -0.663 17927 9681 1 12 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.367 -0.441 17927 9682 1 12 . 1 1 102 102 ASP H H 102 8.828 8.828 8.784 0.044 17927 9683 1 12 . 1 1 103 103 ALA N N 103 122.984 122.984 121.973 1.011 17927 9684 1 12 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.065 -0.079 17927 9685 1 12 . 1 1 103 103 ALA C C 103 178.782 178.782 178.255 0.527 17927 9686 1 12 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.429 0.665 17927 9687 1 12 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.376 0.187 17927 9688 1 12 . 1 1 103 103 ALA H H 103 7.567 7.567 7.500 0.067 17927 9689 1 12 . 1 1 104 104 TYR N N 104 112.159 112.159 114.428 -2.269 17927 9690 1 12 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.492 -0.268 17927 9691 1 12 . 1 1 104 104 TYR C C 104 173.821 173.821 174.837 -1.016 17927 9692 1 12 . 1 1 104 104 TYR CA C 104 58.498 58.498 58.134 0.364 17927 9693 1 12 . 1 1 104 104 TYR CB C 104 38.393 38.393 38.602 -0.209 17927 9694 1 12 . 1 1 104 104 TYR H H 104 7.203 7.203 7.306 -0.103 17927 9695 1 12 . 1 1 105 105 LEU N N 105 119.433 119.433 113.774 5.659 17927 9696 1 12 . 1 1 105 105 LEU HA H 105 3.985 3.985 4.028 -0.043 17927 9697 1 12 . 1 1 105 105 LEU C C 105 176.721 176.721 176.475 0.246 17927 9698 1 12 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.789 -0.004 17927 9699 1 12 . 1 1 105 105 LEU CB C 105 38.443 38.443 40.270 -1.827 17927 9700 1 12 . 1 1 105 105 LEU H H 105 7.582 7.582 7.178 0.404 17927 9701 1 12 . 1 1 106 106 ILE N N 106 119.575 119.575 117.264 2.311 17927 9702 1 12 . 1 1 106 106 ILE HA H 106 4.002 4.002 4.236 -0.234 17927 9703 1 12 . 1 1 106 106 ILE C C 106 175.459 175.459 175.435 0.024 17927 9704 1 12 . 1 1 106 106 ILE CA C 106 62.043 62.043 59.662 2.381 17927 9705 1 12 . 1 1 106 106 ILE CB C 106 36.335 36.335 35.844 0.491 17927 9706 1 12 . 1 1 106 106 ILE H H 106 8.774 8.774 7.480 1.294 17927 9707 1 12 . 1 1 107 107 ASN N N 107 126.514 126.514 122.371 4.143 17927 9708 1 12 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.577 0.286 17927 9709 1 12 . 1 1 107 107 ASN C C 107 174.584 174.584 175.562 -0.978 17927 9710 1 12 . 1 1 107 107 ASN CA C 107 53.112 53.112 53.979 -0.867 17927 9711 1 12 . 1 1 107 107 ASN CB C 107 38.977 38.977 39.038 -0.061 17927 9712 1 12 . 1 1 107 107 ASN H H 107 8.364 8.364 7.836 0.528 17927 9713 1 12 . 1 1 108 108 GLY N N 108 108.469 108.469 109.615 -1.146 17927 9714 1 12 . 1 1 108 108 GLY C C 108 171.245 171.245 173.277 -2.032 17927 9715 1 12 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.559 0.710 17927 9716 1 12 . 1 1 108 108 GLY H H 108 7.678 7.678 7.896 -0.218 17927 9717 1 12 . 1 1 109 109 ILE N N 109 112.817 112.817 119.841 -7.024 17927 9718 1 12 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.579 -0.173 17927 9719 1 12 . 1 1 109 109 ILE C C 109 173.498 173.498 173.896 -0.398 17927 9720 1 12 . 1 1 109 109 ILE CA C 109 58.384 58.384 57.048 1.336 17927 9721 1 12 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.708 1.614 17927 9722 1 12 . 1 1 109 109 ILE H H 109 7.868 7.868 7.314 0.554 17927 9723 1 12 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.332 0.410 17927 9724 1 12 . 1 1 110 110 PRO C C 110 175.715 175.715 175.193 0.522 17927 9725 1 12 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.422 -0.145 17927 9726 1 12 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.244 4.124 17927 9727 1 12 . 1 1 111 111 ARG N N 111 122.358 122.358 121.369 0.989 17927 9728 1 12 . 1 1 111 111 ARG HA H 111 4.469 4.469 4.014 0.455 17927 9729 1 12 . 1 1 111 111 ARG C C 111 171.541 171.541 174.405 -2.864 17927 9730 1 12 . 1 1 111 111 ARG CA C 111 54.356 54.356 54.077 0.279 17927 9731 1 12 . 1 1 111 111 ARG CB C 111 33.430 33.430 33.003 0.427 17927 9732 1 12 . 1 1 111 111 ARG H H 111 7.732 7.732 8.206 -0.474 17927 9733 1 12 . 1 1 112 112 PHE N N 112 125.103 125.103 123.200 1.903 17927 9734 1 12 . 1 1 112 112 PHE HA H 112 5.773 5.773 5.102 0.671 17927 9735 1 12 . 1 1 112 112 PHE C C 112 175.097 175.097 174.791 0.306 17927 9736 1 12 . 1 1 112 112 PHE CA C 112 55.791 55.791 56.740 -0.949 17927 9737 1 12 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.678 1.250 17927 9738 1 12 . 1 1 112 112 PHE H H 112 8.929 8.929 8.345 0.584 17927 9739 1 12 . 1 1 113 113 ILE N N 113 123.778 123.778 121.066 2.712 17927 9740 1 12 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.930 -0.387 17927 9741 1 12 . 1 1 113 113 ILE C C 113 173.197 173.197 174.656 -1.459 17927 9742 1 12 . 1 1 113 113 ILE CA C 113 60.286 60.286 58.979 1.307 17927 9743 1 12 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.426 1.820 17927 9744 1 12 . 1 1 113 113 ILE H H 113 8.873 8.873 8.821 0.052 17927 9745 1 12 . 1 1 114 114 LEU N N 114 127.146 127.146 118.869 8.277 17927 9746 1 12 . 1 1 114 114 LEU HA H 114 6.014 6.014 4.905 1.109 17927 9747 1 12 . 1 1 114 114 LEU C C 114 175.080 175.080 173.954 1.126 17927 9748 1 12 . 1 1 114 114 LEU CA C 114 53.401 53.401 54.734 -1.333 17927 9749 1 12 . 1 1 114 114 LEU CB C 114 47.370 47.370 45.345 2.025 17927 9750 1 12 . 1 1 114 114 LEU H H 114 8.974 8.974 8.092 0.882 17927 9751 1 12 . 1 1 115 115 LEU N N 115 128.323 128.323 115.536 12.787 17927 9752 1 12 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.486 -0.054 17927 9753 1 12 . 1 1 115 115 LEU C C 115 176.660 176.660 175.666 0.994 17927 9754 1 12 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.043 0.034 17927 9755 1 12 . 1 1 115 115 LEU CB C 115 44.584 44.584 45.306 -0.722 17927 9756 1 12 . 1 1 115 115 LEU H H 115 9.874 9.874 9.109 0.765 17927 9757 1 12 . 1 1 116 116 ASP N N 116 119.834 119.834 122.007 -2.173 17927 9758 1 12 . 1 1 116 116 ASP HA H 116 4.935 4.935 4.954 -0.019 17927 9759 1 12 . 1 1 116 116 ASP C C 116 176.898 176.898 177.333 -0.435 17927 9760 1 12 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.723 -1.418 17927 9761 1 12 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.960 -1.932 17927 9762 1 12 . 1 1 116 116 ASP H H 116 9.357 9.357 9.034 0.323 17927 9763 1 12 . 1 1 117 117 ARG N N 117 113.356 113.356 121.096 -7.740 17927 9764 1 12 . 1 1 117 117 ARG HA H 117 3.717 3.717 4.057 -0.340 17927 9765 1 12 . 1 1 117 117 ARG C C 117 177.105 177.105 178.072 -0.967 17927 9766 1 12 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.665 -1.480 17927 9767 1 12 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.902 0.535 17927 9768 1 12 . 1 1 117 117 ARG H H 117 7.697 7.697 8.443 -0.746 17927 9769 1 12 . 1 1 118 118 ASP N N 118 117.226 117.226 116.173 1.053 17927 9770 1 12 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.557 0.338 17927 9771 1 12 . 1 1 118 118 ASP C C 118 176.657 176.657 176.402 0.255 17927 9772 1 12 . 1 1 118 118 ASP CA C 118 53.517 53.517 54.476 -0.959 17927 9773 1 12 . 1 1 118 118 ASP CB C 118 42.556 42.556 40.811 1.745 17927 9774 1 12 . 1 1 118 118 ASP H H 118 8.456 8.456 8.118 0.338 17927 9775 1 12 . 1 1 119 119 GLY N N 119 109.074 109.074 107.198 1.876 17927 9776 1 12 . 1 1 119 119 GLY C C 119 173.355 173.355 173.002 0.353 17927 9777 1 12 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.229 1.027 17927 9778 1 12 . 1 1 119 119 GLY H H 119 8.183 8.183 8.608 -0.425 17927 9779 1 12 . 1 1 120 120 LYS N N 120 120.744 120.744 119.899 0.845 17927 9780 1 12 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.673 -0.140 17927 9781 1 12 . 1 1 120 120 LYS C C 120 177.229 177.229 175.500 1.729 17927 9782 1 12 . 1 1 120 120 LYS CA C 120 55.287 55.287 54.882 0.405 17927 9783 1 12 . 1 1 120 120 LYS CB C 120 32.581 32.581 34.540 -1.959 17927 9784 1 12 . 1 1 120 120 LYS H H 120 8.449 8.449 7.414 1.035 17927 9785 1 12 . 1 1 121 121 ILE N N 121 121.221 121.221 125.221 -4.000 17927 9786 1 12 . 1 1 121 121 ILE HA H 121 3.886 3.886 4.039 -0.153 17927 9787 1 12 . 1 1 121 121 ILE C C 121 177.819 177.819 176.418 1.401 17927 9788 1 12 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.028 0.887 17927 9789 1 12 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.913 1.477 17927 9790 1 12 . 1 1 121 121 ILE H H 121 8.715 8.715 8.714 0.001 17927 9791 1 12 . 1 1 122 122 ILE N N 122 127.165 127.165 127.532 -0.367 17927 9792 1 12 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.278 0.063 17927 9793 1 12 . 1 1 122 122 ILE C C 122 176.978 176.978 176.245 0.733 17927 9794 1 12 . 1 1 122 122 ILE CA C 122 63.719 63.719 61.703 2.016 17927 9795 1 12 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.758 -0.106 17927 9796 1 12 . 1 1 122 122 ILE H H 122 8.974 8.974 8.839 0.135 17927 9797 1 12 . 1 1 123 123 SER N N 123 111.227 111.227 114.899 -3.672 17927 9798 1 12 . 1 1 123 123 SER HA H 123 4.738 4.738 4.666 0.072 17927 9799 1 12 . 1 1 123 123 SER C C 123 174.184 174.184 173.034 1.150 17927 9800 1 12 . 1 1 123 123 SER CA C 123 57.383 57.383 56.682 0.701 17927 9801 1 12 . 1 1 123 123 SER CB C 123 65.326 65.326 64.862 0.464 17927 9802 1 12 . 1 1 123 123 SER H H 123 7.850 7.850 7.721 0.129 17927 9803 1 12 . 1 1 124 124 ALA N N 124 131.373 131.373 126.978 4.395 17927 9804 1 12 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.751 -0.266 17927 9805 1 12 . 1 1 124 124 ALA C C 124 175.147 175.147 176.117 -0.970 17927 9806 1 12 . 1 1 124 124 ALA CA C 124 53.035 53.035 51.178 1.857 17927 9807 1 12 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.317 -0.655 17927 9808 1 12 . 1 1 124 124 ALA H H 124 9.384 9.384 8.943 0.441 17927 9809 1 12 . 1 1 125 125 ASN N N 125 119.476 119.476 114.408 5.068 17927 9810 1 12 . 1 1 125 125 ASN HA H 125 5.056 5.056 4.833 0.223 17927 9811 1 12 . 1 1 125 125 ASN C C 125 173.593 173.593 174.255 -0.662 17927 9812 1 12 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.735 -0.383 17927 9813 1 12 . 1 1 125 125 ASN CB C 125 38.304 38.304 39.385 -1.081 17927 9814 1 12 . 1 1 125 125 ASN H H 125 8.191 8.191 8.033 0.158 17927 9815 1 12 . 1 1 126 126 MET N N 126 122.705 122.705 121.827 0.878 17927 9816 1 12 . 1 1 126 126 MET HA H 126 4.585 4.585 4.460 0.125 17927 9817 1 12 . 1 1 126 126 MET C C 126 175.215 175.215 175.406 -0.191 17927 9818 1 12 . 1 1 126 126 MET CA C 126 53.849 53.849 55.960 -2.111 17927 9819 1 12 . 1 1 126 126 MET CB C 126 31.312 31.312 34.080 -2.768 17927 9820 1 12 . 1 1 126 126 MET H H 126 8.376 8.376 7.862 0.514 17927 9821 1 12 . 1 1 127 127 THR N N 127 111.016 111.016 113.688 -2.672 17927 9822 1 12 . 1 1 127 127 THR HA H 127 4.291 4.291 3.849 0.442 17927 9823 1 12 . 1 1 127 127 THR C C 127 174.574 174.574 172.716 1.858 17927 9824 1 12 . 1 1 127 127 THR CA C 127 62.085 62.085 61.762 0.323 17927 9825 1 12 . 1 1 127 127 THR CB C 127 69.733 69.733 70.820 -1.087 17927 9826 1 12 . 1 1 127 127 THR H H 127 7.714 7.714 8.011 -0.297 17927 9827 1 12 . 1 1 128 128 ARG N N 128 118.722 118.722 125.782 -7.060 17927 9828 1 12 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.433 -1.125 17927 9829 1 12 . 1 1 128 128 ARG C C 128 176.978 176.978 174.549 2.429 17927 9830 1 12 . 1 1 128 128 ARG CA C 128 54.727 54.727 58.868 -4.141 17927 9831 1 12 . 1 1 128 128 ARG CB C 128 29.598 29.598 29.511 0.087 17927 9832 1 12 . 1 1 128 128 ARG H H 128 8.658 8.658 7.458 1.200 17927 9833 1 12 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.340 -0.407 17927 9834 1 12 . 1 1 129 129 PRO C C 129 175.794 175.794 175.768 0.026 17927 9835 1 12 . 1 1 129 129 PRO CA C 129 66.549 66.549 63.937 2.612 17927 9836 1 12 . 1 1 129 129 PRO CB C 129 31.677 31.677 29.848 1.829 17927 9837 1 12 . 1 1 130 130 SER N N 130 108.696 108.696 110.373 -1.677 17927 9838 1 12 . 1 1 130 130 SER HA H 130 3.988 3.988 4.102 -0.114 17927 9839 1 12 . 1 1 130 130 SER C C 130 174.445 174.445 173.979 0.466 17927 9840 1 12 . 1 1 130 130 SER CA C 130 58.911 58.911 59.036 -0.125 17927 9841 1 12 . 1 1 130 130 SER CB C 130 62.680 62.680 61.361 1.319 17927 9842 1 12 . 1 1 130 130 SER H H 130 8.375 8.375 7.906 0.469 17927 9843 1 12 . 1 1 131 131 ASP N N 131 126.377 126.377 122.129 4.248 17927 9844 1 12 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.782 0.090 17927 9845 1 12 . 1 1 131 131 ASP C C 131 176.879 176.879 176.039 0.840 17927 9846 1 12 . 1 1 131 131 ASP CA C 131 51.195 51.195 52.340 -1.145 17927 9847 1 12 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.059 0.756 17927 9848 1 12 . 1 1 131 131 ASP H H 131 7.514 7.514 8.332 -0.818 17927 9849 1 12 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.207 0.185 17927 9850 1 12 . 1 1 132 132 PRO C C 132 178.097 178.097 178.424 -0.327 17927 9851 1 12 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.938 0.141 17927 9852 1 12 . 1 1 132 132 PRO CB C 132 32.409 32.409 31.997 0.412 17927 9853 1 12 . 1 1 133 133 LYS N N 133 116.306 116.306 118.372 -2.066 17927 9854 1 12 . 1 1 133 133 LYS HA H 133 3.958 3.958 3.920 0.038 17927 9855 1 12 . 1 1 133 133 LYS C C 133 179.532 179.532 179.152 0.380 17927 9856 1 12 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.720 -1.199 17927 9857 1 12 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.874 0.317 17927 9858 1 12 . 1 1 133 133 LYS H H 133 8.842 8.842 7.847 0.995 17927 9859 1 12 . 1 1 134 134 THR N N 134 120.833 120.833 114.696 6.137 17927 9860 1 12 . 1 1 134 134 THR HA H 134 3.147 3.147 3.826 -0.679 17927 9861 1 12 . 1 1 134 134 THR C C 134 173.356 173.356 175.230 -1.874 17927 9862 1 12 . 1 1 134 134 THR CA C 134 66.383 66.383 65.212 1.171 17927 9863 1 12 . 1 1 134 134 THR CB C 134 66.847 66.847 68.277 -1.430 17927 9864 1 12 . 1 1 134 134 THR H H 134 8.292 8.292 8.142 0.150 17927 9865 1 12 . 1 1 135 135 ALA N N 135 121.720 121.720 123.979 -2.259 17927 9866 1 12 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.690 -0.107 17927 9867 1 12 . 1 1 135 135 ALA C C 135 178.902 178.902 179.405 -0.503 17927 9868 1 12 . 1 1 135 135 ALA CA C 135 54.999 54.999 55.173 -0.174 17927 9869 1 12 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.013 -0.238 17927 9870 1 12 . 1 1 135 135 ALA H H 135 7.030 7.030 7.726 -0.696 17927 9871 1 12 . 1 1 136 136 GLU N N 136 114.623 114.623 117.591 -2.968 17927 9872 1 12 . 1 1 136 136 GLU HA H 136 3.922 3.922 4.050 -0.128 17927 9873 1 12 . 1 1 136 136 GLU C C 136 179.199 179.199 179.211 -0.012 17927 9874 1 12 . 1 1 136 136 GLU CA C 136 59.837 59.837 59.177 0.660 17927 9875 1 12 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.174 0.612 17927 9876 1 12 . 1 1 136 136 GLU H H 136 7.216 7.216 8.306 -1.090 17927 9877 1 12 . 1 1 137 137 LYS N N 137 120.789 120.789 119.570 1.219 17927 9878 1 12 . 1 1 137 137 LYS HA H 137 4.204 4.204 3.940 0.264 17927 9879 1 12 . 1 1 137 137 LYS C C 137 178.834 178.834 179.089 -0.255 17927 9880 1 12 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.699 -1.356 17927 9881 1 12 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.718 -1.255 17927 9882 1 12 . 1 1 137 137 LYS H H 137 7.681 7.681 7.348 0.333 17927 9883 1 12 . 1 1 138 138 PHE N N 138 118.373 118.373 117.783 0.590 17927 9884 1 12 . 1 1 138 138 PHE HA H 138 4.033 4.033 3.907 0.126 17927 9885 1 12 . 1 1 138 138 PHE C C 138 178.027 178.027 177.680 0.347 17927 9886 1 12 . 1 1 138 138 PHE CA C 138 57.507 57.507 60.361 -2.853 17927 9887 1 12 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.247 -1.358 17927 9888 1 12 . 1 1 138 138 PHE H H 138 8.059 8.059 7.579 0.480 17927 9889 1 12 . 1 1 139 139 ASN N N 139 117.611 117.611 116.329 1.282 17927 9890 1 12 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.568 -0.164 17927 9891 1 12 . 1 1 139 139 ASN C C 139 178.190 178.190 177.401 0.789 17927 9892 1 12 . 1 1 139 139 ASN CA C 139 56.224 56.224 55.994 0.230 17927 9893 1 12 . 1 1 139 139 ASN CB C 139 36.734 36.734 38.176 -1.442 17927 9894 1 12 . 1 1 139 139 ASN H H 139 8.683 8.683 8.069 0.614 17927 9895 1 12 . 1 1 140 140 GLU N N 140 121.432 121.432 121.695 -0.263 17927 9896 1 12 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.085 -0.080 17927 9897 1 12 . 1 1 140 140 GLU C C 140 179.751 179.751 179.359 0.392 17927 9898 1 12 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.509 -0.199 17927 9899 1 12 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.817 0.239 17927 9900 1 12 . 1 1 140 140 GLU H H 140 7.868 7.868 8.385 -0.517 17927 9901 1 12 . 1 1 141 141 LEU N N 141 119.968 119.968 117.488 2.480 17927 9902 1 12 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.193 -0.177 17927 9903 1 12 . 1 1 141 141 LEU C C 141 179.293 179.293 178.650 0.643 17927 9904 1 12 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.273 0.163 17927 9905 1 12 . 1 1 141 141 LEU CB C 141 41.183 41.183 40.971 0.212 17927 9906 1 12 . 1 1 141 141 LEU H H 141 8.303 8.303 7.810 0.493 17927 9907 1 12 . 1 1 142 142 LEU N N 142 115.040 115.040 118.486 -3.446 17927 9908 1 12 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.330 0.054 17927 9909 1 12 . 1 1 142 142 LEU C C 142 178.002 178.002 177.487 0.515 17927 9910 1 12 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.441 -0.162 17927 9911 1 12 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.788 -0.141 17927 9912 1 12 . 1 1 142 142 LEU H H 142 8.230 8.230 7.833 0.397 17927 9913 1 12 . 1 1 143 143 GLY N N 143 108.977 108.977 107.367 1.610 17927 9914 1 12 . 1 1 143 143 GLY C C 143 175.216 175.216 174.779 0.437 17927 9915 1 12 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.808 0.933 17927 9916 1 12 . 1 1 143 143 GLY H H 143 7.762 7.762 7.712 0.050 17927 9917 1 12 . 1 1 144 144 LEU N N 144 119.660 119.660 120.119 -0.459 17927 9918 1 12 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.675 -0.187 17927 9919 1 12 . 1 1 144 144 LEU C C 144 177.375 177.375 176.896 0.479 17927 9920 1 12 . 1 1 144 144 LEU CA C 144 54.525 54.525 53.338 1.187 17927 9921 1 12 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.202 0.571 17927 9922 1 12 . 1 1 144 144 LEU H H 144 8.241 8.241 8.303 -0.062 17927 9923 1 12 . 1 1 145 145 GLU N N 145 119.959 119.959 119.982 -0.023 17927 9924 1 12 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.096 0.145 17927 9925 1 12 . 1 1 145 145 GLU C C 145 177.075 177.075 177.989 -0.914 17927 9926 1 12 . 1 1 145 145 GLU CA C 145 56.799 56.799 58.265 -1.466 17927 9927 1 12 . 1 1 145 145 GLU CB C 145 30.168 30.168 29.758 0.410 17927 9928 1 12 . 1 1 145 145 GLU H H 145 8.410 8.410 8.122 0.288 17927 9929 1 12 . 1 1 146 146 GLY N N 146 109.412 109.412 106.433 2.979 17927 9930 1 12 . 1 1 146 146 GLY C C 146 174.276 174.276 175.557 -1.281 17927 9931 1 12 . 1 1 146 146 GLY CA C 146 45.445 45.445 46.094 -0.649 17927 9932 1 12 . 1 1 146 146 GLY H H 146 8.422 8.422 8.364 0.058 17927 9933 1 12 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.596 0.060 17927 9934 1 12 . 1 1 151 151 HIS C C 151 173.990 173.990 173.686 0.304 17927 9935 1 12 . 1 1 151 151 HIS CA C 151 56.044 56.044 56.092 -0.048 17927 9936 1 12 . 1 1 151 151 HIS CB C 151 30.076 30.076 30.703 -0.627 17927 9937 1 13 . 1 1 2 2 SER HA H 2 4.121 4.121 5.040 -0.919 17927 9938 1 13 . 1 1 2 2 SER CA C 2 57.293 57.293 57.426 -0.133 17927 9939 1 13 . 1 1 2 2 SER CB C 2 63.545 63.545 65.036 -1.491 17927 9940 1 13 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.885 -0.453 17927 9941 1 13 . 1 1 3 3 LEU C C 3 177.383 177.383 176.078 1.305 17927 9942 1 13 . 1 1 3 3 LEU CA C 3 55.575 55.575 54.911 0.664 17927 9943 1 13 . 1 1 3 3 LEU CB C 3 42.584 42.584 44.843 -2.259 17927 9944 1 13 . 1 1 4 4 ARG N N 4 122.080 122.080 120.421 1.659 17927 9945 1 13 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.594 -0.210 17927 9946 1 13 . 1 1 4 4 ARG C C 4 176.410 176.410 176.164 0.246 17927 9947 1 13 . 1 1 4 4 ARG CA C 4 56.269 56.269 55.843 0.427 17927 9948 1 13 . 1 1 4 4 ARG CB C 4 30.842 30.842 31.061 -0.220 17927 9949 1 13 . 1 1 4 4 ARG H H 4 8.410 8.410 8.654 -0.244 17927 9950 1 13 . 1 1 5 5 SER N N 5 117.023 117.023 111.333 5.690 17927 9951 1 13 . 1 1 5 5 SER HA H 5 4.423 4.423 4.484 -0.061 17927 9952 1 13 . 1 1 5 5 SER C C 5 175.039 175.039 174.521 0.518 17927 9953 1 13 . 1 1 5 5 SER CA C 5 58.605 58.605 58.060 0.545 17927 9954 1 13 . 1 1 5 5 SER CB C 5 64.044 64.044 64.277 -0.233 17927 9955 1 13 . 1 1 5 5 SER H H 5 8.292 8.292 7.456 0.836 17927 9956 1 13 . 1 1 6 6 GLY N N 6 110.718 110.718 113.605 -2.887 17927 9957 1 13 . 1 1 6 6 GLY C C 6 173.654 173.654 173.336 0.318 17927 9958 1 13 . 1 1 6 6 GLY CA C 6 45.273 45.273 45.726 -0.453 17927 9959 1 13 . 1 1 6 6 GLY H H 6 8.446 8.446 8.712 -0.266 17927 9960 1 13 . 1 1 7 7 ASN N N 7 119.287 119.287 119.835 -0.548 17927 9961 1 13 . 1 1 7 7 ASN HA H 7 5.024 5.024 5.009 0.015 17927 9962 1 13 . 1 1 7 7 ASN C C 7 173.672 173.672 171.951 1.721 17927 9963 1 13 . 1 1 7 7 ASN CA C 7 51.357 51.357 51.157 0.200 17927 9964 1 13 . 1 1 7 7 ASN CB C 7 38.927 38.927 39.603 -0.676 17927 9965 1 13 . 1 1 7 7 ASN H H 7 8.273 8.273 8.046 0.227 17927 9966 1 13 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.779 -0.332 17927 9967 1 13 . 1 1 8 8 PRO C C 8 176.899 176.899 176.534 0.365 17927 9968 1 13 . 1 1 8 8 PRO CA C 8 63.429 63.429 62.823 0.606 17927 9969 1 13 . 1 1 8 8 PRO CB C 8 32.216 32.216 31.439 0.777 17927 9970 1 13 . 1 1 9 9 SER N N 9 115.642 115.642 121.580 -5.938 17927 9971 1 13 . 1 1 9 9 SER HA H 9 4.415 4.415 4.769 -0.354 17927 9972 1 13 . 1 1 9 9 SER C C 9 174.714 174.714 174.993 -0.279 17927 9973 1 13 . 1 1 9 9 SER CA C 9 58.488 58.488 57.086 1.402 17927 9974 1 13 . 1 1 9 9 SER CB C 9 64.048 64.048 63.122 0.926 17927 9975 1 13 . 1 1 9 9 SER H H 9 8.336 8.336 8.263 0.073 17927 9976 1 13 . 1 1 10 10 ALA N N 10 126.808 126.808 130.513 -3.705 17927 9977 1 13 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.389 -0.127 17927 9978 1 13 . 1 1 10 10 ALA C C 10 177.233 177.233 177.260 -0.027 17927 9979 1 13 . 1 1 10 10 ALA CA C 10 53.230 53.230 54.210 -0.980 17927 9980 1 13 . 1 1 10 10 ALA CB C 10 19.187 19.187 18.007 1.180 17927 9981 1 13 . 1 1 10 10 ALA H H 10 8.137 8.137 9.229 -1.092 17927 9982 1 13 . 1 1 11 11 ALA N N 11 120.449 120.449 123.568 -3.119 17927 9983 1 13 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.001 0.260 17927 9984 1 13 . 1 1 11 11 ALA C C 11 177.469 177.469 176.992 0.477 17927 9985 1 13 . 1 1 11 11 ALA CA C 11 52.475 52.475 52.624 -0.149 17927 9986 1 13 . 1 1 11 11 ALA CB C 11 19.485 19.485 17.787 1.698 17927 9987 1 13 . 1 1 11 11 ALA H H 11 7.851 7.851 8.210 -0.359 17927 9988 1 13 . 1 1 12 12 SER N N 12 114.186 114.186 111.883 2.303 17927 9989 1 13 . 1 1 12 12 SER HA H 12 4.312 4.312 4.015 0.297 17927 9990 1 13 . 1 1 12 12 SER C C 12 173.593 173.593 173.786 -0.193 17927 9991 1 13 . 1 1 12 12 SER CA C 12 58.099 58.099 59.051 -0.952 17927 9992 1 13 . 1 1 12 12 SER CB C 12 63.320 63.320 62.801 0.519 17927 9993 1 13 . 1 1 12 12 SER H H 12 7.990 7.990 8.568 -0.578 17927 9994 1 13 . 1 1 13 13 PHE N N 13 118.092 118.092 119.936 -1.844 17927 9995 1 13 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.751 0.029 17927 9996 1 13 . 1 1 13 13 PHE C C 13 174.220 174.220 174.028 0.192 17927 9997 1 13 . 1 1 13 13 PHE CA C 13 56.717 56.717 55.947 0.770 17927 9998 1 13 . 1 1 13 13 PHE CB C 13 41.151 41.151 41.152 -0.001 17927 9999 1 13 . 1 1 13 13 PHE H H 13 7.147 7.147 7.156 -0.009 17927 10000 1 13 . 1 1 14 14 SER N N 14 116.456 116.456 113.472 2.984 17927 10001 1 13 . 1 1 14 14 SER HA H 14 5.162 5.162 5.140 0.022 17927 10002 1 13 . 1 1 14 14 SER C C 14 172.626 172.626 172.783 -0.157 17927 10003 1 13 . 1 1 14 14 SER CA C 14 57.390 57.390 57.504 -0.114 17927 10004 1 13 . 1 1 14 14 SER CB C 14 64.518 64.518 65.558 -1.040 17927 10005 1 13 . 1 1 14 14 SER H H 14 7.616 7.616 8.072 -0.456 17927 10006 1 13 . 1 1 15 15 TYR N N 15 122.384 122.384 122.590 -0.206 17927 10007 1 13 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.866 0.340 17927 10008 1 13 . 1 1 15 15 TYR C C 15 172.543 172.543 173.006 -0.463 17927 10009 1 13 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.510 -0.564 17927 10010 1 13 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.206 1.021 17927 10011 1 13 . 1 1 15 15 TYR H H 15 8.558 8.558 9.144 -0.586 17927 10012 1 13 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.790 0.319 17927 10013 1 13 . 1 1 16 16 PRO C C 16 176.475 176.475 176.125 0.350 17927 10014 1 13 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.341 -0.360 17927 10015 1 13 . 1 1 16 16 PRO CB C 16 32.662 32.662 31.991 0.671 17927 10016 1 13 . 1 1 17 17 ASP N N 17 119.834 119.834 125.043 -5.209 17927 10017 1 13 . 1 1 17 17 ASP HA H 17 5.739 5.739 5.177 0.562 17927 10018 1 13 . 1 1 17 17 ASP C C 17 180.740 180.740 178.280 2.460 17927 10019 1 13 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.275 -1.558 17927 10020 1 13 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.196 -0.635 17927 10021 1 13 . 1 1 17 17 ASP H H 17 8.643 8.643 8.849 -0.206 17927 10022 1 13 . 1 1 18 18 ILE N N 18 118.340 118.340 122.264 -3.924 17927 10023 1 13 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.998 0.453 17927 10024 1 13 . 1 1 18 18 ILE C C 18 175.742 175.742 176.075 -0.333 17927 10025 1 13 . 1 1 18 18 ILE CA C 18 61.894 61.894 64.153 -2.259 17927 10026 1 13 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.310 0.930 17927 10027 1 13 . 1 1 18 18 ILE H H 18 8.450 8.450 8.188 0.262 17927 10028 1 13 . 1 1 19 19 ASN N N 19 119.377 119.377 116.509 2.868 17927 10029 1 13 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.703 0.312 17927 10030 1 13 . 1 1 19 19 ASN C C 19 175.892 175.892 175.860 0.032 17927 10031 1 13 . 1 1 19 19 ASN CA C 19 53.307 53.307 53.882 -0.575 17927 10032 1 13 . 1 1 19 19 ASN CB C 19 39.825 39.825 38.833 0.992 17927 10033 1 13 . 1 1 19 19 ASN H H 19 8.376 8.376 8.543 -0.167 17927 10034 1 13 . 1 1 20 20 GLY N N 20 109.535 109.535 108.564 0.971 17927 10035 1 13 . 1 1 20 20 GLY C C 20 174.285 174.285 173.544 0.741 17927 10036 1 13 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.709 0.084 17927 10037 1 13 . 1 1 20 20 GLY H H 20 8.539 8.539 8.235 0.304 17927 10038 1 13 . 1 1 21 21 LYS N N 21 124.675 124.675 121.005 3.670 17927 10039 1 13 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.594 -0.151 17927 10040 1 13 . 1 1 21 21 LYS C C 21 176.537 176.537 175.982 0.555 17927 10041 1 13 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.475 0.969 17927 10042 1 13 . 1 1 21 21 LYS CB C 21 32.754 32.754 33.223 -0.469 17927 10043 1 13 . 1 1 21 21 LYS H H 21 8.608 8.608 7.522 1.086 17927 10044 1 13 . 1 1 22 22 THR N N 22 120.666 120.666 124.266 -3.600 17927 10045 1 13 . 1 1 22 22 THR HA H 22 4.087 4.087 4.328 -0.241 17927 10046 1 13 . 1 1 22 22 THR C C 22 174.431 174.431 174.174 0.257 17927 10047 1 13 . 1 1 22 22 THR CA C 22 64.292 64.292 64.014 0.278 17927 10048 1 13 . 1 1 22 22 THR CB C 22 69.069 69.069 68.204 0.865 17927 10049 1 13 . 1 1 22 22 THR H H 22 8.595 8.595 8.813 -0.218 17927 10050 1 13 . 1 1 23 23 VAL N N 23 131.207 131.207 130.538 0.669 17927 10051 1 13 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.237 -0.045 17927 10052 1 13 . 1 1 23 23 VAL C C 23 174.244 174.244 174.682 -0.438 17927 10053 1 13 . 1 1 23 23 VAL CA C 23 62.456 62.456 61.556 0.900 17927 10054 1 13 . 1 1 23 23 VAL CB C 23 33.791 33.791 33.373 0.418 17927 10055 1 13 . 1 1 23 23 VAL H H 23 8.937 8.937 9.031 -0.094 17927 10056 1 13 . 1 1 24 24 SER N N 24 120.787 120.787 121.796 -1.009 17927 10057 1 13 . 1 1 24 24 SER HA H 24 5.407 5.407 5.298 0.109 17927 10058 1 13 . 1 1 24 24 SER C C 24 176.169 176.169 173.699 2.470 17927 10059 1 13 . 1 1 24 24 SER CA C 24 55.135 55.135 55.755 -0.620 17927 10060 1 13 . 1 1 24 24 SER CB C 24 65.646 65.646 66.586 -0.940 17927 10061 1 13 . 1 1 24 24 SER H H 24 8.554 8.554 9.528 -0.974 17927 10062 1 13 . 1 1 25 25 LEU N N 25 124.332 124.332 121.035 3.297 17927 10063 1 13 . 1 1 25 25 LEU HA H 25 3.687 3.687 4.270 -0.583 17927 10064 1 13 . 1 1 25 25 LEU C C 25 179.364 179.364 175.426 3.938 17927 10065 1 13 . 1 1 25 25 LEU CA C 25 58.217 58.217 53.348 4.869 17927 10066 1 13 . 1 1 25 25 LEU CB C 25 40.538 40.538 39.702 0.836 17927 10067 1 13 . 1 1 25 25 LEU H H 25 7.811 7.811 8.579 -0.768 17927 10068 1 13 . 1 1 26 26 ALA N N 26 119.799 119.799 122.249 -2.450 17927 10069 1 13 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.445 -0.452 17927 10070 1 13 . 1 1 26 26 ALA C C 26 179.719 179.719 177.424 2.295 17927 10071 1 13 . 1 1 26 26 ALA CA C 26 54.663 54.663 53.272 1.391 17927 10072 1 13 . 1 1 26 26 ALA CB C 26 18.323 18.323 20.339 -2.016 17927 10073 1 13 . 1 1 26 26 ALA H H 26 8.099 8.099 7.181 0.918 17927 10074 1 13 . 1 1 27 27 ASP N N 27 116.553 116.553 118.161 -1.608 17927 10075 1 13 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.444 0.029 17927 10076 1 13 . 1 1 27 27 ASP C C 27 176.915 176.915 177.717 -0.802 17927 10077 1 13 . 1 1 27 27 ASP CA C 27 56.251 56.251 55.986 0.265 17927 10078 1 13 . 1 1 27 27 ASP CB C 27 40.788 40.788 41.217 -0.429 17927 10079 1 13 . 1 1 27 27 ASP H H 27 7.572 7.572 7.740 -0.168 17927 10080 1 13 . 1 1 28 28 LEU N N 28 118.950 118.950 119.911 -0.961 17927 10081 1 13 . 1 1 28 28 LEU HA H 28 4.233 4.233 3.902 0.331 17927 10082 1 13 . 1 1 28 28 LEU C C 28 175.542 175.542 176.576 -1.034 17927 10083 1 13 . 1 1 28 28 LEU CA C 28 53.706 53.706 55.141 -1.435 17927 10084 1 13 . 1 1 28 28 LEU CB C 28 41.049 41.049 41.866 -0.817 17927 10085 1 13 . 1 1 28 28 LEU H H 28 7.363 7.363 7.348 0.015 17927 10086 1 13 . 1 1 29 29 LYS N N 29 118.429 118.429 119.168 -0.739 17927 10087 1 13 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.134 0.218 17927 10088 1 13 . 1 1 29 29 LYS C C 29 178.063 178.063 177.186 0.877 17927 10089 1 13 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.428 0.348 17927 10090 1 13 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.282 1.158 17927 10091 1 13 . 1 1 29 29 LYS H H 29 6.780 6.780 7.455 -0.675 17927 10092 1 13 . 1 1 30 30 GLY N N 30 112.426 112.426 114.289 -1.863 17927 10093 1 13 . 1 1 30 30 GLY C C 30 173.801 173.801 172.766 1.035 17927 10094 1 13 . 1 1 30 30 GLY CA C 30 44.611 44.611 44.943 -0.332 17927 10095 1 13 . 1 1 30 30 GLY H H 30 9.398 9.398 9.132 0.266 17927 10096 1 13 . 1 1 31 31 LYS N N 31 119.295 119.295 119.806 -0.511 17927 10097 1 13 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.740 -0.588 17927 10098 1 13 . 1 1 31 31 LYS C C 31 173.862 173.862 176.056 -2.194 17927 10099 1 13 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.661 0.527 17927 10100 1 13 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.651 1.317 17927 10101 1 13 . 1 1 31 31 LYS H H 31 7.496 7.496 7.276 0.220 17927 10102 1 13 . 1 1 32 32 TYR N N 32 116.984 116.984 123.552 -6.568 17927 10103 1 13 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.445 -0.288 17927 10104 1 13 . 1 1 32 32 TYR C C 32 175.226 175.226 175.477 -0.251 17927 10105 1 13 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.538 0.052 17927 10106 1 13 . 1 1 32 32 TYR CB C 32 39.121 39.121 38.908 0.213 17927 10107 1 13 . 1 1 32 32 TYR H H 32 7.521 7.521 8.245 -0.724 17927 10108 1 13 . 1 1 33 33 ILE N N 33 118.052 118.052 120.238 -2.186 17927 10109 1 13 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.405 0.502 17927 10110 1 13 . 1 1 33 33 ILE C C 33 174.308 174.308 174.332 -0.024 17927 10111 1 13 . 1 1 33 33 ILE CA C 33 60.702 60.702 58.971 1.731 17927 10112 1 13 . 1 1 33 33 ILE CB C 33 41.616 41.616 40.121 1.495 17927 10113 1 13 . 1 1 33 33 ILE H H 33 8.467 8.467 8.733 -0.266 17927 10114 1 13 . 1 1 34 34 TYR N N 34 130.242 130.242 128.828 1.414 17927 10115 1 13 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.120 0.406 17927 10116 1 13 . 1 1 34 34 TYR C C 34 174.245 174.245 173.360 0.885 17927 10117 1 13 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.600 0.558 17927 10118 1 13 . 1 1 34 34 TYR CB C 34 40.133 40.133 40.929 -0.796 17927 10119 1 13 . 1 1 34 34 TYR H H 34 8.905 8.905 9.340 -0.435 17927 10120 1 13 . 1 1 35 35 ILE N N 35 128.697 128.697 129.145 -0.448 17927 10121 1 13 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.022 0.320 17927 10122 1 13 . 1 1 35 35 ILE C C 35 174.520 174.520 173.838 0.682 17927 10123 1 13 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.920 -0.171 17927 10124 1 13 . 1 1 35 35 ILE CB C 35 40.899 40.899 39.514 1.385 17927 10125 1 13 . 1 1 35 35 ILE H H 35 9.445 9.445 8.511 0.934 17927 10126 1 13 . 1 1 36 36 ASP N N 36 123.675 123.675 127.637 -3.962 17927 10127 1 13 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.286 -0.438 17927 10128 1 13 . 1 1 36 36 ASP C C 36 174.385 174.385 175.467 -1.082 17927 10129 1 13 . 1 1 36 36 ASP CA C 36 51.294 51.294 52.149 -0.855 17927 10130 1 13 . 1 1 36 36 ASP CB C 36 41.778 41.778 45.164 -3.386 17927 10131 1 13 . 1 1 36 36 ASP H H 36 8.875 8.875 8.448 0.427 17927 10132 1 13 . 1 1 37 37 VAL N N 37 127.159 127.159 126.717 0.442 17927 10133 1 13 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.642 0.317 17927 10134 1 13 . 1 1 37 37 VAL C C 37 175.046 175.046 175.690 -0.644 17927 10135 1 13 . 1 1 37 37 VAL CA C 37 62.245 62.245 62.413 -0.168 17927 10136 1 13 . 1 1 37 37 VAL CB C 37 31.807 31.807 31.675 0.132 17927 10137 1 13 . 1 1 37 37 VAL H H 37 8.603 8.603 8.050 0.553 17927 10138 1 13 . 1 1 38 38 TRP N N 38 124.161 124.161 126.634 -2.473 17927 10139 1 13 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.164 0.073 17927 10140 1 13 . 1 1 38 38 TRP C C 38 171.995 171.995 173.585 -1.590 17927 10141 1 13 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.343 1.864 17927 10142 1 13 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.874 2.313 17927 10143 1 13 . 1 1 38 38 TRP H H 38 8.562 8.562 8.546 0.016 17927 10144 1 13 . 1 1 39 39 ALA N N 39 116.252 116.252 125.754 -9.502 17927 10145 1 13 . 1 1 39 39 ALA HA H 39 3.678 3.678 4.252 -0.574 17927 10146 1 13 . 1 1 39 39 ALA C C 39 178.664 178.664 175.889 2.775 17927 10147 1 13 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.638 0.828 17927 10148 1 13 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.245 1.096 17927 10149 1 13 . 1 1 39 39 ALA H H 39 6.757 6.757 8.142 -1.385 17927 10150 1 13 . 1 1 40 40 THR N N 40 114.321 114.321 114.482 -0.161 17927 10151 1 13 . 1 1 40 40 THR HA H 40 3.907 3.907 4.671 -0.764 17927 10152 1 13 . 1 1 40 40 THR C C 40 175.885 175.885 175.101 0.784 17927 10153 1 13 . 1 1 40 40 THR CA C 40 65.447 65.447 62.628 2.819 17927 10154 1 13 . 1 1 40 40 THR CB C 40 70.106 70.106 70.105 0.001 17927 10155 1 13 . 1 1 40 40 THR H H 40 9.639 9.639 8.843 0.796 17927 10156 1 13 . 1 1 41 41 TRP N N 41 114.483 114.483 119.780 -5.297 17927 10157 1 13 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.754 -0.191 17927 10158 1 13 . 1 1 41 41 TRP C C 41 176.189 176.189 176.210 -0.021 17927 10159 1 13 . 1 1 41 41 TRP CA C 41 54.698 54.698 55.810 -1.112 17927 10160 1 13 . 1 1 41 41 TRP CB C 41 29.977 29.977 27.791 2.186 17927 10161 1 13 . 1 1 41 41 TRP H H 41 6.401 6.401 7.561 -1.160 17927 10162 1 13 . 1 1 42 42 CYS N N 42 123.536 123.536 118.392 5.144 17927 10163 1 13 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.033 0.535 17927 10164 1 13 . 1 1 42 42 CYS C C 42 175.726 175.726 175.952 -0.226 17927 10165 1 13 . 1 1 42 42 CYS CA C 42 58.700 58.700 59.493 -0.793 17927 10166 1 13 . 1 1 42 42 CYS CB C 42 27.121 27.121 28.907 -1.786 17927 10167 1 13 . 1 1 42 42 CYS H H 42 6.883 6.883 7.071 -0.188 17927 10168 1 13 . 1 1 43 43 GLY N N 43 120.977 120.977 107.958 13.019 17927 10169 1 13 . 1 1 43 43 GLY CA C 43 49.204 49.204 45.146 4.058 17927 10170 1 13 . 1 1 43 43 GLY H H 43 9.653 9.653 8.054 1.599 17927 10171 1 13 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.348 0.139 17927 10172 1 13 . 1 1 44 44 PRO C C 44 179.956 179.956 178.274 1.682 17927 10173 1 13 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.146 0.496 17927 10174 1 13 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.615 0.963 17927 10175 1 13 . 1 1 45 45 CYS N N 45 113.925 113.925 116.540 -2.615 17927 10176 1 13 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.331 -0.018 17927 10177 1 13 . 1 1 45 45 CYS C C 45 178.325 178.325 176.981 1.344 17927 10178 1 13 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.170 2.221 17927 10179 1 13 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.622 0.883 17927 10180 1 13 . 1 1 45 45 CYS H H 45 7.676 7.676 7.708 -0.032 17927 10181 1 13 . 1 1 46 46 ARG N N 46 120.336 120.336 118.728 1.608 17927 10182 1 13 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.185 -0.116 17927 10183 1 13 . 1 1 46 46 ARG C C 46 180.446 180.446 178.610 1.836 17927 10184 1 13 . 1 1 46 46 ARG CA C 46 59.785 59.785 58.849 0.936 17927 10185 1 13 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.955 -0.087 17927 10186 1 13 . 1 1 46 46 ARG H H 46 8.109 8.109 8.116 -0.007 17927 10187 1 13 . 1 1 47 47 GLY N N 47 105.408 105.408 106.202 -0.794 17927 10188 1 13 . 1 1 47 47 GLY C C 47 175.258 175.258 174.863 0.395 17927 10189 1 13 . 1 1 47 47 GLY CA C 47 46.594 46.594 46.259 0.335 17927 10190 1 13 . 1 1 47 47 GLY H H 47 8.466 8.466 8.044 0.422 17927 10191 1 13 . 1 1 48 48 GLU N N 48 116.343 116.343 119.406 -3.063 17927 10192 1 13 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.474 0.051 17927 10193 1 13 . 1 1 48 48 GLU C C 48 176.535 176.535 178.115 -1.580 17927 10194 1 13 . 1 1 48 48 GLU CA C 48 55.792 55.792 56.239 -0.447 17927 10195 1 13 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.837 1.145 17927 10196 1 13 . 1 1 48 48 GLU H H 48 7.050 7.050 7.579 -0.529 17927 10197 1 13 . 1 1 49 49 LEU N N 49 118.652 118.652 121.344 -2.692 17927 10198 1 13 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.183 -0.031 17927 10199 1 13 . 1 1 49 49 LEU C C 49 176.832 176.832 176.430 0.402 17927 10200 1 13 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.566 -1.220 17927 10201 1 13 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.174 -0.678 17927 10202 1 13 . 1 1 49 49 LEU H H 49 7.385 7.385 7.227 0.158 17927 10203 1 13 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.141 0.112 17927 10204 1 13 . 1 1 50 50 PRO C C 50 179.744 179.744 178.130 1.614 17927 10205 1 13 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.214 0.345 17927 10206 1 13 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.869 -0.107 17927 10207 1 13 . 1 1 51 51 ALA N N 51 120.418 120.418 117.951 2.467 17927 10208 1 13 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.255 -0.110 17927 10209 1 13 . 1 1 51 51 ALA C C 51 180.329 180.329 179.677 0.652 17927 10210 1 13 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.475 -0.041 17927 10211 1 13 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.477 -0.107 17927 10212 1 13 . 1 1 51 51 ALA H H 51 7.731 7.731 7.857 -0.126 17927 10213 1 13 . 1 1 52 52 LEU N N 52 121.506 121.506 120.157 1.349 17927 10214 1 13 . 1 1 52 52 LEU HA H 52 3.988 3.988 4.082 -0.094 17927 10215 1 13 . 1 1 52 52 LEU C C 52 177.944 177.944 178.170 -0.226 17927 10216 1 13 . 1 1 52 52 LEU CA C 52 58.327 58.327 57.693 0.634 17927 10217 1 13 . 1 1 52 52 LEU CB C 52 42.382 42.382 42.226 0.156 17927 10218 1 13 . 1 1 52 52 LEU H H 52 8.355 8.355 7.690 0.665 17927 10219 1 13 . 1 1 53 53 LYS N N 53 119.732 119.732 119.347 0.385 17927 10220 1 13 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.827 0.076 17927 10221 1 13 . 1 1 53 53 LYS C C 53 179.030 179.030 179.046 -0.016 17927 10222 1 13 . 1 1 53 53 LYS CA C 53 59.846 59.846 60.225 -0.379 17927 10223 1 13 . 1 1 53 53 LYS CB C 53 32.211 32.211 32.154 0.057 17927 10224 1 13 . 1 1 53 53 LYS H H 53 8.148 8.148 8.344 -0.196 17927 10225 1 13 . 1 1 54 54 GLU N N 54 117.779 117.779 117.789 -0.010 17927 10226 1 13 . 1 1 54 54 GLU HA H 54 4.059 4.059 4.116 -0.057 17927 10227 1 13 . 1 1 54 54 GLU C C 54 179.646 179.646 178.817 0.829 17927 10228 1 13 . 1 1 54 54 GLU CA C 54 59.625 59.625 58.027 1.598 17927 10229 1 13 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.089 0.478 17927 10230 1 13 . 1 1 54 54 GLU H H 54 7.585 7.585 7.814 -0.229 17927 10231 1 13 . 1 1 55 55 LEU N N 55 120.581 120.581 120.905 -0.324 17927 10232 1 13 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.219 -0.026 17927 10233 1 13 . 1 1 55 55 LEU C C 55 178.557 178.557 178.561 -0.004 17927 10234 1 13 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.579 0.656 17927 10235 1 13 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.723 1.288 17927 10236 1 13 . 1 1 55 55 LEU H H 55 8.096 8.096 7.615 0.481 17927 10237 1 13 . 1 1 56 56 GLU N N 56 118.023 118.023 119.479 -1.456 17927 10238 1 13 . 1 1 56 56 GLU HA H 56 3.177 3.177 3.142 0.035 17927 10239 1 13 . 1 1 56 56 GLU C C 56 179.650 179.650 178.419 1.231 17927 10240 1 13 . 1 1 56 56 GLU CA C 56 58.871 58.871 58.611 0.260 17927 10241 1 13 . 1 1 56 56 GLU CB C 56 26.985 26.985 28.765 -1.780 17927 10242 1 13 . 1 1 56 56 GLU H H 56 8.181 8.181 7.606 0.575 17927 10243 1 13 . 1 1 57 57 GLU N N 57 117.828 117.828 118.377 -0.549 17927 10244 1 13 . 1 1 57 57 GLU HA H 57 4.104 4.104 3.925 0.179 17927 10245 1 13 . 1 1 57 57 GLU C C 57 179.700 179.700 179.398 0.302 17927 10246 1 13 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.914 0.113 17927 10247 1 13 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.086 0.579 17927 10248 1 13 . 1 1 57 57 GLU H H 57 7.762 7.762 7.672 0.090 17927 10249 1 13 . 1 1 58 58 LYS N N 58 120.896 120.896 120.299 0.597 17927 10250 1 13 . 1 1 58 58 LYS HA H 58 3.979 3.979 3.941 0.039 17927 10251 1 13 . 1 1 58 58 LYS C C 58 178.715 178.715 178.475 0.240 17927 10252 1 13 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.973 0.105 17927 10253 1 13 . 1 1 58 58 LYS CB C 58 32.980 32.980 32.436 0.544 17927 10254 1 13 . 1 1 58 58 LYS H H 58 8.410 8.410 7.768 0.642 17927 10255 1 13 . 1 1 59 59 TYR N N 59 113.713 113.713 116.115 -2.402 17927 10256 1 13 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.531 -0.219 17927 10257 1 13 . 1 1 59 59 TYR C C 59 175.025 175.025 174.324 0.701 17927 10258 1 13 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.359 2.614 17927 10259 1 13 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.545 -1.111 17927 10260 1 13 . 1 1 59 59 TYR H H 59 8.102 8.102 7.565 0.537 17927 10261 1 13 . 1 1 60 60 ALA N N 60 126.637 126.637 122.818 3.819 17927 10262 1 13 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.342 0.076 17927 10263 1 13 . 1 1 60 60 ALA C C 60 179.208 179.208 178.218 0.990 17927 10264 1 13 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.323 1.211 17927 10265 1 13 . 1 1 60 60 ALA CB C 60 18.589 18.589 18.564 0.025 17927 10266 1 13 . 1 1 60 60 ALA H H 60 7.201 7.201 7.361 -0.160 17927 10267 1 13 . 1 1 61 61 GLY N N 61 111.816 111.816 111.394 0.422 17927 10268 1 13 . 1 1 61 61 GLY C C 61 174.698 174.698 174.643 0.055 17927 10269 1 13 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.390 0.514 17927 10270 1 13 . 1 1 61 61 GLY H H 61 9.184 9.184 8.757 0.427 17927 10271 1 13 . 1 1 62 62 LYS N N 62 118.497 118.497 120.373 -1.876 17927 10272 1 13 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.421 0.458 17927 10273 1 13 . 1 1 62 62 LYS C C 62 179.019 179.019 175.813 3.206 17927 10274 1 13 . 1 1 62 62 LYS CA C 62 53.988 53.988 54.658 -0.670 17927 10275 1 13 . 1 1 62 62 LYS CB C 62 33.840 33.840 33.253 0.587 17927 10276 1 13 . 1 1 62 62 LYS H H 62 8.019 8.019 7.715 0.304 17927 10277 1 13 . 1 1 63 63 ASP N N 63 122.982 122.982 120.586 2.396 17927 10278 1 13 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.805 -0.278 17927 10279 1 13 . 1 1 63 63 ASP C C 63 174.065 174.065 174.622 -0.557 17927 10280 1 13 . 1 1 63 63 ASP CA C 63 55.055 55.055 53.534 1.521 17927 10281 1 13 . 1 1 63 63 ASP CB C 63 38.582 38.582 40.140 -1.558 17927 10282 1 13 . 1 1 63 63 ASP H H 63 8.709 8.709 8.613 0.096 17927 10283 1 13 . 1 1 64 64 ILE N N 64 122.219 122.219 117.667 4.552 17927 10284 1 13 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.578 0.029 17927 10285 1 13 . 1 1 64 64 ILE C C 64 174.627 174.627 173.599 1.028 17927 10286 1 13 . 1 1 64 64 ILE CA C 64 59.712 59.712 59.617 0.095 17927 10287 1 13 . 1 1 64 64 ILE CB C 64 42.133 42.133 41.827 0.306 17927 10288 1 13 . 1 1 64 64 ILE H H 64 8.678 8.678 7.234 1.444 17927 10289 1 13 . 1 1 65 65 HIS N N 65 125.584 125.584 120.312 5.272 17927 10290 1 13 . 1 1 65 65 HIS HA H 65 5.043 5.043 5.004 0.039 17927 10291 1 13 . 1 1 65 65 HIS C C 65 174.153 174.153 173.907 0.246 17927 10292 1 13 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.846 0.113 17927 10293 1 13 . 1 1 65 65 HIS CB C 65 34.156 34.156 31.805 2.351 17927 10294 1 13 . 1 1 65 65 HIS H H 65 9.204 9.204 8.309 0.895 17927 10295 1 13 . 1 1 66 66 PHE N N 66 123.244 123.244 125.239 -1.995 17927 10296 1 13 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.839 0.371 17927 10297 1 13 . 1 1 66 66 PHE C C 66 175.463 175.463 174.717 0.746 17927 10298 1 13 . 1 1 66 66 PHE CA C 66 58.088 58.088 58.115 -0.027 17927 10299 1 13 . 1 1 66 66 PHE CB C 66 39.637 39.637 38.547 1.090 17927 10300 1 13 . 1 1 66 66 PHE H H 66 9.262 9.262 8.949 0.313 17927 10301 1 13 . 1 1 67 67 VAL N N 67 126.201 126.201 126.277 -0.076 17927 10302 1 13 . 1 1 67 67 VAL HA H 67 4.834 4.834 5.028 -0.194 17927 10303 1 13 . 1 1 67 67 VAL C C 67 174.364 174.364 175.743 -1.379 17927 10304 1 13 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.552 0.172 17927 10305 1 13 . 1 1 67 67 VAL CB C 67 34.893 34.893 32.080 2.813 17927 10306 1 13 . 1 1 67 67 VAL H H 67 8.843 8.843 9.199 -0.356 17927 10307 1 13 . 1 1 68 68 SER N N 68 124.528 124.528 124.015 0.513 17927 10308 1 13 . 1 1 68 68 SER HA H 68 5.585 5.585 5.226 0.359 17927 10309 1 13 . 1 1 68 68 SER C C 68 172.858 172.858 172.988 -0.130 17927 10310 1 13 . 1 1 68 68 SER CA C 68 57.282 57.282 58.575 -1.293 17927 10311 1 13 . 1 1 68 68 SER CB C 68 65.032 65.032 64.069 0.963 17927 10312 1 13 . 1 1 68 68 SER H H 68 9.243 9.243 9.100 0.143 17927 10313 1 13 . 1 1 69 69 LEU N N 69 126.695 126.695 125.720 0.975 17927 10314 1 13 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.285 -0.768 17927 10315 1 13 . 1 1 69 69 LEU C C 69 174.652 174.652 175.376 -0.724 17927 10316 1 13 . 1 1 69 69 LEU CA C 69 52.827 52.827 54.071 -1.244 17927 10317 1 13 . 1 1 69 69 LEU CB C 69 43.895 43.895 45.831 -1.936 17927 10318 1 13 . 1 1 69 69 LEU H H 69 9.360 9.360 9.034 0.326 17927 10319 1 13 . 1 1 70 70 SER N N 70 116.379 116.379 121.528 -5.149 17927 10320 1 13 . 1 1 70 70 SER HA H 70 4.905 4.905 5.173 -0.268 17927 10321 1 13 . 1 1 70 70 SER C C 70 176.307 176.307 175.062 1.245 17927 10322 1 13 . 1 1 70 70 SER CA C 70 55.213 55.213 55.817 -0.604 17927 10323 1 13 . 1 1 70 70 SER CB C 70 63.519 63.519 63.843 -0.324 17927 10324 1 13 . 1 1 70 70 SER H H 70 7.981 7.981 9.002 -1.021 17927 10325 1 13 . 1 1 71 71 CYS N N 71 124.670 124.670 127.997 -3.327 17927 10326 1 13 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.445 0.513 17927 10327 1 13 . 1 1 71 71 CYS C C 71 173.996 173.996 174.436 -0.440 17927 10328 1 13 . 1 1 71 71 CYS CA C 71 55.483 55.483 58.233 -2.750 17927 10329 1 13 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.271 0.841 17927 10330 1 13 . 1 1 71 71 CYS H H 71 8.609 8.609 8.982 -0.373 17927 10331 1 13 . 1 1 72 72 ASP N N 72 122.398 122.398 123.349 -0.951 17927 10332 1 13 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.654 -0.362 17927 10333 1 13 . 1 1 72 72 ASP C C 72 176.653 176.653 176.088 0.565 17927 10334 1 13 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.730 1.052 17927 10335 1 13 . 1 1 72 72 ASP CB C 72 41.526 41.526 40.839 0.687 17927 10336 1 13 . 1 1 72 72 ASP H H 72 8.557 8.557 7.430 1.127 17927 10337 1 13 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.053 0.012 17927 10338 1 13 . 1 1 73 73 LYS C C 73 176.545 176.545 176.292 0.253 17927 10339 1 13 . 1 1 73 73 LYS CA C 73 58.458 58.458 58.545 -0.087 17927 10340 1 13 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.431 0.210 17927 10341 1 13 . 1 1 74 74 ASN N N 74 117.616 117.616 118.755 -1.139 17927 10342 1 13 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.735 0.170 17927 10343 1 13 . 1 1 74 74 ASN C C 74 174.894 174.894 175.377 -0.483 17927 10344 1 13 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.848 -1.327 17927 10345 1 13 . 1 1 74 74 ASN CB C 74 38.109 38.109 37.011 1.098 17927 10346 1 13 . 1 1 74 74 ASN H H 74 8.625 8.625 8.375 0.250 17927 10347 1 13 . 1 1 75 75 LYS N N 75 126.797 126.797 123.336 3.461 17927 10348 1 13 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.804 -0.381 17927 10349 1 13 . 1 1 75 75 LYS C C 75 178.058 178.058 177.884 0.174 17927 10350 1 13 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.342 -0.169 17927 10351 1 13 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.345 0.946 17927 10352 1 13 . 1 1 75 75 LYS H H 75 8.588 8.588 8.090 0.498 17927 10353 1 13 . 1 1 76 76 LYS N N 76 117.875 117.875 119.777 -1.902 17927 10354 1 13 . 1 1 76 76 LYS HA H 76 4.200 4.200 3.947 0.253 17927 10355 1 13 . 1 1 76 76 LYS C C 76 178.791 178.791 178.375 0.416 17927 10356 1 13 . 1 1 76 76 LYS CA C 76 58.608 58.608 60.078 -1.470 17927 10357 1 13 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.901 -0.411 17927 10358 1 13 . 1 1 76 76 LYS H H 76 8.041 8.041 8.509 -0.468 17927 10359 1 13 . 1 1 77 77 ALA N N 77 121.567 121.567 121.314 0.253 17927 10360 1 13 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.141 -0.018 17927 10361 1 13 . 1 1 77 77 ALA C C 77 181.191 181.191 179.617 1.574 17927 10362 1 13 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.680 0.277 17927 10363 1 13 . 1 1 77 77 ALA CB C 77 17.759 17.759 17.839 -0.080 17927 10364 1 13 . 1 1 77 77 ALA H H 77 7.366 7.366 8.368 -1.002 17927 10365 1 13 . 1 1 78 78 TRP N N 78 119.497 119.497 120.103 -0.606 17927 10366 1 13 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.211 -0.134 17927 10367 1 13 . 1 1 78 78 TRP C C 78 175.942 175.942 177.353 -1.411 17927 10368 1 13 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.129 2.632 17927 10369 1 13 . 1 1 78 78 TRP CB C 78 27.272 27.272 29.980 -2.708 17927 10370 1 13 . 1 1 78 78 TRP H H 78 7.187 7.187 8.007 -0.820 17927 10371 1 13 . 1 1 79 79 GLU N N 79 118.771 118.771 118.057 0.714 17927 10372 1 13 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.571 -0.557 17927 10373 1 13 . 1 1 79 79 GLU C C 79 179.863 179.863 179.261 0.602 17927 10374 1 13 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.340 -0.230 17927 10375 1 13 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.381 1.839 17927 10376 1 13 . 1 1 79 79 GLU H H 79 8.813 8.813 8.685 0.128 17927 10377 1 13 . 1 1 80 80 ASN N N 80 115.964 115.964 118.254 -2.290 17927 10378 1 13 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.352 -0.013 17927 10379 1 13 . 1 1 80 80 ASN C C 80 176.749 176.749 177.622 -0.873 17927 10380 1 13 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.723 0.312 17927 10381 1 13 . 1 1 80 80 ASN CB C 80 38.489 38.489 37.901 0.588 17927 10382 1 13 . 1 1 80 80 ASN H H 80 8.491 8.491 7.856 0.635 17927 10383 1 13 . 1 1 81 81 MET N N 81 119.670 119.670 120.078 -0.408 17927 10384 1 13 . 1 1 81 81 MET HA H 81 4.149 4.149 4.178 -0.029 17927 10385 1 13 . 1 1 81 81 MET C C 81 177.933 177.933 178.057 -0.124 17927 10386 1 13 . 1 1 81 81 MET CA C 81 60.276 60.276 58.890 1.386 17927 10387 1 13 . 1 1 81 81 MET CB C 81 32.518 32.518 32.834 -0.316 17927 10388 1 13 . 1 1 81 81 MET H H 81 7.667 7.667 7.569 0.098 17927 10389 1 13 . 1 1 82 82 VAL N N 82 117.634 117.634 118.541 -0.907 17927 10390 1 13 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.575 -0.272 17927 10391 1 13 . 1 1 82 82 VAL C C 82 179.005 179.005 177.466 1.539 17927 10392 1 13 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.473 0.564 17927 10393 1 13 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.095 0.670 17927 10394 1 13 . 1 1 82 82 VAL H H 82 8.338 8.338 7.768 0.570 17927 10395 1 13 . 1 1 83 83 THR N N 83 110.519 110.519 114.437 -3.918 17927 10396 1 13 . 1 1 83 83 THR HA H 83 3.983 3.983 4.108 -0.125 17927 10397 1 13 . 1 1 83 83 THR C C 83 177.591 177.591 175.656 1.935 17927 10398 1 13 . 1 1 83 83 THR CA C 83 65.431 65.431 66.083 -0.652 17927 10399 1 13 . 1 1 83 83 THR CB C 83 69.156 69.156 68.674 0.482 17927 10400 1 13 . 1 1 83 83 THR H H 83 7.659 7.659 7.669 -0.010 17927 10401 1 13 . 1 1 84 84 LYS N N 84 123.927 123.927 119.846 4.081 17927 10402 1 13 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.194 -0.125 17927 10403 1 13 . 1 1 84 84 LYS C C 84 178.582 178.582 177.481 1.101 17927 10404 1 13 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.148 1.729 17927 10405 1 13 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.965 -0.642 17927 10406 1 13 . 1 1 84 84 LYS H H 84 8.665 8.665 7.599 1.066 17927 10407 1 13 . 1 1 85 85 ASP N N 85 116.280 116.280 117.962 -1.682 17927 10408 1 13 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.573 0.177 17927 10409 1 13 . 1 1 85 85 ASP C C 85 175.086 175.086 175.127 -0.041 17927 10410 1 13 . 1 1 85 85 ASP CA C 85 54.693 54.693 55.644 -0.951 17927 10411 1 13 . 1 1 85 85 ASP CB C 85 39.685 39.685 42.120 -2.435 17927 10412 1 13 . 1 1 85 85 ASP H H 85 8.179 8.179 8.347 -0.168 17927 10413 1 13 . 1 1 86 86 GLN N N 86 116.258 116.258 115.927 0.331 17927 10414 1 13 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.875 0.033 17927 10415 1 13 . 1 1 86 86 GLN C C 86 175.659 175.659 174.370 1.289 17927 10416 1 13 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.419 -0.248 17927 10417 1 13 . 1 1 86 86 GLN CB C 86 26.290 26.290 25.761 0.529 17927 10418 1 13 . 1 1 86 86 GLN H H 86 7.431 7.431 7.786 -0.355 17927 10419 1 13 . 1 1 87 87 LEU N N 87 117.031 117.031 121.922 -4.891 17927 10420 1 13 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.420 -0.330 17927 10421 1 13 . 1 1 87 87 LEU C C 87 178.225 178.225 176.216 2.009 17927 10422 1 13 . 1 1 87 87 LEU CA C 87 55.932 55.932 54.544 1.388 17927 10423 1 13 . 1 1 87 87 LEU CB C 87 41.202 41.202 42.811 -1.609 17927 10424 1 13 . 1 1 87 87 LEU H H 87 7.736 7.736 7.682 0.054 17927 10425 1 13 . 1 1 88 88 LYS N N 88 122.367 122.367 121.478 0.889 17927 10426 1 13 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.672 -0.036 17927 10427 1 13 . 1 1 88 88 LYS C C 88 177.538 177.538 176.232 1.306 17927 10428 1 13 . 1 1 88 88 LYS CA C 88 54.930 54.930 54.743 0.187 17927 10429 1 13 . 1 1 88 88 LYS CB C 88 33.316 33.316 33.926 -0.610 17927 10430 1 13 . 1 1 88 88 LYS H H 88 8.496 8.496 8.433 0.063 17927 10431 1 13 . 1 1 89 89 GLY N N 89 108.452 108.452 106.100 2.352 17927 10432 1 13 . 1 1 89 89 GLY C C 89 173.781 173.781 173.774 0.007 17927 10433 1 13 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.491 0.867 17927 10434 1 13 . 1 1 89 89 GLY H H 89 8.497 8.497 8.293 0.204 17927 10435 1 13 . 1 1 90 90 ILE N N 90 123.295 123.295 122.437 0.858 17927 10436 1 13 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.200 0.171 17927 10437 1 13 . 1 1 90 90 ILE C C 90 175.606 175.606 174.583 1.023 17927 10438 1 13 . 1 1 90 90 ILE CA C 90 62.001 62.001 61.063 0.938 17927 10439 1 13 . 1 1 90 90 ILE CB C 90 38.036 38.036 38.529 -0.493 17927 10440 1 13 . 1 1 90 90 ILE H H 90 8.728 8.728 8.249 0.479 17927 10441 1 13 . 1 1 91 91 GLN N N 91 128.632 128.632 127.038 1.594 17927 10442 1 13 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.318 0.448 17927 10443 1 13 . 1 1 91 91 GLN C C 91 174.618 174.618 174.216 0.402 17927 10444 1 13 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.667 1.183 17927 10445 1 13 . 1 1 91 91 GLN CB C 91 28.341 28.341 29.184 -0.843 17927 10446 1 13 . 1 1 91 91 GLN H H 91 8.762 8.762 8.397 0.365 17927 10447 1 13 . 1 1 92 92 LEU N N 92 120.830 120.830 124.299 -3.469 17927 10448 1 13 . 1 1 92 92 LEU HA H 92 5.580 5.580 5.059 0.521 17927 10449 1 13 . 1 1 92 92 LEU C C 92 176.828 176.828 176.094 0.734 17927 10450 1 13 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.962 -1.161 17927 10451 1 13 . 1 1 92 92 LEU CB C 92 44.210 44.210 44.274 -0.064 17927 10452 1 13 . 1 1 92 92 LEU H H 92 9.011 9.011 9.070 -0.059 17927 10453 1 13 . 1 1 93 93 HIS N N 93 121.481 121.481 122.688 -1.207 17927 10454 1 13 . 1 1 93 93 HIS HA H 93 3.931 3.931 5.070 -1.139 17927 10455 1 13 . 1 1 93 93 HIS C C 93 173.590 173.590 173.341 0.249 17927 10456 1 13 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.641 0.942 17927 10457 1 13 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.614 -1.364 17927 10458 1 13 . 1 1 93 93 HIS H H 93 8.038 8.038 9.120 -1.082 17927 10459 1 13 . 1 1 94 94 MET N N 94 121.881 121.881 126.343 -4.462 17927 10460 1 13 . 1 1 94 94 MET HA H 94 3.866 3.866 4.410 -0.544 17927 10461 1 13 . 1 1 94 94 MET C C 94 177.035 177.035 176.457 0.578 17927 10462 1 13 . 1 1 94 94 MET CA C 94 55.189 55.189 57.627 -2.438 17927 10463 1 13 . 1 1 94 94 MET CB C 94 33.993 33.993 34.065 -0.072 17927 10464 1 13 . 1 1 94 94 MET H H 94 8.039 8.039 8.490 -0.451 17927 10465 1 13 . 1 1 95 95 GLY N N 95 104.041 104.041 108.544 -4.503 17927 10466 1 13 . 1 1 95 95 GLY C C 95 174.251 174.251 174.215 0.036 17927 10467 1 13 . 1 1 95 95 GLY CA C 95 46.580 46.580 44.685 1.895 17927 10468 1 13 . 1 1 95 95 GLY H H 95 5.666 5.666 7.470 -1.804 17927 10469 1 13 . 1 1 96 96 THR N N 96 114.114 114.114 109.676 4.438 17927 10470 1 13 . 1 1 96 96 THR HA H 96 4.211 4.211 3.839 0.372 17927 10471 1 13 . 1 1 96 96 THR C C 96 175.122 175.122 173.922 1.200 17927 10472 1 13 . 1 1 96 96 THR CA C 96 61.339 61.339 63.657 -2.318 17927 10473 1 13 . 1 1 96 96 THR CB C 96 68.615 68.615 67.894 0.720 17927 10474 1 13 . 1 1 96 96 THR H H 96 8.517 8.517 8.463 0.054 17927 10475 1 13 . 1 1 97 97 ASP N N 97 121.892 121.892 120.364 1.528 17927 10476 1 13 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.923 -0.338 17927 10477 1 13 . 1 1 97 97 ASP C C 97 178.241 178.241 176.089 2.152 17927 10478 1 13 . 1 1 97 97 ASP CA C 97 55.800 55.800 53.546 2.254 17927 10479 1 13 . 1 1 97 97 ASP CB C 97 43.129 43.129 41.597 1.532 17927 10480 1 13 . 1 1 97 97 ASP H H 97 7.563 7.563 8.218 -0.655 17927 10481 1 13 . 1 1 98 98 ARG N N 98 127.508 127.508 120.799 6.709 17927 10482 1 13 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.401 -0.009 17927 10483 1 13 . 1 1 98 98 ARG C C 98 176.724 176.724 177.271 -0.547 17927 10484 1 13 . 1 1 98 98 ARG CA C 98 55.939 55.939 57.686 -1.747 17927 10485 1 13 . 1 1 98 98 ARG CB C 98 30.291 30.291 29.123 1.168 17927 10486 1 13 . 1 1 98 98 ARG H H 98 9.225 9.225 8.503 0.722 17927 10487 1 13 . 1 1 99 99 THR N N 99 116.384 116.384 116.656 -0.272 17927 10488 1 13 . 1 1 99 99 THR HA H 99 3.987 3.987 4.037 -0.050 17927 10489 1 13 . 1 1 99 99 THR C C 99 176.969 176.969 175.900 1.069 17927 10490 1 13 . 1 1 99 99 THR CA C 99 67.714 67.714 65.979 1.735 17927 10491 1 13 . 1 1 99 99 THR CB C 99 68.777 68.777 68.314 0.463 17927 10492 1 13 . 1 1 99 99 THR H H 99 8.382 8.382 8.027 0.355 17927 10493 1 13 . 1 1 100 100 PHE N N 100 123.232 123.232 121.013 2.219 17927 10494 1 13 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.293 -0.120 17927 10495 1 13 . 1 1 100 100 PHE C C 100 177.010 177.010 176.622 0.388 17927 10496 1 13 . 1 1 100 100 PHE CA C 100 61.923 61.923 60.413 1.510 17927 10497 1 13 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.163 1.599 17927 10498 1 13 . 1 1 100 100 PHE H H 100 7.998 7.998 7.674 0.324 17927 10499 1 13 . 1 1 101 101 MET N N 101 115.968 115.968 119.029 -3.061 17927 10500 1 13 . 1 1 101 101 MET HA H 101 3.975 3.975 3.951 0.024 17927 10501 1 13 . 1 1 101 101 MET C C 101 178.763 178.763 178.024 0.739 17927 10502 1 13 . 1 1 101 101 MET CA C 101 58.552 58.552 59.584 -1.032 17927 10503 1 13 . 1 1 101 101 MET CB C 101 32.593 32.593 32.147 0.446 17927 10504 1 13 . 1 1 101 101 MET H H 101 7.828 7.828 7.660 0.168 17927 10505 1 13 . 1 1 102 102 ASP N N 102 117.553 117.553 119.076 -1.523 17927 10506 1 13 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.409 0.113 17927 10507 1 13 . 1 1 102 102 ASP C C 102 179.503 179.503 178.834 0.669 17927 10508 1 13 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.466 -0.576 17927 10509 1 13 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.569 -0.643 17927 10510 1 13 . 1 1 102 102 ASP H H 102 8.828 8.828 7.788 1.040 17927 10511 1 13 . 1 1 103 103 ALA N N 103 122.984 122.984 122.057 0.927 17927 10512 1 13 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.042 -0.056 17927 10513 1 13 . 1 1 103 103 ALA C C 103 178.782 178.782 178.241 0.541 17927 10514 1 13 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.386 0.708 17927 10515 1 13 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.366 0.197 17927 10516 1 13 . 1 1 103 103 ALA H H 103 7.567 7.567 7.471 0.096 17927 10517 1 13 . 1 1 104 104 TYR N N 104 112.159 112.159 114.491 -2.332 17927 10518 1 13 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.638 -0.414 17927 10519 1 13 . 1 1 104 104 TYR C C 104 173.821 173.821 174.322 -0.501 17927 10520 1 13 . 1 1 104 104 TYR CA C 104 58.498 58.498 57.535 0.963 17927 10521 1 13 . 1 1 104 104 TYR CB C 104 38.393 38.393 38.566 -0.173 17927 10522 1 13 . 1 1 104 104 TYR H H 104 7.203 7.203 7.428 -0.225 17927 10523 1 13 . 1 1 105 105 LEU N N 105 119.433 119.433 116.122 3.311 17927 10524 1 13 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.855 0.130 17927 10525 1 13 . 1 1 105 105 LEU C C 105 176.721 176.721 176.106 0.615 17927 10526 1 13 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.702 0.083 17927 10527 1 13 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.787 -1.344 17927 10528 1 13 . 1 1 105 105 LEU H H 105 7.582 7.582 7.330 0.252 17927 10529 1 13 . 1 1 106 106 ILE N N 106 119.575 119.575 119.595 -0.020 17927 10530 1 13 . 1 1 106 106 ILE HA H 106 4.002 4.002 3.826 0.176 17927 10531 1 13 . 1 1 106 106 ILE C C 106 175.459 175.459 174.698 0.761 17927 10532 1 13 . 1 1 106 106 ILE CA C 106 62.043 62.043 63.233 -1.190 17927 10533 1 13 . 1 1 106 106 ILE CB C 106 36.335 36.335 36.650 -0.315 17927 10534 1 13 . 1 1 106 106 ILE H H 106 8.774 8.774 7.996 0.778 17927 10535 1 13 . 1 1 107 107 ASN N N 107 126.514 126.514 125.142 1.372 17927 10536 1 13 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.776 0.087 17927 10537 1 13 . 1 1 107 107 ASN C C 107 174.584 174.584 175.495 -0.911 17927 10538 1 13 . 1 1 107 107 ASN CA C 107 53.112 53.112 53.268 -0.156 17927 10539 1 13 . 1 1 107 107 ASN CB C 107 38.977 38.977 40.876 -1.899 17927 10540 1 13 . 1 1 107 107 ASN H H 107 8.364 8.364 8.252 0.112 17927 10541 1 13 . 1 1 108 108 GLY N N 108 108.469 108.469 109.954 -1.485 17927 10542 1 13 . 1 1 108 108 GLY C C 108 171.245 171.245 173.654 -2.409 17927 10543 1 13 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.319 0.950 17927 10544 1 13 . 1 1 108 108 GLY H H 108 7.678 7.678 8.140 -0.462 17927 10545 1 13 . 1 1 109 109 ILE N N 109 112.817 112.817 125.094 -12.277 17927 10546 1 13 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.201 0.205 17927 10547 1 13 . 1 1 109 109 ILE C C 109 173.498 173.498 174.772 -1.274 17927 10548 1 13 . 1 1 109 109 ILE CA C 109 58.384 58.384 59.210 -0.826 17927 10549 1 13 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.348 1.974 17927 10550 1 13 . 1 1 109 109 ILE H H 109 7.868 7.868 8.071 -0.203 17927 10551 1 13 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.753 -0.011 17927 10552 1 13 . 1 1 110 110 PRO C C 110 175.715 175.715 175.651 0.064 17927 10553 1 13 . 1 1 110 110 PRO CA C 110 62.277 62.277 61.805 0.472 17927 10554 1 13 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.804 3.564 17927 10555 1 13 . 1 1 111 111 ARG N N 111 122.358 122.358 119.221 3.137 17927 10556 1 13 . 1 1 111 111 ARG HA H 111 4.469 4.469 4.001 0.468 17927 10557 1 13 . 1 1 111 111 ARG C C 111 171.541 171.541 174.591 -3.050 17927 10558 1 13 . 1 1 111 111 ARG CA C 111 54.356 54.356 53.799 0.557 17927 10559 1 13 . 1 1 111 111 ARG CB C 111 33.430 33.430 33.084 0.346 17927 10560 1 13 . 1 1 111 111 ARG H H 111 7.732 7.732 8.305 -0.573 17927 10561 1 13 . 1 1 112 112 PHE N N 112 125.103 125.103 123.358 1.745 17927 10562 1 13 . 1 1 112 112 PHE HA H 112 5.773 5.773 4.930 0.843 17927 10563 1 13 . 1 1 112 112 PHE C C 112 175.097 175.097 175.099 -0.002 17927 10564 1 13 . 1 1 112 112 PHE CA C 112 55.791 55.791 56.339 -0.548 17927 10565 1 13 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.275 1.653 17927 10566 1 13 . 1 1 112 112 PHE H H 112 8.929 8.929 7.834 1.095 17927 10567 1 13 . 1 1 113 113 ILE N N 113 123.778 123.778 123.537 0.241 17927 10568 1 13 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.989 -0.446 17927 10569 1 13 . 1 1 113 113 ILE C C 113 173.197 173.197 174.175 -0.978 17927 10570 1 13 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.842 0.445 17927 10571 1 13 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.282 1.964 17927 10572 1 13 . 1 1 113 113 ILE H H 113 8.873 8.873 8.843 0.030 17927 10573 1 13 . 1 1 114 114 LEU N N 114 127.146 127.146 127.197 -0.051 17927 10574 1 13 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.387 0.627 17927 10575 1 13 . 1 1 114 114 LEU C C 114 175.080 175.080 174.553 0.527 17927 10576 1 13 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.517 -0.116 17927 10577 1 13 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.591 0.779 17927 10578 1 13 . 1 1 114 114 LEU H H 114 8.974 8.974 8.886 0.088 17927 10579 1 13 . 1 1 115 115 LEU N N 115 128.323 128.323 124.373 3.950 17927 10580 1 13 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.259 0.173 17927 10581 1 13 . 1 1 115 115 LEU C C 115 176.660 176.660 175.642 1.018 17927 10582 1 13 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.666 -0.589 17927 10583 1 13 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.230 -1.646 17927 10584 1 13 . 1 1 115 115 LEU H H 115 9.874 9.874 9.393 0.481 17927 10585 1 13 . 1 1 116 116 ASP N N 116 119.834 119.834 121.717 -1.883 17927 10586 1 13 . 1 1 116 116 ASP HA H 116 4.935 4.935 5.018 -0.083 17927 10587 1 13 . 1 1 116 116 ASP C C 116 176.898 176.898 177.431 -0.533 17927 10588 1 13 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.647 -1.342 17927 10589 1 13 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.718 -1.690 17927 10590 1 13 . 1 1 116 116 ASP H H 116 9.357 9.357 8.871 0.486 17927 10591 1 13 . 1 1 117 117 ARG N N 117 113.356 113.356 122.508 -9.152 17927 10592 1 13 . 1 1 117 117 ARG HA H 117 3.717 3.717 3.926 -0.209 17927 10593 1 13 . 1 1 117 117 ARG C C 117 177.105 177.105 178.426 -1.321 17927 10594 1 13 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.660 -1.475 17927 10595 1 13 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.768 0.669 17927 10596 1 13 . 1 1 117 117 ARG H H 117 7.697 7.697 8.223 -0.526 17927 10597 1 13 . 1 1 118 118 ASP N N 118 117.226 117.226 117.346 -0.120 17927 10598 1 13 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.416 0.479 17927 10599 1 13 . 1 1 118 118 ASP C C 118 176.657 176.657 176.818 -0.161 17927 10600 1 13 . 1 1 118 118 ASP CA C 118 53.517 53.517 55.824 -2.307 17927 10601 1 13 . 1 1 118 118 ASP CB C 118 42.556 42.556 41.416 1.141 17927 10602 1 13 . 1 1 118 118 ASP H H 118 8.456 8.456 8.333 0.123 17927 10603 1 13 . 1 1 119 119 GLY N N 119 109.074 109.074 105.594 3.480 17927 10604 1 13 . 1 1 119 119 GLY C C 119 173.355 173.355 173.900 -0.545 17927 10605 1 13 . 1 1 119 119 GLY CA C 119 46.256 46.256 44.802 1.454 17927 10606 1 13 . 1 1 119 119 GLY H H 119 8.183 8.183 8.346 -0.163 17927 10607 1 13 . 1 1 120 120 LYS N N 120 120.744 120.744 121.809 -1.065 17927 10608 1 13 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.469 0.064 17927 10609 1 13 . 1 1 120 120 LYS C C 120 177.229 177.229 176.218 1.011 17927 10610 1 13 . 1 1 120 120 LYS CA C 120 55.287 55.287 55.343 -0.056 17927 10611 1 13 . 1 1 120 120 LYS CB C 120 32.581 32.581 32.607 -0.026 17927 10612 1 13 . 1 1 120 120 LYS H H 120 8.449 8.449 7.514 0.935 17927 10613 1 13 . 1 1 121 121 ILE N N 121 121.221 121.221 128.184 -6.963 17927 10614 1 13 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.858 0.028 17927 10615 1 13 . 1 1 121 121 ILE C C 121 177.819 177.819 176.298 1.521 17927 10616 1 13 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.562 0.353 17927 10617 1 13 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.139 2.251 17927 10618 1 13 . 1 1 121 121 ILE H H 121 8.715 8.715 8.849 -0.134 17927 10619 1 13 . 1 1 122 122 ILE N N 122 127.165 127.165 128.150 -0.985 17927 10620 1 13 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.267 0.074 17927 10621 1 13 . 1 1 122 122 ILE C C 122 176.978 176.978 176.740 0.238 17927 10622 1 13 . 1 1 122 122 ILE CA C 122 63.719 63.719 62.118 1.601 17927 10623 1 13 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.512 0.140 17927 10624 1 13 . 1 1 122 122 ILE H H 122 8.974 8.974 8.647 0.327 17927 10625 1 13 . 1 1 123 123 SER N N 123 111.227 111.227 115.859 -4.632 17927 10626 1 13 . 1 1 123 123 SER HA H 123 4.738 4.738 4.756 -0.018 17927 10627 1 13 . 1 1 123 123 SER C C 123 174.184 174.184 173.917 0.267 17927 10628 1 13 . 1 1 123 123 SER CA C 123 57.383 57.383 57.044 0.339 17927 10629 1 13 . 1 1 123 123 SER CB C 123 65.326 65.326 64.788 0.538 17927 10630 1 13 . 1 1 123 123 SER H H 123 7.850 7.850 8.395 -0.545 17927 10631 1 13 . 1 1 124 124 ALA N N 124 131.373 131.373 128.396 2.977 17927 10632 1 13 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.262 0.223 17927 10633 1 13 . 1 1 124 124 ALA C C 124 175.147 175.147 176.226 -1.079 17927 10634 1 13 . 1 1 124 124 ALA CA C 124 53.035 53.035 54.050 -1.014 17927 10635 1 13 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.380 -0.718 17927 10636 1 13 . 1 1 124 124 ALA H H 124 9.384 9.384 9.008 0.376 17927 10637 1 13 . 1 1 125 125 ASN N N 125 119.476 119.476 113.902 5.574 17927 10638 1 13 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.504 -0.448 17927 10639 1 13 . 1 1 125 125 ASN C C 125 173.593 173.593 174.826 -1.233 17927 10640 1 13 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.782 -0.430 17927 10641 1 13 . 1 1 125 125 ASN CB C 125 38.304 38.304 40.016 -1.712 17927 10642 1 13 . 1 1 125 125 ASN H H 125 8.191 8.191 7.861 0.330 17927 10643 1 13 . 1 1 126 126 MET N N 126 122.705 122.705 125.512 -2.807 17927 10644 1 13 . 1 1 126 126 MET HA H 126 4.585 4.585 4.887 -0.302 17927 10645 1 13 . 1 1 126 126 MET C C 126 175.215 175.215 175.715 -0.500 17927 10646 1 13 . 1 1 126 126 MET CA C 126 53.849 53.849 54.688 -0.839 17927 10647 1 13 . 1 1 126 126 MET CB C 126 31.312 31.312 35.144 -3.832 17927 10648 1 13 . 1 1 126 126 MET H H 126 8.376 8.376 8.969 -0.593 17927 10649 1 13 . 1 1 127 127 THR N N 127 111.016 111.016 114.460 -3.444 17927 10650 1 13 . 1 1 127 127 THR HA H 127 4.291 4.291 4.006 0.285 17927 10651 1 13 . 1 1 127 127 THR C C 127 174.574 174.574 172.840 1.734 17927 10652 1 13 . 1 1 127 127 THR CA C 127 62.085 62.085 60.528 1.557 17927 10653 1 13 . 1 1 127 127 THR CB C 127 69.733 69.733 71.276 -1.543 17927 10654 1 13 . 1 1 127 127 THR H H 127 7.714 7.714 8.347 -0.633 17927 10655 1 13 . 1 1 128 128 ARG N N 128 118.722 118.722 125.235 -6.513 17927 10656 1 13 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.244 -0.936 17927 10657 1 13 . 1 1 128 128 ARG C C 128 176.978 176.978 176.543 0.435 17927 10658 1 13 . 1 1 128 128 ARG CA C 128 54.727 54.727 55.759 -1.032 17927 10659 1 13 . 1 1 128 128 ARG CB C 128 29.598 29.598 29.684 -0.086 17927 10660 1 13 . 1 1 128 128 ARG H H 128 8.658 8.658 7.421 1.237 17927 10661 1 13 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.241 -0.308 17927 10662 1 13 . 1 1 129 129 PRO C C 129 175.794 175.794 177.039 -1.245 17927 10663 1 13 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.232 1.317 17927 10664 1 13 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.728 -0.051 17927 10665 1 13 . 1 1 130 130 SER N N 130 108.696 108.696 111.083 -2.387 17927 10666 1 13 . 1 1 130 130 SER HA H 130 3.988 3.988 4.274 -0.286 17927 10667 1 13 . 1 1 130 130 SER C C 130 174.445 174.445 174.488 -0.043 17927 10668 1 13 . 1 1 130 130 SER CA C 130 58.911 58.911 59.892 -0.981 17927 10669 1 13 . 1 1 130 130 SER CB C 130 62.680 62.680 63.068 -0.388 17927 10670 1 13 . 1 1 130 130 SER H H 130 8.375 8.375 8.172 0.203 17927 10671 1 13 . 1 1 131 131 ASP N N 131 126.377 126.377 121.318 5.059 17927 10672 1 13 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.981 -0.109 17927 10673 1 13 . 1 1 131 131 ASP C C 131 176.879 176.879 175.132 1.747 17927 10674 1 13 . 1 1 131 131 ASP CA C 131 51.195 51.195 50.764 0.431 17927 10675 1 13 . 1 1 131 131 ASP CB C 131 42.816 42.816 41.938 0.878 17927 10676 1 13 . 1 1 131 131 ASP H H 131 7.514 7.514 7.832 -0.318 17927 10677 1 13 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.183 0.209 17927 10678 1 13 . 1 1 132 132 PRO C C 132 178.097 178.097 178.092 0.005 17927 10679 1 13 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.484 0.595 17927 10680 1 13 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.099 0.310 17927 10681 1 13 . 1 1 133 133 LYS N N 133 116.306 116.306 118.311 -2.005 17927 10682 1 13 . 1 1 133 133 LYS HA H 133 3.958 3.958 3.863 0.095 17927 10683 1 13 . 1 1 133 133 LYS C C 133 179.532 179.532 179.089 0.443 17927 10684 1 13 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.338 -0.817 17927 10685 1 13 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.021 1.170 17927 10686 1 13 . 1 1 133 133 LYS H H 133 8.842 8.842 8.031 0.811 17927 10687 1 13 . 1 1 134 134 THR N N 134 120.833 120.833 113.654 7.179 17927 10688 1 13 . 1 1 134 134 THR HA H 134 3.147 3.147 3.666 -0.519 17927 10689 1 13 . 1 1 134 134 THR C C 134 173.356 173.356 174.998 -1.642 17927 10690 1 13 . 1 1 134 134 THR CA C 134 66.383 66.383 65.139 1.244 17927 10691 1 13 . 1 1 134 134 THR CB C 134 66.847 66.847 68.137 -1.290 17927 10692 1 13 . 1 1 134 134 THR H H 134 8.292 8.292 7.309 0.983 17927 10693 1 13 . 1 1 135 135 ALA N N 135 121.720 121.720 122.613 -0.893 17927 10694 1 13 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.650 -0.067 17927 10695 1 13 . 1 1 135 135 ALA C C 135 178.902 178.902 179.644 -0.742 17927 10696 1 13 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.920 0.079 17927 10697 1 13 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.233 -0.458 17927 10698 1 13 . 1 1 135 135 ALA H H 135 7.030 7.030 7.326 -0.296 17927 10699 1 13 . 1 1 136 136 GLU N N 136 114.623 114.623 117.699 -3.076 17927 10700 1 13 . 1 1 136 136 GLU HA H 136 3.922 3.922 4.245 -0.323 17927 10701 1 13 . 1 1 136 136 GLU C C 136 179.199 179.199 178.835 0.364 17927 10702 1 13 . 1 1 136 136 GLU CA C 136 59.837 59.837 57.479 2.358 17927 10703 1 13 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.066 0.720 17927 10704 1 13 . 1 1 136 136 GLU H H 136 7.216 7.216 8.528 -1.312 17927 10705 1 13 . 1 1 137 137 LYS N N 137 120.789 120.789 121.503 -0.714 17927 10706 1 13 . 1 1 137 137 LYS HA H 137 4.204 4.204 3.991 0.213 17927 10707 1 13 . 1 1 137 137 LYS C C 137 178.834 178.834 178.650 0.184 17927 10708 1 13 . 1 1 137 137 LYS CA C 137 57.343 57.343 59.071 -1.728 17927 10709 1 13 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.741 -1.278 17927 10710 1 13 . 1 1 137 137 LYS H H 137 7.681 7.681 7.837 -0.156 17927 10711 1 13 . 1 1 138 138 PHE N N 138 118.373 118.373 117.179 1.194 17927 10712 1 13 . 1 1 138 138 PHE HA H 138 4.033 4.033 4.145 -0.112 17927 10713 1 13 . 1 1 138 138 PHE C C 138 178.027 178.027 177.984 0.043 17927 10714 1 13 . 1 1 138 138 PHE CA C 138 57.507 57.507 59.837 -2.330 17927 10715 1 13 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.551 -1.662 17927 10716 1 13 . 1 1 138 138 PHE H H 138 8.059 8.059 7.248 0.811 17927 10717 1 13 . 1 1 139 139 ASN N N 139 117.611 117.611 117.834 -0.223 17927 10718 1 13 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.451 -0.047 17927 10719 1 13 . 1 1 139 139 ASN C C 139 178.190 178.190 177.914 0.276 17927 10720 1 13 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.489 -0.265 17927 10721 1 13 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.809 -1.075 17927 10722 1 13 . 1 1 139 139 ASN H H 139 8.683 8.683 7.971 0.712 17927 10723 1 13 . 1 1 140 140 GLU N N 140 121.432 121.432 121.704 -0.272 17927 10724 1 13 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.319 -0.314 17927 10725 1 13 . 1 1 140 140 GLU C C 140 179.751 179.751 179.872 -0.121 17927 10726 1 13 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.175 0.135 17927 10727 1 13 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.604 0.451 17927 10728 1 13 . 1 1 140 140 GLU H H 140 7.868 7.868 7.788 0.080 17927 10729 1 13 . 1 1 141 141 LEU N N 141 119.968 119.968 118.611 1.357 17927 10730 1 13 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.066 -0.050 17927 10731 1 13 . 1 1 141 141 LEU C C 141 179.293 179.293 178.056 1.237 17927 10732 1 13 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.088 0.348 17927 10733 1 13 . 1 1 141 141 LEU CB C 141 41.183 41.183 42.127 -0.945 17927 10734 1 13 . 1 1 141 141 LEU H H 141 8.303 8.303 7.692 0.611 17927 10735 1 13 . 1 1 142 142 LEU N N 142 115.040 115.040 114.105 0.935 17927 10736 1 13 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.496 -0.112 17927 10737 1 13 . 1 1 142 142 LEU C C 142 178.002 178.002 177.315 0.687 17927 10738 1 13 . 1 1 142 142 LEU CA C 142 55.279 55.279 54.313 0.966 17927 10739 1 13 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.818 -0.172 17927 10740 1 13 . 1 1 142 142 LEU H H 142 8.230 8.230 7.584 0.646 17927 10741 1 13 . 1 1 143 143 GLY N N 143 108.977 108.977 107.759 1.218 17927 10742 1 13 . 1 1 143 143 GLY C C 143 175.216 175.216 175.174 0.042 17927 10743 1 13 . 1 1 143 143 GLY CA C 143 46.741 46.741 46.140 0.601 17927 10744 1 13 . 1 1 143 143 GLY H H 143 7.762 7.762 7.636 0.126 17927 10745 1 13 . 1 1 144 144 LEU N N 144 119.660 119.660 119.419 0.241 17927 10746 1 13 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.440 0.048 17927 10747 1 13 . 1 1 144 144 LEU C C 144 177.375 177.375 177.767 -0.392 17927 10748 1 13 . 1 1 144 144 LEU CA C 144 54.525 54.525 57.086 -2.561 17927 10749 1 13 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.583 0.190 17927 10750 1 13 . 1 1 144 144 LEU H H 144 8.241 8.241 8.345 -0.104 17927 10751 1 13 . 1 1 145 145 GLU N N 145 119.959 119.959 119.842 0.117 17927 10752 1 13 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.321 -0.080 17927 10753 1 13 . 1 1 145 145 GLU C C 145 177.075 177.075 178.449 -1.374 17927 10754 1 13 . 1 1 145 145 GLU CA C 145 56.799 56.799 57.809 -1.010 17927 10755 1 13 . 1 1 145 145 GLU CB C 145 30.168 30.168 28.291 1.877 17927 10756 1 13 . 1 1 145 145 GLU H H 145 8.410 8.410 8.031 0.379 17927 10757 1 13 . 1 1 146 146 GLY N N 146 109.412 109.412 108.658 0.754 17927 10758 1 13 . 1 1 146 146 GLY C C 146 174.276 174.276 173.905 0.371 17927 10759 1 13 . 1 1 146 146 GLY CA C 146 45.445 45.445 44.276 1.169 17927 10760 1 13 . 1 1 146 146 GLY H H 146 8.422 8.422 8.450 -0.028 17927 10761 1 13 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.252 0.404 17927 10762 1 13 . 1 1 151 151 HIS C C 151 173.990 173.990 173.801 0.189 17927 10763 1 13 . 1 1 151 151 HIS CA C 151 56.044 56.044 56.453 -0.409 17927 10764 1 13 . 1 1 151 151 HIS CB C 151 30.076 30.076 29.705 0.371 17927 10765 1 14 . 1 1 2 2 SER HA H 2 4.121 4.121 4.759 -0.638 17927 10766 1 14 . 1 1 2 2 SER CA C 2 57.293 57.293 58.174 -0.881 17927 10767 1 14 . 1 1 2 2 SER CB C 2 63.545 63.545 61.844 1.701 17927 10768 1 14 . 1 1 3 3 LEU HA H 3 4.432 4.432 3.914 0.518 17927 10769 1 14 . 1 1 3 3 LEU C C 3 177.383 177.383 175.265 2.118 17927 10770 1 14 . 1 1 3 3 LEU CA C 3 55.575 55.575 57.579 -2.004 17927 10771 1 14 . 1 1 3 3 LEU CB C 3 42.584 42.584 41.618 0.966 17927 10772 1 14 . 1 1 4 4 ARG N N 4 122.080 122.080 118.057 4.023 17927 10773 1 14 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.635 -0.251 17927 10774 1 14 . 1 1 4 4 ARG C C 4 176.410 176.410 175.840 0.570 17927 10775 1 14 . 1 1 4 4 ARG CA C 4 56.269 56.269 54.521 1.748 17927 10776 1 14 . 1 1 4 4 ARG CB C 4 30.842 30.842 32.244 -1.402 17927 10777 1 14 . 1 1 4 4 ARG H H 4 8.410 8.410 8.128 0.282 17927 10778 1 14 . 1 1 5 5 SER N N 5 117.023 117.023 113.925 3.098 17927 10779 1 14 . 1 1 5 5 SER HA H 5 4.423 4.423 4.378 0.045 17927 10780 1 14 . 1 1 5 5 SER C C 5 175.039 175.039 174.705 0.334 17927 10781 1 14 . 1 1 5 5 SER CA C 5 58.605 58.605 59.643 -1.038 17927 10782 1 14 . 1 1 5 5 SER CB C 5 64.044 64.044 63.453 0.591 17927 10783 1 14 . 1 1 5 5 SER H H 5 8.292 8.292 8.556 -0.264 17927 10784 1 14 . 1 1 6 6 GLY N N 6 110.718 110.718 108.368 2.350 17927 10785 1 14 . 1 1 6 6 GLY C C 6 173.654 173.654 172.477 1.177 17927 10786 1 14 . 1 1 6 6 GLY CA C 6 45.273 45.273 44.987 0.285 17927 10787 1 14 . 1 1 6 6 GLY H H 6 8.446 8.446 7.614 0.832 17927 10788 1 14 . 1 1 7 7 ASN N N 7 119.287 119.287 117.342 1.945 17927 10789 1 14 . 1 1 7 7 ASN HA H 7 5.024 5.024 4.567 0.457 17927 10790 1 14 . 1 1 7 7 ASN C C 7 173.672 173.672 173.555 0.117 17927 10791 1 14 . 1 1 7 7 ASN CA C 7 51.357 51.357 53.208 -1.851 17927 10792 1 14 . 1 1 7 7 ASN CB C 7 38.927 38.927 38.027 0.900 17927 10793 1 14 . 1 1 7 7 ASN H H 7 8.273 8.273 8.568 -0.295 17927 10794 1 14 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.635 -0.188 17927 10795 1 14 . 1 1 8 8 PRO C C 8 176.899 176.899 177.839 -0.940 17927 10796 1 14 . 1 1 8 8 PRO CA C 8 63.429 63.429 63.620 -0.191 17927 10797 1 14 . 1 1 8 8 PRO CB C 8 32.216 32.216 32.540 -0.324 17927 10798 1 14 . 1 1 9 9 SER N N 9 115.642 115.642 112.170 3.472 17927 10799 1 14 . 1 1 9 9 SER HA H 9 4.415 4.415 4.036 0.379 17927 10800 1 14 . 1 1 9 9 SER C C 9 174.714 174.714 175.246 -0.532 17927 10801 1 14 . 1 1 9 9 SER CA C 9 58.488 58.488 59.124 -0.636 17927 10802 1 14 . 1 1 9 9 SER CB C 9 64.048 64.048 62.811 1.237 17927 10803 1 14 . 1 1 9 9 SER H H 9 8.336 8.336 8.645 -0.309 17927 10804 1 14 . 1 1 10 10 ALA N N 10 126.808 126.808 125.871 0.937 17927 10805 1 14 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.092 0.170 17927 10806 1 14 . 1 1 10 10 ALA C C 10 177.233 177.233 177.159 0.074 17927 10807 1 14 . 1 1 10 10 ALA CA C 10 53.230 53.230 54.725 -1.495 17927 10808 1 14 . 1 1 10 10 ALA CB C 10 19.187 19.187 18.250 0.937 17927 10809 1 14 . 1 1 10 10 ALA H H 10 8.137 8.137 8.972 -0.835 17927 10810 1 14 . 1 1 11 11 ALA N N 11 120.449 120.449 123.416 -2.967 17927 10811 1 14 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.329 -0.068 17927 10812 1 14 . 1 1 11 11 ALA C C 11 177.469 177.469 176.775 0.694 17927 10813 1 14 . 1 1 11 11 ALA CA C 11 52.475 52.475 51.602 0.873 17927 10814 1 14 . 1 1 11 11 ALA CB C 11 19.485 19.485 17.786 1.699 17927 10815 1 14 . 1 1 11 11 ALA H H 11 7.851 7.851 7.909 -0.058 17927 10816 1 14 . 1 1 12 12 SER N N 12 114.186 114.186 115.178 -0.992 17927 10817 1 14 . 1 1 12 12 SER HA H 12 4.312 4.312 4.060 0.252 17927 10818 1 14 . 1 1 12 12 SER C C 12 173.593 173.593 173.371 0.222 17927 10819 1 14 . 1 1 12 12 SER CA C 12 58.099 58.099 59.448 -1.349 17927 10820 1 14 . 1 1 12 12 SER CB C 12 63.320 63.320 62.616 0.704 17927 10821 1 14 . 1 1 12 12 SER H H 12 7.990 7.990 8.443 -0.453 17927 10822 1 14 . 1 1 13 13 PHE N N 13 118.092 118.092 120.348 -2.256 17927 10823 1 14 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.719 0.061 17927 10824 1 14 . 1 1 13 13 PHE C C 13 174.220 174.220 174.621 -0.401 17927 10825 1 14 . 1 1 13 13 PHE CA C 13 56.717 56.717 56.130 0.587 17927 10826 1 14 . 1 1 13 13 PHE CB C 13 41.151 41.151 40.284 0.867 17927 10827 1 14 . 1 1 13 13 PHE H H 13 7.147 7.147 7.771 -0.624 17927 10828 1 14 . 1 1 14 14 SER N N 14 116.456 116.456 119.213 -2.757 17927 10829 1 14 . 1 1 14 14 SER HA H 14 5.162 5.162 5.034 0.128 17927 10830 1 14 . 1 1 14 14 SER C C 14 172.626 172.626 173.120 -0.494 17927 10831 1 14 . 1 1 14 14 SER CA C 14 57.390 57.390 57.582 -0.192 17927 10832 1 14 . 1 1 14 14 SER CB C 14 64.518 64.518 64.200 0.318 17927 10833 1 14 . 1 1 14 14 SER H H 14 7.616 7.616 8.351 -0.735 17927 10834 1 14 . 1 1 15 15 TYR N N 15 122.384 122.384 124.472 -2.088 17927 10835 1 14 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.939 0.267 17927 10836 1 14 . 1 1 15 15 TYR C C 15 172.543 172.543 173.280 -0.737 17927 10837 1 14 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.120 -0.174 17927 10838 1 14 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.430 0.797 17927 10839 1 14 . 1 1 15 15 TYR H H 15 8.558 8.558 8.980 -0.422 17927 10840 1 14 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.812 0.297 17927 10841 1 14 . 1 1 16 16 PRO C C 16 176.475 176.475 176.413 0.062 17927 10842 1 14 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.232 -0.251 17927 10843 1 14 . 1 1 16 16 PRO CB C 16 32.662 32.662 31.971 0.691 17927 10844 1 14 . 1 1 17 17 ASP N N 17 119.834 119.834 125.646 -5.812 17927 10845 1 14 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.986 0.753 17927 10846 1 14 . 1 1 17 17 ASP C C 17 180.740 180.740 178.069 2.671 17927 10847 1 14 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.810 -2.093 17927 10848 1 14 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.856 -1.296 17927 10849 1 14 . 1 1 17 17 ASP H H 17 8.643 8.643 9.080 -0.437 17927 10850 1 14 . 1 1 18 18 ILE N N 18 118.340 118.340 122.795 -4.455 17927 10851 1 14 . 1 1 18 18 ILE HA H 18 4.451 4.451 4.135 0.316 17927 10852 1 14 . 1 1 18 18 ILE C C 18 175.742 175.742 176.051 -0.309 17927 10853 1 14 . 1 1 18 18 ILE CA C 18 61.894 61.894 63.569 -1.675 17927 10854 1 14 . 1 1 18 18 ILE CB C 18 39.240 39.240 37.851 1.389 17927 10855 1 14 . 1 1 18 18 ILE H H 18 8.450 8.450 8.423 0.027 17927 10856 1 14 . 1 1 19 19 ASN N N 19 119.377 119.377 116.998 2.379 17927 10857 1 14 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.581 0.434 17927 10858 1 14 . 1 1 19 19 ASN C C 19 175.892 175.892 175.454 0.438 17927 10859 1 14 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.460 -1.153 17927 10860 1 14 . 1 1 19 19 ASN CB C 19 39.825 39.825 39.171 0.654 17927 10861 1 14 . 1 1 19 19 ASN H H 19 8.376 8.376 8.797 -0.421 17927 10862 1 14 . 1 1 20 20 GLY N N 20 109.535 109.535 107.772 1.763 17927 10863 1 14 . 1 1 20 20 GLY C C 20 174.285 174.285 173.527 0.758 17927 10864 1 14 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.748 0.045 17927 10865 1 14 . 1 1 20 20 GLY H H 20 8.539 8.539 8.324 0.215 17927 10866 1 14 . 1 1 21 21 LYS N N 21 124.675 124.675 120.288 4.387 17927 10867 1 14 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.710 -0.267 17927 10868 1 14 . 1 1 21 21 LYS C C 21 176.537 176.537 175.401 1.136 17927 10869 1 14 . 1 1 21 21 LYS CA C 21 55.444 55.444 53.973 1.471 17927 10870 1 14 . 1 1 21 21 LYS CB C 21 32.754 32.754 35.071 -2.317 17927 10871 1 14 . 1 1 21 21 LYS H H 21 8.608 8.608 7.549 1.059 17927 10872 1 14 . 1 1 22 22 THR N N 22 120.666 120.666 122.296 -1.630 17927 10873 1 14 . 1 1 22 22 THR HA H 22 4.087 4.087 4.308 -0.221 17927 10874 1 14 . 1 1 22 22 THR C C 22 174.431 174.431 174.175 0.256 17927 10875 1 14 . 1 1 22 22 THR CA C 22 64.292 64.292 63.446 0.846 17927 10876 1 14 . 1 1 22 22 THR CB C 22 69.069 69.069 68.423 0.646 17927 10877 1 14 . 1 1 22 22 THR H H 22 8.595 8.595 8.621 -0.026 17927 10878 1 14 . 1 1 23 23 VAL N N 23 131.207 131.207 129.361 1.846 17927 10879 1 14 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.237 -0.045 17927 10880 1 14 . 1 1 23 23 VAL C C 23 174.244 174.244 174.689 -0.445 17927 10881 1 14 . 1 1 23 23 VAL CA C 23 62.456 62.456 61.244 1.212 17927 10882 1 14 . 1 1 23 23 VAL CB C 23 33.791 33.791 33.959 -0.168 17927 10883 1 14 . 1 1 23 23 VAL H H 23 8.937 8.937 8.821 0.116 17927 10884 1 14 . 1 1 24 24 SER N N 24 120.787 120.787 119.826 0.961 17927 10885 1 14 . 1 1 24 24 SER HA H 24 5.407 5.407 5.005 0.402 17927 10886 1 14 . 1 1 24 24 SER C C 24 176.169 176.169 174.312 1.857 17927 10887 1 14 . 1 1 24 24 SER CA C 24 55.135 55.135 55.836 -0.701 17927 10888 1 14 . 1 1 24 24 SER CB C 24 65.646 65.646 66.013 -0.367 17927 10889 1 14 . 1 1 24 24 SER H H 24 8.554 8.554 9.173 -0.619 17927 10890 1 14 . 1 1 25 25 LEU N N 25 124.332 124.332 120.494 3.838 17927 10891 1 14 . 1 1 25 25 LEU HA H 25 3.687 3.687 3.884 -0.197 17927 10892 1 14 . 1 1 25 25 LEU C C 25 179.364 179.364 176.736 2.628 17927 10893 1 14 . 1 1 25 25 LEU CA C 25 58.217 58.217 55.692 2.525 17927 10894 1 14 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.639 -1.101 17927 10895 1 14 . 1 1 25 25 LEU H H 25 7.811 7.811 8.502 -0.691 17927 10896 1 14 . 1 1 26 26 ALA N N 26 119.799 119.799 119.052 0.747 17927 10897 1 14 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.103 -0.110 17927 10898 1 14 . 1 1 26 26 ALA C C 26 179.719 179.719 178.706 1.013 17927 10899 1 14 . 1 1 26 26 ALA CA C 26 54.663 54.663 53.519 1.145 17927 10900 1 14 . 1 1 26 26 ALA CB C 26 18.323 18.323 19.666 -1.343 17927 10901 1 14 . 1 1 26 26 ALA H H 26 8.099 8.099 7.327 0.772 17927 10902 1 14 . 1 1 27 27 ASP N N 27 116.553 116.553 117.845 -1.292 17927 10903 1 14 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.473 0.000 17927 10904 1 14 . 1 1 27 27 ASP C C 27 176.915 176.915 176.894 0.021 17927 10905 1 14 . 1 1 27 27 ASP CA C 27 56.251 56.251 56.175 0.076 17927 10906 1 14 . 1 1 27 27 ASP CB C 27 40.788 40.788 40.940 -0.152 17927 10907 1 14 . 1 1 27 27 ASP H H 27 7.572 7.572 7.839 -0.267 17927 10908 1 14 . 1 1 28 28 LEU N N 28 118.950 118.950 119.036 -0.086 17927 10909 1 14 . 1 1 28 28 LEU HA H 28 4.233 4.233 4.309 -0.076 17927 10910 1 14 . 1 1 28 28 LEU C C 28 175.542 175.542 175.198 0.344 17927 10911 1 14 . 1 1 28 28 LEU CA C 28 53.706 53.706 53.791 -0.085 17927 10912 1 14 . 1 1 28 28 LEU CB C 28 41.049 41.049 42.560 -1.511 17927 10913 1 14 . 1 1 28 28 LEU H H 28 7.363 7.363 7.704 -0.341 17927 10914 1 14 . 1 1 29 29 LYS N N 29 118.429 118.429 119.890 -1.461 17927 10915 1 14 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.351 0.001 17927 10916 1 14 . 1 1 29 29 LYS C C 29 178.063 178.063 177.257 0.806 17927 10917 1 14 . 1 1 29 29 LYS CA C 29 57.777 57.777 56.016 1.761 17927 10918 1 14 . 1 1 29 29 LYS CB C 29 33.440 33.440 33.690 -0.250 17927 10919 1 14 . 1 1 29 29 LYS H H 29 6.780 6.780 7.032 -0.252 17927 10920 1 14 . 1 1 30 30 GLY N N 30 112.426 112.426 111.542 0.884 17927 10921 1 14 . 1 1 30 30 GLY C C 30 173.801 173.801 173.540 0.261 17927 10922 1 14 . 1 1 30 30 GLY CA C 30 44.611 44.611 45.256 -0.645 17927 10923 1 14 . 1 1 30 30 GLY H H 30 9.398 9.398 8.923 0.475 17927 10924 1 14 . 1 1 31 31 LYS N N 31 119.295 119.295 120.998 -1.703 17927 10925 1 14 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.668 -0.516 17927 10926 1 14 . 1 1 31 31 LYS C C 31 173.862 173.862 176.801 -2.939 17927 10927 1 14 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.130 1.058 17927 10928 1 14 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.683 1.285 17927 10929 1 14 . 1 1 31 31 LYS H H 31 7.496 7.496 7.521 -0.025 17927 10930 1 14 . 1 1 32 32 TYR N N 32 116.984 116.984 120.137 -3.153 17927 10931 1 14 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.464 -0.307 17927 10932 1 14 . 1 1 32 32 TYR C C 32 175.226 175.226 175.560 -0.334 17927 10933 1 14 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.606 -0.016 17927 10934 1 14 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.030 0.091 17927 10935 1 14 . 1 1 32 32 TYR H H 32 7.521 7.521 8.040 -0.519 17927 10936 1 14 . 1 1 33 33 ILE N N 33 118.052 118.052 119.961 -1.909 17927 10937 1 14 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.628 0.279 17927 10938 1 14 . 1 1 33 33 ILE C C 33 174.308 174.308 174.252 0.056 17927 10939 1 14 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.163 0.540 17927 10940 1 14 . 1 1 33 33 ILE CB C 33 41.616 41.616 41.208 0.408 17927 10941 1 14 . 1 1 33 33 ILE H H 33 8.467 8.467 8.891 -0.424 17927 10942 1 14 . 1 1 34 34 TYR N N 34 130.242 130.242 128.738 1.504 17927 10943 1 14 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.234 0.292 17927 10944 1 14 . 1 1 34 34 TYR C C 34 174.245 174.245 173.441 0.804 17927 10945 1 14 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.911 0.247 17927 10946 1 14 . 1 1 34 34 TYR CB C 34 40.133 40.133 41.266 -1.133 17927 10947 1 14 . 1 1 34 34 TYR H H 34 8.905 8.905 9.273 -0.368 17927 10948 1 14 . 1 1 35 35 ILE N N 35 128.697 128.697 129.658 -0.961 17927 10949 1 14 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.079 0.263 17927 10950 1 14 . 1 1 35 35 ILE C C 35 174.520 174.520 174.271 0.249 17927 10951 1 14 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.711 0.038 17927 10952 1 14 . 1 1 35 35 ILE CB C 35 40.899 40.899 39.365 1.534 17927 10953 1 14 . 1 1 35 35 ILE H H 35 9.445 9.445 8.636 0.809 17927 10954 1 14 . 1 1 36 36 ASP N N 36 123.675 123.675 126.509 -2.834 17927 10955 1 14 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.613 -0.765 17927 10956 1 14 . 1 1 36 36 ASP C C 36 174.385 174.385 175.547 -1.162 17927 10957 1 14 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.633 -0.339 17927 10958 1 14 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.232 -2.454 17927 10959 1 14 . 1 1 36 36 ASP H H 36 8.875 8.875 8.552 0.323 17927 10960 1 14 . 1 1 37 37 VAL N N 37 127.159 127.159 120.010 7.149 17927 10961 1 14 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.980 -0.021 17927 10962 1 14 . 1 1 37 37 VAL C C 37 175.046 175.046 175.725 -0.679 17927 10963 1 14 . 1 1 37 37 VAL CA C 37 62.245 62.245 60.938 1.307 17927 10964 1 14 . 1 1 37 37 VAL CB C 37 31.807 31.807 31.933 -0.126 17927 10965 1 14 . 1 1 37 37 VAL H H 37 8.603 8.603 8.056 0.547 17927 10966 1 14 . 1 1 38 38 TRP N N 38 124.161 124.161 126.509 -2.348 17927 10967 1 14 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.099 0.138 17927 10968 1 14 . 1 1 38 38 TRP C C 38 171.995 171.995 173.588 -1.593 17927 10969 1 14 . 1 1 38 38 TRP CA C 38 55.207 55.207 54.340 0.867 17927 10970 1 14 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.242 2.945 17927 10971 1 14 . 1 1 38 38 TRP H H 38 8.562 8.562 8.529 0.033 17927 10972 1 14 . 1 1 39 39 ALA N N 39 116.252 116.252 125.531 -9.279 17927 10973 1 14 . 1 1 39 39 ALA HA H 39 3.678 3.678 4.433 -0.755 17927 10974 1 14 . 1 1 39 39 ALA C C 39 178.664 178.664 175.797 2.867 17927 10975 1 14 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.600 0.866 17927 10976 1 14 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.417 0.924 17927 10977 1 14 . 1 1 39 39 ALA H H 39 6.757 6.757 8.143 -1.386 17927 10978 1 14 . 1 1 40 40 THR N N 40 114.321 114.321 115.700 -1.379 17927 10979 1 14 . 1 1 40 40 THR HA H 40 3.907 3.907 4.582 -0.675 17927 10980 1 14 . 1 1 40 40 THR C C 40 175.885 175.885 175.025 0.860 17927 10981 1 14 . 1 1 40 40 THR CA C 40 65.447 65.447 62.860 2.587 17927 10982 1 14 . 1 1 40 40 THR CB C 40 70.106 70.106 69.628 0.478 17927 10983 1 14 . 1 1 40 40 THR H H 40 9.639 9.639 8.864 0.775 17927 10984 1 14 . 1 1 41 41 TRP N N 41 114.483 114.483 120.180 -5.697 17927 10985 1 14 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.689 -0.126 17927 10986 1 14 . 1 1 41 41 TRP C C 41 176.189 176.189 175.750 0.439 17927 10987 1 14 . 1 1 41 41 TRP CA C 41 54.698 54.698 56.283 -1.585 17927 10988 1 14 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.102 1.875 17927 10989 1 14 . 1 1 41 41 TRP H H 41 6.401 6.401 7.661 -1.260 17927 10990 1 14 . 1 1 42 42 CYS N N 42 123.536 123.536 119.573 3.963 17927 10991 1 14 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.090 0.478 17927 10992 1 14 . 1 1 42 42 CYS C C 42 175.726 175.726 175.953 -0.227 17927 10993 1 14 . 1 1 42 42 CYS CA C 42 58.700 58.700 59.493 -0.793 17927 10994 1 14 . 1 1 42 42 CYS CB C 42 27.121 27.121 29.334 -2.212 17927 10995 1 14 . 1 1 42 42 CYS H H 42 6.883 6.883 7.424 -0.541 17927 10996 1 14 . 1 1 43 43 GLY N N 43 120.977 120.977 108.058 12.919 17927 10997 1 14 . 1 1 43 43 GLY CA C 43 49.204 49.204 45.259 3.945 17927 10998 1 14 . 1 1 43 43 GLY H H 43 9.653 9.653 7.512 2.141 17927 10999 1 14 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.357 0.130 17927 11000 1 14 . 1 1 44 44 PRO C C 44 179.956 179.956 178.421 1.535 17927 11001 1 14 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.213 0.429 17927 11002 1 14 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.249 1.329 17927 11003 1 14 . 1 1 45 45 CYS N N 45 113.925 113.925 114.510 -0.585 17927 11004 1 14 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.191 0.122 17927 11005 1 14 . 1 1 45 45 CYS C C 45 178.325 178.325 177.013 1.312 17927 11006 1 14 . 1 1 45 45 CYS CA C 45 63.392 63.392 60.835 2.557 17927 11007 1 14 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.370 1.135 17927 11008 1 14 . 1 1 45 45 CYS H H 45 7.676 7.676 7.714 -0.038 17927 11009 1 14 . 1 1 46 46 ARG N N 46 120.336 120.336 120.163 0.173 17927 11010 1 14 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.228 -0.159 17927 11011 1 14 . 1 1 46 46 ARG C C 46 180.446 180.446 177.966 2.480 17927 11012 1 14 . 1 1 46 46 ARG CA C 46 59.785 59.785 57.972 1.813 17927 11013 1 14 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.882 -0.014 17927 11014 1 14 . 1 1 46 46 ARG H H 46 8.109 8.109 8.196 -0.087 17927 11015 1 14 . 1 1 47 47 GLY N N 47 105.408 105.408 106.691 -1.283 17927 11016 1 14 . 1 1 47 47 GLY C C 47 175.258 175.258 175.044 0.214 17927 11017 1 14 . 1 1 47 47 GLY CA C 47 46.594 46.594 45.740 0.854 17927 11018 1 14 . 1 1 47 47 GLY H H 47 8.466 8.466 8.188 0.278 17927 11019 1 14 . 1 1 48 48 GLU N N 48 116.343 116.343 120.363 -4.020 17927 11020 1 14 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.474 0.051 17927 11021 1 14 . 1 1 48 48 GLU C C 48 176.535 176.535 177.888 -1.353 17927 11022 1 14 . 1 1 48 48 GLU CA C 48 55.792 55.792 56.821 -1.029 17927 11023 1 14 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.990 0.992 17927 11024 1 14 . 1 1 48 48 GLU H H 48 7.050 7.050 7.913 -0.863 17927 11025 1 14 . 1 1 49 49 LEU N N 49 118.652 118.652 122.076 -3.424 17927 11026 1 14 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.150 0.002 17927 11027 1 14 . 1 1 49 49 LEU C C 49 176.832 176.832 176.170 0.662 17927 11028 1 14 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.423 -1.078 17927 11029 1 14 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.391 -0.895 17927 11030 1 14 . 1 1 49 49 LEU H H 49 7.385 7.385 7.678 -0.293 17927 11031 1 14 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.118 0.135 17927 11032 1 14 . 1 1 50 50 PRO C C 50 179.744 179.744 178.135 1.609 17927 11033 1 14 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.174 0.385 17927 11034 1 14 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.921 -0.159 17927 11035 1 14 . 1 1 51 51 ALA N N 51 120.418 120.418 119.224 1.194 17927 11036 1 14 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.218 -0.073 17927 11037 1 14 . 1 1 51 51 ALA C C 51 180.329 180.329 179.764 0.565 17927 11038 1 14 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.617 -0.183 17927 11039 1 14 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.239 0.131 17927 11040 1 14 . 1 1 51 51 ALA H H 51 7.731 7.731 7.986 -0.255 17927 11041 1 14 . 1 1 52 52 LEU N N 52 121.506 121.506 118.966 2.540 17927 11042 1 14 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.875 0.113 17927 11043 1 14 . 1 1 52 52 LEU C C 52 177.944 177.944 179.026 -1.082 17927 11044 1 14 . 1 1 52 52 LEU CA C 52 58.327 58.327 57.576 0.751 17927 11045 1 14 . 1 1 52 52 LEU CB C 52 42.382 42.382 41.419 0.963 17927 11046 1 14 . 1 1 52 52 LEU H H 52 8.355 8.355 8.413 -0.058 17927 11047 1 14 . 1 1 53 53 LYS N N 53 119.732 119.732 119.830 -0.098 17927 11048 1 14 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.922 -0.019 17927 11049 1 14 . 1 1 53 53 LYS C C 53 179.030 179.030 178.836 0.194 17927 11050 1 14 . 1 1 53 53 LYS CA C 53 59.846 59.846 59.849 -0.003 17927 11051 1 14 . 1 1 53 53 LYS CB C 53 32.211 32.211 32.033 0.177 17927 11052 1 14 . 1 1 53 53 LYS H H 53 8.148 8.148 7.570 0.578 17927 11053 1 14 . 1 1 54 54 GLU N N 54 117.779 117.779 119.991 -2.212 17927 11054 1 14 . 1 1 54 54 GLU HA H 54 4.059 4.059 3.970 0.089 17927 11055 1 14 . 1 1 54 54 GLU C C 54 179.646 179.646 179.184 0.462 17927 11056 1 14 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.243 0.382 17927 11057 1 14 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.160 0.407 17927 11058 1 14 . 1 1 54 54 GLU H H 54 7.585 7.585 7.925 -0.340 17927 11059 1 14 . 1 1 55 55 LEU N N 55 120.581 120.581 119.925 0.656 17927 11060 1 14 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.066 0.127 17927 11061 1 14 . 1 1 55 55 LEU C C 55 178.557 178.557 178.614 -0.057 17927 11062 1 14 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.586 0.649 17927 11063 1 14 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.484 1.527 17927 11064 1 14 . 1 1 55 55 LEU H H 55 8.096 8.096 8.049 0.047 17927 11065 1 14 . 1 1 56 56 GLU N N 56 118.023 118.023 119.487 -1.464 17927 11066 1 14 . 1 1 56 56 GLU HA H 56 3.177 3.177 3.543 -0.366 17927 11067 1 14 . 1 1 56 56 GLU C C 56 179.650 179.650 179.131 0.519 17927 11068 1 14 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.657 -0.786 17927 11069 1 14 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.490 -2.505 17927 11070 1 14 . 1 1 56 56 GLU H H 56 8.181 8.181 8.211 -0.030 17927 11071 1 14 . 1 1 57 57 GLU N N 57 117.828 117.828 116.704 1.124 17927 11072 1 14 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.130 -0.026 17927 11073 1 14 . 1 1 57 57 GLU C C 57 179.700 179.700 178.119 1.581 17927 11074 1 14 . 1 1 57 57 GLU CA C 57 59.027 59.027 57.793 1.234 17927 11075 1 14 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.730 -0.065 17927 11076 1 14 . 1 1 57 57 GLU H H 57 7.762 7.762 8.206 -0.444 17927 11077 1 14 . 1 1 58 58 LYS N N 58 120.896 120.896 118.024 2.872 17927 11078 1 14 . 1 1 58 58 LYS HA H 58 3.979 3.979 3.966 0.013 17927 11079 1 14 . 1 1 58 58 LYS C C 58 178.715 178.715 177.521 1.194 17927 11080 1 14 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.163 0.915 17927 11081 1 14 . 1 1 58 58 LYS CB C 58 32.980 32.980 32.850 0.130 17927 11082 1 14 . 1 1 58 58 LYS H H 58 8.410 8.410 7.613 0.797 17927 11083 1 14 . 1 1 59 59 TYR N N 59 113.713 113.713 115.370 -1.657 17927 11084 1 14 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.651 -0.339 17927 11085 1 14 . 1 1 59 59 TYR C C 59 175.025 175.025 174.348 0.677 17927 11086 1 14 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.497 2.476 17927 11087 1 14 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.749 -1.315 17927 11088 1 14 . 1 1 59 59 TYR H H 59 8.102 8.102 7.808 0.294 17927 11089 1 14 . 1 1 60 60 ALA N N 60 126.637 126.637 122.657 3.980 17927 11090 1 14 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.387 0.031 17927 11091 1 14 . 1 1 60 60 ALA C C 60 179.208 179.208 177.646 1.562 17927 11092 1 14 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.516 1.018 17927 11093 1 14 . 1 1 60 60 ALA CB C 60 18.589 18.589 19.297 -0.708 17927 11094 1 14 . 1 1 60 60 ALA H H 60 7.201 7.201 7.524 -0.323 17927 11095 1 14 . 1 1 61 61 GLY N N 61 111.816 111.816 109.882 1.934 17927 11096 1 14 . 1 1 61 61 GLY C C 61 174.698 174.698 174.048 0.650 17927 11097 1 14 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.868 0.036 17927 11098 1 14 . 1 1 61 61 GLY H H 61 9.184 9.184 8.784 0.400 17927 11099 1 14 . 1 1 62 62 LYS N N 62 118.497 118.497 119.603 -1.106 17927 11100 1 14 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.575 0.304 17927 11101 1 14 . 1 1 62 62 LYS C C 62 179.019 179.019 175.905 3.114 17927 11102 1 14 . 1 1 62 62 LYS CA C 62 53.988 53.988 54.105 -0.117 17927 11103 1 14 . 1 1 62 62 LYS CB C 62 33.840 33.840 34.291 -0.451 17927 11104 1 14 . 1 1 62 62 LYS H H 62 8.019 8.019 7.712 0.307 17927 11105 1 14 . 1 1 63 63 ASP N N 63 122.982 122.982 121.537 1.445 17927 11106 1 14 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.735 -0.208 17927 11107 1 14 . 1 1 63 63 ASP C C 63 174.065 174.065 174.125 -0.060 17927 11108 1 14 . 1 1 63 63 ASP CA C 63 55.055 55.055 54.363 0.692 17927 11109 1 14 . 1 1 63 63 ASP CB C 63 38.582 38.582 40.016 -1.434 17927 11110 1 14 . 1 1 63 63 ASP H H 63 8.709 8.709 8.581 0.128 17927 11111 1 14 . 1 1 64 64 ILE N N 64 122.219 122.219 117.269 4.950 17927 11112 1 14 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.631 -0.024 17927 11113 1 14 . 1 1 64 64 ILE C C 64 174.627 174.627 173.578 1.049 17927 11114 1 14 . 1 1 64 64 ILE CA C 64 59.712 59.712 59.223 0.489 17927 11115 1 14 . 1 1 64 64 ILE CB C 64 42.133 42.133 41.580 0.553 17927 11116 1 14 . 1 1 64 64 ILE H H 64 8.678 8.678 6.983 1.695 17927 11117 1 14 . 1 1 65 65 HIS N N 65 125.584 125.584 124.375 1.209 17927 11118 1 14 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.886 0.157 17927 11119 1 14 . 1 1 65 65 HIS C C 65 174.153 174.153 173.699 0.454 17927 11120 1 14 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.078 0.881 17927 11121 1 14 . 1 1 65 65 HIS CB C 65 34.156 34.156 31.809 2.347 17927 11122 1 14 . 1 1 65 65 HIS H H 65 9.204 9.204 8.669 0.535 17927 11123 1 14 . 1 1 66 66 PHE N N 66 123.244 123.244 124.977 -1.733 17927 11124 1 14 . 1 1 66 66 PHE HA H 66 5.210 5.210 5.042 0.168 17927 11125 1 14 . 1 1 66 66 PHE C C 66 175.463 175.463 174.984 0.479 17927 11126 1 14 . 1 1 66 66 PHE CA C 66 58.088 58.088 57.971 0.117 17927 11127 1 14 . 1 1 66 66 PHE CB C 66 39.637 39.637 38.977 0.660 17927 11128 1 14 . 1 1 66 66 PHE H H 66 9.262 9.262 9.181 0.081 17927 11129 1 14 . 1 1 67 67 VAL N N 67 126.201 126.201 126.350 -0.149 17927 11130 1 14 . 1 1 67 67 VAL HA H 67 4.834 4.834 5.059 -0.225 17927 11131 1 14 . 1 1 67 67 VAL C C 67 174.364 174.364 175.656 -1.292 17927 11132 1 14 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.705 0.019 17927 11133 1 14 . 1 1 67 67 VAL CB C 67 34.893 34.893 33.406 1.487 17927 11134 1 14 . 1 1 67 67 VAL H H 67 8.843 8.843 9.297 -0.454 17927 11135 1 14 . 1 1 68 68 SER N N 68 124.528 124.528 123.711 0.817 17927 11136 1 14 . 1 1 68 68 SER HA H 68 5.585 5.585 5.420 0.165 17927 11137 1 14 . 1 1 68 68 SER C C 68 172.858 172.858 172.999 -0.141 17927 11138 1 14 . 1 1 68 68 SER CA C 68 57.282 57.282 57.790 -0.508 17927 11139 1 14 . 1 1 68 68 SER CB C 68 65.032 65.032 63.980 1.052 17927 11140 1 14 . 1 1 68 68 SER H H 68 9.243 9.243 8.745 0.498 17927 11141 1 14 . 1 1 69 69 LEU N N 69 126.695 126.695 126.146 0.549 17927 11142 1 14 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.702 -1.185 17927 11143 1 14 . 1 1 69 69 LEU C C 69 174.652 174.652 175.044 -0.392 17927 11144 1 14 . 1 1 69 69 LEU CA C 69 52.827 52.827 54.061 -1.234 17927 11145 1 14 . 1 1 69 69 LEU CB C 69 43.895 43.895 46.498 -2.603 17927 11146 1 14 . 1 1 69 69 LEU H H 69 9.360 9.360 9.096 0.264 17927 11147 1 14 . 1 1 70 70 SER N N 70 116.379 116.379 120.692 -4.313 17927 11148 1 14 . 1 1 70 70 SER HA H 70 4.905 4.905 5.208 -0.303 17927 11149 1 14 . 1 1 70 70 SER C C 70 176.307 176.307 175.128 1.179 17927 11150 1 14 . 1 1 70 70 SER CA C 70 55.213 55.213 55.647 -0.434 17927 11151 1 14 . 1 1 70 70 SER CB C 70 63.519 63.519 64.096 -0.576 17927 11152 1 14 . 1 1 70 70 SER H H 70 7.981 7.981 8.845 -0.864 17927 11153 1 14 . 1 1 71 71 CYS N N 71 124.670 124.670 125.101 -0.431 17927 11154 1 14 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.582 0.376 17927 11155 1 14 . 1 1 71 71 CYS C C 71 173.996 173.996 174.469 -0.473 17927 11156 1 14 . 1 1 71 71 CYS CA C 71 55.483 55.483 57.082 -1.599 17927 11157 1 14 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.387 0.724 17927 11158 1 14 . 1 1 71 71 CYS H H 71 8.609 8.609 9.025 -0.416 17927 11159 1 14 . 1 1 72 72 ASP N N 72 122.398 122.398 124.085 -1.687 17927 11160 1 14 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.614 -0.322 17927 11161 1 14 . 1 1 72 72 ASP C C 72 176.653 176.653 176.324 0.329 17927 11162 1 14 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.785 0.997 17927 11163 1 14 . 1 1 72 72 ASP CB C 72 41.526 41.526 40.837 0.688 17927 11164 1 14 . 1 1 72 72 ASP H H 72 8.557 8.557 7.605 0.952 17927 11165 1 14 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.259 -0.194 17927 11166 1 14 . 1 1 73 73 LYS C C 73 176.545 176.545 175.892 0.653 17927 11167 1 14 . 1 1 73 73 LYS CA C 73 58.458 58.458 57.843 0.615 17927 11168 1 14 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.993 -0.352 17927 11169 1 14 . 1 1 74 74 ASN N N 74 117.616 117.616 118.454 -0.838 17927 11170 1 14 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.702 0.203 17927 11171 1 14 . 1 1 74 74 ASN C C 74 174.894 174.894 175.434 -0.540 17927 11172 1 14 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.999 -1.478 17927 11173 1 14 . 1 1 74 74 ASN CB C 74 38.109 38.109 38.058 0.051 17927 11174 1 14 . 1 1 74 74 ASN H H 74 8.625 8.625 8.213 0.412 17927 11175 1 14 . 1 1 75 75 LYS N N 75 126.797 126.797 125.348 1.449 17927 11176 1 14 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.880 -0.457 17927 11177 1 14 . 1 1 75 75 LYS C C 75 178.058 178.058 177.656 0.402 17927 11178 1 14 . 1 1 75 75 LYS CA C 75 60.173 60.173 59.506 0.667 17927 11179 1 14 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.495 0.796 17927 11180 1 14 . 1 1 75 75 LYS H H 75 8.588 8.588 8.140 0.448 17927 11181 1 14 . 1 1 76 76 LYS N N 76 117.875 117.875 120.417 -2.542 17927 11182 1 14 . 1 1 76 76 LYS HA H 76 4.200 4.200 3.986 0.214 17927 11183 1 14 . 1 1 76 76 LYS C C 76 178.791 178.791 178.531 0.260 17927 11184 1 14 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.871 -1.263 17927 11185 1 14 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.904 -0.414 17927 11186 1 14 . 1 1 76 76 LYS H H 76 8.041 8.041 8.520 -0.479 17927 11187 1 14 . 1 1 77 77 ALA N N 77 121.567 121.567 121.038 0.529 17927 11188 1 14 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.155 -0.032 17927 11189 1 14 . 1 1 77 77 ALA C C 77 181.191 181.191 179.378 1.813 17927 11190 1 14 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.690 0.267 17927 11191 1 14 . 1 1 77 77 ALA CB C 77 17.759 17.759 17.893 -0.134 17927 11192 1 14 . 1 1 77 77 ALA H H 77 7.366 7.366 8.512 -1.146 17927 11193 1 14 . 1 1 78 78 TRP N N 78 119.497 119.497 119.667 -0.170 17927 11194 1 14 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.259 -0.182 17927 11195 1 14 . 1 1 78 78 TRP C C 78 175.942 175.942 177.199 -1.257 17927 11196 1 14 . 1 1 78 78 TRP CA C 78 61.761 61.761 58.830 2.932 17927 11197 1 14 . 1 1 78 78 TRP CB C 78 27.272 27.272 30.161 -2.889 17927 11198 1 14 . 1 1 78 78 TRP H H 78 7.187 7.187 7.784 -0.597 17927 11199 1 14 . 1 1 79 79 GLU N N 79 118.771 118.771 118.495 0.276 17927 11200 1 14 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.573 -0.559 17927 11201 1 14 . 1 1 79 79 GLU C C 79 179.863 179.863 178.954 0.909 17927 11202 1 14 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.427 -0.317 17927 11203 1 14 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.431 1.789 17927 11204 1 14 . 1 1 79 79 GLU H H 79 8.813 8.813 8.109 0.704 17927 11205 1 14 . 1 1 80 80 ASN N N 80 115.964 115.964 118.157 -2.193 17927 11206 1 14 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.384 -0.045 17927 11207 1 14 . 1 1 80 80 ASN C C 80 176.749 176.749 177.591 -0.842 17927 11208 1 14 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.806 0.229 17927 11209 1 14 . 1 1 80 80 ASN CB C 80 38.489 38.489 37.946 0.543 17927 11210 1 14 . 1 1 80 80 ASN H H 80 8.491 8.491 7.985 0.506 17927 11211 1 14 . 1 1 81 81 MET N N 81 119.670 119.670 120.196 -0.526 17927 11212 1 14 . 1 1 81 81 MET HA H 81 4.149 4.149 4.190 -0.041 17927 11213 1 14 . 1 1 81 81 MET C C 81 177.933 177.933 178.136 -0.203 17927 11214 1 14 . 1 1 81 81 MET CA C 81 60.276 60.276 58.870 1.406 17927 11215 1 14 . 1 1 81 81 MET CB C 81 32.518 32.518 32.867 -0.349 17927 11216 1 14 . 1 1 81 81 MET H H 81 7.667 7.667 7.525 0.142 17927 11217 1 14 . 1 1 82 82 VAL N N 82 117.634 117.634 118.857 -1.223 17927 11218 1 14 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.543 -0.240 17927 11219 1 14 . 1 1 82 82 VAL C C 82 179.005 179.005 177.445 1.560 17927 11220 1 14 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.157 0.880 17927 11221 1 14 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.029 0.736 17927 11222 1 14 . 1 1 82 82 VAL H H 82 8.338 8.338 7.922 0.416 17927 11223 1 14 . 1 1 83 83 THR N N 83 110.519 110.519 116.286 -5.767 17927 11224 1 14 . 1 1 83 83 THR HA H 83 3.983 3.983 4.019 -0.036 17927 11225 1 14 . 1 1 83 83 THR C C 83 177.591 177.591 176.680 0.911 17927 11226 1 14 . 1 1 83 83 THR CA C 83 65.431 65.431 66.680 -1.249 17927 11227 1 14 . 1 1 83 83 THR CB C 83 69.156 69.156 68.459 0.697 17927 11228 1 14 . 1 1 83 83 THR H H 83 7.659 7.659 7.602 0.057 17927 11229 1 14 . 1 1 84 84 LYS N N 84 123.927 123.927 119.666 4.261 17927 11230 1 14 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.226 -0.157 17927 11231 1 14 . 1 1 84 84 LYS C C 84 178.582 178.582 178.151 0.431 17927 11232 1 14 . 1 1 84 84 LYS CA C 84 59.877 59.877 57.508 2.369 17927 11233 1 14 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.236 0.087 17927 11234 1 14 . 1 1 84 84 LYS H H 84 8.665 8.665 7.697 0.968 17927 11235 1 14 . 1 1 85 85 ASP N N 85 116.280 116.280 117.678 -1.398 17927 11236 1 14 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.660 0.090 17927 11237 1 14 . 1 1 85 85 ASP C C 85 175.086 175.086 176.088 -1.002 17927 11238 1 14 . 1 1 85 85 ASP CA C 85 54.693 54.693 55.025 -0.332 17927 11239 1 14 . 1 1 85 85 ASP CB C 85 39.685 39.685 41.817 -2.132 17927 11240 1 14 . 1 1 85 85 ASP H H 85 8.179 8.179 8.198 -0.019 17927 11241 1 14 . 1 1 86 86 GLN N N 86 116.258 116.258 113.279 2.979 17927 11242 1 14 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.819 0.089 17927 11243 1 14 . 1 1 86 86 GLN C C 86 175.659 175.659 175.653 0.006 17927 11244 1 14 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.575 -0.404 17927 11245 1 14 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.219 0.071 17927 11246 1 14 . 1 1 86 86 GLN H H 86 7.431 7.431 7.548 -0.117 17927 11247 1 14 . 1 1 87 87 LEU N N 87 117.031 117.031 119.241 -2.210 17927 11248 1 14 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.058 0.032 17927 11249 1 14 . 1 1 87 87 LEU C C 87 178.225 178.225 176.230 1.995 17927 11250 1 14 . 1 1 87 87 LEU CA C 87 55.932 55.932 56.482 -0.550 17927 11251 1 14 . 1 1 87 87 LEU CB C 87 41.202 41.202 41.661 -0.459 17927 11252 1 14 . 1 1 87 87 LEU H H 87 7.736 7.736 7.266 0.470 17927 11253 1 14 . 1 1 88 88 LYS N N 88 122.367 122.367 122.957 -0.590 17927 11254 1 14 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.427 0.209 17927 11255 1 14 . 1 1 88 88 LYS C C 88 177.538 177.538 176.190 1.348 17927 11256 1 14 . 1 1 88 88 LYS CA C 88 54.930 54.930 54.522 0.408 17927 11257 1 14 . 1 1 88 88 LYS CB C 88 33.316 33.316 34.880 -1.564 17927 11258 1 14 . 1 1 88 88 LYS H H 88 8.496 8.496 7.903 0.593 17927 11259 1 14 . 1 1 89 89 GLY N N 89 108.452 108.452 107.740 0.712 17927 11260 1 14 . 1 1 89 89 GLY C C 89 173.781 173.781 173.528 0.253 17927 11261 1 14 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.661 0.697 17927 11262 1 14 . 1 1 89 89 GLY H H 89 8.497 8.497 8.143 0.354 17927 11263 1 14 . 1 1 90 90 ILE N N 90 123.295 123.295 123.031 0.264 17927 11264 1 14 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.340 0.031 17927 11265 1 14 . 1 1 90 90 ILE C C 90 175.606 175.606 174.280 1.326 17927 11266 1 14 . 1 1 90 90 ILE CA C 90 62.001 62.001 59.371 2.630 17927 11267 1 14 . 1 1 90 90 ILE CB C 90 38.036 38.036 37.265 0.771 17927 11268 1 14 . 1 1 90 90 ILE H H 90 8.728 8.728 7.897 0.831 17927 11269 1 14 . 1 1 91 91 GLN N N 91 128.632 128.632 125.594 3.038 17927 11270 1 14 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.768 -0.002 17927 11271 1 14 . 1 1 91 91 GLN C C 91 174.618 174.618 174.230 0.388 17927 11272 1 14 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.699 1.151 17927 11273 1 14 . 1 1 91 91 GLN CB C 91 28.341 28.341 29.647 -1.306 17927 11274 1 14 . 1 1 91 91 GLN H H 91 8.762 8.762 9.454 -0.692 17927 11275 1 14 . 1 1 92 92 LEU N N 92 120.830 120.830 125.228 -4.398 17927 11276 1 14 . 1 1 92 92 LEU HA H 92 5.580 5.580 4.953 0.627 17927 11277 1 14 . 1 1 92 92 LEU C C 92 176.828 176.828 176.151 0.677 17927 11278 1 14 . 1 1 92 92 LEU CA C 92 52.801 52.801 54.159 -1.358 17927 11279 1 14 . 1 1 92 92 LEU CB C 92 44.210 44.210 43.856 0.354 17927 11280 1 14 . 1 1 92 92 LEU H H 92 9.011 9.011 9.221 -0.210 17927 11281 1 14 . 1 1 93 93 HIS N N 93 121.481 121.481 123.774 -2.293 17927 11282 1 14 . 1 1 93 93 HIS HA H 93 3.931 3.931 4.941 -1.010 17927 11283 1 14 . 1 1 93 93 HIS C C 93 173.590 173.590 174.120 -0.530 17927 11284 1 14 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.215 1.368 17927 11285 1 14 . 1 1 93 93 HIS CB C 93 32.250 32.250 32.679 -0.429 17927 11286 1 14 . 1 1 93 93 HIS H H 93 8.038 8.038 9.170 -1.132 17927 11287 1 14 . 1 1 94 94 MET N N 94 121.881 121.881 126.493 -4.612 17927 11288 1 14 . 1 1 94 94 MET HA H 94 3.866 3.866 4.071 -0.205 17927 11289 1 14 . 1 1 94 94 MET C C 94 177.035 177.035 176.373 0.662 17927 11290 1 14 . 1 1 94 94 MET CA C 94 55.189 55.189 58.033 -2.844 17927 11291 1 14 . 1 1 94 94 MET CB C 94 33.993 33.993 33.424 0.569 17927 11292 1 14 . 1 1 94 94 MET H H 94 8.039 8.039 8.570 -0.531 17927 11293 1 14 . 1 1 95 95 GLY N N 95 104.041 104.041 105.749 -1.708 17927 11294 1 14 . 1 1 95 95 GLY C C 95 174.251 174.251 175.471 -1.220 17927 11295 1 14 . 1 1 95 95 GLY CA C 95 46.580 46.580 46.757 -0.177 17927 11296 1 14 . 1 1 95 95 GLY H H 95 5.666 5.666 7.648 -1.982 17927 11297 1 14 . 1 1 96 96 THR N N 96 114.114 114.114 118.954 -4.840 17927 11298 1 14 . 1 1 96 96 THR HA H 96 4.211 4.211 4.447 -0.236 17927 11299 1 14 . 1 1 96 96 THR C C 96 175.122 175.122 173.244 1.878 17927 11300 1 14 . 1 1 96 96 THR CA C 96 61.339 61.339 62.852 -1.513 17927 11301 1 14 . 1 1 96 96 THR CB C 96 68.615 68.615 69.982 -1.367 17927 11302 1 14 . 1 1 96 96 THR H H 96 8.517 8.517 7.898 0.619 17927 11303 1 14 . 1 1 97 97 ASP N N 97 121.892 121.892 124.732 -2.840 17927 11304 1 14 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.823 -0.238 17927 11305 1 14 . 1 1 97 97 ASP C C 97 178.241 178.241 175.439 2.802 17927 11306 1 14 . 1 1 97 97 ASP CA C 97 55.800 55.800 53.103 2.697 17927 11307 1 14 . 1 1 97 97 ASP CB C 97 43.129 43.129 40.412 2.717 17927 11308 1 14 . 1 1 97 97 ASP H H 97 7.563 7.563 7.663 -0.100 17927 11309 1 14 . 1 1 98 98 ARG N N 98 127.508 127.508 122.555 4.953 17927 11310 1 14 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.598 -0.206 17927 11311 1 14 . 1 1 98 98 ARG C C 98 176.724 176.724 177.030 -0.306 17927 11312 1 14 . 1 1 98 98 ARG CA C 98 55.939 55.939 55.465 0.474 17927 11313 1 14 . 1 1 98 98 ARG CB C 98 30.291 30.291 28.225 2.066 17927 11314 1 14 . 1 1 98 98 ARG H H 98 9.225 9.225 7.707 1.518 17927 11315 1 14 . 1 1 99 99 THR N N 99 116.384 116.384 119.771 -3.387 17927 11316 1 14 . 1 1 99 99 THR HA H 99 3.987 3.987 4.119 -0.132 17927 11317 1 14 . 1 1 99 99 THR C C 99 176.969 176.969 176.162 0.807 17927 11318 1 14 . 1 1 99 99 THR CA C 99 67.714 67.714 67.564 0.150 17927 11319 1 14 . 1 1 99 99 THR CB C 99 68.777 68.777 68.595 0.182 17927 11320 1 14 . 1 1 99 99 THR H H 99 8.382 8.382 7.871 0.511 17927 11321 1 14 . 1 1 100 100 PHE N N 100 123.232 123.232 121.640 1.592 17927 11322 1 14 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.503 -0.330 17927 11323 1 14 . 1 1 100 100 PHE C C 100 177.010 177.010 177.300 -0.290 17927 11324 1 14 . 1 1 100 100 PHE CA C 100 61.923 61.923 61.270 0.653 17927 11325 1 14 . 1 1 100 100 PHE CB C 100 40.762 40.762 38.753 2.009 17927 11326 1 14 . 1 1 100 100 PHE H H 100 7.998 7.998 7.823 0.175 17927 11327 1 14 . 1 1 101 101 MET N N 101 115.968 115.968 119.667 -3.699 17927 11328 1 14 . 1 1 101 101 MET HA H 101 3.975 3.975 3.931 0.044 17927 11329 1 14 . 1 1 101 101 MET C C 101 178.763 178.763 177.718 1.045 17927 11330 1 14 . 1 1 101 101 MET CA C 101 58.552 58.552 59.285 -0.733 17927 11331 1 14 . 1 1 101 101 MET CB C 101 32.593 32.593 32.342 0.251 17927 11332 1 14 . 1 1 101 101 MET H H 101 7.828 7.828 8.153 -0.325 17927 11333 1 14 . 1 1 102 102 ASP N N 102 117.553 117.553 119.391 -1.838 17927 11334 1 14 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.422 0.100 17927 11335 1 14 . 1 1 102 102 ASP C C 102 179.503 179.503 178.899 0.604 17927 11336 1 14 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.639 -0.749 17927 11337 1 14 . 1 1 102 102 ASP CB C 102 39.926 39.926 41.049 -1.123 17927 11338 1 14 . 1 1 102 102 ASP H H 102 8.828 8.828 8.256 0.572 17927 11339 1 14 . 1 1 103 103 ALA N N 103 122.984 122.984 121.602 1.382 17927 11340 1 14 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.155 -0.169 17927 11341 1 14 . 1 1 103 103 ALA C C 103 178.782 178.782 179.303 -0.521 17927 11342 1 14 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.430 0.664 17927 11343 1 14 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.760 -0.197 17927 11344 1 14 . 1 1 103 103 ALA H H 103 7.567 7.567 8.156 -0.589 17927 11345 1 14 . 1 1 104 104 TYR N N 104 112.159 112.159 114.398 -2.239 17927 11346 1 14 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.527 -0.303 17927 11347 1 14 . 1 1 104 104 TYR C C 104 173.821 173.821 175.043 -1.222 17927 11348 1 14 . 1 1 104 104 TYR CA C 104 58.498 58.498 56.637 1.861 17927 11349 1 14 . 1 1 104 104 TYR CB C 104 38.393 38.393 39.265 -0.872 17927 11350 1 14 . 1 1 104 104 TYR H H 104 7.203 7.203 7.871 -0.668 17927 11351 1 14 . 1 1 105 105 LEU N N 105 119.433 119.433 118.142 1.291 17927 11352 1 14 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.942 0.043 17927 11353 1 14 . 1 1 105 105 LEU C C 105 176.721 176.721 176.311 0.410 17927 11354 1 14 . 1 1 105 105 LEU CA C 105 55.785 55.785 56.012 -0.227 17927 11355 1 14 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.785 -1.342 17927 11356 1 14 . 1 1 105 105 LEU H H 105 7.582 7.582 7.689 -0.107 17927 11357 1 14 . 1 1 106 106 ILE N N 106 119.575 119.575 119.081 0.494 17927 11358 1 14 . 1 1 106 106 ILE HA H 106 4.002 4.002 3.794 0.208 17927 11359 1 14 . 1 1 106 106 ILE C C 106 175.459 175.459 174.795 0.664 17927 11360 1 14 . 1 1 106 106 ILE CA C 106 62.043 62.043 62.393 -0.350 17927 11361 1 14 . 1 1 106 106 ILE CB C 106 36.335 36.335 35.423 0.912 17927 11362 1 14 . 1 1 106 106 ILE H H 106 8.774 8.774 7.799 0.975 17927 11363 1 14 . 1 1 107 107 ASN N N 107 126.514 126.514 123.385 3.129 17927 11364 1 14 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.853 0.010 17927 11365 1 14 . 1 1 107 107 ASN C C 107 174.584 174.584 175.902 -1.318 17927 11366 1 14 . 1 1 107 107 ASN CA C 107 53.112 53.112 54.021 -0.909 17927 11367 1 14 . 1 1 107 107 ASN CB C 107 38.977 38.977 40.668 -1.691 17927 11368 1 14 . 1 1 107 107 ASN H H 107 8.364 8.364 8.351 0.013 17927 11369 1 14 . 1 1 108 108 GLY N N 108 108.469 108.469 110.671 -2.202 17927 11370 1 14 . 1 1 108 108 GLY C C 108 171.245 171.245 173.278 -2.033 17927 11371 1 14 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.969 0.300 17927 11372 1 14 . 1 1 108 108 GLY H H 108 7.678 7.678 8.281 -0.603 17927 11373 1 14 . 1 1 109 109 ILE N N 109 112.817 112.817 120.323 -7.506 17927 11374 1 14 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.596 -0.190 17927 11375 1 14 . 1 1 109 109 ILE C C 109 173.498 173.498 174.583 -1.085 17927 11376 1 14 . 1 1 109 109 ILE CA C 109 58.384 58.384 56.056 2.328 17927 11377 1 14 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.308 2.014 17927 11378 1 14 . 1 1 109 109 ILE H H 109 7.868 7.868 7.452 0.416 17927 11379 1 14 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.605 0.137 17927 11380 1 14 . 1 1 110 110 PRO C C 110 175.715 175.715 175.928 -0.213 17927 11381 1 14 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.525 -0.248 17927 11382 1 14 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.453 3.915 17927 11383 1 14 . 1 1 111 111 ARG N N 111 122.358 122.358 120.304 2.054 17927 11384 1 14 . 1 1 111 111 ARG HA H 111 4.469 4.469 4.238 0.231 17927 11385 1 14 . 1 1 111 111 ARG C C 111 171.541 171.541 174.909 -3.368 17927 11386 1 14 . 1 1 111 111 ARG CA C 111 54.356 54.356 53.969 0.387 17927 11387 1 14 . 1 1 111 111 ARG CB C 111 33.430 33.430 33.165 0.265 17927 11388 1 14 . 1 1 111 111 ARG H H 111 7.732 7.732 8.405 -0.673 17927 11389 1 14 . 1 1 112 112 PHE N N 112 125.103 125.103 119.491 5.612 17927 11390 1 14 . 1 1 112 112 PHE HA H 112 5.773 5.773 5.021 0.752 17927 11391 1 14 . 1 1 112 112 PHE C C 112 175.097 175.097 174.525 0.572 17927 11392 1 14 . 1 1 112 112 PHE CA C 112 55.791 55.791 55.894 -0.103 17927 11393 1 14 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.572 1.356 17927 11394 1 14 . 1 1 112 112 PHE H H 112 8.929 8.929 7.518 1.411 17927 11395 1 14 . 1 1 113 113 ILE N N 113 123.778 123.778 123.389 0.389 17927 11396 1 14 . 1 1 113 113 ILE HA H 113 4.543 4.543 5.002 -0.459 17927 11397 1 14 . 1 1 113 113 ILE C C 113 173.197 173.197 174.101 -0.904 17927 11398 1 14 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.840 0.446 17927 11399 1 14 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.370 1.876 17927 11400 1 14 . 1 1 113 113 ILE H H 113 8.873 8.873 8.917 -0.044 17927 11401 1 14 . 1 1 114 114 LEU N N 114 127.146 127.146 127.337 -0.191 17927 11402 1 14 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.381 0.633 17927 11403 1 14 . 1 1 114 114 LEU C C 114 175.080 175.080 174.542 0.538 17927 11404 1 14 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.651 -0.250 17927 11405 1 14 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.343 1.027 17927 11406 1 14 . 1 1 114 114 LEU H H 114 8.974 8.974 9.015 -0.041 17927 11407 1 14 . 1 1 115 115 LEU N N 115 128.323 128.323 124.634 3.689 17927 11408 1 14 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.205 0.227 17927 11409 1 14 . 1 1 115 115 LEU C C 115 176.660 176.660 175.617 1.043 17927 11410 1 14 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.747 -0.670 17927 11411 1 14 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.369 -1.785 17927 11412 1 14 . 1 1 115 115 LEU H H 115 9.874 9.874 9.463 0.411 17927 11413 1 14 . 1 1 116 116 ASP N N 116 119.834 119.834 121.619 -1.785 17927 11414 1 14 . 1 1 116 116 ASP HA H 116 4.935 4.935 5.031 -0.096 17927 11415 1 14 . 1 1 116 116 ASP C C 116 176.898 176.898 177.355 -0.457 17927 11416 1 14 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.177 -0.872 17927 11417 1 14 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.854 -1.826 17927 11418 1 14 . 1 1 116 116 ASP H H 116 9.357 9.357 8.748 0.609 17927 11419 1 14 . 1 1 117 117 ARG N N 117 113.356 113.356 120.901 -7.545 17927 11420 1 14 . 1 1 117 117 ARG HA H 117 3.717 3.717 4.013 -0.296 17927 11421 1 14 . 1 1 117 117 ARG C C 117 177.105 177.105 178.168 -1.063 17927 11422 1 14 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.465 -1.280 17927 11423 1 14 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.964 0.473 17927 11424 1 14 . 1 1 117 117 ARG H H 117 7.697 7.697 8.196 -0.499 17927 11425 1 14 . 1 1 118 118 ASP N N 118 117.226 117.226 116.085 1.141 17927 11426 1 14 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.554 0.341 17927 11427 1 14 . 1 1 118 118 ASP C C 118 176.657 176.657 176.724 -0.067 17927 11428 1 14 . 1 1 118 118 ASP CA C 118 53.517 53.517 54.908 -1.391 17927 11429 1 14 . 1 1 118 118 ASP CB C 118 42.556 42.556 40.585 1.971 17927 11430 1 14 . 1 1 118 118 ASP H H 118 8.456 8.456 8.471 -0.015 17927 11431 1 14 . 1 1 119 119 GLY N N 119 109.074 109.074 107.069 2.005 17927 11432 1 14 . 1 1 119 119 GLY C C 119 173.355 173.355 174.037 -0.682 17927 11433 1 14 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.319 0.937 17927 11434 1 14 . 1 1 119 119 GLY H H 119 8.183 8.183 8.256 -0.073 17927 11435 1 14 . 1 1 120 120 LYS N N 120 120.744 120.744 121.371 -0.627 17927 11436 1 14 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.580 -0.047 17927 11437 1 14 . 1 1 120 120 LYS C C 120 177.229 177.229 176.261 0.968 17927 11438 1 14 . 1 1 120 120 LYS CA C 120 55.287 55.287 54.926 0.361 17927 11439 1 14 . 1 1 120 120 LYS CB C 120 32.581 32.581 32.900 -0.319 17927 11440 1 14 . 1 1 120 120 LYS H H 120 8.449 8.449 7.443 1.006 17927 11441 1 14 . 1 1 121 121 ILE N N 121 121.221 121.221 128.197 -6.976 17927 11442 1 14 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.986 -0.100 17927 11443 1 14 . 1 1 121 121 ILE C C 121 177.819 177.819 176.577 1.242 17927 11444 1 14 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.277 0.638 17927 11445 1 14 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.196 2.194 17927 11446 1 14 . 1 1 121 121 ILE H H 121 8.715 8.715 8.895 -0.180 17927 11447 1 14 . 1 1 122 122 ILE N N 122 127.165 127.165 128.879 -1.714 17927 11448 1 14 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.255 0.086 17927 11449 1 14 . 1 1 122 122 ILE C C 122 176.978 176.978 176.768 0.210 17927 11450 1 14 . 1 1 122 122 ILE CA C 122 63.719 63.719 62.182 1.537 17927 11451 1 14 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.325 0.327 17927 11452 1 14 . 1 1 122 122 ILE H H 122 8.974 8.974 8.626 0.348 17927 11453 1 14 . 1 1 123 123 SER N N 123 111.227 111.227 114.938 -3.711 17927 11454 1 14 . 1 1 123 123 SER HA H 123 4.738 4.738 4.744 -0.006 17927 11455 1 14 . 1 1 123 123 SER C C 123 174.184 174.184 173.973 0.211 17927 11456 1 14 . 1 1 123 123 SER CA C 123 57.383 57.383 57.027 0.356 17927 11457 1 14 . 1 1 123 123 SER CB C 123 65.326 65.326 64.988 0.338 17927 11458 1 14 . 1 1 123 123 SER H H 123 7.850 7.850 8.278 -0.428 17927 11459 1 14 . 1 1 124 124 ALA N N 124 131.373 131.373 127.516 3.857 17927 11460 1 14 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.265 0.220 17927 11461 1 14 . 1 1 124 124 ALA C C 124 175.147 175.147 176.369 -1.222 17927 11462 1 14 . 1 1 124 124 ALA CA C 124 53.035 53.035 53.918 -0.883 17927 11463 1 14 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.069 -0.407 17927 11464 1 14 . 1 1 124 124 ALA H H 124 9.384 9.384 8.710 0.674 17927 11465 1 14 . 1 1 125 125 ASN N N 125 119.476 119.476 114.067 5.409 17927 11466 1 14 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.195 -0.139 17927 11467 1 14 . 1 1 125 125 ASN C C 125 173.593 173.593 174.214 -0.621 17927 11468 1 14 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.310 0.042 17927 11469 1 14 . 1 1 125 125 ASN CB C 125 38.304 38.304 39.968 -1.664 17927 11470 1 14 . 1 1 125 125 ASN H H 125 8.191 8.191 7.785 0.406 17927 11471 1 14 . 1 1 126 126 MET N N 126 122.705 122.705 123.680 -0.975 17927 11472 1 14 . 1 1 126 126 MET HA H 126 4.585 4.585 4.540 0.045 17927 11473 1 14 . 1 1 126 126 MET C C 126 175.215 175.215 175.787 -0.572 17927 11474 1 14 . 1 1 126 126 MET CA C 126 53.849 53.849 58.625 -4.776 17927 11475 1 14 . 1 1 126 126 MET CB C 126 31.312 31.312 33.908 -2.596 17927 11476 1 14 . 1 1 126 126 MET H H 126 8.376 8.376 9.413 -1.037 17927 11477 1 14 . 1 1 127 127 THR N N 127 111.016 111.016 107.915 3.101 17927 11478 1 14 . 1 1 127 127 THR HA H 127 4.291 4.291 4.182 0.109 17927 11479 1 14 . 1 1 127 127 THR C C 127 174.574 174.574 173.350 1.224 17927 11480 1 14 . 1 1 127 127 THR CA C 127 62.085 62.085 61.669 0.416 17927 11481 1 14 . 1 1 127 127 THR CB C 127 69.733 69.733 70.618 -0.885 17927 11482 1 14 . 1 1 127 127 THR H H 127 7.714 7.714 8.133 -0.419 17927 11483 1 14 . 1 1 128 128 ARG N N 128 118.722 118.722 120.160 -1.438 17927 11484 1 14 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.233 -0.925 17927 11485 1 14 . 1 1 128 128 ARG C C 128 176.978 176.978 173.773 3.205 17927 11486 1 14 . 1 1 128 128 ARG CA C 128 54.727 54.727 54.993 -0.266 17927 11487 1 14 . 1 1 128 128 ARG CB C 128 29.598 29.598 32.193 -2.595 17927 11488 1 14 . 1 1 128 128 ARG H H 128 8.658 8.658 7.334 1.324 17927 11489 1 14 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.561 -0.628 17927 11490 1 14 . 1 1 129 129 PRO C C 129 175.794 175.794 177.221 -1.427 17927 11491 1 14 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.549 1.000 17927 11492 1 14 . 1 1 129 129 PRO CB C 129 31.677 31.677 32.273 -0.596 17927 11493 1 14 . 1 1 130 130 SER N N 130 108.696 108.696 110.461 -1.765 17927 11494 1 14 . 1 1 130 130 SER HA H 130 3.988 3.988 4.528 -0.540 17927 11495 1 14 . 1 1 130 130 SER C C 130 174.445 174.445 173.037 1.408 17927 11496 1 14 . 1 1 130 130 SER CA C 130 58.911 58.911 57.023 1.888 17927 11497 1 14 . 1 1 130 130 SER CB C 130 62.680 62.680 62.875 -0.195 17927 11498 1 14 . 1 1 130 130 SER H H 130 8.375 8.375 8.145 0.230 17927 11499 1 14 . 1 1 131 131 ASP N N 131 126.377 126.377 123.339 3.038 17927 11500 1 14 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.938 -0.066 17927 11501 1 14 . 1 1 131 131 ASP C C 131 176.879 176.879 176.045 0.834 17927 11502 1 14 . 1 1 131 131 ASP CA C 131 51.195 51.195 51.545 -0.350 17927 11503 1 14 . 1 1 131 131 ASP CB C 131 42.816 42.816 43.187 -0.370 17927 11504 1 14 . 1 1 131 131 ASP H H 131 7.514 7.514 7.730 -0.216 17927 11505 1 14 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.187 0.205 17927 11506 1 14 . 1 1 132 132 PRO C C 132 178.097 178.097 178.528 -0.431 17927 11507 1 14 . 1 1 132 132 PRO CA C 132 65.079 65.079 65.097 -0.018 17927 11508 1 14 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.133 0.277 17927 11509 1 14 . 1 1 133 133 LYS N N 133 116.306 116.306 116.981 -0.675 17927 11510 1 14 . 1 1 133 133 LYS HA H 133 3.958 3.958 4.207 -0.249 17927 11511 1 14 . 1 1 133 133 LYS C C 133 179.532 179.532 179.079 0.453 17927 11512 1 14 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.258 -0.737 17927 11513 1 14 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.905 0.286 17927 11514 1 14 . 1 1 133 133 LYS H H 133 8.842 8.842 8.468 0.374 17927 11515 1 14 . 1 1 134 134 THR N N 134 120.833 120.833 116.295 4.538 17927 11516 1 14 . 1 1 134 134 THR HA H 134 3.147 3.147 3.626 -0.479 17927 11517 1 14 . 1 1 134 134 THR C C 134 173.356 173.356 175.288 -1.932 17927 11518 1 14 . 1 1 134 134 THR CA C 134 66.383 66.383 65.909 0.474 17927 11519 1 14 . 1 1 134 134 THR CB C 134 66.847 66.847 68.201 -1.354 17927 11520 1 14 . 1 1 134 134 THR H H 134 8.292 8.292 7.308 0.984 17927 11521 1 14 . 1 1 135 135 ALA N N 135 121.720 121.720 123.189 -1.469 17927 11522 1 14 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.916 -0.333 17927 11523 1 14 . 1 1 135 135 ALA C C 135 178.902 178.902 180.133 -1.231 17927 11524 1 14 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.784 0.215 17927 11525 1 14 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.211 -0.436 17927 11526 1 14 . 1 1 135 135 ALA H H 135 7.030 7.030 7.377 -0.347 17927 11527 1 14 . 1 1 136 136 GLU N N 136 114.623 114.623 119.185 -4.562 17927 11528 1 14 . 1 1 136 136 GLU HA H 136 3.922 3.922 3.874 0.048 17927 11529 1 14 . 1 1 136 136 GLU C C 136 179.199 179.199 178.862 0.337 17927 11530 1 14 . 1 1 136 136 GLU CA C 136 59.837 59.837 59.243 0.594 17927 11531 1 14 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.212 0.574 17927 11532 1 14 . 1 1 136 136 GLU H H 136 7.216 7.216 8.456 -1.240 17927 11533 1 14 . 1 1 137 137 LYS N N 137 120.789 120.789 119.180 1.609 17927 11534 1 14 . 1 1 137 137 LYS HA H 137 4.204 4.204 3.983 0.221 17927 11535 1 14 . 1 1 137 137 LYS C C 137 178.834 178.834 178.888 -0.054 17927 11536 1 14 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.638 -1.295 17927 11537 1 14 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.838 -1.375 17927 11538 1 14 . 1 1 137 137 LYS H H 137 7.681 7.681 7.559 0.122 17927 11539 1 14 . 1 1 138 138 PHE N N 138 118.373 118.373 116.996 1.377 17927 11540 1 14 . 1 1 138 138 PHE HA H 138 4.033 4.033 3.910 0.123 17927 11541 1 14 . 1 1 138 138 PHE C C 138 178.027 178.027 177.500 0.527 17927 11542 1 14 . 1 1 138 138 PHE CA C 138 57.507 57.507 60.167 -2.660 17927 11543 1 14 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.344 -1.455 17927 11544 1 14 . 1 1 138 138 PHE H H 138 8.059 8.059 7.341 0.718 17927 11545 1 14 . 1 1 139 139 ASN N N 139 117.611 117.611 115.991 1.620 17927 11546 1 14 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.538 -0.134 17927 11547 1 14 . 1 1 139 139 ASN C C 139 178.190 178.190 177.380 0.810 17927 11548 1 14 . 1 1 139 139 ASN CA C 139 56.224 56.224 55.573 0.651 17927 11549 1 14 . 1 1 139 139 ASN CB C 139 36.734 36.734 38.520 -1.786 17927 11550 1 14 . 1 1 139 139 ASN H H 139 8.683 8.683 8.131 0.552 17927 11551 1 14 . 1 1 140 140 GLU N N 140 121.432 121.432 122.839 -1.407 17927 11552 1 14 . 1 1 140 140 GLU HA H 140 4.005 4.005 3.988 0.017 17927 11553 1 14 . 1 1 140 140 GLU C C 140 179.751 179.751 178.639 1.112 17927 11554 1 14 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.769 -0.459 17927 11555 1 14 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.753 0.302 17927 11556 1 14 . 1 1 140 140 GLU H H 140 7.868 7.868 8.292 -0.424 17927 11557 1 14 . 1 1 141 141 LEU N N 141 119.968 119.968 115.944 4.024 17927 11558 1 14 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.207 -0.191 17927 11559 1 14 . 1 1 141 141 LEU C C 141 179.293 179.293 178.360 0.933 17927 11560 1 14 . 1 1 141 141 LEU CA C 141 57.436 57.436 56.812 0.624 17927 11561 1 14 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.544 -0.361 17927 11562 1 14 . 1 1 141 141 LEU H H 141 8.303 8.303 7.617 0.686 17927 11563 1 14 . 1 1 142 142 LEU N N 142 115.040 115.040 117.745 -2.705 17927 11564 1 14 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.327 0.057 17927 11565 1 14 . 1 1 142 142 LEU C C 142 178.002 178.002 177.873 0.129 17927 11566 1 14 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.217 0.062 17927 11567 1 14 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.389 0.257 17927 11568 1 14 . 1 1 142 142 LEU H H 142 8.230 8.230 7.595 0.635 17927 11569 1 14 . 1 1 143 143 GLY N N 143 108.977 108.977 107.212 1.765 17927 11570 1 14 . 1 1 143 143 GLY C C 143 175.216 175.216 174.511 0.705 17927 11571 1 14 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.675 1.066 17927 11572 1 14 . 1 1 143 143 GLY H H 143 7.762 7.762 7.690 0.072 17927 11573 1 14 . 1 1 144 144 LEU N N 144 119.660 119.660 119.421 0.239 17927 11574 1 14 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.859 -0.371 17927 11575 1 14 . 1 1 144 144 LEU C C 144 177.375 177.375 176.158 1.217 17927 11576 1 14 . 1 1 144 144 LEU CA C 144 54.525 54.525 53.989 0.536 17927 11577 1 14 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.998 -0.225 17927 11578 1 14 . 1 1 144 144 LEU H H 144 8.241 8.241 8.321 -0.080 17927 11579 1 14 . 1 1 145 145 GLU N N 145 119.959 119.959 120.824 -0.865 17927 11580 1 14 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.087 0.154 17927 11581 1 14 . 1 1 145 145 GLU C C 145 177.075 177.075 176.742 0.333 17927 11582 1 14 . 1 1 145 145 GLU CA C 145 56.799 56.799 56.956 -0.157 17927 11583 1 14 . 1 1 145 145 GLU CB C 145 30.168 30.168 28.565 1.603 17927 11584 1 14 . 1 1 145 145 GLU H H 145 8.410 8.410 8.098 0.312 17927 11585 1 14 . 1 1 146 146 GLY N N 146 109.412 109.412 108.984 0.428 17927 11586 1 14 . 1 1 146 146 GLY C C 146 174.276 174.276 174.105 0.171 17927 11587 1 14 . 1 1 146 146 GLY CA C 146 45.445 45.445 45.395 0.050 17927 11588 1 14 . 1 1 146 146 GLY H H 146 8.422 8.422 7.884 0.538 17927 11589 1 14 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.687 -0.031 17927 11590 1 14 . 1 1 151 151 HIS C C 151 173.990 173.990 174.521 -0.531 17927 11591 1 14 . 1 1 151 151 HIS CA C 151 56.044 56.044 55.722 0.322 17927 11592 1 14 . 1 1 151 151 HIS CB C 151 30.076 30.076 28.467 1.609 17927 11593 1 15 . 1 1 2 2 SER HA H 2 4.121 4.121 4.289 -0.168 17927 11594 1 15 . 1 1 2 2 SER CA C 2 57.293 57.293 58.666 -1.373 17927 11595 1 15 . 1 1 2 2 SER CB C 2 63.545 63.545 63.100 0.445 17927 11596 1 15 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.018 0.414 17927 11597 1 15 . 1 1 3 3 LEU C C 3 177.383 177.383 174.885 2.498 17927 11598 1 15 . 1 1 3 3 LEU CA C 3 55.575 55.575 55.466 0.109 17927 11599 1 15 . 1 1 3 3 LEU CB C 3 42.584 42.584 41.027 1.557 17927 11600 1 15 . 1 1 4 4 ARG N N 4 122.080 122.080 120.492 1.588 17927 11601 1 15 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.553 -0.169 17927 11602 1 15 . 1 1 4 4 ARG C C 4 176.410 176.410 175.679 0.731 17927 11603 1 15 . 1 1 4 4 ARG CA C 4 56.269 56.269 54.968 1.301 17927 11604 1 15 . 1 1 4 4 ARG CB C 4 30.842 30.842 31.404 -0.562 17927 11605 1 15 . 1 1 4 4 ARG H H 4 8.410 8.410 7.832 0.578 17927 11606 1 15 . 1 1 5 5 SER N N 5 117.023 117.023 116.157 0.866 17927 11607 1 15 . 1 1 5 5 SER HA H 5 4.423 4.423 4.210 0.213 17927 11608 1 15 . 1 1 5 5 SER C C 5 175.039 175.039 174.013 1.026 17927 11609 1 15 . 1 1 5 5 SER CA C 5 58.605 58.605 58.759 -0.154 17927 11610 1 15 . 1 1 5 5 SER CB C 5 64.044 64.044 62.291 1.753 17927 11611 1 15 . 1 1 5 5 SER H H 5 8.292 8.292 8.836 -0.544 17927 11612 1 15 . 1 1 6 6 GLY N N 6 110.718 110.718 109.627 1.091 17927 11613 1 15 . 1 1 6 6 GLY C C 6 173.654 173.654 172.725 0.929 17927 11614 1 15 . 1 1 6 6 GLY CA C 6 45.273 45.273 45.003 0.270 17927 11615 1 15 . 1 1 6 6 GLY H H 6 8.446 8.446 8.465 -0.019 17927 11616 1 15 . 1 1 7 7 ASN N N 7 119.287 119.287 119.624 -0.337 17927 11617 1 15 . 1 1 7 7 ASN HA H 7 5.024 5.024 5.076 -0.052 17927 11618 1 15 . 1 1 7 7 ASN C C 7 173.672 173.672 173.769 -0.097 17927 11619 1 15 . 1 1 7 7 ASN CA C 7 51.357 51.357 52.035 -0.678 17927 11620 1 15 . 1 1 7 7 ASN CB C 7 38.927 38.927 40.871 -1.944 17927 11621 1 15 . 1 1 7 7 ASN H H 7 8.273 8.273 8.297 -0.024 17927 11622 1 15 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.506 -0.059 17927 11623 1 15 . 1 1 8 8 PRO C C 8 176.899 176.899 177.209 -0.310 17927 11624 1 15 . 1 1 8 8 PRO CA C 8 63.429 63.429 64.177 -0.748 17927 11625 1 15 . 1 1 8 8 PRO CB C 8 32.216 32.216 32.171 0.045 17927 11626 1 15 . 1 1 9 9 SER N N 9 115.642 115.642 112.282 3.360 17927 11627 1 15 . 1 1 9 9 SER HA H 9 4.415 4.415 4.672 -0.257 17927 11628 1 15 . 1 1 9 9 SER C C 9 174.714 174.714 174.245 0.469 17927 11629 1 15 . 1 1 9 9 SER CA C 9 58.488 58.488 59.062 -0.574 17927 11630 1 15 . 1 1 9 9 SER CB C 9 64.048 64.048 63.837 0.211 17927 11631 1 15 . 1 1 9 9 SER H H 9 8.336 8.336 8.555 -0.219 17927 11632 1 15 . 1 1 10 10 ALA N N 10 126.808 126.808 123.524 3.284 17927 11633 1 15 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.959 -0.697 17927 11634 1 15 . 1 1 10 10 ALA C C 10 177.233 177.233 175.501 1.732 17927 11635 1 15 . 1 1 10 10 ALA CA C 10 53.230 53.230 52.084 1.146 17927 11636 1 15 . 1 1 10 10 ALA CB C 10 19.187 19.187 19.206 -0.019 17927 11637 1 15 . 1 1 10 10 ALA H H 10 8.137 8.137 7.220 0.917 17927 11638 1 15 . 1 1 11 11 ALA N N 11 120.449 120.449 119.584 0.865 17927 11639 1 15 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.726 -0.465 17927 11640 1 15 . 1 1 11 11 ALA C C 11 177.469 177.469 176.596 0.873 17927 11641 1 15 . 1 1 11 11 ALA CA C 11 52.475 52.475 51.954 0.521 17927 11642 1 15 . 1 1 11 11 ALA CB C 11 19.485 19.485 20.757 -1.272 17927 11643 1 15 . 1 1 11 11 ALA H H 11 7.851 7.851 7.688 0.163 17927 11644 1 15 . 1 1 12 12 SER N N 12 114.186 114.186 116.756 -2.570 17927 11645 1 15 . 1 1 12 12 SER HA H 12 4.312 4.312 3.994 0.318 17927 11646 1 15 . 1 1 12 12 SER C C 12 173.593 173.593 174.181 -0.588 17927 11647 1 15 . 1 1 12 12 SER CA C 12 58.099 58.099 58.780 -0.681 17927 11648 1 15 . 1 1 12 12 SER CB C 12 63.320 63.320 62.212 1.108 17927 11649 1 15 . 1 1 12 12 SER H H 12 7.990 7.990 8.694 -0.704 17927 11650 1 15 . 1 1 13 13 PHE N N 13 118.092 118.092 116.814 1.278 17927 11651 1 15 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.410 0.370 17927 11652 1 15 . 1 1 13 13 PHE C C 13 174.220 174.220 174.319 -0.099 17927 11653 1 15 . 1 1 13 13 PHE CA C 13 56.717 56.717 56.862 -0.145 17927 11654 1 15 . 1 1 13 13 PHE CB C 13 41.151 41.151 39.417 1.734 17927 11655 1 15 . 1 1 13 13 PHE H H 13 7.147 7.147 7.709 -0.562 17927 11656 1 15 . 1 1 14 14 SER N N 14 116.456 116.456 114.617 1.839 17927 11657 1 15 . 1 1 14 14 SER HA H 14 5.162 5.162 5.141 0.021 17927 11658 1 15 . 1 1 14 14 SER C C 14 172.626 172.626 172.759 -0.133 17927 11659 1 15 . 1 1 14 14 SER CA C 14 57.390 57.390 57.328 0.062 17927 11660 1 15 . 1 1 14 14 SER CB C 14 64.518 64.518 64.893 -0.375 17927 11661 1 15 . 1 1 14 14 SER H H 14 7.616 7.616 7.991 -0.375 17927 11662 1 15 . 1 1 15 15 TYR N N 15 122.384 122.384 123.930 -1.546 17927 11663 1 15 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.867 0.339 17927 11664 1 15 . 1 1 15 15 TYR C C 15 172.543 172.543 172.949 -0.406 17927 11665 1 15 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.179 -0.233 17927 11666 1 15 . 1 1 15 15 TYR CB C 15 43.227 43.227 41.724 1.503 17927 11667 1 15 . 1 1 15 15 TYR H H 15 8.558 8.558 9.131 -0.573 17927 11668 1 15 . 1 1 16 16 PRO HA H 16 5.109 5.109 5.254 -0.145 17927 11669 1 15 . 1 1 16 16 PRO C C 16 176.475 176.475 176.683 -0.208 17927 11670 1 15 . 1 1 16 16 PRO CA C 16 61.981 61.981 61.930 0.051 17927 11671 1 15 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.549 0.113 17927 11672 1 15 . 1 1 17 17 ASP N N 17 119.834 119.834 123.815 -3.981 17927 11673 1 15 . 1 1 17 17 ASP HA H 17 5.739 5.739 5.154 0.585 17927 11674 1 15 . 1 1 17 17 ASP C C 17 180.740 180.740 178.654 2.086 17927 11675 1 15 . 1 1 17 17 ASP CA C 17 51.717 51.717 54.983 -3.266 17927 11676 1 15 . 1 1 17 17 ASP CB C 17 42.561 42.561 42.449 0.112 17927 11677 1 15 . 1 1 17 17 ASP H H 17 8.643 8.643 8.876 -0.233 17927 11678 1 15 . 1 1 18 18 ILE N N 18 118.340 118.340 121.167 -2.827 17927 11679 1 15 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.689 0.762 17927 11680 1 15 . 1 1 18 18 ILE C C 18 175.742 175.742 176.129 -0.387 17927 11681 1 15 . 1 1 18 18 ILE CA C 18 61.894 61.894 64.662 -2.768 17927 11682 1 15 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.221 1.019 17927 11683 1 15 . 1 1 18 18 ILE H H 18 8.450 8.450 7.989 0.461 17927 11684 1 15 . 1 1 19 19 ASN N N 19 119.377 119.377 115.597 3.780 17927 11685 1 15 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.545 0.470 17927 11686 1 15 . 1 1 19 19 ASN C C 19 175.892 175.892 175.995 -0.103 17927 11687 1 15 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.031 -0.724 17927 11688 1 15 . 1 1 19 19 ASN CB C 19 39.825 39.825 38.441 1.384 17927 11689 1 15 . 1 1 19 19 ASN H H 19 8.376 8.376 8.277 0.099 17927 11690 1 15 . 1 1 20 20 GLY N N 20 109.535 109.535 108.063 1.472 17927 11691 1 15 . 1 1 20 20 GLY C C 20 174.285 174.285 173.310 0.975 17927 11692 1 15 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.348 0.445 17927 11693 1 15 . 1 1 20 20 GLY H H 20 8.539 8.539 8.497 0.042 17927 11694 1 15 . 1 1 21 21 LYS N N 21 124.675 124.675 120.585 4.090 17927 11695 1 15 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.659 -0.216 17927 11696 1 15 . 1 1 21 21 LYS C C 21 176.537 176.537 175.483 1.054 17927 11697 1 15 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.005 1.439 17927 11698 1 15 . 1 1 21 21 LYS CB C 21 32.754 32.754 34.297 -1.544 17927 11699 1 15 . 1 1 21 21 LYS H H 21 8.608 8.608 7.518 1.090 17927 11700 1 15 . 1 1 22 22 THR N N 22 120.666 120.666 123.110 -2.444 17927 11701 1 15 . 1 1 22 22 THR HA H 22 4.087 4.087 4.490 -0.403 17927 11702 1 15 . 1 1 22 22 THR C C 22 174.431 174.431 174.126 0.305 17927 11703 1 15 . 1 1 22 22 THR CA C 22 64.292 64.292 63.349 0.943 17927 11704 1 15 . 1 1 22 22 THR CB C 22 69.069 69.069 68.523 0.546 17927 11705 1 15 . 1 1 22 22 THR H H 22 8.595 8.595 8.655 -0.060 17927 11706 1 15 . 1 1 23 23 VAL N N 23 131.207 131.207 128.329 2.878 17927 11707 1 15 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.391 -0.199 17927 11708 1 15 . 1 1 23 23 VAL C C 23 174.244 174.244 174.584 -0.340 17927 11709 1 15 . 1 1 23 23 VAL CA C 23 62.456 62.456 60.674 1.782 17927 11710 1 15 . 1 1 23 23 VAL CB C 23 33.791 33.791 34.806 -1.015 17927 11711 1 15 . 1 1 23 23 VAL H H 23 8.937 8.937 9.019 -0.082 17927 11712 1 15 . 1 1 24 24 SER N N 24 120.787 120.787 119.372 1.415 17927 11713 1 15 . 1 1 24 24 SER HA H 24 5.407 5.407 5.060 0.347 17927 11714 1 15 . 1 1 24 24 SER C C 24 176.169 176.169 175.102 1.067 17927 11715 1 15 . 1 1 24 24 SER CA C 24 55.135 55.135 56.352 -1.217 17927 11716 1 15 . 1 1 24 24 SER CB C 24 65.646 65.646 66.128 -0.482 17927 11717 1 15 . 1 1 24 24 SER H H 24 8.554 8.554 8.243 0.311 17927 11718 1 15 . 1 1 25 25 LEU N N 25 124.332 124.332 122.190 2.142 17927 11719 1 15 . 1 1 25 25 LEU HA H 25 3.687 3.687 3.849 -0.162 17927 11720 1 15 . 1 1 25 25 LEU C C 25 179.364 179.364 177.088 2.276 17927 11721 1 15 . 1 1 25 25 LEU CA C 25 58.217 58.217 55.562 2.655 17927 11722 1 15 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.497 -0.959 17927 11723 1 15 . 1 1 25 25 LEU H H 25 7.811 7.811 8.623 -0.812 17927 11724 1 15 . 1 1 26 26 ALA N N 26 119.799 119.799 117.784 2.015 17927 11725 1 15 . 1 1 26 26 ALA HA H 26 3.993 3.993 3.994 -0.001 17927 11726 1 15 . 1 1 26 26 ALA C C 26 179.719 179.719 177.475 2.244 17927 11727 1 15 . 1 1 26 26 ALA CA C 26 54.663 54.663 53.895 0.768 17927 11728 1 15 . 1 1 26 26 ALA CB C 26 18.323 18.323 18.323 0.000 17927 11729 1 15 . 1 1 26 26 ALA H H 26 8.099 8.099 7.928 0.171 17927 11730 1 15 . 1 1 27 27 ASP N N 27 116.553 116.553 118.428 -1.875 17927 11731 1 15 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.444 0.029 17927 11732 1 15 . 1 1 27 27 ASP C C 27 176.915 176.915 177.527 -0.612 17927 11733 1 15 . 1 1 27 27 ASP CA C 27 56.251 56.251 55.901 0.350 17927 11734 1 15 . 1 1 27 27 ASP CB C 27 40.788 40.788 41.445 -0.657 17927 11735 1 15 . 1 1 27 27 ASP H H 27 7.572 7.572 7.659 -0.087 17927 11736 1 15 . 1 1 28 28 LEU N N 28 118.950 118.950 118.476 0.474 17927 11737 1 15 . 1 1 28 28 LEU HA H 28 4.233 4.233 3.711 0.522 17927 11738 1 15 . 1 1 28 28 LEU C C 28 175.542 175.542 176.610 -1.068 17927 11739 1 15 . 1 1 28 28 LEU CA C 28 53.706 53.706 54.381 -0.675 17927 11740 1 15 . 1 1 28 28 LEU CB C 28 41.049 41.049 42.038 -0.989 17927 11741 1 15 . 1 1 28 28 LEU H H 28 7.363 7.363 7.125 0.238 17927 11742 1 15 . 1 1 29 29 LYS N N 29 118.429 118.429 119.841 -1.412 17927 11743 1 15 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.073 0.279 17927 11744 1 15 . 1 1 29 29 LYS C C 29 178.063 178.063 176.995 1.068 17927 11745 1 15 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.717 0.060 17927 11746 1 15 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.501 0.939 17927 11747 1 15 . 1 1 29 29 LYS H H 29 6.780 6.780 7.269 -0.489 17927 11748 1 15 . 1 1 30 30 GLY N N 30 112.426 112.426 115.187 -2.761 17927 11749 1 15 . 1 1 30 30 GLY C C 30 173.801 173.801 173.464 0.337 17927 11750 1 15 . 1 1 30 30 GLY CA C 30 44.611 44.611 45.006 -0.395 17927 11751 1 15 . 1 1 30 30 GLY H H 30 9.398 9.398 9.235 0.163 17927 11752 1 15 . 1 1 31 31 LYS N N 31 119.295 119.295 121.119 -1.824 17927 11753 1 15 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.644 -0.492 17927 11754 1 15 . 1 1 31 31 LYS C C 31 173.862 173.862 176.484 -2.622 17927 11755 1 15 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.374 0.814 17927 11756 1 15 . 1 1 31 31 LYS CB C 31 36.968 36.968 36.090 0.878 17927 11757 1 15 . 1 1 31 31 LYS H H 31 7.496 7.496 7.442 0.054 17927 11758 1 15 . 1 1 32 32 TYR N N 32 116.984 116.984 118.999 -2.015 17927 11759 1 15 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.523 -0.366 17927 11760 1 15 . 1 1 32 32 TYR C C 32 175.226 175.226 176.057 -0.831 17927 11761 1 15 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.349 0.241 17927 11762 1 15 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.159 -0.038 17927 11763 1 15 . 1 1 32 32 TYR H H 32 7.521 7.521 8.505 -0.984 17927 11764 1 15 . 1 1 33 33 ILE N N 33 118.052 118.052 119.520 -1.468 17927 11765 1 15 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.723 0.184 17927 11766 1 15 . 1 1 33 33 ILE C C 33 174.308 174.308 174.455 -0.147 17927 11767 1 15 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.464 0.238 17927 11768 1 15 . 1 1 33 33 ILE CB C 33 41.616 41.616 41.351 0.265 17927 11769 1 15 . 1 1 33 33 ILE H H 33 8.467 8.467 8.671 -0.204 17927 11770 1 15 . 1 1 34 34 TYR N N 34 130.242 130.242 128.801 1.441 17927 11771 1 15 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.472 0.054 17927 11772 1 15 . 1 1 34 34 TYR C C 34 174.245 174.245 173.615 0.630 17927 11773 1 15 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.782 0.376 17927 11774 1 15 . 1 1 34 34 TYR CB C 34 40.133 40.133 41.225 -1.092 17927 11775 1 15 . 1 1 34 34 TYR H H 34 8.905 8.905 9.626 -0.721 17927 11776 1 15 . 1 1 35 35 ILE N N 35 128.697 128.697 130.298 -1.601 17927 11777 1 15 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.026 0.316 17927 11778 1 15 . 1 1 35 35 ILE C C 35 174.520 174.520 174.400 0.120 17927 11779 1 15 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.989 -0.240 17927 11780 1 15 . 1 1 35 35 ILE CB C 35 40.899 40.899 38.883 2.016 17927 11781 1 15 . 1 1 35 35 ILE H H 35 9.445 9.445 8.604 0.841 17927 11782 1 15 . 1 1 36 36 ASP N N 36 123.675 123.675 126.288 -2.613 17927 11783 1 15 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.518 -0.670 17927 11784 1 15 . 1 1 36 36 ASP C C 36 174.385 174.385 175.562 -1.177 17927 11785 1 15 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.484 -0.190 17927 11786 1 15 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.082 -2.304 17927 11787 1 15 . 1 1 36 36 ASP H H 36 8.875 8.875 8.408 0.467 17927 11788 1 15 . 1 1 37 37 VAL N N 37 127.159 127.159 119.318 7.841 17927 11789 1 15 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.921 0.038 17927 11790 1 15 . 1 1 37 37 VAL C C 37 175.046 175.046 176.016 -0.970 17927 11791 1 15 . 1 1 37 37 VAL CA C 37 62.245 62.245 61.001 1.244 17927 11792 1 15 . 1 1 37 37 VAL CB C 37 31.807 31.807 32.408 -0.601 17927 11793 1 15 . 1 1 37 37 VAL H H 37 8.603 8.603 7.812 0.791 17927 11794 1 15 . 1 1 38 38 TRP N N 38 124.161 124.161 125.176 -1.015 17927 11795 1 15 . 1 1 38 38 TRP HA H 38 5.237 5.237 4.991 0.246 17927 11796 1 15 . 1 1 38 38 TRP C C 38 171.995 171.995 173.553 -1.558 17927 11797 1 15 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.594 1.613 17927 11798 1 15 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.765 2.422 17927 11799 1 15 . 1 1 38 38 TRP H H 38 8.562 8.562 8.522 0.040 17927 11800 1 15 . 1 1 39 39 ALA N N 39 116.252 116.252 124.187 -7.935 17927 11801 1 15 . 1 1 39 39 ALA HA H 39 3.678 3.678 3.967 -0.289 17927 11802 1 15 . 1 1 39 39 ALA C C 39 178.664 178.664 175.563 3.101 17927 11803 1 15 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.039 1.427 17927 11804 1 15 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.339 1.002 17927 11805 1 15 . 1 1 39 39 ALA H H 39 6.757 6.757 7.808 -1.051 17927 11806 1 15 . 1 1 40 40 THR N N 40 114.321 114.321 115.088 -0.767 17927 11807 1 15 . 1 1 40 40 THR HA H 40 3.907 3.907 4.375 -0.468 17927 11808 1 15 . 1 1 40 40 THR C C 40 175.885 175.885 175.533 0.352 17927 11809 1 15 . 1 1 40 40 THR CA C 40 65.447 65.447 63.854 1.593 17927 11810 1 15 . 1 1 40 40 THR CB C 40 70.106 70.106 69.041 1.065 17927 11811 1 15 . 1 1 40 40 THR H H 40 9.639 9.639 8.501 1.138 17927 11812 1 15 . 1 1 41 41 TRP N N 41 114.483 114.483 121.098 -6.615 17927 11813 1 15 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.887 -0.324 17927 11814 1 15 . 1 1 41 41 TRP C C 41 176.189 176.189 175.998 0.191 17927 11815 1 15 . 1 1 41 41 TRP CA C 41 54.698 54.698 55.550 -0.851 17927 11816 1 15 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.233 1.744 17927 11817 1 15 . 1 1 41 41 TRP H H 41 6.401 6.401 7.204 -0.803 17927 11818 1 15 . 1 1 42 42 CYS N N 42 123.536 123.536 114.792 8.744 17927 11819 1 15 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.075 0.493 17927 11820 1 15 . 1 1 42 42 CYS C C 42 175.726 175.726 176.337 -0.611 17927 11821 1 15 . 1 1 42 42 CYS CA C 42 58.700 58.700 58.941 -0.240 17927 11822 1 15 . 1 1 42 42 CYS CB C 42 27.121 27.121 27.749 -0.628 17927 11823 1 15 . 1 1 42 42 CYS H H 42 6.883 6.883 6.946 -0.063 17927 11824 1 15 . 1 1 43 43 GLY N N 43 120.977 120.977 110.898 10.079 17927 11825 1 15 . 1 1 43 43 GLY CA C 43 49.204 49.204 47.270 1.934 17927 11826 1 15 . 1 1 43 43 GLY H H 43 9.653 9.653 8.104 1.549 17927 11827 1 15 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.306 0.181 17927 11828 1 15 . 1 1 44 44 PRO C C 44 179.956 179.956 178.193 1.763 17927 11829 1 15 . 1 1 44 44 PRO CA C 44 65.642 65.642 64.969 0.673 17927 11830 1 15 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.553 1.025 17927 11831 1 15 . 1 1 45 45 CYS N N 45 113.925 113.925 116.464 -2.539 17927 11832 1 15 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.265 0.048 17927 11833 1 15 . 1 1 45 45 CYS C C 45 178.325 178.325 176.809 1.516 17927 11834 1 15 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.446 1.946 17927 11835 1 15 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.190 1.315 17927 11836 1 15 . 1 1 45 45 CYS H H 45 7.676 7.676 8.091 -0.415 17927 11837 1 15 . 1 1 46 46 ARG N N 46 120.336 120.336 121.382 -1.046 17927 11838 1 15 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.216 -0.147 17927 11839 1 15 . 1 1 46 46 ARG C C 46 180.446 180.446 178.904 1.542 17927 11840 1 15 . 1 1 46 46 ARG CA C 46 59.785 59.785 59.091 0.694 17927 11841 1 15 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.834 0.034 17927 11842 1 15 . 1 1 46 46 ARG H H 46 8.109 8.109 8.152 -0.043 17927 11843 1 15 . 1 1 47 47 GLY N N 47 105.408 105.408 107.189 -1.781 17927 11844 1 15 . 1 1 47 47 GLY C C 47 175.258 175.258 175.124 0.134 17927 11845 1 15 . 1 1 47 47 GLY CA C 47 46.594 46.594 46.478 0.116 17927 11846 1 15 . 1 1 47 47 GLY H H 47 8.466 8.466 7.710 0.756 17927 11847 1 15 . 1 1 48 48 GLU N N 48 116.343 116.343 119.926 -3.583 17927 11848 1 15 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.672 -0.147 17927 11849 1 15 . 1 1 48 48 GLU C C 48 176.535 176.535 177.205 -0.670 17927 11850 1 15 . 1 1 48 48 GLU CA C 48 55.792 55.792 54.786 1.006 17927 11851 1 15 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.595 1.387 17927 11852 1 15 . 1 1 48 48 GLU H H 48 7.050 7.050 7.608 -0.558 17927 11853 1 15 . 1 1 49 49 LEU N N 49 118.652 118.652 122.071 -3.419 17927 11854 1 15 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.200 -0.048 17927 11855 1 15 . 1 1 49 49 LEU C C 49 176.832 176.832 176.205 0.627 17927 11856 1 15 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.850 -1.505 17927 11857 1 15 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.212 -0.716 17927 11858 1 15 . 1 1 49 49 LEU H H 49 7.385 7.385 7.753 -0.368 17927 11859 1 15 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.089 0.164 17927 11860 1 15 . 1 1 50 50 PRO C C 50 179.744 179.744 178.261 1.483 17927 11861 1 15 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.374 0.185 17927 11862 1 15 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.928 -0.166 17927 11863 1 15 . 1 1 51 51 ALA N N 51 120.418 120.418 118.841 1.577 17927 11864 1 15 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.235 -0.090 17927 11865 1 15 . 1 1 51 51 ALA C C 51 180.329 180.329 179.589 0.740 17927 11866 1 15 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.360 0.074 17927 11867 1 15 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.367 0.003 17927 11868 1 15 . 1 1 51 51 ALA H H 51 7.731 7.731 7.912 -0.181 17927 11869 1 15 . 1 1 52 52 LEU N N 52 121.506 121.506 120.240 1.266 17927 11870 1 15 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.913 0.075 17927 11871 1 15 . 1 1 52 52 LEU C C 52 177.944 177.944 178.609 -0.665 17927 11872 1 15 . 1 1 52 52 LEU CA C 52 58.327 58.327 57.982 0.345 17927 11873 1 15 . 1 1 52 52 LEU CB C 52 42.382 42.382 42.014 0.368 17927 11874 1 15 . 1 1 52 52 LEU H H 52 8.355 8.355 8.305 0.050 17927 11875 1 15 . 1 1 53 53 LYS N N 53 119.732 119.732 118.569 1.163 17927 11876 1 15 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.945 -0.042 17927 11877 1 15 . 1 1 53 53 LYS C C 53 179.030 179.030 179.064 -0.034 17927 11878 1 15 . 1 1 53 53 LYS CA C 53 59.846 59.846 58.927 0.919 17927 11879 1 15 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.334 0.877 17927 11880 1 15 . 1 1 53 53 LYS H H 53 8.148 8.148 8.304 -0.156 17927 11881 1 15 . 1 1 54 54 GLU N N 54 117.779 117.779 119.926 -2.147 17927 11882 1 15 . 1 1 54 54 GLU HA H 54 4.059 4.059 4.040 0.019 17927 11883 1 15 . 1 1 54 54 GLU C C 54 179.646 179.646 179.063 0.583 17927 11884 1 15 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.770 -0.145 17927 11885 1 15 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.562 0.005 17927 11886 1 15 . 1 1 54 54 GLU H H 54 7.585 7.585 7.967 -0.382 17927 11887 1 15 . 1 1 55 55 LEU N N 55 120.581 120.581 120.434 0.147 17927 11888 1 15 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.192 0.001 17927 11889 1 15 . 1 1 55 55 LEU C C 55 178.557 178.557 178.570 -0.013 17927 11890 1 15 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.962 0.274 17927 11891 1 15 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.789 1.222 17927 11892 1 15 . 1 1 55 55 LEU H H 55 8.096 8.096 7.910 0.186 17927 11893 1 15 . 1 1 56 56 GLU N N 56 118.023 118.023 119.741 -1.718 17927 11894 1 15 . 1 1 56 56 GLU HA H 56 3.177 3.177 4.183 -1.006 17927 11895 1 15 . 1 1 56 56 GLU C C 56 179.650 179.650 179.157 0.493 17927 11896 1 15 . 1 1 56 56 GLU CA C 56 58.871 58.871 60.220 -1.349 17927 11897 1 15 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.705 -2.720 17927 11898 1 15 . 1 1 56 56 GLU H H 56 8.181 8.181 8.604 -0.423 17927 11899 1 15 . 1 1 57 57 GLU N N 57 117.828 117.828 117.531 0.297 17927 11900 1 15 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.157 -0.053 17927 11901 1 15 . 1 1 57 57 GLU C C 57 179.700 179.700 178.809 0.891 17927 11902 1 15 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.423 0.604 17927 11903 1 15 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.749 -0.084 17927 11904 1 15 . 1 1 57 57 GLU H H 57 7.762 7.762 8.394 -0.632 17927 11905 1 15 . 1 1 58 58 LYS N N 58 120.896 120.896 117.576 3.320 17927 11906 1 15 . 1 1 58 58 LYS HA H 58 3.979 3.979 4.091 -0.112 17927 11907 1 15 . 1 1 58 58 LYS C C 58 178.715 178.715 178.656 0.059 17927 11908 1 15 . 1 1 58 58 LYS CA C 58 59.078 59.078 59.267 -0.190 17927 11909 1 15 . 1 1 58 58 LYS CB C 58 32.980 32.980 33.212 -0.233 17927 11910 1 15 . 1 1 58 58 LYS H H 58 8.410 8.410 7.853 0.557 17927 11911 1 15 . 1 1 59 59 TYR N N 59 113.713 113.713 114.954 -1.241 17927 11912 1 15 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.535 -0.223 17927 11913 1 15 . 1 1 59 59 TYR C C 59 175.025 175.025 174.793 0.232 17927 11914 1 15 . 1 1 59 59 TYR CA C 59 58.973 58.973 57.455 1.518 17927 11915 1 15 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.145 -0.711 17927 11916 1 15 . 1 1 59 59 TYR H H 59 8.102 8.102 8.434 -0.332 17927 11917 1 15 . 1 1 60 60 ALA N N 60 126.637 126.637 121.839 4.798 17927 11918 1 15 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.310 0.108 17927 11919 1 15 . 1 1 60 60 ALA C C 60 179.208 179.208 177.378 1.830 17927 11920 1 15 . 1 1 60 60 ALA CA C 60 54.534 54.534 52.838 1.696 17927 11921 1 15 . 1 1 60 60 ALA CB C 60 18.589 18.589 19.503 -0.914 17927 11922 1 15 . 1 1 60 60 ALA H H 60 7.201 7.201 7.406 -0.205 17927 11923 1 15 . 1 1 61 61 GLY N N 61 111.816 111.816 108.137 3.679 17927 11924 1 15 . 1 1 61 61 GLY C C 61 174.698 174.698 174.115 0.583 17927 11925 1 15 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.986 -0.083 17927 11926 1 15 . 1 1 61 61 GLY H H 61 9.184 9.184 8.644 0.540 17927 11927 1 15 . 1 1 62 62 LYS N N 62 118.497 118.497 119.617 -1.120 17927 11928 1 15 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.530 0.349 17927 11929 1 15 . 1 1 62 62 LYS C C 62 179.019 179.019 175.909 3.110 17927 11930 1 15 . 1 1 62 62 LYS CA C 62 53.988 53.988 53.826 0.162 17927 11931 1 15 . 1 1 62 62 LYS CB C 62 33.840 33.840 33.785 0.055 17927 11932 1 15 . 1 1 62 62 LYS H H 62 8.019 8.019 7.686 0.333 17927 11933 1 15 . 1 1 63 63 ASP N N 63 122.982 122.982 121.290 1.692 17927 11934 1 15 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.842 -0.315 17927 11935 1 15 . 1 1 63 63 ASP C C 63 174.065 174.065 174.600 -0.535 17927 11936 1 15 . 1 1 63 63 ASP CA C 63 55.055 55.055 54.046 1.009 17927 11937 1 15 . 1 1 63 63 ASP CB C 63 38.582 38.582 39.761 -1.179 17927 11938 1 15 . 1 1 63 63 ASP H H 63 8.709 8.709 8.597 0.112 17927 11939 1 15 . 1 1 64 64 ILE N N 64 122.219 122.219 111.153 11.066 17927 11940 1 15 . 1 1 64 64 ILE HA H 64 4.607 4.607 5.100 -0.493 17927 11941 1 15 . 1 1 64 64 ILE C C 64 174.627 174.627 174.126 0.501 17927 11942 1 15 . 1 1 64 64 ILE CA C 64 59.712 59.712 58.657 1.055 17927 11943 1 15 . 1 1 64 64 ILE CB C 64 42.133 42.133 42.586 -0.453 17927 11944 1 15 . 1 1 64 64 ILE H H 64 8.678 8.678 6.913 1.765 17927 11945 1 15 . 1 1 65 65 HIS N N 65 125.584 125.584 118.947 6.637 17927 11946 1 15 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.806 0.237 17927 11947 1 15 . 1 1 65 65 HIS C C 65 174.153 174.153 174.045 0.108 17927 11948 1 15 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.620 0.339 17927 11949 1 15 . 1 1 65 65 HIS CB C 65 34.156 34.156 32.600 1.556 17927 11950 1 15 . 1 1 65 65 HIS H H 65 9.204 9.204 8.401 0.803 17927 11951 1 15 . 1 1 66 66 PHE N N 66 123.244 123.244 124.740 -1.496 17927 11952 1 15 . 1 1 66 66 PHE HA H 66 5.210 5.210 5.010 0.200 17927 11953 1 15 . 1 1 66 66 PHE C C 66 175.463 175.463 175.170 0.293 17927 11954 1 15 . 1 1 66 66 PHE CA C 66 58.088 58.088 56.732 1.356 17927 11955 1 15 . 1 1 66 66 PHE CB C 66 39.637 39.637 38.804 0.833 17927 11956 1 15 . 1 1 66 66 PHE H H 66 9.262 9.262 8.948 0.314 17927 11957 1 15 . 1 1 67 67 VAL N N 67 126.201 126.201 125.879 0.322 17927 11958 1 15 . 1 1 67 67 VAL HA H 67 4.834 4.834 4.987 -0.153 17927 11959 1 15 . 1 1 67 67 VAL C C 67 174.364 174.364 175.464 -1.100 17927 11960 1 15 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.873 -0.150 17927 11961 1 15 . 1 1 67 67 VAL CB C 67 34.893 34.893 33.769 1.124 17927 11962 1 15 . 1 1 67 67 VAL H H 67 8.843 8.843 9.484 -0.641 17927 11963 1 15 . 1 1 68 68 SER N N 68 124.528 124.528 123.618 0.910 17927 11964 1 15 . 1 1 68 68 SER HA H 68 5.585 5.585 5.243 0.342 17927 11965 1 15 . 1 1 68 68 SER C C 68 172.858 172.858 173.432 -0.574 17927 11966 1 15 . 1 1 68 68 SER CA C 68 57.282 57.282 57.859 -0.577 17927 11967 1 15 . 1 1 68 68 SER CB C 68 65.032 65.032 63.349 1.683 17927 11968 1 15 . 1 1 68 68 SER H H 68 9.243 9.243 8.741 0.502 17927 11969 1 15 . 1 1 69 69 LEU N N 69 126.695 126.695 126.288 0.407 17927 11970 1 15 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.500 -0.983 17927 11971 1 15 . 1 1 69 69 LEU C C 69 174.652 174.652 176.604 -1.952 17927 11972 1 15 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.557 -0.730 17927 11973 1 15 . 1 1 69 69 LEU CB C 69 43.895 43.895 44.729 -0.834 17927 11974 1 15 . 1 1 69 69 LEU H H 69 9.360 9.360 9.133 0.227 17927 11975 1 15 . 1 1 70 70 SER N N 70 116.379 116.379 117.737 -1.358 17927 11976 1 15 . 1 1 70 70 SER HA H 70 4.905 4.905 5.146 -0.241 17927 11977 1 15 . 1 1 70 70 SER C C 70 176.307 176.307 174.835 1.472 17927 11978 1 15 . 1 1 70 70 SER CA C 70 55.213 55.213 55.918 -0.705 17927 11979 1 15 . 1 1 70 70 SER CB C 70 63.519 63.519 64.462 -0.943 17927 11980 1 15 . 1 1 70 70 SER H H 70 7.981 7.981 8.572 -0.592 17927 11981 1 15 . 1 1 71 71 CYS N N 71 124.670 124.670 125.941 -1.271 17927 11982 1 15 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.641 0.317 17927 11983 1 15 . 1 1 71 71 CYS C C 71 173.996 173.996 174.659 -0.663 17927 11984 1 15 . 1 1 71 71 CYS CA C 71 55.483 55.483 55.810 -0.327 17927 11985 1 15 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.077 1.035 17927 11986 1 15 . 1 1 71 71 CYS H H 71 8.609 8.609 8.987 -0.378 17927 11987 1 15 . 1 1 72 72 ASP N N 72 122.398 122.398 123.861 -1.463 17927 11988 1 15 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.777 -0.485 17927 11989 1 15 . 1 1 72 72 ASP C C 72 176.653 176.653 177.048 -0.395 17927 11990 1 15 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.653 1.129 17927 11991 1 15 . 1 1 72 72 ASP CB C 72 41.526 41.526 41.549 -0.023 17927 11992 1 15 . 1 1 72 72 ASP H H 72 8.557 8.557 7.435 1.122 17927 11993 1 15 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.116 -0.051 17927 11994 1 15 . 1 1 73 73 LYS C C 73 176.545 176.545 176.324 0.221 17927 11995 1 15 . 1 1 73 73 LYS CA C 73 58.458 58.458 58.333 0.125 17927 11996 1 15 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.719 -0.078 17927 11997 1 15 . 1 1 74 74 ASN N N 74 117.616 117.616 118.612 -0.996 17927 11998 1 15 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.728 0.177 17927 11999 1 15 . 1 1 74 74 ASN C C 74 174.894 174.894 175.586 -0.692 17927 12000 1 15 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.908 -1.387 17927 12001 1 15 . 1 1 74 74 ASN CB C 74 38.109 38.109 37.519 0.590 17927 12002 1 15 . 1 1 74 74 ASN H H 74 8.625 8.625 8.484 0.141 17927 12003 1 15 . 1 1 75 75 LYS N N 75 126.797 126.797 124.536 2.261 17927 12004 1 15 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.691 -0.268 17927 12005 1 15 . 1 1 75 75 LYS C C 75 178.058 178.058 177.709 0.349 17927 12006 1 15 . 1 1 75 75 LYS CA C 75 60.173 60.173 59.932 0.241 17927 12007 1 15 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.414 0.877 17927 12008 1 15 . 1 1 75 75 LYS H H 75 8.588 8.588 7.979 0.609 17927 12009 1 15 . 1 1 76 76 LYS N N 76 117.875 117.875 120.055 -2.180 17927 12010 1 15 . 1 1 76 76 LYS HA H 76 4.200 4.200 4.404 -0.204 17927 12011 1 15 . 1 1 76 76 LYS C C 76 178.791 178.791 178.897 -0.106 17927 12012 1 15 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.306 -0.698 17927 12013 1 15 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.631 -0.141 17927 12014 1 15 . 1 1 76 76 LYS H H 76 8.041 8.041 8.465 -0.424 17927 12015 1 15 . 1 1 77 77 ALA N N 77 121.567 121.567 121.394 0.173 17927 12016 1 15 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.177 -0.054 17927 12017 1 15 . 1 1 77 77 ALA C C 77 181.191 181.191 179.712 1.479 17927 12018 1 15 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.875 0.082 17927 12019 1 15 . 1 1 77 77 ALA CB C 77 17.759 17.759 17.998 -0.239 17927 12020 1 15 . 1 1 77 77 ALA H H 77 7.366 7.366 8.361 -0.995 17927 12021 1 15 . 1 1 78 78 TRP N N 78 119.497 119.497 120.396 -0.899 17927 12022 1 15 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.201 -0.124 17927 12023 1 15 . 1 1 78 78 TRP C C 78 175.942 175.942 177.028 -1.086 17927 12024 1 15 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.139 2.622 17927 12025 1 15 . 1 1 78 78 TRP CB C 78 27.272 27.272 30.064 -2.792 17927 12026 1 15 . 1 1 78 78 TRP H H 78 7.187 7.187 7.848 -0.661 17927 12027 1 15 . 1 1 79 79 GLU N N 79 118.771 118.771 119.427 -0.656 17927 12028 1 15 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.477 -0.463 17927 12029 1 15 . 1 1 79 79 GLU C C 79 179.863 179.863 178.421 1.442 17927 12030 1 15 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.560 -0.450 17927 12031 1 15 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.886 1.334 17927 12032 1 15 . 1 1 79 79 GLU H H 79 8.813 8.813 8.802 0.011 17927 12033 1 15 . 1 1 80 80 ASN N N 80 115.964 115.964 119.318 -3.354 17927 12034 1 15 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.379 -0.040 17927 12035 1 15 . 1 1 80 80 ASN C C 80 176.749 176.749 177.609 -0.860 17927 12036 1 15 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.727 0.308 17927 12037 1 15 . 1 1 80 80 ASN CB C 80 38.489 38.489 37.806 0.683 17927 12038 1 15 . 1 1 80 80 ASN H H 80 8.491 8.491 7.896 0.595 17927 12039 1 15 . 1 1 81 81 MET N N 81 119.670 119.670 121.138 -1.468 17927 12040 1 15 . 1 1 81 81 MET HA H 81 4.149 4.149 4.146 0.003 17927 12041 1 15 . 1 1 81 81 MET C C 81 177.933 177.933 177.565 0.368 17927 12042 1 15 . 1 1 81 81 MET CA C 81 60.276 60.276 58.058 2.218 17927 12043 1 15 . 1 1 81 81 MET CB C 81 32.518 32.518 32.194 0.324 17927 12044 1 15 . 1 1 81 81 MET H H 81 7.667 7.667 7.507 0.160 17927 12045 1 15 . 1 1 82 82 VAL N N 82 117.634 117.634 117.837 -0.203 17927 12046 1 15 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.453 -0.149 17927 12047 1 15 . 1 1 82 82 VAL C C 82 179.005 179.005 177.169 1.836 17927 12048 1 15 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.094 0.943 17927 12049 1 15 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.412 0.353 17927 12050 1 15 . 1 1 82 82 VAL H H 82 8.338 8.338 7.667 0.671 17927 12051 1 15 . 1 1 83 83 THR N N 83 110.519 110.519 115.231 -4.712 17927 12052 1 15 . 1 1 83 83 THR HA H 83 3.983 3.983 3.887 0.096 17927 12053 1 15 . 1 1 83 83 THR C C 83 177.591 177.591 176.302 1.289 17927 12054 1 15 . 1 1 83 83 THR CA C 83 65.431 65.431 66.511 -1.080 17927 12055 1 15 . 1 1 83 83 THR CB C 83 69.156 69.156 68.680 0.476 17927 12056 1 15 . 1 1 83 83 THR H H 83 7.659 7.659 7.422 0.237 17927 12057 1 15 . 1 1 84 84 LYS N N 84 123.927 123.927 120.614 3.313 17927 12058 1 15 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.166 -0.097 17927 12059 1 15 . 1 1 84 84 LYS C C 84 178.582 178.582 177.765 0.817 17927 12060 1 15 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.330 1.547 17927 12061 1 15 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.525 -0.202 17927 12062 1 15 . 1 1 84 84 LYS H H 84 8.665 8.665 7.741 0.924 17927 12063 1 15 . 1 1 85 85 ASP N N 85 116.280 116.280 117.205 -0.925 17927 12064 1 15 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.741 0.009 17927 12065 1 15 . 1 1 85 85 ASP C C 85 175.086 175.086 175.418 -0.332 17927 12066 1 15 . 1 1 85 85 ASP CA C 85 54.693 54.693 54.663 0.030 17927 12067 1 15 . 1 1 85 85 ASP CB C 85 39.685 39.685 40.761 -1.076 17927 12068 1 15 . 1 1 85 85 ASP H H 85 8.179 8.179 8.224 -0.045 17927 12069 1 15 . 1 1 86 86 GLN N N 86 116.258 116.258 113.331 2.927 17927 12070 1 15 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.872 0.036 17927 12071 1 15 . 1 1 86 86 GLN C C 86 175.659 175.659 175.938 -0.279 17927 12072 1 15 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.946 -0.775 17927 12073 1 15 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.589 -0.299 17927 12074 1 15 . 1 1 86 86 GLN H H 86 7.431 7.431 7.499 -0.068 17927 12075 1 15 . 1 1 87 87 LEU N N 87 117.031 117.031 119.886 -2.855 17927 12076 1 15 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.109 -0.019 17927 12077 1 15 . 1 1 87 87 LEU C C 87 178.225 178.225 176.504 1.721 17927 12078 1 15 . 1 1 87 87 LEU CA C 87 55.932 55.932 56.154 -0.223 17927 12079 1 15 . 1 1 87 87 LEU CB C 87 41.202 41.202 41.690 -0.488 17927 12080 1 15 . 1 1 87 87 LEU H H 87 7.736 7.736 7.493 0.243 17927 12081 1 15 . 1 1 88 88 LYS N N 88 122.367 122.367 124.023 -1.656 17927 12082 1 15 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.437 0.199 17927 12083 1 15 . 1 1 88 88 LYS C C 88 177.538 177.538 176.335 1.203 17927 12084 1 15 . 1 1 88 88 LYS CA C 88 54.930 54.930 54.191 0.739 17927 12085 1 15 . 1 1 88 88 LYS CB C 88 33.316 33.316 35.264 -1.948 17927 12086 1 15 . 1 1 88 88 LYS H H 88 8.496 8.496 8.551 -0.055 17927 12087 1 15 . 1 1 89 89 GLY N N 89 108.452 108.452 107.653 0.799 17927 12088 1 15 . 1 1 89 89 GLY C C 89 173.781 173.781 173.565 0.216 17927 12089 1 15 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.631 0.727 17927 12090 1 15 . 1 1 89 89 GLY H H 89 8.497 8.497 8.120 0.377 17927 12091 1 15 . 1 1 90 90 ILE N N 90 123.295 123.295 123.363 -0.068 17927 12092 1 15 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.235 0.136 17927 12093 1 15 . 1 1 90 90 ILE C C 90 175.606 175.606 174.482 1.124 17927 12094 1 15 . 1 1 90 90 ILE CA C 90 62.001 62.001 59.543 2.458 17927 12095 1 15 . 1 1 90 90 ILE CB C 90 38.036 38.036 36.605 1.431 17927 12096 1 15 . 1 1 90 90 ILE H H 90 8.728 8.728 7.941 0.787 17927 12097 1 15 . 1 1 91 91 GLN N N 91 128.632 128.632 125.429 3.203 17927 12098 1 15 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.828 -0.062 17927 12099 1 15 . 1 1 91 91 GLN C C 91 174.618 174.618 174.544 0.074 17927 12100 1 15 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.830 1.020 17927 12101 1 15 . 1 1 91 91 GLN CB C 91 28.341 28.341 29.805 -1.464 17927 12102 1 15 . 1 1 91 91 GLN H H 91 8.762 8.762 9.520 -0.758 17927 12103 1 15 . 1 1 92 92 LEU N N 92 120.830 120.830 125.004 -4.174 17927 12104 1 15 . 1 1 92 92 LEU HA H 92 5.580 5.580 5.035 0.545 17927 12105 1 15 . 1 1 92 92 LEU C C 92 176.828 176.828 175.926 0.902 17927 12106 1 15 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.842 -1.041 17927 12107 1 15 . 1 1 92 92 LEU CB C 92 44.210 44.210 44.537 -0.327 17927 12108 1 15 . 1 1 92 92 LEU H H 92 9.011 9.011 9.060 -0.049 17927 12109 1 15 . 1 1 93 93 HIS N N 93 121.481 121.481 120.929 0.552 17927 12110 1 15 . 1 1 93 93 HIS HA H 93 3.931 3.931 4.885 -0.954 17927 12111 1 15 . 1 1 93 93 HIS C C 93 173.590 173.590 173.157 0.433 17927 12112 1 15 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.334 1.248 17927 12113 1 15 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.369 -1.119 17927 12114 1 15 . 1 1 93 93 HIS H H 93 8.038 8.038 8.837 -0.799 17927 12115 1 15 . 1 1 94 94 MET N N 94 121.881 121.881 124.489 -2.608 17927 12116 1 15 . 1 1 94 94 MET HA H 94 3.866 3.866 3.772 0.094 17927 12117 1 15 . 1 1 94 94 MET C C 94 177.035 177.035 176.237 0.798 17927 12118 1 15 . 1 1 94 94 MET CA C 94 55.189 55.189 57.505 -2.316 17927 12119 1 15 . 1 1 94 94 MET CB C 94 33.993 33.993 33.592 0.401 17927 12120 1 15 . 1 1 94 94 MET H H 94 8.039 8.039 8.482 -0.443 17927 12121 1 15 . 1 1 95 95 GLY N N 95 104.041 104.041 105.303 -1.262 17927 12122 1 15 . 1 1 95 95 GLY C C 95 174.251 174.251 174.619 -0.368 17927 12123 1 15 . 1 1 95 95 GLY CA C 95 46.580 46.580 45.594 0.986 17927 12124 1 15 . 1 1 95 95 GLY H H 95 5.666 5.666 7.539 -1.873 17927 12125 1 15 . 1 1 96 96 THR N N 96 114.114 114.114 118.262 -4.148 17927 12126 1 15 . 1 1 96 96 THR HA H 96 4.211 4.211 4.472 -0.261 17927 12127 1 15 . 1 1 96 96 THR C C 96 175.122 175.122 174.703 0.419 17927 12128 1 15 . 1 1 96 96 THR CA C 96 61.339 61.339 62.915 -1.576 17927 12129 1 15 . 1 1 96 96 THR CB C 96 68.615 68.615 69.922 -1.307 17927 12130 1 15 . 1 1 96 96 THR H H 96 8.517 8.517 8.175 0.342 17927 12131 1 15 . 1 1 97 97 ASP N N 97 121.892 121.892 123.353 -1.461 17927 12132 1 15 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.746 -0.161 17927 12133 1 15 . 1 1 97 97 ASP C C 97 178.241 178.241 176.232 2.009 17927 12134 1 15 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.674 1.126 17927 12135 1 15 . 1 1 97 97 ASP CB C 97 43.129 43.129 39.036 4.093 17927 12136 1 15 . 1 1 97 97 ASP H H 97 7.563 7.563 8.475 -0.912 17927 12137 1 15 . 1 1 98 98 ARG N N 98 127.508 127.508 119.053 8.455 17927 12138 1 15 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.183 0.209 17927 12139 1 15 . 1 1 98 98 ARG C C 98 176.724 176.724 177.337 -0.613 17927 12140 1 15 . 1 1 98 98 ARG CA C 98 55.939 55.939 58.081 -2.142 17927 12141 1 15 . 1 1 98 98 ARG CB C 98 30.291 30.291 29.282 1.009 17927 12142 1 15 . 1 1 98 98 ARG H H 98 9.225 9.225 7.896 1.329 17927 12143 1 15 . 1 1 99 99 THR N N 99 116.384 116.384 117.901 -1.517 17927 12144 1 15 . 1 1 99 99 THR HA H 99 3.987 3.987 4.068 -0.081 17927 12145 1 15 . 1 1 99 99 THR C C 99 176.969 176.969 176.085 0.884 17927 12146 1 15 . 1 1 99 99 THR CA C 99 67.714 67.714 66.255 1.459 17927 12147 1 15 . 1 1 99 99 THR CB C 99 68.777 68.777 68.384 0.393 17927 12148 1 15 . 1 1 99 99 THR H H 99 8.382 8.382 7.904 0.478 17927 12149 1 15 . 1 1 100 100 PHE N N 100 123.232 123.232 123.091 0.141 17927 12150 1 15 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.304 -0.131 17927 12151 1 15 . 1 1 100 100 PHE C C 100 177.010 177.010 176.327 0.683 17927 12152 1 15 . 1 1 100 100 PHE CA C 100 61.923 61.923 61.826 0.097 17927 12153 1 15 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.367 1.395 17927 12154 1 15 . 1 1 100 100 PHE H H 100 7.998 7.998 8.397 -0.399 17927 12155 1 15 . 1 1 101 101 MET N N 101 115.968 115.968 117.149 -1.181 17927 12156 1 15 . 1 1 101 101 MET HA H 101 3.975 3.975 3.978 -0.003 17927 12157 1 15 . 1 1 101 101 MET C C 101 178.763 178.763 178.349 0.414 17927 12158 1 15 . 1 1 101 101 MET CA C 101 58.552 58.552 57.330 1.222 17927 12159 1 15 . 1 1 101 101 MET CB C 101 32.593 32.593 31.052 1.541 17927 12160 1 15 . 1 1 101 101 MET H H 101 7.828 7.828 7.801 0.027 17927 12161 1 15 . 1 1 102 102 ASP N N 102 117.553 117.553 120.103 -2.550 17927 12162 1 15 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.348 0.174 17927 12163 1 15 . 1 1 102 102 ASP C C 102 179.503 179.503 178.822 0.681 17927 12164 1 15 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.831 -0.941 17927 12165 1 15 . 1 1 102 102 ASP CB C 102 39.926 39.926 41.137 -1.211 17927 12166 1 15 . 1 1 102 102 ASP H H 102 8.828 8.828 8.161 0.667 17927 12167 1 15 . 1 1 103 103 ALA N N 103 122.984 122.984 120.148 2.836 17927 12168 1 15 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.088 -0.102 17927 12169 1 15 . 1 1 103 103 ALA C C 103 178.782 178.782 177.395 1.387 17927 12170 1 15 . 1 1 103 103 ALA CA C 103 55.094 55.094 53.563 1.531 17927 12171 1 15 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.658 -0.095 17927 12172 1 15 . 1 1 103 103 ALA H H 103 7.567 7.567 7.837 -0.270 17927 12173 1 15 . 1 1 104 104 TYR N N 104 112.159 112.159 113.841 -1.682 17927 12174 1 15 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.512 -0.288 17927 12175 1 15 . 1 1 104 104 TYR C C 104 173.821 173.821 174.658 -0.837 17927 12176 1 15 . 1 1 104 104 TYR CA C 104 58.498 58.498 56.833 1.665 17927 12177 1 15 . 1 1 104 104 TYR CB C 104 38.393 38.393 39.151 -0.758 17927 12178 1 15 . 1 1 104 104 TYR H H 104 7.203 7.203 7.356 -0.153 17927 12179 1 15 . 1 1 105 105 LEU N N 105 119.433 119.433 116.867 2.566 17927 12180 1 15 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.941 0.044 17927 12181 1 15 . 1 1 105 105 LEU C C 105 176.721 176.721 176.432 0.289 17927 12182 1 15 . 1 1 105 105 LEU CA C 105 55.785 55.785 56.054 -0.269 17927 12183 1 15 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.061 -0.618 17927 12184 1 15 . 1 1 105 105 LEU H H 105 7.582 7.582 7.860 -0.278 17927 12185 1 15 . 1 1 106 106 ILE N N 106 119.575 119.575 119.531 0.044 17927 12186 1 15 . 1 1 106 106 ILE HA H 106 4.002 4.002 3.910 0.092 17927 12187 1 15 . 1 1 106 106 ILE C C 106 175.459 175.459 175.164 0.295 17927 12188 1 15 . 1 1 106 106 ILE CA C 106 62.043 62.043 62.107 -0.064 17927 12189 1 15 . 1 1 106 106 ILE CB C 106 36.335 36.335 35.472 0.863 17927 12190 1 15 . 1 1 106 106 ILE H H 106 8.774 8.774 8.286 0.488 17927 12191 1 15 . 1 1 107 107 ASN N N 107 126.514 126.514 124.614 1.900 17927 12192 1 15 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.760 0.103 17927 12193 1 15 . 1 1 107 107 ASN C C 107 174.584 174.584 175.679 -1.095 17927 12194 1 15 . 1 1 107 107 ASN CA C 107 53.112 53.112 54.723 -1.611 17927 12195 1 15 . 1 1 107 107 ASN CB C 107 38.977 38.977 39.062 -0.085 17927 12196 1 15 . 1 1 107 107 ASN H H 107 8.364 8.364 7.913 0.451 17927 12197 1 15 . 1 1 108 108 GLY N N 108 108.469 108.469 108.285 0.184 17927 12198 1 15 . 1 1 108 108 GLY C C 108 171.245 171.245 173.163 -1.918 17927 12199 1 15 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.389 0.880 17927 12200 1 15 . 1 1 108 108 GLY H H 108 7.678 7.678 8.100 -0.422 17927 12201 1 15 . 1 1 109 109 ILE N N 109 112.817 112.817 120.154 -7.337 17927 12202 1 15 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.510 -0.104 17927 12203 1 15 . 1 1 109 109 ILE C C 109 173.498 173.498 174.406 -0.908 17927 12204 1 15 . 1 1 109 109 ILE CA C 109 58.384 58.384 56.631 1.753 17927 12205 1 15 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.311 2.011 17927 12206 1 15 . 1 1 109 109 ILE H H 109 7.868 7.868 8.127 -0.260 17927 12207 1 15 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.383 0.359 17927 12208 1 15 . 1 1 110 110 PRO C C 110 175.715 175.715 175.480 0.235 17927 12209 1 15 . 1 1 110 110 PRO CA C 110 62.277 62.277 61.984 0.293 17927 12210 1 15 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.787 3.581 17927 12211 1 15 . 1 1 111 111 ARG N N 111 122.358 122.358 120.326 2.032 17927 12212 1 15 . 1 1 111 111 ARG HA H 111 4.469 4.469 4.054 0.415 17927 12213 1 15 . 1 1 111 111 ARG C C 111 171.541 171.541 174.413 -2.872 17927 12214 1 15 . 1 1 111 111 ARG CA C 111 54.356 54.356 54.286 0.070 17927 12215 1 15 . 1 1 111 111 ARG CB C 111 33.430 33.430 32.914 0.516 17927 12216 1 15 . 1 1 111 111 ARG H H 111 7.732 7.732 8.227 -0.495 17927 12217 1 15 . 1 1 112 112 PHE N N 112 125.103 125.103 119.399 5.704 17927 12218 1 15 . 1 1 112 112 PHE HA H 112 5.773 5.773 4.937 0.836 17927 12219 1 15 . 1 1 112 112 PHE C C 112 175.097 175.097 175.545 -0.448 17927 12220 1 15 . 1 1 112 112 PHE CA C 112 55.791 55.791 56.761 -0.970 17927 12221 1 15 . 1 1 112 112 PHE CB C 112 40.928 40.928 41.037 -0.109 17927 12222 1 15 . 1 1 112 112 PHE H H 112 8.929 8.929 8.442 0.487 17927 12223 1 15 . 1 1 113 113 ILE N N 113 123.778 123.778 122.362 1.416 17927 12224 1 15 . 1 1 113 113 ILE HA H 113 4.543 4.543 5.016 -0.473 17927 12225 1 15 . 1 1 113 113 ILE C C 113 173.197 173.197 174.175 -0.978 17927 12226 1 15 . 1 1 113 113 ILE CA C 113 60.286 60.286 60.136 0.150 17927 12227 1 15 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.878 1.368 17927 12228 1 15 . 1 1 113 113 ILE H H 113 8.873 8.873 8.910 -0.037 17927 12229 1 15 . 1 1 114 114 LEU N N 114 127.146 127.146 126.483 0.663 17927 12230 1 15 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.593 0.421 17927 12231 1 15 . 1 1 114 114 LEU C C 114 175.080 175.080 174.694 0.386 17927 12232 1 15 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.605 -0.204 17927 12233 1 15 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.653 0.717 17927 12234 1 15 . 1 1 114 114 LEU H H 114 8.974 8.974 8.854 0.120 17927 12235 1 15 . 1 1 115 115 LEU N N 115 128.323 128.323 124.458 3.865 17927 12236 1 15 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.319 0.113 17927 12237 1 15 . 1 1 115 115 LEU C C 115 176.660 176.660 176.129 0.531 17927 12238 1 15 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.478 -0.401 17927 12239 1 15 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.394 -1.810 17927 12240 1 15 . 1 1 115 115 LEU H H 115 9.874 9.874 9.471 0.403 17927 12241 1 15 . 1 1 116 116 ASP N N 116 119.834 119.834 121.575 -1.741 17927 12242 1 15 . 1 1 116 116 ASP HA H 116 4.935 4.935 5.052 -0.117 17927 12243 1 15 . 1 1 116 116 ASP C C 116 176.898 176.898 177.257 -0.359 17927 12244 1 15 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.133 -0.828 17927 12245 1 15 . 1 1 116 116 ASP CB C 116 41.028 41.028 41.582 -0.554 17927 12246 1 15 . 1 1 116 116 ASP H H 116 9.357 9.357 9.021 0.336 17927 12247 1 15 . 1 1 117 117 ARG N N 117 113.356 113.356 117.907 -4.551 17927 12248 1 15 . 1 1 117 117 ARG HA H 117 3.717 3.717 4.124 -0.407 17927 12249 1 15 . 1 1 117 117 ARG C C 117 177.105 177.105 178.181 -1.076 17927 12250 1 15 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.272 -1.087 17927 12251 1 15 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.887 0.551 17927 12252 1 15 . 1 1 117 117 ARG H H 117 7.697 7.697 8.475 -0.778 17927 12253 1 15 . 1 1 118 118 ASP N N 118 117.226 117.226 117.337 -0.111 17927 12254 1 15 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.539 0.356 17927 12255 1 15 . 1 1 118 118 ASP C C 118 176.657 176.657 176.594 0.063 17927 12256 1 15 . 1 1 118 118 ASP CA C 118 53.517 53.517 54.902 -1.385 17927 12257 1 15 . 1 1 118 118 ASP CB C 118 42.556 42.556 41.299 1.257 17927 12258 1 15 . 1 1 118 118 ASP H H 118 8.456 8.456 8.206 0.250 17927 12259 1 15 . 1 1 119 119 GLY N N 119 109.074 109.074 107.014 2.060 17927 12260 1 15 . 1 1 119 119 GLY C C 119 173.355 173.355 174.027 -0.672 17927 12261 1 15 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.193 1.063 17927 12262 1 15 . 1 1 119 119 GLY H H 119 8.183 8.183 8.307 -0.124 17927 12263 1 15 . 1 1 120 120 LYS N N 120 120.744 120.744 120.653 0.091 17927 12264 1 15 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.782 -0.249 17927 12265 1 15 . 1 1 120 120 LYS C C 120 177.229 177.229 176.462 0.767 17927 12266 1 15 . 1 1 120 120 LYS CA C 120 55.287 55.287 53.789 1.498 17927 12267 1 15 . 1 1 120 120 LYS CB C 120 32.581 32.581 33.584 -1.003 17927 12268 1 15 . 1 1 120 120 LYS H H 120 8.449 8.449 8.214 0.235 17927 12269 1 15 . 1 1 121 121 ILE N N 121 121.221 121.221 127.851 -6.630 17927 12270 1 15 . 1 1 121 121 ILE HA H 121 3.886 3.886 4.014 -0.128 17927 12271 1 15 . 1 1 121 121 ILE C C 121 177.819 177.819 176.554 1.265 17927 12272 1 15 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.414 0.501 17927 12273 1 15 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.140 2.250 17927 12274 1 15 . 1 1 121 121 ILE H H 121 8.715 8.715 9.042 -0.327 17927 12275 1 15 . 1 1 122 122 ILE N N 122 127.165 127.165 127.606 -0.441 17927 12276 1 15 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.175 0.166 17927 12277 1 15 . 1 1 122 122 ILE C C 122 176.978 176.978 176.616 0.362 17927 12278 1 15 . 1 1 122 122 ILE CA C 122 63.719 63.719 61.956 1.763 17927 12279 1 15 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.521 0.131 17927 12280 1 15 . 1 1 122 122 ILE H H 122 8.974 8.974 8.762 0.212 17927 12281 1 15 . 1 1 123 123 SER N N 123 111.227 111.227 115.679 -4.452 17927 12282 1 15 . 1 1 123 123 SER HA H 123 4.738 4.738 4.738 -0.000 17927 12283 1 15 . 1 1 123 123 SER C C 123 174.184 174.184 173.905 0.279 17927 12284 1 15 . 1 1 123 123 SER CA C 123 57.383 57.383 56.939 0.444 17927 12285 1 15 . 1 1 123 123 SER CB C 123 65.326 65.326 64.868 0.458 17927 12286 1 15 . 1 1 123 123 SER H H 123 7.850 7.850 8.302 -0.452 17927 12287 1 15 . 1 1 124 124 ALA N N 124 131.373 131.373 128.540 2.833 17927 12288 1 15 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.206 0.279 17927 12289 1 15 . 1 1 124 124 ALA C C 124 175.147 175.147 176.407 -1.260 17927 12290 1 15 . 1 1 124 124 ALA CA C 124 53.035 53.035 54.076 -1.041 17927 12291 1 15 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.238 -0.576 17927 12292 1 15 . 1 1 124 124 ALA H H 124 9.384 9.384 8.947 0.437 17927 12293 1 15 . 1 1 125 125 ASN N N 125 119.476 119.476 114.348 5.128 17927 12294 1 15 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.455 -0.399 17927 12295 1 15 . 1 1 125 125 ASN C C 125 173.593 173.593 174.425 -0.832 17927 12296 1 15 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.387 -0.035 17927 12297 1 15 . 1 1 125 125 ASN CB C 125 38.304 38.304 39.588 -1.284 17927 12298 1 15 . 1 1 125 125 ASN H H 125 8.191 8.191 7.909 0.282 17927 12299 1 15 . 1 1 126 126 MET N N 126 122.705 122.705 125.096 -2.391 17927 12300 1 15 . 1 1 126 126 MET HA H 126 4.585 4.585 4.943 -0.358 17927 12301 1 15 . 1 1 126 126 MET C C 126 175.215 175.215 175.346 -0.131 17927 12302 1 15 . 1 1 126 126 MET CA C 126 53.849 53.849 53.782 0.067 17927 12303 1 15 . 1 1 126 126 MET CB C 126 31.312 31.312 34.943 -3.631 17927 12304 1 15 . 1 1 126 126 MET H H 126 8.376 8.376 9.215 -0.839 17927 12305 1 15 . 1 1 127 127 THR N N 127 111.016 111.016 113.599 -2.583 17927 12306 1 15 . 1 1 127 127 THR HA H 127 4.291 4.291 4.398 -0.107 17927 12307 1 15 . 1 1 127 127 THR C C 127 174.574 174.574 172.968 1.606 17927 12308 1 15 . 1 1 127 127 THR CA C 127 62.085 62.085 60.297 1.788 17927 12309 1 15 . 1 1 127 127 THR CB C 127 69.733 69.733 70.858 -1.125 17927 12310 1 15 . 1 1 127 127 THR H H 127 7.714 7.714 8.367 -0.653 17927 12311 1 15 . 1 1 128 128 ARG N N 128 118.722 118.722 125.601 -6.879 17927 12312 1 15 . 1 1 128 128 ARG HA H 128 3.308 3.308 2.892 0.416 17927 12313 1 15 . 1 1 128 128 ARG C C 128 176.978 176.978 176.108 0.870 17927 12314 1 15 . 1 1 128 128 ARG CA C 128 54.727 54.727 56.904 -2.177 17927 12315 1 15 . 1 1 128 128 ARG CB C 128 29.598 29.598 29.629 -0.031 17927 12316 1 15 . 1 1 128 128 ARG H H 128 8.658 8.658 7.718 0.940 17927 12317 1 15 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.079 -0.146 17927 12318 1 15 . 1 1 129 129 PRO C C 129 175.794 175.794 177.076 -1.282 17927 12319 1 15 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.374 1.175 17927 12320 1 15 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.552 0.124 17927 12321 1 15 . 1 1 130 130 SER N N 130 108.696 108.696 109.460 -0.764 17927 12322 1 15 . 1 1 130 130 SER HA H 130 3.988 3.988 4.283 -0.295 17927 12323 1 15 . 1 1 130 130 SER C C 130 174.445 174.445 174.404 0.041 17927 12324 1 15 . 1 1 130 130 SER CA C 130 58.911 58.911 58.714 0.197 17927 12325 1 15 . 1 1 130 130 SER CB C 130 62.680 62.680 62.975 -0.295 17927 12326 1 15 . 1 1 130 130 SER H H 130 8.375 8.375 8.112 0.263 17927 12327 1 15 . 1 1 131 131 ASP N N 131 126.377 126.377 123.945 2.432 17927 12328 1 15 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.874 -0.002 17927 12329 1 15 . 1 1 131 131 ASP C C 131 176.879 176.879 175.456 1.423 17927 12330 1 15 . 1 1 131 131 ASP CA C 131 51.195 51.195 51.191 0.003 17927 12331 1 15 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.397 0.419 17927 12332 1 15 . 1 1 131 131 ASP H H 131 7.514 7.514 7.799 -0.285 17927 12333 1 15 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.251 0.141 17927 12334 1 15 . 1 1 132 132 PRO C C 132 178.097 178.097 177.553 0.544 17927 12335 1 15 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.585 0.494 17927 12336 1 15 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.006 0.403 17927 12337 1 15 . 1 1 133 133 LYS N N 133 116.306 116.306 117.706 -1.400 17927 12338 1 15 . 1 1 133 133 LYS HA H 133 3.958 3.958 4.287 -0.329 17927 12339 1 15 . 1 1 133 133 LYS C C 133 179.532 179.532 179.075 0.457 17927 12340 1 15 . 1 1 133 133 LYS CA C 133 58.521 58.521 58.588 -0.067 17927 12341 1 15 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.309 0.882 17927 12342 1 15 . 1 1 133 133 LYS H H 133 8.842 8.842 7.689 1.153 17927 12343 1 15 . 1 1 134 134 THR N N 134 120.833 120.833 115.805 5.028 17927 12344 1 15 . 1 1 134 134 THR HA H 134 3.147 3.147 3.681 -0.534 17927 12345 1 15 . 1 1 134 134 THR C C 134 173.356 173.356 174.812 -1.456 17927 12346 1 15 . 1 1 134 134 THR CA C 134 66.383 66.383 65.234 1.149 17927 12347 1 15 . 1 1 134 134 THR CB C 134 66.847 66.847 68.354 -1.507 17927 12348 1 15 . 1 1 134 134 THR H H 134 8.292 8.292 8.493 -0.201 17927 12349 1 15 . 1 1 135 135 ALA N N 135 121.720 121.720 123.168 -1.448 17927 12350 1 15 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.518 0.065 17927 12351 1 15 . 1 1 135 135 ALA C C 135 178.902 178.902 178.732 0.170 17927 12352 1 15 . 1 1 135 135 ALA CA C 135 54.999 54.999 55.053 -0.054 17927 12353 1 15 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.288 -0.513 17927 12354 1 15 . 1 1 135 135 ALA H H 135 7.030 7.030 7.221 -0.191 17927 12355 1 15 . 1 1 136 136 GLU N N 136 114.623 114.623 118.107 -3.484 17927 12356 1 15 . 1 1 136 136 GLU HA H 136 3.922 3.922 4.226 -0.304 17927 12357 1 15 . 1 1 136 136 GLU C C 136 179.199 179.199 178.960 0.239 17927 12358 1 15 . 1 1 136 136 GLU CA C 136 59.837 59.837 58.728 1.109 17927 12359 1 15 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.057 0.729 17927 12360 1 15 . 1 1 136 136 GLU H H 136 7.216 7.216 8.432 -1.216 17927 12361 1 15 . 1 1 137 137 LYS N N 137 120.789 120.789 120.705 0.084 17927 12362 1 15 . 1 1 137 137 LYS HA H 137 4.204 4.204 4.185 0.019 17927 12363 1 15 . 1 1 137 137 LYS C C 137 178.834 178.834 178.666 0.168 17927 12364 1 15 . 1 1 137 137 LYS CA C 137 57.343 57.343 59.069 -1.726 17927 12365 1 15 . 1 1 137 137 LYS CB C 137 30.463 30.463 32.096 -1.633 17927 12366 1 15 . 1 1 137 137 LYS H H 137 7.681 7.681 7.144 0.537 17927 12367 1 15 . 1 1 138 138 PHE N N 138 118.373 118.373 118.490 -0.117 17927 12368 1 15 . 1 1 138 138 PHE HA H 138 4.033 4.033 3.992 0.041 17927 12369 1 15 . 1 1 138 138 PHE C C 138 178.027 178.027 178.247 -0.220 17927 12370 1 15 . 1 1 138 138 PHE CA C 138 57.507 57.507 60.345 -2.838 17927 12371 1 15 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.581 -1.692 17927 12372 1 15 . 1 1 138 138 PHE H H 138 8.059 8.059 7.703 0.356 17927 12373 1 15 . 1 1 139 139 ASN N N 139 117.611 117.611 117.086 0.525 17927 12374 1 15 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.472 -0.068 17927 12375 1 15 . 1 1 139 139 ASN C C 139 178.190 178.190 177.780 0.410 17927 12376 1 15 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.088 0.136 17927 12377 1 15 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.885 -1.151 17927 12378 1 15 . 1 1 139 139 ASN H H 139 8.683 8.683 8.081 0.602 17927 12379 1 15 . 1 1 140 140 GLU N N 140 121.432 121.432 121.129 0.303 17927 12380 1 15 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.030 -0.025 17927 12381 1 15 . 1 1 140 140 GLU C C 140 179.751 179.751 179.599 0.152 17927 12382 1 15 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.541 -0.231 17927 12383 1 15 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.763 0.292 17927 12384 1 15 . 1 1 140 140 GLU H H 140 7.868 7.868 8.330 -0.462 17927 12385 1 15 . 1 1 141 141 LEU N N 141 119.968 119.968 117.181 2.787 17927 12386 1 15 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.173 -0.157 17927 12387 1 15 . 1 1 141 141 LEU C C 141 179.293 179.293 178.367 0.926 17927 12388 1 15 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.615 -0.179 17927 12389 1 15 . 1 1 141 141 LEU CB C 141 41.183 41.183 40.849 0.334 17927 12390 1 15 . 1 1 141 141 LEU H H 141 8.303 8.303 8.536 -0.233 17927 12391 1 15 . 1 1 142 142 LEU N N 142 115.040 115.040 117.976 -2.936 17927 12392 1 15 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.274 0.110 17927 12393 1 15 . 1 1 142 142 LEU C C 142 178.002 178.002 177.949 0.053 17927 12394 1 15 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.832 -0.553 17927 12395 1 15 . 1 1 142 142 LEU CB C 142 42.646 42.646 41.094 1.552 17927 12396 1 15 . 1 1 142 142 LEU H H 142 8.230 8.230 7.733 0.497 17927 12397 1 15 . 1 1 143 143 GLY N N 143 108.977 108.977 106.872 2.105 17927 12398 1 15 . 1 1 143 143 GLY C C 143 175.216 175.216 174.753 0.463 17927 12399 1 15 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.574 1.167 17927 12400 1 15 . 1 1 143 143 GLY H H 143 7.762 7.762 7.801 -0.039 17927 12401 1 15 . 1 1 144 144 LEU N N 144 119.660 119.660 119.370 0.290 17927 12402 1 15 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.529 -0.041 17927 12403 1 15 . 1 1 144 144 LEU C C 144 177.375 177.375 176.920 0.455 17927 12404 1 15 . 1 1 144 144 LEU CA C 144 54.525 54.525 56.999 -2.474 17927 12405 1 15 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.953 -0.180 17927 12406 1 15 . 1 1 144 144 LEU H H 144 8.241 8.241 8.557 -0.316 17927 12407 1 15 . 1 1 145 145 GLU N N 145 119.959 119.959 117.844 2.115 17927 12408 1 15 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.375 -0.134 17927 12409 1 15 . 1 1 145 145 GLU C C 145 177.075 177.075 175.897 1.178 17927 12410 1 15 . 1 1 145 145 GLU CA C 145 56.799 56.799 55.735 1.064 17927 12411 1 15 . 1 1 145 145 GLU CB C 145 30.168 30.168 31.308 -1.140 17927 12412 1 15 . 1 1 145 145 GLU H H 145 8.410 8.410 7.380 1.030 17927 12413 1 15 . 1 1 146 146 GLY N N 146 109.412 109.412 106.797 2.615 17927 12414 1 15 . 1 1 146 146 GLY C C 146 174.276 174.276 173.686 0.590 17927 12415 1 15 . 1 1 146 146 GLY CA C 146 45.445 45.445 44.494 0.951 17927 12416 1 15 . 1 1 146 146 GLY H H 146 8.422 8.422 8.473 -0.051 17927 12417 1 15 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.701 -0.045 17927 12418 1 15 . 1 1 151 151 HIS C C 151 173.990 173.990 174.065 -0.075 17927 12419 1 15 . 1 1 151 151 HIS CA C 151 56.044 56.044 56.888 -0.844 17927 12420 1 15 . 1 1 151 151 HIS CB C 151 30.076 30.076 31.939 -1.863 17927 12421 1 16 . 1 1 2 2 SER HA H 2 4.121 4.121 4.596 -0.475 17927 12422 1 16 . 1 1 2 2 SER CA C 2 57.293 57.293 57.955 -0.662 17927 12423 1 16 . 1 1 2 2 SER CB C 2 63.545 63.545 63.540 0.005 17927 12424 1 16 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.318 0.114 17927 12425 1 16 . 1 1 3 3 LEU C C 3 177.383 177.383 177.102 0.281 17927 12426 1 16 . 1 1 3 3 LEU CA C 3 55.575 55.575 54.285 1.290 17927 12427 1 16 . 1 1 3 3 LEU CB C 3 42.584 42.584 38.968 3.616 17927 12428 1 16 . 1 1 4 4 ARG N N 4 122.080 122.080 122.735 -0.655 17927 12429 1 16 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.498 -0.114 17927 12430 1 16 . 1 1 4 4 ARG C C 4 176.410 176.410 177.215 -0.805 17927 12431 1 16 . 1 1 4 4 ARG CA C 4 56.269 56.269 56.791 -0.522 17927 12432 1 16 . 1 1 4 4 ARG CB C 4 30.842 30.842 31.454 -0.612 17927 12433 1 16 . 1 1 4 4 ARG H H 4 8.410 8.410 8.313 0.097 17927 12434 1 16 . 1 1 5 5 SER N N 5 117.023 117.023 115.170 1.853 17927 12435 1 16 . 1 1 5 5 SER HA H 5 4.423 4.423 4.427 -0.004 17927 12436 1 16 . 1 1 5 5 SER C C 5 175.039 175.039 175.568 -0.529 17927 12437 1 16 . 1 1 5 5 SER CA C 5 58.605 58.605 58.739 -0.134 17927 12438 1 16 . 1 1 5 5 SER CB C 5 64.044 64.044 63.671 0.373 17927 12439 1 16 . 1 1 5 5 SER H H 5 8.292 8.292 8.395 -0.103 17927 12440 1 16 . 1 1 6 6 GLY N N 6 110.718 110.718 108.445 2.273 17927 12441 1 16 . 1 1 6 6 GLY C C 6 173.654 173.654 174.188 -0.534 17927 12442 1 16 . 1 1 6 6 GLY CA C 6 45.273 45.273 44.929 0.344 17927 12443 1 16 . 1 1 6 6 GLY H H 6 8.446 8.446 8.652 -0.206 17927 12444 1 16 . 1 1 7 7 ASN N N 7 119.287 119.287 119.783 -0.496 17927 12445 1 16 . 1 1 7 7 ASN HA H 7 5.024 5.024 5.167 -0.143 17927 12446 1 16 . 1 1 7 7 ASN C C 7 173.672 173.672 175.178 -1.506 17927 12447 1 16 . 1 1 7 7 ASN CA C 7 51.357 51.357 50.896 0.461 17927 12448 1 16 . 1 1 7 7 ASN CB C 7 38.927 38.927 39.340 -0.413 17927 12449 1 16 . 1 1 7 7 ASN H H 7 8.273 8.273 7.597 0.676 17927 12450 1 16 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.286 0.161 17927 12451 1 16 . 1 1 8 8 PRO C C 8 176.899 176.899 177.498 -0.599 17927 12452 1 16 . 1 1 8 8 PRO CA C 8 63.429 63.429 64.793 -1.363 17927 12453 1 16 . 1 1 8 8 PRO CB C 8 32.216 32.216 32.006 0.210 17927 12454 1 16 . 1 1 9 9 SER N N 9 115.642 115.642 111.451 4.191 17927 12455 1 16 . 1 1 9 9 SER HA H 9 4.415 4.415 3.937 0.478 17927 12456 1 16 . 1 1 9 9 SER C C 9 174.714 174.714 174.507 0.207 17927 12457 1 16 . 1 1 9 9 SER CA C 9 58.488 58.488 59.700 -1.212 17927 12458 1 16 . 1 1 9 9 SER CB C 9 64.048 64.048 62.481 1.567 17927 12459 1 16 . 1 1 9 9 SER H H 9 8.336 8.336 8.306 0.030 17927 12460 1 16 . 1 1 10 10 ALA N N 10 126.808 126.808 123.729 3.079 17927 12461 1 16 . 1 1 10 10 ALA HA H 10 4.262 4.262 3.828 0.434 17927 12462 1 16 . 1 1 10 10 ALA C C 10 177.233 177.233 176.165 1.068 17927 12463 1 16 . 1 1 10 10 ALA CA C 10 53.230 53.230 52.038 1.192 17927 12464 1 16 . 1 1 10 10 ALA CB C 10 19.187 19.187 16.372 2.815 17927 12465 1 16 . 1 1 10 10 ALA H H 10 8.137 8.137 7.940 0.197 17927 12466 1 16 . 1 1 11 11 ALA N N 11 120.449 120.449 123.893 -3.444 17927 12467 1 16 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.526 -0.265 17927 12468 1 16 . 1 1 11 11 ALA C C 11 177.469 177.469 176.668 0.801 17927 12469 1 16 . 1 1 11 11 ALA CA C 11 52.475 52.475 52.070 0.405 17927 12470 1 16 . 1 1 11 11 ALA CB C 11 19.485 19.485 21.696 -2.211 17927 12471 1 16 . 1 1 11 11 ALA H H 11 7.851 7.851 8.083 -0.232 17927 12472 1 16 . 1 1 12 12 SER N N 12 114.186 114.186 112.887 1.299 17927 12473 1 16 . 1 1 12 12 SER HA H 12 4.312 4.312 4.804 -0.492 17927 12474 1 16 . 1 1 12 12 SER C C 12 173.593 173.593 172.349 1.244 17927 12475 1 16 . 1 1 12 12 SER CA C 12 58.099 58.099 57.871 0.228 17927 12476 1 16 . 1 1 12 12 SER CB C 12 63.320 63.320 64.356 -1.036 17927 12477 1 16 . 1 1 12 12 SER H H 12 7.990 7.990 7.709 0.281 17927 12478 1 16 . 1 1 13 13 PHE N N 13 118.092 118.092 118.246 -0.154 17927 12479 1 16 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.710 0.070 17927 12480 1 16 . 1 1 13 13 PHE C C 13 174.220 174.220 172.451 1.769 17927 12481 1 16 . 1 1 13 13 PHE CA C 13 56.717 56.717 56.911 -0.194 17927 12482 1 16 . 1 1 13 13 PHE CB C 13 41.151 41.151 41.362 -0.211 17927 12483 1 16 . 1 1 13 13 PHE H H 13 7.147 7.147 7.786 -0.639 17927 12484 1 16 . 1 1 14 14 SER N N 14 116.456 116.456 116.320 0.136 17927 12485 1 16 . 1 1 14 14 SER HA H 14 5.162 5.162 5.220 -0.058 17927 12486 1 16 . 1 1 14 14 SER C C 14 172.626 172.626 172.940 -0.314 17927 12487 1 16 . 1 1 14 14 SER CA C 14 57.390 57.390 57.427 -0.037 17927 12488 1 16 . 1 1 14 14 SER CB C 14 64.518 64.518 64.250 0.268 17927 12489 1 16 . 1 1 14 14 SER H H 14 7.616 7.616 8.108 -0.492 17927 12490 1 16 . 1 1 15 15 TYR N N 15 122.384 122.384 123.766 -1.382 17927 12491 1 16 . 1 1 15 15 TYR HA H 15 5.206 5.206 5.040 0.166 17927 12492 1 16 . 1 1 15 15 TYR C C 15 172.543 172.543 173.455 -0.912 17927 12493 1 16 . 1 1 15 15 TYR CA C 15 55.946 55.946 55.383 0.563 17927 12494 1 16 . 1 1 15 15 TYR CB C 15 43.227 43.227 41.498 1.729 17927 12495 1 16 . 1 1 15 15 TYR H H 15 8.558 8.558 9.103 -0.545 17927 12496 1 16 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.762 0.347 17927 12497 1 16 . 1 1 16 16 PRO C C 16 176.475 176.475 176.181 0.294 17927 12498 1 16 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.323 -0.342 17927 12499 1 16 . 1 1 16 16 PRO CB C 16 32.662 32.662 31.917 0.745 17927 12500 1 16 . 1 1 17 17 ASP N N 17 119.834 119.834 125.706 -5.872 17927 12501 1 16 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.914 0.825 17927 12502 1 16 . 1 1 17 17 ASP C C 17 180.740 180.740 178.184 2.556 17927 12503 1 16 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.314 -1.597 17927 12504 1 16 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.561 -1.000 17927 12505 1 16 . 1 1 17 17 ASP H H 17 8.643 8.643 8.756 -0.113 17927 12506 1 16 . 1 1 18 18 ILE N N 18 118.340 118.340 121.593 -3.253 17927 12507 1 16 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.750 0.701 17927 12508 1 16 . 1 1 18 18 ILE C C 18 175.742 175.742 176.713 -0.971 17927 12509 1 16 . 1 1 18 18 ILE CA C 18 61.894 61.894 64.834 -2.940 17927 12510 1 16 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.250 0.990 17927 12511 1 16 . 1 1 18 18 ILE H H 18 8.450 8.450 8.300 0.150 17927 12512 1 16 . 1 1 19 19 ASN N N 19 119.377 119.377 117.410 1.967 17927 12513 1 16 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.643 0.372 17927 12514 1 16 . 1 1 19 19 ASN C C 19 175.892 175.892 175.895 -0.003 17927 12515 1 16 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.300 -0.993 17927 12516 1 16 . 1 1 19 19 ASN CB C 19 39.825 39.825 38.976 0.849 17927 12517 1 16 . 1 1 19 19 ASN H H 19 8.376 8.376 8.854 -0.478 17927 12518 1 16 . 1 1 20 20 GLY N N 20 109.535 109.535 108.557 0.978 17927 12519 1 16 . 1 1 20 20 GLY C C 20 174.285 174.285 173.310 0.975 17927 12520 1 16 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.148 0.645 17927 12521 1 16 . 1 1 20 20 GLY H H 20 8.539 8.539 8.520 0.019 17927 12522 1 16 . 1 1 21 21 LYS N N 21 124.675 124.675 121.126 3.549 17927 12523 1 16 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.611 -0.168 17927 12524 1 16 . 1 1 21 21 LYS C C 21 176.537 176.537 175.842 0.695 17927 12525 1 16 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.636 0.808 17927 12526 1 16 . 1 1 21 21 LYS CB C 21 32.754 32.754 33.189 -0.435 17927 12527 1 16 . 1 1 21 21 LYS H H 21 8.608 8.608 7.439 1.169 17927 12528 1 16 . 1 1 22 22 THR N N 22 120.666 120.666 124.194 -3.528 17927 12529 1 16 . 1 1 22 22 THR HA H 22 4.087 4.087 4.501 -0.414 17927 12530 1 16 . 1 1 22 22 THR C C 22 174.431 174.431 174.222 0.209 17927 12531 1 16 . 1 1 22 22 THR CA C 22 64.292 64.292 64.540 -0.248 17927 12532 1 16 . 1 1 22 22 THR CB C 22 69.069 69.069 68.843 0.226 17927 12533 1 16 . 1 1 22 22 THR H H 22 8.595 8.595 8.747 -0.152 17927 12534 1 16 . 1 1 23 23 VAL N N 23 131.207 131.207 129.040 2.167 17927 12535 1 16 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.411 -0.219 17927 12536 1 16 . 1 1 23 23 VAL C C 23 174.244 174.244 173.750 0.494 17927 12537 1 16 . 1 1 23 23 VAL CA C 23 62.456 62.456 59.876 2.580 17927 12538 1 16 . 1 1 23 23 VAL CB C 23 33.791 33.791 35.676 -1.885 17927 12539 1 16 . 1 1 23 23 VAL H H 23 8.937 8.937 9.118 -0.181 17927 12540 1 16 . 1 1 24 24 SER N N 24 120.787 120.787 122.873 -2.086 17927 12541 1 16 . 1 1 24 24 SER HA H 24 5.407 5.407 5.213 0.194 17927 12542 1 16 . 1 1 24 24 SER C C 24 176.169 176.169 173.541 2.628 17927 12543 1 16 . 1 1 24 24 SER CA C 24 55.135 55.135 55.646 -0.511 17927 12544 1 16 . 1 1 24 24 SER CB C 24 65.646 65.646 65.652 -0.006 17927 12545 1 16 . 1 1 24 24 SER H H 24 8.554 8.554 9.082 -0.528 17927 12546 1 16 . 1 1 25 25 LEU N N 25 124.332 124.332 120.064 4.268 17927 12547 1 16 . 1 1 25 25 LEU HA H 25 3.687 3.687 4.015 -0.328 17927 12548 1 16 . 1 1 25 25 LEU C C 25 179.364 179.364 176.952 2.412 17927 12549 1 16 . 1 1 25 25 LEU CA C 25 58.217 58.217 55.256 2.961 17927 12550 1 16 . 1 1 25 25 LEU CB C 25 40.538 40.538 42.081 -1.543 17927 12551 1 16 . 1 1 25 25 LEU H H 25 7.811 7.811 7.605 0.206 17927 12552 1 16 . 1 1 26 26 ALA N N 26 119.799 119.799 120.555 -0.756 17927 12553 1 16 . 1 1 26 26 ALA HA H 26 3.993 3.993 3.999 -0.006 17927 12554 1 16 . 1 1 26 26 ALA C C 26 179.719 179.719 179.128 0.591 17927 12555 1 16 . 1 1 26 26 ALA CA C 26 54.663 54.663 54.324 0.339 17927 12556 1 16 . 1 1 26 26 ALA CB C 26 18.323 18.323 19.099 -0.776 17927 12557 1 16 . 1 1 26 26 ALA H H 26 8.099 8.099 7.271 0.828 17927 12558 1 16 . 1 1 27 27 ASP N N 27 116.553 116.553 117.827 -1.274 17927 12559 1 16 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.426 0.047 17927 12560 1 16 . 1 1 27 27 ASP C C 27 176.915 176.915 176.833 0.082 17927 12561 1 16 . 1 1 27 27 ASP CA C 27 56.251 56.251 56.046 0.205 17927 12562 1 16 . 1 1 27 27 ASP CB C 27 40.788 40.788 40.266 0.522 17927 12563 1 16 . 1 1 27 27 ASP H H 27 7.572 7.572 7.735 -0.163 17927 12564 1 16 . 1 1 28 28 LEU N N 28 118.950 118.950 118.174 0.776 17927 12565 1 16 . 1 1 28 28 LEU HA H 28 4.233 4.233 3.848 0.385 17927 12566 1 16 . 1 1 28 28 LEU C C 28 175.542 175.542 176.203 -0.661 17927 12567 1 16 . 1 1 28 28 LEU CA C 28 53.706 53.706 54.158 -0.452 17927 12568 1 16 . 1 1 28 28 LEU CB C 28 41.049 41.049 41.418 -0.369 17927 12569 1 16 . 1 1 28 28 LEU H H 28 7.363 7.363 7.499 -0.136 17927 12570 1 16 . 1 1 29 29 LYS N N 29 118.429 118.429 119.281 -0.852 17927 12571 1 16 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.478 -0.126 17927 12572 1 16 . 1 1 29 29 LYS C C 29 178.063 178.063 177.826 0.237 17927 12573 1 16 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.062 0.715 17927 12574 1 16 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.831 0.609 17927 12575 1 16 . 1 1 29 29 LYS H H 29 6.780 6.780 7.102 -0.322 17927 12576 1 16 . 1 1 30 30 GLY N N 30 112.426 112.426 110.130 2.296 17927 12577 1 16 . 1 1 30 30 GLY C C 30 173.801 173.801 173.464 0.337 17927 12578 1 16 . 1 1 30 30 GLY CA C 30 44.611 44.611 44.917 -0.306 17927 12579 1 16 . 1 1 30 30 GLY H H 30 9.398 9.398 8.875 0.523 17927 12580 1 16 . 1 1 31 31 LYS N N 31 119.295 119.295 119.290 0.005 17927 12581 1 16 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.634 -0.482 17927 12582 1 16 . 1 1 31 31 LYS C C 31 173.862 173.862 176.037 -2.175 17927 12583 1 16 . 1 1 31 31 LYS CA C 31 55.188 55.188 55.374 -0.186 17927 12584 1 16 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.052 1.916 17927 12585 1 16 . 1 1 31 31 LYS H H 31 7.496 7.496 7.409 0.087 17927 12586 1 16 . 1 1 32 32 TYR N N 32 116.984 116.984 123.649 -6.665 17927 12587 1 16 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.488 -0.331 17927 12588 1 16 . 1 1 32 32 TYR C C 32 175.226 175.226 175.705 -0.479 17927 12589 1 16 . 1 1 32 32 TYR CA C 32 60.590 60.590 61.184 -0.594 17927 12590 1 16 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.290 -0.169 17927 12591 1 16 . 1 1 32 32 TYR H H 32 7.521 7.521 9.331 -1.810 17927 12592 1 16 . 1 1 33 33 ILE N N 33 118.052 118.052 119.826 -1.774 17927 12593 1 16 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.540 0.367 17927 12594 1 16 . 1 1 33 33 ILE C C 33 174.308 174.308 174.162 0.146 17927 12595 1 16 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.425 0.277 17927 12596 1 16 . 1 1 33 33 ILE CB C 33 41.616 41.616 41.350 0.266 17927 12597 1 16 . 1 1 33 33 ILE H H 33 8.467 8.467 9.073 -0.606 17927 12598 1 16 . 1 1 34 34 TYR N N 34 130.242 130.242 127.857 2.385 17927 12599 1 16 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.214 0.312 17927 12600 1 16 . 1 1 34 34 TYR C C 34 174.245 174.245 173.371 0.874 17927 12601 1 16 . 1 1 34 34 TYR CA C 34 56.158 56.158 56.199 -0.041 17927 12602 1 16 . 1 1 34 34 TYR CB C 34 40.133 40.133 41.987 -1.854 17927 12603 1 16 . 1 1 34 34 TYR H H 34 8.905 8.905 9.242 -0.337 17927 12604 1 16 . 1 1 35 35 ILE N N 35 128.697 128.697 128.861 -0.164 17927 12605 1 16 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.158 0.184 17927 12606 1 16 . 1 1 35 35 ILE C C 35 174.520 174.520 174.236 0.284 17927 12607 1 16 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.707 0.042 17927 12608 1 16 . 1 1 35 35 ILE CB C 35 40.899 40.899 39.814 1.085 17927 12609 1 16 . 1 1 35 35 ILE H H 35 9.445 9.445 8.423 1.022 17927 12610 1 16 . 1 1 36 36 ASP N N 36 123.675 123.675 125.699 -2.024 17927 12611 1 16 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.902 -1.054 17927 12612 1 16 . 1 1 36 36 ASP C C 36 174.385 174.385 175.513 -1.128 17927 12613 1 16 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.421 -0.127 17927 12614 1 16 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.877 -3.099 17927 12615 1 16 . 1 1 36 36 ASP H H 36 8.875 8.875 8.904 -0.029 17927 12616 1 16 . 1 1 37 37 VAL N N 37 127.159 127.159 119.480 7.679 17927 12617 1 16 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.917 0.042 17927 12618 1 16 . 1 1 37 37 VAL C C 37 175.046 175.046 175.857 -0.811 17927 12619 1 16 . 1 1 37 37 VAL CA C 37 62.245 62.245 60.873 1.372 17927 12620 1 16 . 1 1 37 37 VAL CB C 37 31.807 31.807 32.698 -0.891 17927 12621 1 16 . 1 1 37 37 VAL H H 37 8.603 8.603 7.986 0.617 17927 12622 1 16 . 1 1 38 38 TRP N N 38 124.161 124.161 127.286 -3.125 17927 12623 1 16 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.068 0.169 17927 12624 1 16 . 1 1 38 38 TRP C C 38 171.995 171.995 173.413 -1.418 17927 12625 1 16 . 1 1 38 38 TRP CA C 38 55.207 55.207 54.443 0.764 17927 12626 1 16 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.181 3.006 17927 12627 1 16 . 1 1 38 38 TRP H H 38 8.562 8.562 8.403 0.159 17927 12628 1 16 . 1 1 39 39 ALA N N 39 116.252 116.252 125.702 -9.450 17927 12629 1 16 . 1 1 39 39 ALA HA H 39 3.678 3.678 4.318 -0.640 17927 12630 1 16 . 1 1 39 39 ALA C C 39 178.664 178.664 176.270 2.394 17927 12631 1 16 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.142 1.323 17927 12632 1 16 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.254 1.087 17927 12633 1 16 . 1 1 39 39 ALA H H 39 6.757 6.757 7.852 -1.095 17927 12634 1 16 . 1 1 40 40 THR N N 40 114.321 114.321 117.322 -3.001 17927 12635 1 16 . 1 1 40 40 THR HA H 40 3.907 3.907 4.342 -0.435 17927 12636 1 16 . 1 1 40 40 THR C C 40 175.885 175.885 175.789 0.096 17927 12637 1 16 . 1 1 40 40 THR CA C 40 65.447 65.447 64.498 0.949 17927 12638 1 16 . 1 1 40 40 THR CB C 40 70.106 70.106 69.434 0.672 17927 12639 1 16 . 1 1 40 40 THR H H 40 9.639 9.639 8.948 0.691 17927 12640 1 16 . 1 1 41 41 TRP N N 41 114.483 114.483 120.693 -6.210 17927 12641 1 16 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.697 -0.134 17927 12642 1 16 . 1 1 41 41 TRP C C 41 176.189 176.189 175.655 0.534 17927 12643 1 16 . 1 1 41 41 TRP CA C 41 54.698 54.698 55.814 -1.116 17927 12644 1 16 . 1 1 41 41 TRP CB C 41 29.977 29.977 27.889 2.088 17927 12645 1 16 . 1 1 41 41 TRP H H 41 6.401 6.401 7.626 -1.225 17927 12646 1 16 . 1 1 42 42 CYS N N 42 123.536 123.536 119.974 3.562 17927 12647 1 16 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.087 0.481 17927 12648 1 16 . 1 1 42 42 CYS C C 42 175.726 175.726 175.984 -0.258 17927 12649 1 16 . 1 1 42 42 CYS CA C 42 58.700 58.700 59.313 -0.613 17927 12650 1 16 . 1 1 42 42 CYS CB C 42 27.121 27.121 29.301 -2.180 17927 12651 1 16 . 1 1 42 42 CYS H H 42 6.883 6.883 7.419 -0.536 17927 12652 1 16 . 1 1 43 43 GLY N N 43 120.977 120.977 108.117 12.860 17927 12653 1 16 . 1 1 43 43 GLY CA C 43 49.204 49.204 45.227 3.977 17927 12654 1 16 . 1 1 43 43 GLY H H 43 9.653 9.653 7.493 2.160 17927 12655 1 16 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.355 0.132 17927 12656 1 16 . 1 1 44 44 PRO C C 44 179.956 179.956 178.363 1.593 17927 12657 1 16 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.093 0.549 17927 12658 1 16 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.179 1.399 17927 12659 1 16 . 1 1 45 45 CYS N N 45 113.925 113.925 114.929 -1.004 17927 12660 1 16 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.047 0.266 17927 12661 1 16 . 1 1 45 45 CYS C C 45 178.325 178.325 176.421 1.904 17927 12662 1 16 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.353 2.039 17927 12663 1 16 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.352 1.153 17927 12664 1 16 . 1 1 45 45 CYS H H 45 7.676 7.676 7.625 0.051 17927 12665 1 16 . 1 1 46 46 ARG N N 46 120.336 120.336 119.644 0.692 17927 12666 1 16 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.211 -0.142 17927 12667 1 16 . 1 1 46 46 ARG C C 46 180.446 180.446 178.066 2.380 17927 12668 1 16 . 1 1 46 46 ARG CA C 46 59.785 59.785 57.883 1.902 17927 12669 1 16 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.986 -0.118 17927 12670 1 16 . 1 1 46 46 ARG H H 46 8.109 8.109 7.991 0.118 17927 12671 1 16 . 1 1 47 47 GLY N N 47 105.408 105.408 107.058 -1.650 17927 12672 1 16 . 1 1 47 47 GLY C C 47 175.258 175.258 175.210 0.048 17927 12673 1 16 . 1 1 47 47 GLY CA C 47 46.594 46.594 45.933 0.661 17927 12674 1 16 . 1 1 47 47 GLY H H 47 8.466 8.466 8.310 0.156 17927 12675 1 16 . 1 1 48 48 GLU N N 48 116.343 116.343 121.060 -4.717 17927 12676 1 16 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.377 0.148 17927 12677 1 16 . 1 1 48 48 GLU C C 48 176.535 176.535 178.283 -1.748 17927 12678 1 16 . 1 1 48 48 GLU CA C 48 55.792 55.792 57.017 -1.225 17927 12679 1 16 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.543 1.439 17927 12680 1 16 . 1 1 48 48 GLU H H 48 7.050 7.050 7.654 -0.604 17927 12681 1 16 . 1 1 49 49 LEU N N 49 118.652 118.652 121.412 -2.760 17927 12682 1 16 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.115 0.037 17927 12683 1 16 . 1 1 49 49 LEU C C 49 176.832 176.832 176.378 0.454 17927 12684 1 16 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.749 -1.404 17927 12685 1 16 . 1 1 49 49 LEU CB C 49 38.496 38.496 38.975 -0.479 17927 12686 1 16 . 1 1 49 49 LEU H H 49 7.385 7.385 7.848 -0.463 17927 12687 1 16 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.100 0.153 17927 12688 1 16 . 1 1 50 50 PRO C C 50 179.744 179.744 178.084 1.660 17927 12689 1 16 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.300 0.259 17927 12690 1 16 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.857 -0.095 17927 12691 1 16 . 1 1 51 51 ALA N N 51 120.418 120.418 118.898 1.520 17927 12692 1 16 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.096 0.049 17927 12693 1 16 . 1 1 51 51 ALA C C 51 180.329 180.329 179.176 1.153 17927 12694 1 16 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.203 0.231 17927 12695 1 16 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.288 0.082 17927 12696 1 16 . 1 1 51 51 ALA H H 51 7.731 7.731 7.813 -0.082 17927 12697 1 16 . 1 1 52 52 LEU N N 52 121.506 121.506 120.668 0.838 17927 12698 1 16 . 1 1 52 52 LEU HA H 52 3.988 3.988 4.022 -0.034 17927 12699 1 16 . 1 1 52 52 LEU C C 52 177.944 177.944 178.500 -0.556 17927 12700 1 16 . 1 1 52 52 LEU CA C 52 58.327 58.327 57.508 0.819 17927 12701 1 16 . 1 1 52 52 LEU CB C 52 42.382 42.382 42.100 0.282 17927 12702 1 16 . 1 1 52 52 LEU H H 52 8.355 8.355 8.547 -0.192 17927 12703 1 16 . 1 1 53 53 LYS N N 53 119.732 119.732 119.731 0.001 17927 12704 1 16 . 1 1 53 53 LYS HA H 53 3.903 3.903 4.052 -0.149 17927 12705 1 16 . 1 1 53 53 LYS C C 53 179.030 179.030 179.052 -0.022 17927 12706 1 16 . 1 1 53 53 LYS CA C 53 59.846 59.846 59.738 0.108 17927 12707 1 16 . 1 1 53 53 LYS CB C 53 32.211 32.211 32.010 0.201 17927 12708 1 16 . 1 1 53 53 LYS H H 53 8.148 8.148 8.099 0.049 17927 12709 1 16 . 1 1 54 54 GLU N N 54 117.779 117.779 119.153 -1.374 17927 12710 1 16 . 1 1 54 54 GLU HA H 54 4.059 4.059 4.013 0.046 17927 12711 1 16 . 1 1 54 54 GLU C C 54 179.646 179.646 179.209 0.437 17927 12712 1 16 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.413 0.212 17927 12713 1 16 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.366 0.202 17927 12714 1 16 . 1 1 54 54 GLU H H 54 7.585 7.585 7.853 -0.268 17927 12715 1 16 . 1 1 55 55 LEU N N 55 120.581 120.581 119.514 1.067 17927 12716 1 16 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.225 -0.032 17927 12717 1 16 . 1 1 55 55 LEU C C 55 178.557 178.557 178.735 -0.178 17927 12718 1 16 . 1 1 55 55 LEU CA C 55 58.235 58.235 58.393 -0.158 17927 12719 1 16 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.996 1.015 17927 12720 1 16 . 1 1 55 55 LEU H H 55 8.096 8.096 7.629 0.467 17927 12721 1 16 . 1 1 56 56 GLU N N 56 118.023 118.023 118.920 -0.897 17927 12722 1 16 . 1 1 56 56 GLU HA H 56 3.177 3.177 3.104 0.073 17927 12723 1 16 . 1 1 56 56 GLU C C 56 179.650 179.650 179.248 0.402 17927 12724 1 16 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.040 -0.169 17927 12725 1 16 . 1 1 56 56 GLU CB C 56 26.985 26.985 28.768 -1.783 17927 12726 1 16 . 1 1 56 56 GLU H H 56 8.181 8.181 8.335 -0.154 17927 12727 1 16 . 1 1 57 57 GLU N N 57 117.828 117.828 118.719 -0.891 17927 12728 1 16 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.162 -0.058 17927 12729 1 16 . 1 1 57 57 GLU C C 57 179.700 179.700 178.460 1.240 17927 12730 1 16 . 1 1 57 57 GLU CA C 57 59.027 59.027 57.940 1.087 17927 12731 1 16 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.526 0.139 17927 12732 1 16 . 1 1 57 57 GLU H H 57 7.762 7.762 8.070 -0.308 17927 12733 1 16 . 1 1 58 58 LYS N N 58 120.896 120.896 119.350 1.546 17927 12734 1 16 . 1 1 58 58 LYS HA H 58 3.979 3.979 4.010 -0.031 17927 12735 1 16 . 1 1 58 58 LYS C C 58 178.715 178.715 177.566 1.149 17927 12736 1 16 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.616 0.462 17927 12737 1 16 . 1 1 58 58 LYS CB C 58 32.980 32.980 32.874 0.106 17927 12738 1 16 . 1 1 58 58 LYS H H 58 8.410 8.410 7.682 0.728 17927 12739 1 16 . 1 1 59 59 TYR N N 59 113.713 113.713 116.547 -2.834 17927 12740 1 16 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.571 -0.259 17927 12741 1 16 . 1 1 59 59 TYR C C 59 175.025 175.025 174.703 0.322 17927 12742 1 16 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.455 2.518 17927 12743 1 16 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.607 -1.173 17927 12744 1 16 . 1 1 59 59 TYR H H 59 8.102 8.102 8.230 -0.128 17927 12745 1 16 . 1 1 60 60 ALA N N 60 126.637 126.637 123.803 2.834 17927 12746 1 16 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.309 0.109 17927 12747 1 16 . 1 1 60 60 ALA C C 60 179.208 179.208 177.883 1.325 17927 12748 1 16 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.661 0.873 17927 12749 1 16 . 1 1 60 60 ALA CB C 60 18.589 18.589 17.979 0.610 17927 12750 1 16 . 1 1 60 60 ALA H H 60 7.201 7.201 7.520 -0.319 17927 12751 1 16 . 1 1 61 61 GLY N N 61 111.816 111.816 111.820 -0.004 17927 12752 1 16 . 1 1 61 61 GLY C C 61 174.698 174.698 174.749 -0.051 17927 12753 1 16 . 1 1 61 61 GLY CA C 61 45.904 45.904 44.779 1.125 17927 12754 1 16 . 1 1 61 61 GLY H H 61 9.184 9.184 8.400 0.784 17927 12755 1 16 . 1 1 62 62 LYS N N 62 118.497 118.497 121.124 -2.627 17927 12756 1 16 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.524 0.355 17927 12757 1 16 . 1 1 62 62 LYS C C 62 179.019 179.019 175.544 3.475 17927 12758 1 16 . 1 1 62 62 LYS CA C 62 53.988 53.988 55.382 -1.394 17927 12759 1 16 . 1 1 62 62 LYS CB C 62 33.840 33.840 33.637 0.203 17927 12760 1 16 . 1 1 62 62 LYS H H 62 8.019 8.019 7.843 0.176 17927 12761 1 16 . 1 1 63 63 ASP N N 63 122.982 122.982 120.568 2.414 17927 12762 1 16 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.711 -0.184 17927 12763 1 16 . 1 1 63 63 ASP C C 63 174.065 174.065 174.351 -0.286 17927 12764 1 16 . 1 1 63 63 ASP CA C 63 55.055 55.055 53.707 1.348 17927 12765 1 16 . 1 1 63 63 ASP CB C 63 38.582 38.582 40.117 -1.535 17927 12766 1 16 . 1 1 63 63 ASP H H 63 8.709 8.709 8.616 0.093 17927 12767 1 16 . 1 1 64 64 ILE N N 64 122.219 122.219 119.127 3.092 17927 12768 1 16 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.387 0.220 17927 12769 1 16 . 1 1 64 64 ILE C C 64 174.627 174.627 173.456 1.171 17927 12770 1 16 . 1 1 64 64 ILE CA C 64 59.712 59.712 59.636 0.076 17927 12771 1 16 . 1 1 64 64 ILE CB C 64 42.133 42.133 41.013 1.120 17927 12772 1 16 . 1 1 64 64 ILE H H 64 8.678 8.678 7.352 1.326 17927 12773 1 16 . 1 1 65 65 HIS N N 65 125.584 125.584 125.913 -0.329 17927 12774 1 16 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.896 0.147 17927 12775 1 16 . 1 1 65 65 HIS C C 65 174.153 174.153 174.048 0.105 17927 12776 1 16 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.310 0.649 17927 12777 1 16 . 1 1 65 65 HIS CB C 65 34.156 34.156 30.690 3.466 17927 12778 1 16 . 1 1 65 65 HIS H H 65 9.204 9.204 8.614 0.590 17927 12779 1 16 . 1 1 66 66 PHE N N 66 123.244 123.244 125.749 -2.505 17927 12780 1 16 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.797 0.413 17927 12781 1 16 . 1 1 66 66 PHE C C 66 175.463 175.463 174.941 0.522 17927 12782 1 16 . 1 1 66 66 PHE CA C 66 58.088 58.088 58.883 -0.795 17927 12783 1 16 . 1 1 66 66 PHE CB C 66 39.637 39.637 38.580 1.057 17927 12784 1 16 . 1 1 66 66 PHE H H 66 9.262 9.262 9.198 0.064 17927 12785 1 16 . 1 1 67 67 VAL N N 67 126.201 126.201 126.832 -0.631 17927 12786 1 16 . 1 1 67 67 VAL HA H 67 4.834 4.834 4.936 -0.102 17927 12787 1 16 . 1 1 67 67 VAL C C 67 174.364 174.364 175.499 -1.135 17927 12788 1 16 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.923 -0.199 17927 12789 1 16 . 1 1 67 67 VAL CB C 67 34.893 34.893 33.416 1.477 17927 12790 1 16 . 1 1 67 67 VAL H H 67 8.843 8.843 9.419 -0.576 17927 12791 1 16 . 1 1 68 68 SER N N 68 124.528 124.528 124.187 0.341 17927 12792 1 16 . 1 1 68 68 SER HA H 68 5.585 5.585 5.525 0.060 17927 12793 1 16 . 1 1 68 68 SER C C 68 172.858 172.858 172.807 0.051 17927 12794 1 16 . 1 1 68 68 SER CA C 68 57.282 57.282 57.800 -0.517 17927 12795 1 16 . 1 1 68 68 SER CB C 68 65.032 65.032 63.831 1.201 17927 12796 1 16 . 1 1 68 68 SER H H 68 9.243 9.243 8.919 0.324 17927 12797 1 16 . 1 1 69 69 LEU N N 69 126.695 126.695 127.632 -0.937 17927 12798 1 16 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.825 -1.308 17927 12799 1 16 . 1 1 69 69 LEU C C 69 174.652 174.652 175.124 -0.472 17927 12800 1 16 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.501 -0.674 17927 12801 1 16 . 1 1 69 69 LEU CB C 69 43.895 43.895 46.544 -2.649 17927 12802 1 16 . 1 1 69 69 LEU H H 69 9.360 9.360 9.194 0.166 17927 12803 1 16 . 1 1 70 70 SER N N 70 116.379 116.379 120.012 -3.633 17927 12804 1 16 . 1 1 70 70 SER HA H 70 4.905 4.905 5.148 -0.243 17927 12805 1 16 . 1 1 70 70 SER C C 70 176.307 176.307 175.034 1.273 17927 12806 1 16 . 1 1 70 70 SER CA C 70 55.213 55.213 55.962 -0.749 17927 12807 1 16 . 1 1 70 70 SER CB C 70 63.519 63.519 64.072 -0.553 17927 12808 1 16 . 1 1 70 70 SER H H 70 7.981 7.981 8.659 -0.678 17927 12809 1 16 . 1 1 71 71 CYS N N 71 124.670 124.670 127.598 -2.928 17927 12810 1 16 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.321 0.637 17927 12811 1 16 . 1 1 71 71 CYS C C 71 173.996 173.996 174.259 -0.263 17927 12812 1 16 . 1 1 71 71 CYS CA C 71 55.483 55.483 58.556 -3.073 17927 12813 1 16 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.473 0.639 17927 12814 1 16 . 1 1 71 71 CYS H H 71 8.609 8.609 9.081 -0.472 17927 12815 1 16 . 1 1 72 72 ASP N N 72 122.398 122.398 122.802 -0.404 17927 12816 1 16 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.809 -0.517 17927 12817 1 16 . 1 1 72 72 ASP C C 72 176.653 176.653 176.742 -0.089 17927 12818 1 16 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.814 0.968 17927 12819 1 16 . 1 1 72 72 ASP CB C 72 41.526 41.526 41.384 0.142 17927 12820 1 16 . 1 1 72 72 ASP H H 72 8.557 8.557 7.576 0.981 17927 12821 1 16 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.056 0.009 17927 12822 1 16 . 1 1 73 73 LYS C C 73 176.545 176.545 175.842 0.703 17927 12823 1 16 . 1 1 73 73 LYS CA C 73 58.458 58.458 58.309 0.149 17927 12824 1 16 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.619 0.022 17927 12825 1 16 . 1 1 74 74 ASN N N 74 117.616 117.616 119.299 -1.683 17927 12826 1 16 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.762 0.143 17927 12827 1 16 . 1 1 74 74 ASN C C 74 174.894 174.894 175.249 -0.355 17927 12828 1 16 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.718 -1.198 17927 12829 1 16 . 1 1 74 74 ASN CB C 74 38.109 38.109 37.902 0.207 17927 12830 1 16 . 1 1 74 74 ASN H H 74 8.625 8.625 8.258 0.367 17927 12831 1 16 . 1 1 75 75 LYS N N 75 126.797 126.797 126.304 0.493 17927 12832 1 16 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.699 -0.276 17927 12833 1 16 . 1 1 75 75 LYS C C 75 178.058 178.058 177.650 0.408 17927 12834 1 16 . 1 1 75 75 LYS CA C 75 60.173 60.173 59.538 0.635 17927 12835 1 16 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.671 0.620 17927 12836 1 16 . 1 1 75 75 LYS H H 75 8.588 8.588 8.323 0.265 17927 12837 1 16 . 1 1 76 76 LYS N N 76 117.875 117.875 120.079 -2.204 17927 12838 1 16 . 1 1 76 76 LYS HA H 76 4.200 4.200 4.456 -0.256 17927 12839 1 16 . 1 1 76 76 LYS C C 76 178.791 178.791 178.797 -0.006 17927 12840 1 16 . 1 1 76 76 LYS CA C 76 58.608 58.608 60.080 -1.472 17927 12841 1 16 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.826 -0.336 17927 12842 1 16 . 1 1 76 76 LYS H H 76 8.041 8.041 8.399 -0.358 17927 12843 1 16 . 1 1 77 77 ALA N N 77 121.567 121.567 121.166 0.401 17927 12844 1 16 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.368 -0.245 17927 12845 1 16 . 1 1 77 77 ALA C C 77 181.191 181.191 179.907 1.284 17927 12846 1 16 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.515 0.442 17927 12847 1 16 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.017 -0.258 17927 12848 1 16 . 1 1 77 77 ALA H H 77 7.366 7.366 8.505 -1.139 17927 12849 1 16 . 1 1 78 78 TRP N N 78 119.497 119.497 120.602 -1.105 17927 12850 1 16 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.271 -0.194 17927 12851 1 16 . 1 1 78 78 TRP C C 78 175.942 175.942 177.179 -1.237 17927 12852 1 16 . 1 1 78 78 TRP CA C 78 61.761 61.761 58.879 2.882 17927 12853 1 16 . 1 1 78 78 TRP CB C 78 27.272 27.272 29.989 -2.717 17927 12854 1 16 . 1 1 78 78 TRP H H 78 7.187 7.187 7.302 -0.115 17927 12855 1 16 . 1 1 79 79 GLU N N 79 118.771 118.771 119.940 -1.169 17927 12856 1 16 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.492 -0.478 17927 12857 1 16 . 1 1 79 79 GLU C C 79 179.863 179.863 178.266 1.597 17927 12858 1 16 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.661 -0.551 17927 12859 1 16 . 1 1 79 79 GLU CB C 79 30.220 30.220 29.084 1.136 17927 12860 1 16 . 1 1 79 79 GLU H H 79 8.813 8.813 8.944 -0.131 17927 12861 1 16 . 1 1 80 80 ASN N N 80 115.964 115.964 116.788 -0.824 17927 12862 1 16 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.515 -0.176 17927 12863 1 16 . 1 1 80 80 ASN C C 80 176.749 176.749 177.493 -0.744 17927 12864 1 16 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.329 0.706 17927 12865 1 16 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.577 -0.088 17927 12866 1 16 . 1 1 80 80 ASN H H 80 8.491 8.491 8.480 0.011 17927 12867 1 16 . 1 1 81 81 MET N N 81 119.670 119.670 121.817 -2.147 17927 12868 1 16 . 1 1 81 81 MET HA H 81 4.149 4.149 4.184 -0.035 17927 12869 1 16 . 1 1 81 81 MET C C 81 177.933 177.933 177.739 0.194 17927 12870 1 16 . 1 1 81 81 MET CA C 81 60.276 60.276 59.174 1.102 17927 12871 1 16 . 1 1 81 81 MET CB C 81 32.518 32.518 32.901 -0.383 17927 12872 1 16 . 1 1 81 81 MET H H 81 7.667 7.667 7.538 0.129 17927 12873 1 16 . 1 1 82 82 VAL N N 82 117.634 117.634 118.809 -1.175 17927 12874 1 16 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.472 -0.169 17927 12875 1 16 . 1 1 82 82 VAL C C 82 179.005 179.005 176.927 2.078 17927 12876 1 16 . 1 1 82 82 VAL CA C 82 67.037 67.037 65.919 1.118 17927 12877 1 16 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.453 0.312 17927 12878 1 16 . 1 1 82 82 VAL H H 82 8.338 8.338 8.324 0.014 17927 12879 1 16 . 1 1 83 83 THR N N 83 110.519 110.519 115.402 -4.883 17927 12880 1 16 . 1 1 83 83 THR HA H 83 3.983 3.983 3.999 -0.016 17927 12881 1 16 . 1 1 83 83 THR C C 83 177.591 177.591 176.485 1.106 17927 12882 1 16 . 1 1 83 83 THR CA C 83 65.431 65.431 66.504 -1.073 17927 12883 1 16 . 1 1 83 83 THR CB C 83 69.156 69.156 68.509 0.647 17927 12884 1 16 . 1 1 83 83 THR H H 83 7.659 7.659 7.625 0.034 17927 12885 1 16 . 1 1 84 84 LYS N N 84 123.927 123.927 121.683 2.244 17927 12886 1 16 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.135 -0.066 17927 12887 1 16 . 1 1 84 84 LYS C C 84 178.582 178.582 178.197 0.385 17927 12888 1 16 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.250 1.627 17927 12889 1 16 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.439 -0.116 17927 12890 1 16 . 1 1 84 84 LYS H H 84 8.665 8.665 7.638 1.027 17927 12891 1 16 . 1 1 85 85 ASP N N 85 116.280 116.280 116.289 -0.009 17927 12892 1 16 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.648 0.102 17927 12893 1 16 . 1 1 85 85 ASP C C 85 175.086 175.086 175.378 -0.292 17927 12894 1 16 . 1 1 85 85 ASP CA C 85 54.693 54.693 55.632 -0.939 17927 12895 1 16 . 1 1 85 85 ASP CB C 85 39.685 39.685 41.123 -1.438 17927 12896 1 16 . 1 1 85 85 ASP H H 85 8.179 8.179 8.372 -0.193 17927 12897 1 16 . 1 1 86 86 GLN N N 86 116.258 116.258 113.631 2.627 17927 12898 1 16 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.884 0.024 17927 12899 1 16 . 1 1 86 86 GLN C C 86 175.659 175.659 175.511 0.148 17927 12900 1 16 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.318 -0.147 17927 12901 1 16 . 1 1 86 86 GLN CB C 86 26.290 26.290 25.883 0.407 17927 12902 1 16 . 1 1 86 86 GLN H H 86 7.431 7.431 7.559 -0.128 17927 12903 1 16 . 1 1 87 87 LEU N N 87 117.031 117.031 118.639 -1.608 17927 12904 1 16 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.118 -0.028 17927 12905 1 16 . 1 1 87 87 LEU C C 87 178.225 178.225 176.398 1.827 17927 12906 1 16 . 1 1 87 87 LEU CA C 87 55.932 55.932 56.248 -0.316 17927 12907 1 16 . 1 1 87 87 LEU CB C 87 41.202 41.202 41.932 -0.730 17927 12908 1 16 . 1 1 87 87 LEU H H 87 7.736 7.736 7.436 0.300 17927 12909 1 16 . 1 1 88 88 LYS N N 88 122.367 122.367 121.218 1.149 17927 12910 1 16 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.436 0.200 17927 12911 1 16 . 1 1 88 88 LYS C C 88 177.538 177.538 175.935 1.603 17927 12912 1 16 . 1 1 88 88 LYS CA C 88 54.930 54.930 54.742 0.188 17927 12913 1 16 . 1 1 88 88 LYS CB C 88 33.316 33.316 34.693 -1.377 17927 12914 1 16 . 1 1 88 88 LYS H H 88 8.496 8.496 8.107 0.389 17927 12915 1 16 . 1 1 89 89 GLY N N 89 108.452 108.452 107.750 0.702 17927 12916 1 16 . 1 1 89 89 GLY C C 89 173.781 173.781 173.516 0.265 17927 12917 1 16 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.744 0.614 17927 12918 1 16 . 1 1 89 89 GLY H H 89 8.497 8.497 8.072 0.425 17927 12919 1 16 . 1 1 90 90 ILE N N 90 123.295 123.295 124.094 -0.799 17927 12920 1 16 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.244 0.127 17927 12921 1 16 . 1 1 90 90 ILE C C 90 175.606 175.606 174.032 1.574 17927 12922 1 16 . 1 1 90 90 ILE CA C 90 62.001 62.001 60.860 1.141 17927 12923 1 16 . 1 1 90 90 ILE CB C 90 38.036 38.036 38.389 -0.353 17927 12924 1 16 . 1 1 90 90 ILE H H 90 8.728 8.728 7.954 0.774 17927 12925 1 16 . 1 1 91 91 GLN N N 91 128.632 128.632 127.308 1.324 17927 12926 1 16 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.722 0.044 17927 12927 1 16 . 1 1 91 91 GLN C C 91 174.618 174.618 174.576 0.042 17927 12928 1 16 . 1 1 91 91 GLN CA C 91 54.850 54.850 54.031 0.819 17927 12929 1 16 . 1 1 91 91 GLN CB C 91 28.341 28.341 29.549 -1.208 17927 12930 1 16 . 1 1 91 91 GLN H H 91 8.762 8.762 8.530 0.232 17927 12931 1 16 . 1 1 92 92 LEU N N 92 120.830 120.830 119.297 1.533 17927 12932 1 16 . 1 1 92 92 LEU HA H 92 5.580 5.580 5.069 0.511 17927 12933 1 16 . 1 1 92 92 LEU C C 92 176.828 176.828 175.353 1.475 17927 12934 1 16 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.277 -0.476 17927 12935 1 16 . 1 1 92 92 LEU CB C 92 44.210 44.210 44.637 -0.427 17927 12936 1 16 . 1 1 92 92 LEU H H 92 9.011 9.011 9.134 -0.123 17927 12937 1 16 . 1 1 93 93 HIS N N 93 121.481 121.481 123.060 -1.579 17927 12938 1 16 . 1 1 93 93 HIS HA H 93 3.931 3.931 4.966 -1.035 17927 12939 1 16 . 1 1 93 93 HIS C C 93 173.590 173.590 173.731 -0.141 17927 12940 1 16 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.722 0.861 17927 12941 1 16 . 1 1 93 93 HIS CB C 93 32.250 32.250 32.805 -0.555 17927 12942 1 16 . 1 1 93 93 HIS H H 93 8.038 8.038 9.050 -1.012 17927 12943 1 16 . 1 1 94 94 MET N N 94 121.881 121.881 126.492 -4.611 17927 12944 1 16 . 1 1 94 94 MET HA H 94 3.866 3.866 3.508 0.358 17927 12945 1 16 . 1 1 94 94 MET C C 94 177.035 177.035 175.764 1.271 17927 12946 1 16 . 1 1 94 94 MET CA C 94 55.189 55.189 57.096 -1.907 17927 12947 1 16 . 1 1 94 94 MET CB C 94 33.993 33.993 33.487 0.506 17927 12948 1 16 . 1 1 94 94 MET H H 94 8.039 8.039 8.557 -0.518 17927 12949 1 16 . 1 1 95 95 GLY N N 95 104.041 104.041 105.514 -1.473 17927 12950 1 16 . 1 1 95 95 GLY C C 95 174.251 174.251 174.528 -0.277 17927 12951 1 16 . 1 1 95 95 GLY CA C 95 46.580 46.580 46.477 0.103 17927 12952 1 16 . 1 1 95 95 GLY H H 95 5.666 5.666 8.117 -2.451 17927 12953 1 16 . 1 1 96 96 THR N N 96 114.114 114.114 117.328 -3.214 17927 12954 1 16 . 1 1 96 96 THR HA H 96 4.211 4.211 4.332 -0.121 17927 12955 1 16 . 1 1 96 96 THR C C 96 175.122 175.122 174.818 0.304 17927 12956 1 16 . 1 1 96 96 THR CA C 96 61.339 61.339 62.610 -1.271 17927 12957 1 16 . 1 1 96 96 THR CB C 96 68.615 68.615 69.701 -1.086 17927 12958 1 16 . 1 1 96 96 THR H H 96 8.517 8.517 7.742 0.775 17927 12959 1 16 . 1 1 97 97 ASP N N 97 121.892 121.892 123.793 -1.901 17927 12960 1 16 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.865 -0.280 17927 12961 1 16 . 1 1 97 97 ASP C C 97 178.241 178.241 175.611 2.630 17927 12962 1 16 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.191 1.609 17927 12963 1 16 . 1 1 97 97 ASP CB C 97 43.129 43.129 39.593 3.536 17927 12964 1 16 . 1 1 97 97 ASP H H 97 7.563 7.563 7.850 -0.287 17927 12965 1 16 . 1 1 98 98 ARG N N 98 127.508 127.508 121.510 5.998 17927 12966 1 16 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.477 -0.085 17927 12967 1 16 . 1 1 98 98 ARG C C 98 176.724 176.724 176.882 -0.158 17927 12968 1 16 . 1 1 98 98 ARG CA C 98 55.939 55.939 55.375 0.564 17927 12969 1 16 . 1 1 98 98 ARG CB C 98 30.291 30.291 28.048 2.243 17927 12970 1 16 . 1 1 98 98 ARG H H 98 9.225 9.225 7.948 1.277 17927 12971 1 16 . 1 1 99 99 THR N N 99 116.384 116.384 115.900 0.484 17927 12972 1 16 . 1 1 99 99 THR HA H 99 3.987 3.987 4.176 -0.189 17927 12973 1 16 . 1 1 99 99 THR C C 99 176.969 176.969 175.321 1.648 17927 12974 1 16 . 1 1 99 99 THR CA C 99 67.714 67.714 65.092 2.622 17927 12975 1 16 . 1 1 99 99 THR CB C 99 68.777 68.777 68.633 0.144 17927 12976 1 16 . 1 1 99 99 THR H H 99 8.382 8.382 8.082 0.300 17927 12977 1 16 . 1 1 100 100 PHE N N 100 123.232 123.232 120.310 2.922 17927 12978 1 16 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.430 -0.257 17927 12979 1 16 . 1 1 100 100 PHE C C 100 177.010 177.010 177.179 -0.169 17927 12980 1 16 . 1 1 100 100 PHE CA C 100 61.923 61.923 61.625 0.298 17927 12981 1 16 . 1 1 100 100 PHE CB C 100 40.762 40.762 38.712 2.050 17927 12982 1 16 . 1 1 100 100 PHE H H 100 7.998 7.998 7.956 0.042 17927 12983 1 16 . 1 1 101 101 MET N N 101 115.968 115.968 119.356 -3.388 17927 12984 1 16 . 1 1 101 101 MET HA H 101 3.975 3.975 4.077 -0.102 17927 12985 1 16 . 1 1 101 101 MET C C 101 178.763 178.763 178.206 0.557 17927 12986 1 16 . 1 1 101 101 MET CA C 101 58.552 58.552 59.747 -1.195 17927 12987 1 16 . 1 1 101 101 MET CB C 101 32.593 32.593 32.310 0.283 17927 12988 1 16 . 1 1 101 101 MET H H 101 7.828 7.828 8.002 -0.174 17927 12989 1 16 . 1 1 102 102 ASP N N 102 117.553 117.553 119.360 -1.807 17927 12990 1 16 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.402 0.120 17927 12991 1 16 . 1 1 102 102 ASP C C 102 179.503 179.503 177.517 1.986 17927 12992 1 16 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.253 -0.363 17927 12993 1 16 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.481 -0.555 17927 12994 1 16 . 1 1 102 102 ASP H H 102 8.828 8.828 7.920 0.908 17927 12995 1 16 . 1 1 103 103 ALA N N 103 122.984 122.984 120.169 2.815 17927 12996 1 16 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.037 -0.051 17927 12997 1 16 . 1 1 103 103 ALA C C 103 178.782 178.782 178.486 0.296 17927 12998 1 16 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.174 0.920 17927 12999 1 16 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.903 -0.340 17927 13000 1 16 . 1 1 103 103 ALA H H 103 7.567 7.567 7.544 0.023 17927 13001 1 16 . 1 1 104 104 TYR N N 104 112.159 112.159 114.585 -2.426 17927 13002 1 16 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.651 -0.427 17927 13003 1 16 . 1 1 104 104 TYR C C 104 173.821 173.821 175.203 -1.382 17927 13004 1 16 . 1 1 104 104 TYR CA C 104 58.498 58.498 58.542 -0.044 17927 13005 1 16 . 1 1 104 104 TYR CB C 104 38.393 38.393 39.361 -0.968 17927 13006 1 16 . 1 1 104 104 TYR H H 104 7.203 7.203 8.090 -0.887 17927 13007 1 16 . 1 1 105 105 LEU N N 105 119.433 119.433 116.926 2.507 17927 13008 1 16 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.987 -0.002 17927 13009 1 16 . 1 1 105 105 LEU C C 105 176.721 176.721 175.835 0.886 17927 13010 1 16 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.907 -0.122 17927 13011 1 16 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.772 -1.329 17927 13012 1 16 . 1 1 105 105 LEU H H 105 7.582 7.582 7.754 -0.172 17927 13013 1 16 . 1 1 106 106 ILE N N 106 119.575 119.575 120.007 -0.432 17927 13014 1 16 . 1 1 106 106 ILE HA H 106 4.002 4.002 3.847 0.155 17927 13015 1 16 . 1 1 106 106 ILE C C 106 175.459 175.459 175.312 0.147 17927 13016 1 16 . 1 1 106 106 ILE CA C 106 62.043 62.043 62.335 -0.292 17927 13017 1 16 . 1 1 106 106 ILE CB C 106 36.335 36.335 35.484 0.851 17927 13018 1 16 . 1 1 106 106 ILE H H 106 8.774 8.774 7.777 0.997 17927 13019 1 16 . 1 1 107 107 ASN N N 107 126.514 126.514 125.820 0.694 17927 13020 1 16 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.804 0.059 17927 13021 1 16 . 1 1 107 107 ASN C C 107 174.584 174.584 175.147 -0.563 17927 13022 1 16 . 1 1 107 107 ASN CA C 107 53.112 53.112 53.654 -0.542 17927 13023 1 16 . 1 1 107 107 ASN CB C 107 38.977 38.977 40.762 -1.785 17927 13024 1 16 . 1 1 107 107 ASN H H 107 8.364 8.364 8.232 0.132 17927 13025 1 16 . 1 1 108 108 GLY N N 108 108.469 108.469 111.240 -2.771 17927 13026 1 16 . 1 1 108 108 GLY C C 108 171.245 171.245 173.503 -2.258 17927 13027 1 16 . 1 1 108 108 GLY CA C 108 45.269 45.269 45.187 0.082 17927 13028 1 16 . 1 1 108 108 GLY H H 108 7.678 7.678 8.358 -0.680 17927 13029 1 16 . 1 1 109 109 ILE N N 109 112.817 112.817 120.614 -7.797 17927 13030 1 16 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.570 -0.164 17927 13031 1 16 . 1 1 109 109 ILE C C 109 173.498 173.498 174.220 -0.722 17927 13032 1 16 . 1 1 109 109 ILE CA C 109 58.384 58.384 56.158 2.226 17927 13033 1 16 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.432 1.890 17927 13034 1 16 . 1 1 109 109 ILE H H 109 7.868 7.868 7.454 0.414 17927 13035 1 16 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.586 0.156 17927 13036 1 16 . 1 1 110 110 PRO C C 110 175.715 175.715 175.884 -0.169 17927 13037 1 16 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.681 -0.404 17927 13038 1 16 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.242 4.126 17927 13039 1 16 . 1 1 111 111 ARG N N 111 122.358 122.358 122.164 0.194 17927 13040 1 16 . 1 1 111 111 ARG HA H 111 4.469 4.469 3.928 0.541 17927 13041 1 16 . 1 1 111 111 ARG C C 111 171.541 171.541 175.024 -3.483 17927 13042 1 16 . 1 1 111 111 ARG CA C 111 54.356 54.356 54.240 0.116 17927 13043 1 16 . 1 1 111 111 ARG CB C 111 33.430 33.430 32.327 1.103 17927 13044 1 16 . 1 1 111 111 ARG H H 111 7.732 7.732 8.395 -0.663 17927 13045 1 16 . 1 1 112 112 PHE N N 112 125.103 125.103 118.569 6.534 17927 13046 1 16 . 1 1 112 112 PHE HA H 112 5.773 5.773 5.069 0.704 17927 13047 1 16 . 1 1 112 112 PHE C C 112 175.097 175.097 174.569 0.528 17927 13048 1 16 . 1 1 112 112 PHE CA C 112 55.791 55.791 55.752 0.039 17927 13049 1 16 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.549 1.379 17927 13050 1 16 . 1 1 112 112 PHE H H 112 8.929 8.929 7.380 1.549 17927 13051 1 16 . 1 1 113 113 ILE N N 113 123.778 123.778 122.525 1.253 17927 13052 1 16 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.770 -0.227 17927 13053 1 16 . 1 1 113 113 ILE C C 113 173.197 173.197 173.865 -0.668 17927 13054 1 16 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.597 0.688 17927 13055 1 16 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.273 1.973 17927 13056 1 16 . 1 1 113 113 ILE H H 113 8.873 8.873 8.749 0.124 17927 13057 1 16 . 1 1 114 114 LEU N N 114 127.146 127.146 127.145 0.001 17927 13058 1 16 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.196 0.818 17927 13059 1 16 . 1 1 114 114 LEU C C 114 175.080 175.080 174.372 0.708 17927 13060 1 16 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.610 -0.209 17927 13061 1 16 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.299 1.071 17927 13062 1 16 . 1 1 114 114 LEU H H 114 8.974 8.974 8.619 0.355 17927 13063 1 16 . 1 1 115 115 LEU N N 115 128.323 128.323 124.669 3.654 17927 13064 1 16 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.159 0.273 17927 13065 1 16 . 1 1 115 115 LEU C C 115 176.660 176.660 175.465 1.195 17927 13066 1 16 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.719 -0.642 17927 13067 1 16 . 1 1 115 115 LEU CB C 115 44.584 44.584 45.918 -1.334 17927 13068 1 16 . 1 1 115 115 LEU H H 115 9.874 9.874 9.341 0.533 17927 13069 1 16 . 1 1 116 116 ASP N N 116 119.834 119.834 122.257 -2.423 17927 13070 1 16 . 1 1 116 116 ASP HA H 116 4.935 4.935 4.958 -0.024 17927 13071 1 16 . 1 1 116 116 ASP C C 116 176.898 176.898 177.350 -0.452 17927 13072 1 16 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.435 -1.130 17927 13073 1 16 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.631 -1.603 17927 13074 1 16 . 1 1 116 116 ASP H H 116 9.357 9.357 8.867 0.490 17927 13075 1 16 . 1 1 117 117 ARG N N 117 113.356 113.356 120.502 -7.146 17927 13076 1 16 . 1 1 117 117 ARG HA H 117 3.717 3.717 4.133 -0.416 17927 13077 1 16 . 1 1 117 117 ARG C C 117 177.105 177.105 177.100 0.005 17927 13078 1 16 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.478 -1.293 17927 13079 1 16 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.939 0.498 17927 13080 1 16 . 1 1 117 117 ARG H H 117 7.697 7.697 8.122 -0.425 17927 13081 1 16 . 1 1 118 118 ASP N N 118 117.226 117.226 115.937 1.289 17927 13082 1 16 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.606 0.289 17927 13083 1 16 . 1 1 118 118 ASP C C 118 176.657 176.657 176.315 0.342 17927 13084 1 16 . 1 1 118 118 ASP CA C 118 53.517 53.517 54.079 -0.562 17927 13085 1 16 . 1 1 118 118 ASP CB C 118 42.556 42.556 41.026 1.530 17927 13086 1 16 . 1 1 118 118 ASP H H 118 8.456 8.456 8.074 0.382 17927 13087 1 16 . 1 1 119 119 GLY N N 119 109.074 109.074 107.781 1.293 17927 13088 1 16 . 1 1 119 119 GLY C C 119 173.355 173.355 174.130 -0.775 17927 13089 1 16 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.369 0.887 17927 13090 1 16 . 1 1 119 119 GLY H H 119 8.183 8.183 8.502 -0.319 17927 13091 1 16 . 1 1 120 120 LYS N N 120 120.744 120.744 121.759 -1.015 17927 13092 1 16 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.416 0.117 17927 13093 1 16 . 1 1 120 120 LYS C C 120 177.229 177.229 176.358 0.871 17927 13094 1 16 . 1 1 120 120 LYS CA C 120 55.287 55.287 55.451 -0.164 17927 13095 1 16 . 1 1 120 120 LYS CB C 120 32.581 32.581 32.445 0.136 17927 13096 1 16 . 1 1 120 120 LYS H H 120 8.449 8.449 7.489 0.960 17927 13097 1 16 . 1 1 121 121 ILE N N 121 121.221 121.221 127.433 -6.212 17927 13098 1 16 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.873 0.013 17927 13099 1 16 . 1 1 121 121 ILE C C 121 177.819 177.819 176.585 1.234 17927 13100 1 16 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.461 0.454 17927 13101 1 16 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.342 2.048 17927 13102 1 16 . 1 1 121 121 ILE H H 121 8.715 8.715 8.712 0.003 17927 13103 1 16 . 1 1 122 122 ILE N N 122 127.165 127.165 129.447 -2.282 17927 13104 1 16 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.096 0.245 17927 13105 1 16 . 1 1 122 122 ILE C C 122 176.978 176.978 176.620 0.358 17927 13106 1 16 . 1 1 122 122 ILE CA C 122 63.719 63.719 63.022 0.697 17927 13107 1 16 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.791 -0.139 17927 13108 1 16 . 1 1 122 122 ILE H H 122 8.974 8.974 8.856 0.118 17927 13109 1 16 . 1 1 123 123 SER N N 123 111.227 111.227 113.782 -2.555 17927 13110 1 16 . 1 1 123 123 SER HA H 123 4.738 4.738 4.788 -0.050 17927 13111 1 16 . 1 1 123 123 SER C C 123 174.184 174.184 173.794 0.390 17927 13112 1 16 . 1 1 123 123 SER CA C 123 57.383 57.383 57.483 -0.100 17927 13113 1 16 . 1 1 123 123 SER CB C 123 65.326 65.326 65.739 -0.413 17927 13114 1 16 . 1 1 123 123 SER H H 123 7.850 7.850 8.117 -0.267 17927 13115 1 16 . 1 1 124 124 ALA N N 124 131.373 131.373 125.676 5.697 17927 13116 1 16 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.322 0.163 17927 13117 1 16 . 1 1 124 124 ALA C C 124 175.147 175.147 175.928 -0.781 17927 13118 1 16 . 1 1 124 124 ALA CA C 124 53.035 53.035 54.076 -1.041 17927 13119 1 16 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.122 -0.460 17927 13120 1 16 . 1 1 124 124 ALA H H 124 9.384 9.384 8.691 0.693 17927 13121 1 16 . 1 1 125 125 ASN N N 125 119.476 119.476 112.448 7.028 17927 13122 1 16 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.359 -0.303 17927 13123 1 16 . 1 1 125 125 ASN C C 125 173.593 173.593 174.359 -0.766 17927 13124 1 16 . 1 1 125 125 ASN CA C 125 52.352 52.352 51.954 0.398 17927 13125 1 16 . 1 1 125 125 ASN CB C 125 38.304 38.304 40.554 -2.250 17927 13126 1 16 . 1 1 125 125 ASN H H 125 8.191 8.191 7.708 0.483 17927 13127 1 16 . 1 1 126 126 MET N N 126 122.705 122.705 120.560 2.145 17927 13128 1 16 . 1 1 126 126 MET HA H 126 4.585 4.585 4.863 -0.278 17927 13129 1 16 . 1 1 126 126 MET C C 126 175.215 175.215 176.287 -1.072 17927 13130 1 16 . 1 1 126 126 MET CA C 126 53.849 53.849 55.404 -1.555 17927 13131 1 16 . 1 1 126 126 MET CB C 126 31.312 31.312 33.645 -2.333 17927 13132 1 16 . 1 1 126 126 MET H H 126 8.376 8.376 9.399 -1.023 17927 13133 1 16 . 1 1 127 127 THR N N 127 111.016 111.016 110.792 0.224 17927 13134 1 16 . 1 1 127 127 THR HA H 127 4.291 4.291 4.083 0.208 17927 13135 1 16 . 1 1 127 127 THR C C 127 174.574 174.574 173.008 1.566 17927 13136 1 16 . 1 1 127 127 THR CA C 127 62.085 62.085 62.368 -0.283 17927 13137 1 16 . 1 1 127 127 THR CB C 127 69.733 69.733 71.441 -1.708 17927 13138 1 16 . 1 1 127 127 THR H H 127 7.714 7.714 7.826 -0.112 17927 13139 1 16 . 1 1 128 128 ARG N N 128 118.722 118.722 120.876 -2.154 17927 13140 1 16 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.598 -1.290 17927 13141 1 16 . 1 1 128 128 ARG C C 128 176.978 176.978 173.659 3.319 17927 13142 1 16 . 1 1 128 128 ARG CA C 128 54.727 54.727 53.787 0.940 17927 13143 1 16 . 1 1 128 128 ARG CB C 128 29.598 29.598 32.091 -2.493 17927 13144 1 16 . 1 1 128 128 ARG H H 128 8.658 8.658 8.148 0.510 17927 13145 1 16 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.853 -0.920 17927 13146 1 16 . 1 1 129 129 PRO C C 129 175.794 175.794 176.147 -0.353 17927 13147 1 16 . 1 1 129 129 PRO CA C 129 66.549 66.549 64.082 2.467 17927 13148 1 16 . 1 1 129 129 PRO CB C 129 31.677 31.677 32.053 -0.376 17927 13149 1 16 . 1 1 130 130 SER N N 130 108.696 108.696 106.912 1.784 17927 13150 1 16 . 1 1 130 130 SER HA H 130 3.988 3.988 4.546 -0.558 17927 13151 1 16 . 1 1 130 130 SER C C 130 174.445 174.445 173.054 1.391 17927 13152 1 16 . 1 1 130 130 SER CA C 130 58.911 58.911 56.876 2.035 17927 13153 1 16 . 1 1 130 130 SER CB C 130 62.680 62.680 63.837 -1.157 17927 13154 1 16 . 1 1 130 130 SER H H 130 8.375 8.375 8.018 0.356 17927 13155 1 16 . 1 1 131 131 ASP N N 131 126.377 126.377 122.910 3.467 17927 13156 1 16 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.838 0.034 17927 13157 1 16 . 1 1 131 131 ASP C C 131 176.879 176.879 176.135 0.744 17927 13158 1 16 . 1 1 131 131 ASP CA C 131 51.195 51.195 52.302 -1.107 17927 13159 1 16 . 1 1 131 131 ASP CB C 131 42.816 42.816 41.166 1.650 17927 13160 1 16 . 1 1 131 131 ASP H H 131 7.514 7.514 7.495 0.019 17927 13161 1 16 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.176 0.216 17927 13162 1 16 . 1 1 132 132 PRO C C 132 178.097 178.097 178.220 -0.123 17927 13163 1 16 . 1 1 132 132 PRO CA C 132 65.079 65.079 65.022 0.057 17927 13164 1 16 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.043 0.366 17927 13165 1 16 . 1 1 133 133 LYS N N 133 116.306 116.306 118.030 -1.724 17927 13166 1 16 . 1 1 133 133 LYS HA H 133 3.958 3.958 4.297 -0.339 17927 13167 1 16 . 1 1 133 133 LYS C C 133 179.532 179.532 179.032 0.500 17927 13168 1 16 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.224 -0.703 17927 13169 1 16 . 1 1 133 133 LYS CB C 133 32.191 32.191 32.186 0.005 17927 13170 1 16 . 1 1 133 133 LYS H H 133 8.842 8.842 8.144 0.698 17927 13171 1 16 . 1 1 134 134 THR N N 134 120.833 120.833 116.205 4.628 17927 13172 1 16 . 1 1 134 134 THR HA H 134 3.147 3.147 3.820 -0.673 17927 13173 1 16 . 1 1 134 134 THR C C 134 173.356 173.356 175.024 -1.668 17927 13174 1 16 . 1 1 134 134 THR CA C 134 66.383 66.383 65.918 0.465 17927 13175 1 16 . 1 1 134 134 THR CB C 134 66.847 66.847 68.409 -1.562 17927 13176 1 16 . 1 1 134 134 THR H H 134 8.292 8.292 8.577 -0.285 17927 13177 1 16 . 1 1 135 135 ALA N N 135 121.720 121.720 123.310 -1.590 17927 13178 1 16 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.306 0.277 17927 13179 1 16 . 1 1 135 135 ALA C C 135 178.902 178.902 178.903 -0.001 17927 13180 1 16 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.920 0.079 17927 13181 1 16 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.149 -0.374 17927 13182 1 16 . 1 1 135 135 ALA H H 135 7.030 7.030 7.452 -0.422 17927 13183 1 16 . 1 1 136 136 GLU N N 136 114.623 114.623 116.710 -2.087 17927 13184 1 16 . 1 1 136 136 GLU HA H 136 3.922 3.922 3.860 0.062 17927 13185 1 16 . 1 1 136 136 GLU C C 136 179.199 179.199 178.532 0.667 17927 13186 1 16 . 1 1 136 136 GLU CA C 136 59.837 59.837 58.728 1.109 17927 13187 1 16 . 1 1 136 136 GLU CB C 136 29.786 29.786 28.838 0.948 17927 13188 1 16 . 1 1 136 136 GLU H H 136 7.216 7.216 8.274 -1.058 17927 13189 1 16 . 1 1 137 137 LYS N N 137 120.789 120.789 120.573 0.216 17927 13190 1 16 . 1 1 137 137 LYS HA H 137 4.204 4.204 3.977 0.227 17927 13191 1 16 . 1 1 137 137 LYS C C 137 178.834 178.834 178.674 0.160 17927 13192 1 16 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.563 -1.220 17927 13193 1 16 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.693 -1.230 17927 13194 1 16 . 1 1 137 137 LYS H H 137 7.681 7.681 7.260 0.421 17927 13195 1 16 . 1 1 138 138 PHE N N 138 118.373 118.373 117.550 0.823 17927 13196 1 16 . 1 1 138 138 PHE HA H 138 4.033 4.033 3.993 0.040 17927 13197 1 16 . 1 1 138 138 PHE C C 138 178.027 178.027 178.051 -0.024 17927 13198 1 16 . 1 1 138 138 PHE CA C 138 57.507 57.507 59.792 -2.285 17927 13199 1 16 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.199 -1.310 17927 13200 1 16 . 1 1 138 138 PHE H H 138 8.059 8.059 7.292 0.767 17927 13201 1 16 . 1 1 139 139 ASN N N 139 117.611 117.611 117.293 0.318 17927 13202 1 16 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.429 -0.025 17927 13203 1 16 . 1 1 139 139 ASN C C 139 178.190 178.190 177.769 0.421 17927 13204 1 16 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.176 0.048 17927 13205 1 16 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.839 -1.105 17927 13206 1 16 . 1 1 139 139 ASN H H 139 8.683 8.683 7.941 0.742 17927 13207 1 16 . 1 1 140 140 GLU N N 140 121.432 121.432 121.104 0.328 17927 13208 1 16 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.026 -0.021 17927 13209 1 16 . 1 1 140 140 GLU C C 140 179.751 179.751 179.295 0.456 17927 13210 1 16 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.231 0.079 17927 13211 1 16 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.611 0.444 17927 13212 1 16 . 1 1 140 140 GLU H H 140 7.868 7.868 8.059 -0.191 17927 13213 1 16 . 1 1 141 141 LEU N N 141 119.968 119.968 118.693 1.275 17927 13214 1 16 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.008 0.008 17927 13215 1 16 . 1 1 141 141 LEU C C 141 179.293 179.293 178.866 0.427 17927 13216 1 16 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.522 -0.086 17927 13217 1 16 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.845 -0.662 17927 13218 1 16 . 1 1 141 141 LEU H H 141 8.303 8.303 8.206 0.097 17927 13219 1 16 . 1 1 142 142 LEU N N 142 115.040 115.040 116.466 -1.426 17927 13220 1 16 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.337 0.047 17927 13221 1 16 . 1 1 142 142 LEU C C 142 178.002 178.002 177.824 0.178 17927 13222 1 16 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.469 -0.191 17927 13223 1 16 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.688 -0.042 17927 13224 1 16 . 1 1 142 142 LEU H H 142 8.230 8.230 7.821 0.409 17927 13225 1 16 . 1 1 143 143 GLY N N 143 108.977 108.977 106.555 2.422 17927 13226 1 16 . 1 1 143 143 GLY C C 143 175.216 175.216 174.708 0.508 17927 13227 1 16 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.474 1.267 17927 13228 1 16 . 1 1 143 143 GLY H H 143 7.762 7.762 7.824 -0.062 17927 13229 1 16 . 1 1 144 144 LEU N N 144 119.660 119.660 119.133 0.527 17927 13230 1 16 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.479 0.009 17927 13231 1 16 . 1 1 144 144 LEU C C 144 177.375 177.375 176.780 0.595 17927 13232 1 16 . 1 1 144 144 LEU CA C 144 54.525 54.525 55.811 -1.286 17927 13233 1 16 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.613 0.160 17927 13234 1 16 . 1 1 144 144 LEU H H 144 8.241 8.241 8.322 -0.081 17927 13235 1 16 . 1 1 145 145 GLU N N 145 119.959 119.959 118.721 1.238 17927 13236 1 16 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.110 0.131 17927 13237 1 16 . 1 1 145 145 GLU C C 145 177.075 177.075 176.404 0.671 17927 13238 1 16 . 1 1 145 145 GLU CA C 145 56.799 56.799 57.693 -0.894 17927 13239 1 16 . 1 1 145 145 GLU CB C 145 30.168 30.168 30.248 -0.080 17927 13240 1 16 . 1 1 145 145 GLU H H 145 8.410 8.410 7.427 0.983 17927 13241 1 16 . 1 1 146 146 GLY N N 146 109.412 109.412 111.401 -1.989 17927 13242 1 16 . 1 1 146 146 GLY C C 146 174.276 174.276 174.119 0.157 17927 13243 1 16 . 1 1 146 146 GLY CA C 146 45.445 45.445 45.276 0.169 17927 13244 1 16 . 1 1 146 146 GLY H H 146 8.422 8.422 8.228 0.194 17927 13245 1 16 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.705 -0.049 17927 13246 1 16 . 1 1 151 151 HIS C C 151 173.990 173.990 174.691 -0.701 17927 13247 1 16 . 1 1 151 151 HIS CA C 151 56.044 56.044 56.472 -0.428 17927 13248 1 16 . 1 1 151 151 HIS CB C 151 30.076 30.076 31.143 -1.067 17927 13249 1 17 . 1 1 2 2 SER HA H 2 4.121 4.121 4.280 -0.159 17927 13250 1 17 . 1 1 2 2 SER CA C 2 57.293 57.293 58.843 -1.550 17927 13251 1 17 . 1 1 2 2 SER CB C 2 63.545 63.545 63.249 0.296 17927 13252 1 17 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.863 -0.431 17927 13253 1 17 . 1 1 3 3 LEU C C 3 177.383 177.383 176.212 1.171 17927 13254 1 17 . 1 1 3 3 LEU CA C 3 55.575 55.575 54.509 1.066 17927 13255 1 17 . 1 1 3 3 LEU CB C 3 42.584 42.584 43.151 -0.567 17927 13256 1 17 . 1 1 4 4 ARG N N 4 122.080 122.080 124.985 -2.905 17927 13257 1 17 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.276 0.108 17927 13258 1 17 . 1 1 4 4 ARG C C 4 176.410 176.410 175.522 0.888 17927 13259 1 17 . 1 1 4 4 ARG CA C 4 56.269 56.269 56.591 -0.322 17927 13260 1 17 . 1 1 4 4 ARG CB C 4 30.842 30.842 30.701 0.141 17927 13261 1 17 . 1 1 4 4 ARG H H 4 8.410 8.410 8.825 -0.415 17927 13262 1 17 . 1 1 5 5 SER N N 5 117.023 117.023 114.242 2.781 17927 13263 1 17 . 1 1 5 5 SER HA H 5 4.423 4.423 4.653 -0.230 17927 13264 1 17 . 1 1 5 5 SER C C 5 175.039 175.039 174.710 0.329 17927 13265 1 17 . 1 1 5 5 SER CA C 5 58.605 58.605 58.247 0.358 17927 13266 1 17 . 1 1 5 5 SER CB C 5 64.044 64.044 64.406 -0.362 17927 13267 1 17 . 1 1 5 5 SER H H 5 8.292 8.292 8.000 0.292 17927 13268 1 17 . 1 1 6 6 GLY N N 6 110.718 110.718 115.127 -4.409 17927 13269 1 17 . 1 1 6 6 GLY C C 6 173.654 173.654 173.385 0.269 17927 13270 1 17 . 1 1 6 6 GLY CA C 6 45.273 45.273 45.339 -0.066 17927 13271 1 17 . 1 1 6 6 GLY H H 6 8.446 8.446 8.727 -0.281 17927 13272 1 17 . 1 1 7 7 ASN N N 7 119.287 119.287 119.729 -0.442 17927 13273 1 17 . 1 1 7 7 ASN HA H 7 5.024 5.024 4.899 0.125 17927 13274 1 17 . 1 1 7 7 ASN C C 7 173.672 173.672 172.089 1.583 17927 13275 1 17 . 1 1 7 7 ASN CA C 7 51.357 51.357 51.563 -0.207 17927 13276 1 17 . 1 1 7 7 ASN CB C 7 38.927 38.927 39.636 -0.709 17927 13277 1 17 . 1 1 7 7 ASN H H 7 8.273 8.273 8.346 -0.073 17927 13278 1 17 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.664 -0.217 17927 13279 1 17 . 1 1 8 8 PRO C C 8 176.899 176.899 177.199 -0.300 17927 13280 1 17 . 1 1 8 8 PRO CA C 8 63.429 63.429 62.599 0.831 17927 13281 1 17 . 1 1 8 8 PRO CB C 8 32.216 32.216 32.446 -0.230 17927 13282 1 17 . 1 1 9 9 SER N N 9 115.642 115.642 119.323 -3.681 17927 13283 1 17 . 1 1 9 9 SER HA H 9 4.415 4.415 4.239 0.176 17927 13284 1 17 . 1 1 9 9 SER C C 9 174.714 174.714 174.489 0.225 17927 13285 1 17 . 1 1 9 9 SER CA C 9 58.488 58.488 59.284 -0.796 17927 13286 1 17 . 1 1 9 9 SER CB C 9 64.048 64.048 61.771 2.277 17927 13287 1 17 . 1 1 9 9 SER H H 9 8.336 8.336 8.514 -0.178 17927 13288 1 17 . 1 1 10 10 ALA N N 10 126.808 126.808 125.208 1.600 17927 13289 1 17 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.372 -0.110 17927 13290 1 17 . 1 1 10 10 ALA C C 10 177.233 177.233 177.028 0.205 17927 13291 1 17 . 1 1 10 10 ALA CA C 10 53.230 53.230 53.679 -0.449 17927 13292 1 17 . 1 1 10 10 ALA CB C 10 19.187 19.187 17.609 1.578 17927 13293 1 17 . 1 1 10 10 ALA H H 10 8.137 8.137 8.303 -0.166 17927 13294 1 17 . 1 1 11 11 ALA N N 11 120.449 120.449 117.538 2.911 17927 13295 1 17 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.541 -0.280 17927 13296 1 17 . 1 1 11 11 ALA C C 11 177.469 177.469 176.552 0.917 17927 13297 1 17 . 1 1 11 11 ALA CA C 11 52.475 52.475 51.742 0.733 17927 13298 1 17 . 1 1 11 11 ALA CB C 11 19.485 19.485 19.744 -0.259 17927 13299 1 17 . 1 1 11 11 ALA H H 11 7.851 7.851 8.432 -0.581 17927 13300 1 17 . 1 1 12 12 SER N N 12 114.186 114.186 111.863 2.323 17927 13301 1 17 . 1 1 12 12 SER HA H 12 4.312 4.312 4.620 -0.308 17927 13302 1 17 . 1 1 12 12 SER C C 12 173.593 173.593 172.614 0.979 17927 13303 1 17 . 1 1 12 12 SER CA C 12 58.099 58.099 58.010 0.089 17927 13304 1 17 . 1 1 12 12 SER CB C 12 63.320 63.320 65.970 -2.650 17927 13305 1 17 . 1 1 12 12 SER H H 12 7.990 7.990 7.871 0.119 17927 13306 1 17 . 1 1 13 13 PHE N N 13 118.092 118.092 118.896 -0.804 17927 13307 1 17 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.630 0.150 17927 13308 1 17 . 1 1 13 13 PHE C C 13 174.220 174.220 173.138 1.082 17927 13309 1 17 . 1 1 13 13 PHE CA C 13 56.717 56.717 56.884 -0.167 17927 13310 1 17 . 1 1 13 13 PHE CB C 13 41.151 41.151 40.880 0.271 17927 13311 1 17 . 1 1 13 13 PHE H H 13 7.147 7.147 7.747 -0.600 17927 13312 1 17 . 1 1 14 14 SER N N 14 116.456 116.456 115.018 1.438 17927 13313 1 17 . 1 1 14 14 SER HA H 14 5.162 5.162 5.045 0.117 17927 13314 1 17 . 1 1 14 14 SER C C 14 172.626 172.626 172.542 0.084 17927 13315 1 17 . 1 1 14 14 SER CA C 14 57.390 57.390 57.849 -0.459 17927 13316 1 17 . 1 1 14 14 SER CB C 14 64.518 64.518 65.549 -1.031 17927 13317 1 17 . 1 1 14 14 SER H H 14 7.616 7.616 7.942 -0.326 17927 13318 1 17 . 1 1 15 15 TYR N N 15 122.384 122.384 123.727 -1.343 17927 13319 1 17 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.876 0.330 17927 13320 1 17 . 1 1 15 15 TYR C C 15 172.543 172.543 172.894 -0.351 17927 13321 1 17 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.575 -0.629 17927 13322 1 17 . 1 1 15 15 TYR CB C 15 43.227 43.227 41.974 1.253 17927 13323 1 17 . 1 1 15 15 TYR H H 15 8.558 8.558 9.282 -0.724 17927 13324 1 17 . 1 1 16 16 PRO HA H 16 5.109 5.109 5.087 0.022 17927 13325 1 17 . 1 1 16 16 PRO C C 16 176.475 176.475 176.466 0.009 17927 13326 1 17 . 1 1 16 16 PRO CA C 16 61.981 61.981 61.849 0.132 17927 13327 1 17 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.157 0.505 17927 13328 1 17 . 1 1 17 17 ASP N N 17 119.834 119.834 124.987 -5.153 17927 13329 1 17 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.992 0.747 17927 13330 1 17 . 1 1 17 17 ASP C C 17 180.740 180.740 178.442 2.298 17927 13331 1 17 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.773 -2.056 17927 13332 1 17 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.569 -1.008 17927 13333 1 17 . 1 1 17 17 ASP H H 17 8.643 8.643 8.709 -0.066 17927 13334 1 17 . 1 1 18 18 ILE N N 18 118.340 118.340 123.936 -5.596 17927 13335 1 17 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.966 0.485 17927 13336 1 17 . 1 1 18 18 ILE C C 18 175.742 175.742 176.618 -0.876 17927 13337 1 17 . 1 1 18 18 ILE CA C 18 61.894 61.894 64.132 -2.238 17927 13338 1 17 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.308 0.932 17927 13339 1 17 . 1 1 18 18 ILE H H 18 8.450 8.450 8.359 0.091 17927 13340 1 17 . 1 1 19 19 ASN N N 19 119.377 119.377 117.172 2.205 17927 13341 1 17 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.604 0.411 17927 13342 1 17 . 1 1 19 19 ASN C C 19 175.892 175.892 176.022 -0.130 17927 13343 1 17 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.638 -1.331 17927 13344 1 17 . 1 1 19 19 ASN CB C 19 39.825 39.825 39.123 0.702 17927 13345 1 17 . 1 1 19 19 ASN H H 19 8.376 8.376 8.760 -0.384 17927 13346 1 17 . 1 1 20 20 GLY N N 20 109.535 109.535 108.079 1.456 17927 13347 1 17 . 1 1 20 20 GLY C C 20 174.285 174.285 173.206 1.079 17927 13348 1 17 . 1 1 20 20 GLY CA C 20 45.793 45.793 44.959 0.834 17927 13349 1 17 . 1 1 20 20 GLY H H 20 8.539 8.539 8.498 0.041 17927 13350 1 17 . 1 1 21 21 LYS N N 21 124.675 124.675 121.058 3.617 17927 13351 1 17 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.637 -0.194 17927 13352 1 17 . 1 1 21 21 LYS C C 21 176.537 176.537 175.863 0.674 17927 13353 1 17 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.379 1.065 17927 13354 1 17 . 1 1 21 21 LYS CB C 21 32.754 32.754 33.729 -0.975 17927 13355 1 17 . 1 1 21 21 LYS H H 21 8.608 8.608 7.536 1.072 17927 13356 1 17 . 1 1 22 22 THR N N 22 120.666 120.666 123.682 -3.016 17927 13357 1 17 . 1 1 22 22 THR HA H 22 4.087 4.087 4.190 -0.103 17927 13358 1 17 . 1 1 22 22 THR C C 22 174.431 174.431 173.947 0.484 17927 13359 1 17 . 1 1 22 22 THR CA C 22 64.292 64.292 63.678 0.614 17927 13360 1 17 . 1 1 22 22 THR CB C 22 69.069 69.069 68.171 0.898 17927 13361 1 17 . 1 1 22 22 THR H H 22 8.595 8.595 8.851 -0.256 17927 13362 1 17 . 1 1 23 23 VAL N N 23 131.207 131.207 130.009 1.198 17927 13363 1 17 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.302 -0.110 17927 13364 1 17 . 1 1 23 23 VAL C C 23 174.244 174.244 174.675 -0.431 17927 13365 1 17 . 1 1 23 23 VAL CA C 23 62.456 62.456 61.036 1.420 17927 13366 1 17 . 1 1 23 23 VAL CB C 23 33.791 33.791 32.804 0.987 17927 13367 1 17 . 1 1 23 23 VAL H H 23 8.937 8.937 8.990 -0.053 17927 13368 1 17 . 1 1 24 24 SER N N 24 120.787 120.787 122.725 -1.938 17927 13369 1 17 . 1 1 24 24 SER HA H 24 5.407 5.407 4.991 0.416 17927 13370 1 17 . 1 1 24 24 SER C C 24 176.169 176.169 174.723 1.446 17927 13371 1 17 . 1 1 24 24 SER CA C 24 55.135 55.135 56.574 -1.439 17927 13372 1 17 . 1 1 24 24 SER CB C 24 65.646 65.646 65.541 0.105 17927 13373 1 17 . 1 1 24 24 SER H H 24 8.554 8.554 8.466 0.088 17927 13374 1 17 . 1 1 25 25 LEU N N 25 124.332 124.332 121.260 3.072 17927 13375 1 17 . 1 1 25 25 LEU HA H 25 3.687 3.687 3.801 -0.114 17927 13376 1 17 . 1 1 25 25 LEU C C 25 179.364 179.364 176.975 2.389 17927 13377 1 17 . 1 1 25 25 LEU CA C 25 58.217 58.217 55.731 2.486 17927 13378 1 17 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.504 -0.966 17927 13379 1 17 . 1 1 25 25 LEU H H 25 7.811 7.811 8.432 -0.621 17927 13380 1 17 . 1 1 26 26 ALA N N 26 119.799 119.799 118.640 1.159 17927 13381 1 17 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.017 -0.024 17927 13382 1 17 . 1 1 26 26 ALA C C 26 179.719 179.719 178.789 0.930 17927 13383 1 17 . 1 1 26 26 ALA CA C 26 54.663 54.663 53.816 0.847 17927 13384 1 17 . 1 1 26 26 ALA CB C 26 18.323 18.323 18.652 -0.329 17927 13385 1 17 . 1 1 26 26 ALA H H 26 8.099 8.099 8.029 0.070 17927 13386 1 17 . 1 1 27 27 ASP N N 27 116.553 116.553 119.942 -3.389 17927 13387 1 17 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.443 0.030 17927 13388 1 17 . 1 1 27 27 ASP C C 27 176.915 176.915 177.227 -0.312 17927 13389 1 17 . 1 1 27 27 ASP CA C 27 56.251 56.251 56.346 -0.095 17927 13390 1 17 . 1 1 27 27 ASP CB C 27 40.788 40.788 41.092 -0.304 17927 13391 1 17 . 1 1 27 27 ASP H H 27 7.572 7.572 7.701 -0.129 17927 13392 1 17 . 1 1 28 28 LEU N N 28 118.950 118.950 117.449 1.501 17927 13393 1 17 . 1 1 28 28 LEU HA H 28 4.233 4.233 4.384 -0.151 17927 13394 1 17 . 1 1 28 28 LEU C C 28 175.542 175.542 175.921 -0.379 17927 13395 1 17 . 1 1 28 28 LEU CA C 28 53.706 53.706 54.012 -0.306 17927 13396 1 17 . 1 1 28 28 LEU CB C 28 41.049 41.049 42.414 -1.365 17927 13397 1 17 . 1 1 28 28 LEU H H 28 7.363 7.363 7.357 0.006 17927 13398 1 17 . 1 1 29 29 LYS N N 29 118.429 118.429 119.506 -1.077 17927 13399 1 17 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.295 0.057 17927 13400 1 17 . 1 1 29 29 LYS C C 29 178.063 178.063 177.636 0.427 17927 13401 1 17 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.796 -0.019 17927 13402 1 17 . 1 1 29 29 LYS CB C 29 33.440 33.440 33.010 0.430 17927 13403 1 17 . 1 1 29 29 LYS H H 29 6.780 6.780 7.209 -0.429 17927 13404 1 17 . 1 1 30 30 GLY N N 30 112.426 112.426 109.961 2.465 17927 13405 1 17 . 1 1 30 30 GLY C C 30 173.801 173.801 173.153 0.648 17927 13406 1 17 . 1 1 30 30 GLY CA C 30 44.611 44.611 45.139 -0.528 17927 13407 1 17 . 1 1 30 30 GLY H H 30 9.398 9.398 8.800 0.598 17927 13408 1 17 . 1 1 31 31 LYS N N 31 119.295 119.295 120.214 -0.919 17927 13409 1 17 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.461 -0.309 17927 13410 1 17 . 1 1 31 31 LYS C C 31 173.862 173.862 176.277 -2.415 17927 13411 1 17 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.221 0.967 17927 13412 1 17 . 1 1 31 31 LYS CB C 31 36.968 36.968 34.988 1.980 17927 13413 1 17 . 1 1 31 31 LYS H H 31 7.496 7.496 7.624 -0.128 17927 13414 1 17 . 1 1 32 32 TYR N N 32 116.984 116.984 120.159 -3.175 17927 13415 1 17 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.537 -0.380 17927 13416 1 17 . 1 1 32 32 TYR C C 32 175.226 175.226 175.779 -0.553 17927 13417 1 17 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.166 0.424 17927 13418 1 17 . 1 1 32 32 TYR CB C 32 39.121 39.121 38.629 0.492 17927 13419 1 17 . 1 1 32 32 TYR H H 32 7.521 7.521 8.928 -1.407 17927 13420 1 17 . 1 1 33 33 ILE N N 33 118.052 118.052 122.524 -4.472 17927 13421 1 17 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.928 -0.021 17927 13422 1 17 . 1 1 33 33 ILE C C 33 174.308 174.308 174.921 -0.613 17927 13423 1 17 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.000 0.702 17927 13424 1 17 . 1 1 33 33 ILE CB C 33 41.616 41.616 39.707 1.909 17927 13425 1 17 . 1 1 33 33 ILE H H 33 8.467 8.467 8.464 0.003 17927 13426 1 17 . 1 1 34 34 TYR N N 34 130.242 130.242 128.732 1.510 17927 13427 1 17 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.311 0.215 17927 13428 1 17 . 1 1 34 34 TYR C C 34 174.245 174.245 174.563 -0.318 17927 13429 1 17 . 1 1 34 34 TYR CA C 34 56.158 56.158 56.030 0.128 17927 13430 1 17 . 1 1 34 34 TYR CB C 34 40.133 40.133 40.543 -0.410 17927 13431 1 17 . 1 1 34 34 TYR H H 34 8.905 8.905 8.771 0.134 17927 13432 1 17 . 1 1 35 35 ILE N N 35 128.697 128.697 129.803 -1.106 17927 13433 1 17 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.264 0.078 17927 13434 1 17 . 1 1 35 35 ILE C C 35 174.520 174.520 174.706 -0.186 17927 13435 1 17 . 1 1 35 35 ILE CA C 35 59.749 59.749 60.523 -0.774 17927 13436 1 17 . 1 1 35 35 ILE CB C 35 40.899 40.899 39.125 1.774 17927 13437 1 17 . 1 1 35 35 ILE H H 35 9.445 9.445 8.555 0.890 17927 13438 1 17 . 1 1 36 36 ASP N N 36 123.675 123.675 128.584 -4.909 17927 13439 1 17 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.506 -0.658 17927 13440 1 17 . 1 1 36 36 ASP C C 36 174.385 174.385 176.139 -1.754 17927 13441 1 17 . 1 1 36 36 ASP CA C 36 51.294 51.294 52.366 -1.072 17927 13442 1 17 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.379 -2.601 17927 13443 1 17 . 1 1 36 36 ASP H H 36 8.875 8.875 8.502 0.373 17927 13444 1 17 . 1 1 37 37 VAL N N 37 127.159 127.159 126.502 0.657 17927 13445 1 17 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.815 0.144 17927 13446 1 17 . 1 1 37 37 VAL C C 37 175.046 175.046 175.906 -0.860 17927 13447 1 17 . 1 1 37 37 VAL CA C 37 62.245 62.245 62.063 0.182 17927 13448 1 17 . 1 1 37 37 VAL CB C 37 31.807 31.807 31.011 0.796 17927 13449 1 17 . 1 1 37 37 VAL H H 37 8.603 8.603 8.265 0.338 17927 13450 1 17 . 1 1 38 38 TRP N N 38 124.161 124.161 127.459 -3.298 17927 13451 1 17 . 1 1 38 38 TRP HA H 38 5.237 5.237 4.981 0.256 17927 13452 1 17 . 1 1 38 38 TRP C C 38 171.995 171.995 173.741 -1.746 17927 13453 1 17 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.485 1.722 17927 13454 1 17 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.029 3.158 17927 13455 1 17 . 1 1 38 38 TRP H H 38 8.562 8.562 8.375 0.187 17927 13456 1 17 . 1 1 39 39 ALA N N 39 116.252 116.252 125.387 -9.135 17927 13457 1 17 . 1 1 39 39 ALA HA H 39 3.678 3.678 3.493 0.185 17927 13458 1 17 . 1 1 39 39 ALA C C 39 178.664 178.664 175.389 3.275 17927 13459 1 17 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.330 1.137 17927 13460 1 17 . 1 1 39 39 ALA CB C 39 22.341 22.341 20.941 1.400 17927 13461 1 17 . 1 1 39 39 ALA H H 39 6.757 6.757 7.859 -1.102 17927 13462 1 17 . 1 1 40 40 THR N N 40 114.321 114.321 113.827 0.494 17927 13463 1 17 . 1 1 40 40 THR HA H 40 3.907 3.907 4.301 -0.394 17927 13464 1 17 . 1 1 40 40 THR C C 40 175.885 175.885 174.392 1.493 17927 13465 1 17 . 1 1 40 40 THR CA C 40 65.447 65.447 63.539 1.908 17927 13466 1 17 . 1 1 40 40 THR CB C 40 70.106 70.106 68.545 1.561 17927 13467 1 17 . 1 1 40 40 THR H H 40 9.639 9.639 8.068 1.571 17927 13468 1 17 . 1 1 41 41 TRP N N 41 114.483 114.483 117.899 -3.416 17927 13469 1 17 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.931 -0.368 17927 13470 1 17 . 1 1 41 41 TRP C C 41 176.189 176.189 174.755 1.434 17927 13471 1 17 . 1 1 41 41 TRP CA C 41 54.698 54.698 53.632 1.066 17927 13472 1 17 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.144 1.833 17927 13473 1 17 . 1 1 41 41 TRP H H 41 6.401 6.401 6.946 -0.545 17927 13474 1 17 . 1 1 42 42 CYS N N 42 123.536 123.536 119.687 3.849 17927 13475 1 17 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.849 -0.281 17927 13476 1 17 . 1 1 42 42 CYS C C 42 175.726 175.726 175.693 0.033 17927 13477 1 17 . 1 1 42 42 CYS CA C 42 58.700 58.700 57.197 1.503 17927 13478 1 17 . 1 1 42 42 CYS CB C 42 27.121 27.121 29.482 -2.361 17927 13479 1 17 . 1 1 42 42 CYS H H 42 6.883 6.883 7.173 -0.290 17927 13480 1 17 . 1 1 43 43 GLY N N 43 120.977 120.977 113.022 7.955 17927 13481 1 17 . 1 1 43 43 GLY CA C 43 49.204 49.204 46.738 2.466 17927 13482 1 17 . 1 1 43 43 GLY H H 43 9.653 9.653 9.128 0.525 17927 13483 1 17 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.329 0.158 17927 13484 1 17 . 1 1 44 44 PRO C C 44 179.956 179.956 178.943 1.013 17927 13485 1 17 . 1 1 44 44 PRO CA C 44 65.642 65.642 64.749 0.893 17927 13486 1 17 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.610 0.968 17927 13487 1 17 . 1 1 45 45 CYS N N 45 113.925 113.925 116.560 -2.635 17927 13488 1 17 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.301 0.012 17927 13489 1 17 . 1 1 45 45 CYS C C 45 178.325 178.325 177.343 0.982 17927 13490 1 17 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.555 1.837 17927 13491 1 17 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.727 0.778 17927 13492 1 17 . 1 1 45 45 CYS H H 45 7.676 7.676 8.219 -0.543 17927 13493 1 17 . 1 1 46 46 ARG N N 46 120.336 120.336 120.144 0.192 17927 13494 1 17 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.198 -0.129 17927 13495 1 17 . 1 1 46 46 ARG C C 46 180.446 180.446 178.985 1.461 17927 13496 1 17 . 1 1 46 46 ARG CA C 46 59.785 59.785 58.944 0.841 17927 13497 1 17 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.654 0.214 17927 13498 1 17 . 1 1 46 46 ARG H H 46 8.109 8.109 8.240 -0.131 17927 13499 1 17 . 1 1 47 47 GLY N N 47 105.408 105.408 104.563 0.845 17927 13500 1 17 . 1 1 47 47 GLY C C 47 175.258 175.258 175.029 0.229 17927 13501 1 17 . 1 1 47 47 GLY CA C 47 46.594 46.594 46.197 0.397 17927 13502 1 17 . 1 1 47 47 GLY H H 47 8.466 8.466 7.857 0.609 17927 13503 1 17 . 1 1 48 48 GLU N N 48 116.343 116.343 118.707 -2.364 17927 13504 1 17 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.628 -0.103 17927 13505 1 17 . 1 1 48 48 GLU C C 48 176.535 176.535 177.299 -0.764 17927 13506 1 17 . 1 1 48 48 GLU CA C 48 55.792 55.792 55.152 0.640 17927 13507 1 17 . 1 1 48 48 GLU CB C 48 30.982 30.982 30.213 0.769 17927 13508 1 17 . 1 1 48 48 GLU H H 48 7.050 7.050 7.521 -0.471 17927 13509 1 17 . 1 1 49 49 LEU N N 49 118.652 118.652 122.234 -3.582 17927 13510 1 17 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.134 0.018 17927 13511 1 17 . 1 1 49 49 LEU C C 49 176.832 176.832 176.105 0.727 17927 13512 1 17 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.788 -1.443 17927 13513 1 17 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.230 -0.734 17927 13514 1 17 . 1 1 49 49 LEU H H 49 7.385 7.385 7.585 -0.200 17927 13515 1 17 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.158 0.095 17927 13516 1 17 . 1 1 50 50 PRO C C 50 179.744 179.744 178.347 1.397 17927 13517 1 17 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.208 0.351 17927 13518 1 17 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.911 -0.149 17927 13519 1 17 . 1 1 51 51 ALA N N 51 120.418 120.418 118.711 1.707 17927 13520 1 17 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.110 0.035 17927 13521 1 17 . 1 1 51 51 ALA C C 51 180.329 180.329 179.755 0.574 17927 13522 1 17 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.599 -0.165 17927 13523 1 17 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.353 0.017 17927 13524 1 17 . 1 1 51 51 ALA H H 51 7.731 7.731 7.201 0.530 17927 13525 1 17 . 1 1 52 52 LEU N N 52 121.506 121.506 119.946 1.560 17927 13526 1 17 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.744 0.243 17927 13527 1 17 . 1 1 52 52 LEU C C 52 177.944 177.944 178.247 -0.303 17927 13528 1 17 . 1 1 52 52 LEU CA C 52 58.327 58.327 58.032 0.295 17927 13529 1 17 . 1 1 52 52 LEU CB C 52 42.382 42.382 41.975 0.407 17927 13530 1 17 . 1 1 52 52 LEU H H 52 8.355 8.355 8.138 0.217 17927 13531 1 17 . 1 1 53 53 LYS N N 53 119.732 119.732 117.605 2.127 17927 13532 1 17 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.926 -0.023 17927 13533 1 17 . 1 1 53 53 LYS C C 53 179.030 179.030 178.760 0.270 17927 13534 1 17 . 1 1 53 53 LYS CA C 53 59.846 59.846 59.362 0.484 17927 13535 1 17 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.874 0.337 17927 13536 1 17 . 1 1 53 53 LYS H H 53 8.148 8.148 7.787 0.361 17927 13537 1 17 . 1 1 54 54 GLU N N 54 117.779 117.779 121.012 -3.233 17927 13538 1 17 . 1 1 54 54 GLU HA H 54 4.059 4.059 4.298 -0.239 17927 13539 1 17 . 1 1 54 54 GLU C C 54 179.646 179.646 179.151 0.495 17927 13540 1 17 . 1 1 54 54 GLU CA C 54 59.625 59.625 58.849 0.776 17927 13541 1 17 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.554 0.013 17927 13542 1 17 . 1 1 54 54 GLU H H 54 7.585 7.585 7.795 -0.210 17927 13543 1 17 . 1 1 55 55 LEU N N 55 120.581 120.581 120.575 0.006 17927 13544 1 17 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.099 0.094 17927 13545 1 17 . 1 1 55 55 LEU C C 55 178.557 178.557 178.595 -0.038 17927 13546 1 17 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.979 0.256 17927 13547 1 17 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.846 1.165 17927 13548 1 17 . 1 1 55 55 LEU H H 55 8.096 8.096 8.066 0.030 17927 13549 1 17 . 1 1 56 56 GLU N N 56 118.023 118.023 119.427 -1.404 17927 13550 1 17 . 1 1 56 56 GLU HA H 56 3.177 3.177 4.338 -1.161 17927 13551 1 17 . 1 1 56 56 GLU C C 56 179.650 179.650 178.790 0.860 17927 13552 1 17 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.515 -0.644 17927 13553 1 17 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.246 -2.261 17927 13554 1 17 . 1 1 56 56 GLU H H 56 8.181 8.181 7.719 0.462 17927 13555 1 17 . 1 1 57 57 GLU N N 57 117.828 117.828 118.493 -0.665 17927 13556 1 17 . 1 1 57 57 GLU HA H 57 4.104 4.104 3.967 0.137 17927 13557 1 17 . 1 1 57 57 GLU C C 57 179.700 179.700 178.754 0.946 17927 13558 1 17 . 1 1 57 57 GLU CA C 57 59.027 59.027 59.069 -0.042 17927 13559 1 17 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.498 0.167 17927 13560 1 17 . 1 1 57 57 GLU H H 57 7.762 7.762 8.242 -0.480 17927 13561 1 17 . 1 1 58 58 LYS N N 58 120.896 120.896 118.353 2.543 17927 13562 1 17 . 1 1 58 58 LYS HA H 58 3.979 3.979 4.016 -0.037 17927 13563 1 17 . 1 1 58 58 LYS C C 58 178.715 178.715 178.766 -0.051 17927 13564 1 17 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.865 0.213 17927 13565 1 17 . 1 1 58 58 LYS CB C 58 32.980 32.980 32.726 0.254 17927 13566 1 17 . 1 1 58 58 LYS H H 58 8.410 8.410 7.595 0.815 17927 13567 1 17 . 1 1 59 59 TYR N N 59 113.713 113.713 117.100 -3.387 17927 13568 1 17 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.620 -0.308 17927 13569 1 17 . 1 1 59 59 TYR C C 59 175.025 175.025 175.477 -0.452 17927 13570 1 17 . 1 1 59 59 TYR CA C 59 58.973 58.973 57.914 1.059 17927 13571 1 17 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.778 -1.344 17927 13572 1 17 . 1 1 59 59 TYR H H 59 8.102 8.102 7.930 0.172 17927 13573 1 17 . 1 1 60 60 ALA N N 60 126.637 126.637 122.767 3.870 17927 13574 1 17 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.403 0.015 17927 13575 1 17 . 1 1 60 60 ALA C C 60 179.208 179.208 177.671 1.537 17927 13576 1 17 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.626 0.908 17927 13577 1 17 . 1 1 60 60 ALA CB C 60 18.589 18.589 18.472 0.117 17927 13578 1 17 . 1 1 60 60 ALA H H 60 7.201 7.201 8.417 -1.216 17927 13579 1 17 . 1 1 61 61 GLY N N 61 111.816 111.816 111.824 -0.008 17927 13580 1 17 . 1 1 61 61 GLY C C 61 174.698 174.698 175.180 -0.482 17927 13581 1 17 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.923 -0.019 17927 13582 1 17 . 1 1 61 61 GLY H H 61 9.184 9.184 8.775 0.409 17927 13583 1 17 . 1 1 62 62 LYS N N 62 118.497 118.497 122.323 -3.826 17927 13584 1 17 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.238 0.641 17927 13585 1 17 . 1 1 62 62 LYS C C 62 179.019 179.019 177.586 1.433 17927 13586 1 17 . 1 1 62 62 LYS CA C 62 53.988 53.988 58.414 -4.426 17927 13587 1 17 . 1 1 62 62 LYS CB C 62 33.840 33.840 32.679 1.161 17927 13588 1 17 . 1 1 62 62 LYS H H 62 8.019 8.019 7.727 0.292 17927 13589 1 17 . 1 1 63 63 ASP N N 63 122.982 122.982 115.324 7.658 17927 13590 1 17 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.730 -0.203 17927 13591 1 17 . 1 1 63 63 ASP C C 63 174.065 174.065 174.851 -0.786 17927 13592 1 17 . 1 1 63 63 ASP CA C 63 55.055 55.055 53.919 1.136 17927 13593 1 17 . 1 1 63 63 ASP CB C 63 38.582 38.582 42.522 -3.940 17927 13594 1 17 . 1 1 63 63 ASP H H 63 8.709 8.709 8.402 0.307 17927 13595 1 17 . 1 1 64 64 ILE N N 64 122.219 122.219 118.971 3.248 17927 13596 1 17 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.931 -0.324 17927 13597 1 17 . 1 1 64 64 ILE C C 64 174.627 174.627 172.636 1.991 17927 13598 1 17 . 1 1 64 64 ILE CA C 64 59.712 59.712 59.721 -0.009 17927 13599 1 17 . 1 1 64 64 ILE CB C 64 42.133 42.133 41.054 1.079 17927 13600 1 17 . 1 1 64 64 ILE H H 64 8.678 8.678 7.108 1.570 17927 13601 1 17 . 1 1 65 65 HIS N N 65 125.584 125.584 115.463 10.121 17927 13602 1 17 . 1 1 65 65 HIS HA H 65 5.043 5.043 5.004 0.039 17927 13603 1 17 . 1 1 65 65 HIS C C 65 174.153 174.153 173.404 0.749 17927 13604 1 17 . 1 1 65 65 HIS CA C 65 54.959 54.959 53.119 1.840 17927 13605 1 17 . 1 1 65 65 HIS CB C 65 34.156 34.156 32.157 1.999 17927 13606 1 17 . 1 1 65 65 HIS H H 65 9.204 9.204 8.641 0.563 17927 13607 1 17 . 1 1 66 66 PHE N N 66 123.244 123.244 120.368 2.876 17927 13608 1 17 . 1 1 66 66 PHE HA H 66 5.210 5.210 5.046 0.164 17927 13609 1 17 . 1 1 66 66 PHE C C 66 175.463 175.463 174.901 0.562 17927 13610 1 17 . 1 1 66 66 PHE CA C 66 58.088 58.088 57.687 0.401 17927 13611 1 17 . 1 1 66 66 PHE CB C 66 39.637 39.637 40.469 -0.832 17927 13612 1 17 . 1 1 66 66 PHE H H 66 9.262 9.262 9.685 -0.423 17927 13613 1 17 . 1 1 67 67 VAL N N 67 126.201 126.201 123.740 2.461 17927 13614 1 17 . 1 1 67 67 VAL HA H 67 4.834 4.834 5.033 -0.199 17927 13615 1 17 . 1 1 67 67 VAL C C 67 174.364 174.364 175.526 -1.162 17927 13616 1 17 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.663 0.061 17927 13617 1 17 . 1 1 67 67 VAL CB C 67 34.893 34.893 34.898 -0.005 17927 13618 1 17 . 1 1 67 67 VAL H H 67 8.843 8.843 9.290 -0.447 17927 13619 1 17 . 1 1 68 68 SER N N 68 124.528 124.528 123.429 1.099 17927 13620 1 17 . 1 1 68 68 SER HA H 68 5.585 5.585 5.436 0.149 17927 13621 1 17 . 1 1 68 68 SER C C 68 172.858 172.858 172.850 0.008 17927 13622 1 17 . 1 1 68 68 SER CA C 68 57.282 57.282 58.110 -0.828 17927 13623 1 17 . 1 1 68 68 SER CB C 68 65.032 65.032 63.952 1.080 17927 13624 1 17 . 1 1 68 68 SER H H 68 9.243 9.243 8.891 0.352 17927 13625 1 17 . 1 1 69 69 LEU N N 69 126.695 126.695 127.144 -0.449 17927 13626 1 17 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.657 -1.140 17927 13627 1 17 . 1 1 69 69 LEU C C 69 174.652 174.652 175.258 -0.606 17927 13628 1 17 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.833 -1.006 17927 13629 1 17 . 1 1 69 69 LEU CB C 69 43.895 43.895 46.403 -2.508 17927 13630 1 17 . 1 1 69 69 LEU H H 69 9.360 9.360 8.652 0.708 17927 13631 1 17 . 1 1 70 70 SER N N 70 116.379 116.379 120.540 -4.161 17927 13632 1 17 . 1 1 70 70 SER HA H 70 4.905 4.905 5.106 -0.201 17927 13633 1 17 . 1 1 70 70 SER C C 70 176.307 176.307 174.937 1.370 17927 13634 1 17 . 1 1 70 70 SER CA C 70 55.213 55.213 55.719 -0.506 17927 13635 1 17 . 1 1 70 70 SER CB C 70 63.519 63.519 63.512 0.007 17927 13636 1 17 . 1 1 70 70 SER H H 70 7.981 7.981 8.837 -0.856 17927 13637 1 17 . 1 1 71 71 CYS N N 71 124.670 124.670 128.696 -4.026 17927 13638 1 17 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.749 0.209 17927 13639 1 17 . 1 1 71 71 CYS C C 71 173.996 173.996 174.631 -0.635 17927 13640 1 17 . 1 1 71 71 CYS CA C 71 55.483 55.483 58.133 -2.650 17927 13641 1 17 . 1 1 71 71 CYS CB C 71 28.112 28.112 26.639 1.473 17927 13642 1 17 . 1 1 71 71 CYS H H 71 8.609 8.609 8.890 -0.281 17927 13643 1 17 . 1 1 72 72 ASP N N 72 122.398 122.398 122.209 0.189 17927 13644 1 17 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.740 -0.448 17927 13645 1 17 . 1 1 72 72 ASP C C 72 176.653 176.653 177.049 -0.396 17927 13646 1 17 . 1 1 72 72 ASP CA C 72 56.782 56.782 54.791 1.991 17927 13647 1 17 . 1 1 72 72 ASP CB C 72 41.526 41.526 42.554 -1.028 17927 13648 1 17 . 1 1 72 72 ASP H H 72 8.557 8.557 7.120 1.437 17927 13649 1 17 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.649 -0.584 17927 13650 1 17 . 1 1 73 73 LYS C C 73 176.545 176.545 176.096 0.449 17927 13651 1 17 . 1 1 73 73 LYS CA C 73 58.458 58.458 56.887 1.571 17927 13652 1 17 . 1 1 73 73 LYS CB C 73 32.641 32.641 33.048 -0.407 17927 13653 1 17 . 1 1 74 74 ASN N N 74 117.616 117.616 121.344 -3.728 17927 13654 1 17 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.961 -0.056 17927 13655 1 17 . 1 1 74 74 ASN C C 74 174.894 174.894 174.840 0.054 17927 13656 1 17 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.458 -0.937 17927 13657 1 17 . 1 1 74 74 ASN CB C 74 38.109 38.109 38.035 0.074 17927 13658 1 17 . 1 1 74 74 ASN H H 74 8.625 8.625 8.335 0.290 17927 13659 1 17 . 1 1 75 75 LYS N N 75 126.797 126.797 124.998 1.799 17927 13660 1 17 . 1 1 75 75 LYS HA H 75 3.423 3.423 4.101 -0.678 17927 13661 1 17 . 1 1 75 75 LYS C C 75 178.058 178.058 178.015 0.043 17927 13662 1 17 . 1 1 75 75 LYS CA C 75 60.173 60.173 61.332 -1.159 17927 13663 1 17 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.721 0.570 17927 13664 1 17 . 1 1 75 75 LYS H H 75 8.588 8.588 7.740 0.848 17927 13665 1 17 . 1 1 76 76 LYS N N 76 117.875 117.875 119.684 -1.809 17927 13666 1 17 . 1 1 76 76 LYS HA H 76 4.200 4.200 3.994 0.206 17927 13667 1 17 . 1 1 76 76 LYS C C 76 178.791 178.791 178.476 0.315 17927 13668 1 17 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.255 -0.647 17927 13669 1 17 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.340 0.150 17927 13670 1 17 . 1 1 76 76 LYS H H 76 8.041 8.041 8.534 -0.493 17927 13671 1 17 . 1 1 77 77 ALA N N 77 121.567 121.567 120.990 0.577 17927 13672 1 17 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.189 -0.066 17927 13673 1 17 . 1 1 77 77 ALA C C 77 181.191 181.191 179.692 1.499 17927 13674 1 17 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.732 0.225 17927 13675 1 17 . 1 1 77 77 ALA CB C 77 17.759 17.759 17.995 -0.236 17927 13676 1 17 . 1 1 77 77 ALA H H 77 7.366 7.366 8.165 -0.798 17927 13677 1 17 . 1 1 78 78 TRP N N 78 119.497 119.497 120.587 -1.090 17927 13678 1 17 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.082 -0.005 17927 13679 1 17 . 1 1 78 78 TRP C C 78 175.942 175.942 177.791 -1.849 17927 13680 1 17 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.531 2.230 17927 13681 1 17 . 1 1 78 78 TRP CB C 78 27.272 27.272 29.625 -2.353 17927 13682 1 17 . 1 1 78 78 TRP H H 78 7.187 7.187 8.558 -1.371 17927 13683 1 17 . 1 1 79 79 GLU N N 79 118.771 118.771 117.410 1.361 17927 13684 1 17 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.490 -0.476 17927 13685 1 17 . 1 1 79 79 GLU C C 79 179.863 179.863 179.218 0.645 17927 13686 1 17 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.089 0.021 17927 13687 1 17 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.369 1.851 17927 13688 1 17 . 1 1 79 79 GLU H H 79 8.813 8.813 8.637 0.176 17927 13689 1 17 . 1 1 80 80 ASN N N 80 115.964 115.964 118.001 -2.037 17927 13690 1 17 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.379 -0.040 17927 13691 1 17 . 1 1 80 80 ASN C C 80 176.749 176.749 177.663 -0.914 17927 13692 1 17 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.545 0.490 17927 13693 1 17 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.001 0.488 17927 13694 1 17 . 1 1 80 80 ASN H H 80 8.491 8.491 7.883 0.608 17927 13695 1 17 . 1 1 81 81 MET N N 81 119.670 119.670 120.662 -0.992 17927 13696 1 17 . 1 1 81 81 MET HA H 81 4.149 4.149 4.215 -0.066 17927 13697 1 17 . 1 1 81 81 MET C C 81 177.933 177.933 177.624 0.309 17927 13698 1 17 . 1 1 81 81 MET CA C 81 60.276 60.276 57.356 2.920 17927 13699 1 17 . 1 1 81 81 MET CB C 81 32.518 32.518 32.099 0.419 17927 13700 1 17 . 1 1 81 81 MET H H 81 7.667 7.667 7.581 0.086 17927 13701 1 17 . 1 1 82 82 VAL N N 82 117.634 117.634 118.635 -1.001 17927 13702 1 17 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.441 -0.138 17927 13703 1 17 . 1 1 82 82 VAL C C 82 179.005 179.005 177.217 1.788 17927 13704 1 17 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.253 0.784 17927 13705 1 17 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.341 0.424 17927 13706 1 17 . 1 1 82 82 VAL H H 82 8.338 8.338 7.883 0.455 17927 13707 1 17 . 1 1 83 83 THR N N 83 110.519 110.519 112.602 -2.083 17927 13708 1 17 . 1 1 83 83 THR HA H 83 3.983 3.983 4.103 -0.120 17927 13709 1 17 . 1 1 83 83 THR C C 83 177.591 177.591 175.855 1.736 17927 13710 1 17 . 1 1 83 83 THR CA C 83 65.431 65.431 64.806 0.625 17927 13711 1 17 . 1 1 83 83 THR CB C 83 69.156 69.156 68.524 0.632 17927 13712 1 17 . 1 1 83 83 THR H H 83 7.659 7.659 7.658 0.001 17927 13713 1 17 . 1 1 84 84 LYS N N 84 123.927 123.927 120.177 3.750 17927 13714 1 17 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.210 -0.141 17927 13715 1 17 . 1 1 84 84 LYS C C 84 178.582 178.582 177.535 1.047 17927 13716 1 17 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.731 1.146 17927 13717 1 17 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.992 -0.669 17927 13718 1 17 . 1 1 84 84 LYS H H 84 8.665 8.665 7.707 0.958 17927 13719 1 17 . 1 1 85 85 ASP N N 85 116.280 116.280 117.084 -0.804 17927 13720 1 17 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.611 0.139 17927 13721 1 17 . 1 1 85 85 ASP C C 85 175.086 175.086 175.569 -0.483 17927 13722 1 17 . 1 1 85 85 ASP CA C 85 54.693 54.693 54.814 -0.121 17927 13723 1 17 . 1 1 85 85 ASP CB C 85 39.685 39.685 41.964 -2.279 17927 13724 1 17 . 1 1 85 85 ASP H H 85 8.179 8.179 8.166 0.013 17927 13725 1 17 . 1 1 86 86 GLN N N 86 116.258 116.258 115.856 0.402 17927 13726 1 17 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.973 -0.065 17927 13727 1 17 . 1 1 86 86 GLN C C 86 175.659 175.659 174.453 1.206 17927 13728 1 17 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.163 0.008 17927 13729 1 17 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.252 0.038 17927 13730 1 17 . 1 1 86 86 GLN H H 86 7.431 7.431 7.833 -0.402 17927 13731 1 17 . 1 1 87 87 LEU N N 87 117.031 117.031 122.708 -5.677 17927 13732 1 17 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.460 -0.370 17927 13733 1 17 . 1 1 87 87 LEU C C 87 178.225 178.225 176.280 1.945 17927 13734 1 17 . 1 1 87 87 LEU CA C 87 55.932 55.932 54.171 1.761 17927 13735 1 17 . 1 1 87 87 LEU CB C 87 41.202 41.202 42.218 -1.016 17927 13736 1 17 . 1 1 87 87 LEU H H 87 7.736 7.736 7.929 -0.193 17927 13737 1 17 . 1 1 88 88 LYS N N 88 122.367 122.367 124.165 -1.798 17927 13738 1 17 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.561 0.075 17927 13739 1 17 . 1 1 88 88 LYS C C 88 177.538 177.538 176.579 0.959 17927 13740 1 17 . 1 1 88 88 LYS CA C 88 54.930 54.930 53.972 0.958 17927 13741 1 17 . 1 1 88 88 LYS CB C 88 33.316 33.316 34.388 -1.071 17927 13742 1 17 . 1 1 88 88 LYS H H 88 8.496 8.496 8.372 0.124 17927 13743 1 17 . 1 1 89 89 GLY N N 89 108.452 108.452 105.300 3.152 17927 13744 1 17 . 1 1 89 89 GLY C C 89 173.781 173.781 173.610 0.171 17927 13745 1 17 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.335 1.023 17927 13746 1 17 . 1 1 89 89 GLY H H 89 8.497 8.497 8.100 0.397 17927 13747 1 17 . 1 1 90 90 ILE N N 90 123.295 123.295 122.337 0.958 17927 13748 1 17 . 1 1 90 90 ILE HA H 90 4.371 4.371 3.992 0.379 17927 13749 1 17 . 1 1 90 90 ILE C C 90 175.606 175.606 174.678 0.928 17927 13750 1 17 . 1 1 90 90 ILE CA C 90 62.001 62.001 61.841 0.160 17927 13751 1 17 . 1 1 90 90 ILE CB C 90 38.036 38.036 37.706 0.330 17927 13752 1 17 . 1 1 90 90 ILE H H 90 8.728 8.728 8.048 0.680 17927 13753 1 17 . 1 1 91 91 GLN N N 91 128.632 128.632 126.173 2.459 17927 13754 1 17 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.927 -0.161 17927 13755 1 17 . 1 1 91 91 GLN C C 91 174.618 174.618 174.348 0.270 17927 13756 1 17 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.618 1.232 17927 13757 1 17 . 1 1 91 91 GLN CB C 91 28.341 28.341 30.203 -1.862 17927 13758 1 17 . 1 1 91 91 GLN H H 91 8.762 8.762 9.511 -0.749 17927 13759 1 17 . 1 1 92 92 LEU N N 92 120.830 120.830 125.150 -4.320 17927 13760 1 17 . 1 1 92 92 LEU HA H 92 5.580 5.580 5.233 0.347 17927 13761 1 17 . 1 1 92 92 LEU C C 92 176.828 176.828 176.254 0.574 17927 13762 1 17 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.753 -0.952 17927 13763 1 17 . 1 1 92 92 LEU CB C 92 44.210 44.210 44.387 -0.177 17927 13764 1 17 . 1 1 92 92 LEU H H 92 9.011 9.011 9.335 -0.324 17927 13765 1 17 . 1 1 93 93 HIS N N 93 121.481 121.481 123.475 -1.994 17927 13766 1 17 . 1 1 93 93 HIS HA H 93 3.931 3.931 4.958 -1.027 17927 13767 1 17 . 1 1 93 93 HIS C C 93 173.590 173.590 173.747 -0.157 17927 13768 1 17 . 1 1 93 93 HIS CA C 93 56.583 56.583 54.481 2.102 17927 13769 1 17 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.418 -1.168 17927 13770 1 17 . 1 1 93 93 HIS H H 93 8.038 8.038 9.033 -0.995 17927 13771 1 17 . 1 1 94 94 MET N N 94 121.881 121.881 128.638 -6.757 17927 13772 1 17 . 1 1 94 94 MET HA H 94 3.866 3.866 4.751 -0.885 17927 13773 1 17 . 1 1 94 94 MET C C 94 177.035 177.035 174.803 2.232 17927 13774 1 17 . 1 1 94 94 MET CA C 94 55.189 55.189 53.807 1.382 17927 13775 1 17 . 1 1 94 94 MET CB C 94 33.993 33.993 33.165 0.828 17927 13776 1 17 . 1 1 94 94 MET H H 94 8.039 8.039 8.890 -0.851 17927 13777 1 17 . 1 1 95 95 GLY N N 95 104.041 104.041 111.300 -7.259 17927 13778 1 17 . 1 1 95 95 GLY C C 95 174.251 174.251 174.629 -0.378 17927 13779 1 17 . 1 1 95 95 GLY CA C 95 46.580 46.580 47.321 -0.741 17927 13780 1 17 . 1 1 95 95 GLY H H 95 5.666 5.666 7.991 -2.325 17927 13781 1 17 . 1 1 96 96 THR N N 96 114.114 114.114 110.408 3.706 17927 13782 1 17 . 1 1 96 96 THR HA H 96 4.211 4.211 4.360 -0.149 17927 13783 1 17 . 1 1 96 96 THR C C 96 175.122 175.122 174.657 0.465 17927 13784 1 17 . 1 1 96 96 THR CA C 96 61.339 61.339 62.403 -1.064 17927 13785 1 17 . 1 1 96 96 THR CB C 96 68.615 68.615 69.087 -0.472 17927 13786 1 17 . 1 1 96 96 THR H H 96 8.517 8.517 8.173 0.344 17927 13787 1 17 . 1 1 97 97 ASP N N 97 121.892 121.892 121.562 0.330 17927 13788 1 17 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.793 -0.208 17927 13789 1 17 . 1 1 97 97 ASP C C 97 178.241 178.241 177.030 1.211 17927 13790 1 17 . 1 1 97 97 ASP CA C 97 55.800 55.800 55.425 0.375 17927 13791 1 17 . 1 1 97 97 ASP CB C 97 43.129 43.129 40.631 2.498 17927 13792 1 17 . 1 1 97 97 ASP H H 97 7.563 7.563 8.698 -1.135 17927 13793 1 17 . 1 1 98 98 ARG N N 98 127.508 127.508 117.906 9.602 17927 13794 1 17 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.341 0.051 17927 13795 1 17 . 1 1 98 98 ARG C C 98 176.724 176.724 177.148 -0.424 17927 13796 1 17 . 1 1 98 98 ARG CA C 98 55.939 55.939 56.656 -0.717 17927 13797 1 17 . 1 1 98 98 ARG CB C 98 30.291 30.291 28.354 1.937 17927 13798 1 17 . 1 1 98 98 ARG H H 98 9.225 9.225 8.010 1.215 17927 13799 1 17 . 1 1 99 99 THR N N 99 116.384 116.384 115.619 0.765 17927 13800 1 17 . 1 1 99 99 THR HA H 99 3.987 3.987 4.126 -0.139 17927 13801 1 17 . 1 1 99 99 THR C C 99 176.969 176.969 174.933 2.036 17927 13802 1 17 . 1 1 99 99 THR CA C 99 67.714 67.714 65.229 2.485 17927 13803 1 17 . 1 1 99 99 THR CB C 99 68.777 68.777 68.734 0.043 17927 13804 1 17 . 1 1 99 99 THR H H 99 8.382 8.382 7.975 0.407 17927 13805 1 17 . 1 1 100 100 PHE N N 100 123.232 123.232 120.677 2.555 17927 13806 1 17 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.390 -0.217 17927 13807 1 17 . 1 1 100 100 PHE C C 100 177.010 177.010 177.047 -0.037 17927 13808 1 17 . 1 1 100 100 PHE CA C 100 61.923 61.923 60.162 1.761 17927 13809 1 17 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.395 1.367 17927 13810 1 17 . 1 1 100 100 PHE H H 100 7.998 7.998 8.063 -0.065 17927 13811 1 17 . 1 1 101 101 MET N N 101 115.968 115.968 120.632 -4.664 17927 13812 1 17 . 1 1 101 101 MET HA H 101 3.975 3.975 4.191 -0.216 17927 13813 1 17 . 1 1 101 101 MET C C 101 178.763 178.763 177.718 1.045 17927 13814 1 17 . 1 1 101 101 MET CA C 101 58.552 58.552 57.713 0.839 17927 13815 1 17 . 1 1 101 101 MET CB C 101 32.593 32.593 31.926 0.667 17927 13816 1 17 . 1 1 101 101 MET H H 101 7.828 7.828 8.134 -0.306 17927 13817 1 17 . 1 1 102 102 ASP N N 102 117.553 117.553 119.208 -1.655 17927 13818 1 17 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.439 0.083 17927 13819 1 17 . 1 1 102 102 ASP C C 102 179.503 179.503 178.185 1.318 17927 13820 1 17 . 1 1 102 102 ASP CA C 102 56.890 56.890 56.846 0.044 17927 13821 1 17 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.127 -0.201 17927 13822 1 17 . 1 1 102 102 ASP H H 102 8.828 8.828 7.955 0.873 17927 13823 1 17 . 1 1 103 103 ALA N N 103 122.984 122.984 122.112 0.872 17927 13824 1 17 . 1 1 103 103 ALA HA H 103 3.986 3.986 3.975 0.011 17927 13825 1 17 . 1 1 103 103 ALA C C 103 178.782 178.782 178.244 0.538 17927 13826 1 17 . 1 1 103 103 ALA CA C 103 55.094 55.094 53.955 1.139 17927 13827 1 17 . 1 1 103 103 ALA CB C 103 18.563 18.563 17.857 0.706 17927 13828 1 17 . 1 1 103 103 ALA H H 103 7.567 7.567 7.318 0.249 17927 13829 1 17 . 1 1 104 104 TYR N N 104 112.159 112.159 114.974 -2.815 17927 13830 1 17 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.501 -0.277 17927 13831 1 17 . 1 1 104 104 TYR C C 104 173.821 173.821 175.779 -1.958 17927 13832 1 17 . 1 1 104 104 TYR CA C 104 58.498 58.498 58.417 0.081 17927 13833 1 17 . 1 1 104 104 TYR CB C 104 38.393 38.393 39.046 -0.653 17927 13834 1 17 . 1 1 104 104 TYR H H 104 7.203 7.203 7.366 -0.163 17927 13835 1 17 . 1 1 105 105 LEU N N 105 119.433 119.433 114.630 4.803 17927 13836 1 17 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.955 0.030 17927 13837 1 17 . 1 1 105 105 LEU C C 105 176.721 176.721 176.027 0.694 17927 13838 1 17 . 1 1 105 105 LEU CA C 105 55.785 55.785 56.473 -0.688 17927 13839 1 17 . 1 1 105 105 LEU CB C 105 38.443 38.443 40.246 -1.803 17927 13840 1 17 . 1 1 105 105 LEU H H 105 7.582 7.582 7.524 0.058 17927 13841 1 17 . 1 1 106 106 ILE N N 106 119.575 119.575 119.757 -0.182 17927 13842 1 17 . 1 1 106 106 ILE HA H 106 4.002 4.002 4.108 -0.106 17927 13843 1 17 . 1 1 106 106 ILE C C 106 175.459 175.459 175.250 0.209 17927 13844 1 17 . 1 1 106 106 ILE CA C 106 62.043 62.043 60.770 1.273 17927 13845 1 17 . 1 1 106 106 ILE CB C 106 36.335 36.335 37.259 -0.924 17927 13846 1 17 . 1 1 106 106 ILE H H 106 8.774 8.774 7.250 1.524 17927 13847 1 17 . 1 1 107 107 ASN N N 107 126.514 126.514 123.790 2.724 17927 13848 1 17 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.660 0.203 17927 13849 1 17 . 1 1 107 107 ASN C C 107 174.584 174.584 175.676 -1.092 17927 13850 1 17 . 1 1 107 107 ASN CA C 107 53.112 53.112 53.217 -0.105 17927 13851 1 17 . 1 1 107 107 ASN CB C 107 38.977 38.977 39.143 -0.166 17927 13852 1 17 . 1 1 107 107 ASN H H 107 8.364 8.364 8.390 -0.026 17927 13853 1 17 . 1 1 108 108 GLY N N 108 108.469 108.469 108.563 -0.094 17927 13854 1 17 . 1 1 108 108 GLY C C 108 171.245 171.245 173.211 -1.966 17927 13855 1 17 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.707 0.562 17927 13856 1 17 . 1 1 108 108 GLY H H 108 7.678 7.678 7.845 -0.167 17927 13857 1 17 . 1 1 109 109 ILE N N 109 112.817 112.817 120.882 -8.065 17927 13858 1 17 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.531 -0.125 17927 13859 1 17 . 1 1 109 109 ILE C C 109 173.498 173.498 173.753 -0.255 17927 13860 1 17 . 1 1 109 109 ILE CA C 109 58.384 58.384 57.374 1.010 17927 13861 1 17 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.833 1.489 17927 13862 1 17 . 1 1 109 109 ILE H H 109 7.868 7.868 7.366 0.502 17927 13863 1 17 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.387 0.355 17927 13864 1 17 . 1 1 110 110 PRO C C 110 175.715 175.715 175.345 0.370 17927 13865 1 17 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.643 -0.366 17927 13866 1 17 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.160 4.208 17927 13867 1 17 . 1 1 111 111 ARG N N 111 122.358 122.358 122.477 -0.119 17927 13868 1 17 . 1 1 111 111 ARG HA H 111 4.469 4.469 3.849 0.620 17927 13869 1 17 . 1 1 111 111 ARG C C 111 171.541 171.541 174.725 -3.184 17927 13870 1 17 . 1 1 111 111 ARG CA C 111 54.356 54.356 53.868 0.488 17927 13871 1 17 . 1 1 111 111 ARG CB C 111 33.430 33.430 32.253 1.177 17927 13872 1 17 . 1 1 111 111 ARG H H 111 7.732 7.732 8.269 -0.537 17927 13873 1 17 . 1 1 112 112 PHE N N 112 125.103 125.103 121.121 3.982 17927 13874 1 17 . 1 1 112 112 PHE HA H 112 5.773 5.773 5.105 0.668 17927 13875 1 17 . 1 1 112 112 PHE C C 112 175.097 175.097 174.874 0.223 17927 13876 1 17 . 1 1 112 112 PHE CA C 112 55.791 55.791 56.169 -0.378 17927 13877 1 17 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.652 1.276 17927 13878 1 17 . 1 1 112 112 PHE H H 112 8.929 8.929 8.139 0.790 17927 13879 1 17 . 1 1 113 113 ILE N N 113 123.778 123.778 122.215 1.563 17927 13880 1 17 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.875 -0.332 17927 13881 1 17 . 1 1 113 113 ILE C C 113 173.197 173.197 173.963 -0.766 17927 13882 1 17 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.425 0.861 17927 13883 1 17 . 1 1 113 113 ILE CB C 113 44.246 44.246 41.764 2.482 17927 13884 1 17 . 1 1 113 113 ILE H H 113 8.873 8.873 8.792 0.081 17927 13885 1 17 . 1 1 114 114 LEU N N 114 127.146 127.146 127.735 -0.589 17927 13886 1 17 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.139 0.875 17927 13887 1 17 . 1 1 114 114 LEU C C 114 175.080 175.080 174.554 0.526 17927 13888 1 17 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.216 0.185 17927 13889 1 17 . 1 1 114 114 LEU CB C 114 47.370 47.370 45.510 1.860 17927 13890 1 17 . 1 1 114 114 LEU H H 114 8.974 8.974 8.640 0.334 17927 13891 1 17 . 1 1 115 115 LEU N N 115 128.323 128.323 125.725 2.598 17927 13892 1 17 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.080 0.352 17927 13893 1 17 . 1 1 115 115 LEU C C 115 176.660 176.660 175.841 0.819 17927 13894 1 17 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.773 -0.695 17927 13895 1 17 . 1 1 115 115 LEU CB C 115 44.584 44.584 45.956 -1.371 17927 13896 1 17 . 1 1 115 115 LEU H H 115 9.874 9.874 9.105 0.769 17927 13897 1 17 . 1 1 116 116 ASP N N 116 119.834 119.834 122.593 -2.759 17927 13898 1 17 . 1 1 116 116 ASP HA H 116 4.935 4.935 4.723 0.212 17927 13899 1 17 . 1 1 116 116 ASP C C 116 176.898 176.898 177.262 -0.364 17927 13900 1 17 . 1 1 116 116 ASP CA C 116 52.305 52.305 54.026 -1.720 17927 13901 1 17 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.622 -1.594 17927 13902 1 17 . 1 1 116 116 ASP H H 116 9.357 9.357 8.848 0.509 17927 13903 1 17 . 1 1 117 117 ARG N N 117 113.356 113.356 120.253 -6.897 17927 13904 1 17 . 1 1 117 117 ARG HA H 117 3.717 3.717 4.026 -0.309 17927 13905 1 17 . 1 1 117 117 ARG C C 117 177.105 177.105 177.412 -0.307 17927 13906 1 17 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.365 -1.180 17927 13907 1 17 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.897 0.540 17927 13908 1 17 . 1 1 117 117 ARG H H 117 7.697 7.697 8.053 -0.356 17927 13909 1 17 . 1 1 118 118 ASP N N 118 117.226 117.226 116.298 0.928 17927 13910 1 17 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.563 0.332 17927 13911 1 17 . 1 1 118 118 ASP C C 118 176.657 176.657 176.220 0.437 17927 13912 1 17 . 1 1 118 118 ASP CA C 118 53.517 53.517 53.636 -0.119 17927 13913 1 17 . 1 1 118 118 ASP CB C 118 42.556 42.556 40.746 1.810 17927 13914 1 17 . 1 1 118 118 ASP H H 118 8.456 8.456 8.083 0.373 17927 13915 1 17 . 1 1 119 119 GLY N N 119 109.074 109.074 108.131 0.943 17927 13916 1 17 . 1 1 119 119 GLY C C 119 173.355 173.355 174.283 -0.928 17927 13917 1 17 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.612 0.644 17927 13918 1 17 . 1 1 119 119 GLY H H 119 8.183 8.183 8.208 -0.025 17927 13919 1 17 . 1 1 120 120 LYS N N 120 120.744 120.744 120.808 -0.064 17927 13920 1 17 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.684 -0.151 17927 13921 1 17 . 1 1 120 120 LYS C C 120 177.229 177.229 176.389 0.840 17927 13922 1 17 . 1 1 120 120 LYS CA C 120 55.287 55.287 53.867 1.419 17927 13923 1 17 . 1 1 120 120 LYS CB C 120 32.581 32.581 32.537 0.044 17927 13924 1 17 . 1 1 120 120 LYS H H 120 8.449 8.449 7.552 0.897 17927 13925 1 17 . 1 1 121 121 ILE N N 121 121.221 121.221 127.533 -6.312 17927 13926 1 17 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.976 -0.090 17927 13927 1 17 . 1 1 121 121 ILE C C 121 177.819 177.819 176.937 0.882 17927 13928 1 17 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.386 0.529 17927 13929 1 17 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.085 2.305 17927 13930 1 17 . 1 1 121 121 ILE H H 121 8.715 8.715 8.965 -0.250 17927 13931 1 17 . 1 1 122 122 ILE N N 122 127.165 127.165 129.490 -2.325 17927 13932 1 17 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.075 0.266 17927 13933 1 17 . 1 1 122 122 ILE C C 122 176.978 176.978 176.639 0.339 17927 13934 1 17 . 1 1 122 122 ILE CA C 122 63.719 63.719 63.189 0.530 17927 13935 1 17 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.773 -0.121 17927 13936 1 17 . 1 1 122 122 ILE H H 122 8.974 8.974 8.993 -0.019 17927 13937 1 17 . 1 1 123 123 SER N N 123 111.227 111.227 114.100 -2.873 17927 13938 1 17 . 1 1 123 123 SER HA H 123 4.738 4.738 4.707 0.031 17927 13939 1 17 . 1 1 123 123 SER C C 123 174.184 174.184 173.708 0.476 17927 13940 1 17 . 1 1 123 123 SER CA C 123 57.383 57.383 57.684 -0.301 17927 13941 1 17 . 1 1 123 123 SER CB C 123 65.326 65.326 65.396 -0.070 17927 13942 1 17 . 1 1 123 123 SER H H 123 7.850 7.850 7.983 -0.133 17927 13943 1 17 . 1 1 124 124 ALA N N 124 131.373 131.373 125.604 5.769 17927 13944 1 17 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.212 0.273 17927 13945 1 17 . 1 1 124 124 ALA C C 124 175.147 175.147 177.031 -1.884 17927 13946 1 17 . 1 1 124 124 ALA CA C 124 53.035 53.035 53.789 -0.754 17927 13947 1 17 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.270 -0.608 17927 13948 1 17 . 1 1 124 124 ALA H H 124 9.384 9.384 8.609 0.775 17927 13949 1 17 . 1 1 125 125 ASN N N 125 119.476 119.476 115.617 3.859 17927 13950 1 17 . 1 1 125 125 ASN HA H 125 5.056 5.056 4.768 0.288 17927 13951 1 17 . 1 1 125 125 ASN C C 125 173.593 173.593 174.157 -0.564 17927 13952 1 17 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.692 -0.340 17927 13953 1 17 . 1 1 125 125 ASN CB C 125 38.304 38.304 38.793 -0.489 17927 13954 1 17 . 1 1 125 125 ASN H H 125 8.191 8.191 7.726 0.465 17927 13955 1 17 . 1 1 126 126 MET N N 126 122.705 122.705 126.937 -4.232 17927 13956 1 17 . 1 1 126 126 MET HA H 126 4.585 4.585 4.960 -0.375 17927 13957 1 17 . 1 1 126 126 MET C C 126 175.215 175.215 175.935 -0.720 17927 13958 1 17 . 1 1 126 126 MET CA C 126 53.849 53.849 56.234 -2.385 17927 13959 1 17 . 1 1 126 126 MET CB C 126 31.312 31.312 34.015 -2.703 17927 13960 1 17 . 1 1 126 126 MET H H 126 8.376 8.376 8.993 -0.617 17927 13961 1 17 . 1 1 127 127 THR N N 127 111.016 111.016 109.490 1.526 17927 13962 1 17 . 1 1 127 127 THR HA H 127 4.291 4.291 4.432 -0.141 17927 13963 1 17 . 1 1 127 127 THR C C 127 174.574 174.574 173.451 1.123 17927 13964 1 17 . 1 1 127 127 THR CA C 127 62.085 62.085 61.870 0.214 17927 13965 1 17 . 1 1 127 127 THR CB C 127 69.733 69.733 70.467 -0.734 17927 13966 1 17 . 1 1 127 127 THR H H 127 7.714 7.714 8.177 -0.463 17927 13967 1 17 . 1 1 128 128 ARG N N 128 118.722 118.722 120.078 -1.356 17927 13968 1 17 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.024 -0.716 17927 13969 1 17 . 1 1 128 128 ARG C C 128 176.978 176.978 174.168 2.810 17927 13970 1 17 . 1 1 128 128 ARG CA C 128 54.727 54.727 55.388 -0.661 17927 13971 1 17 . 1 1 128 128 ARG CB C 128 29.598 29.598 30.201 -0.603 17927 13972 1 17 . 1 1 128 128 ARG H H 128 8.658 8.658 7.701 0.957 17927 13973 1 17 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.066 -0.133 17927 13974 1 17 . 1 1 129 129 PRO C C 129 175.794 175.794 176.646 -0.852 17927 13975 1 17 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.176 1.373 17927 13976 1 17 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.812 -0.135 17927 13977 1 17 . 1 1 130 130 SER N N 130 108.696 108.696 107.628 1.068 17927 13978 1 17 . 1 1 130 130 SER HA H 130 3.988 3.988 4.299 -0.311 17927 13979 1 17 . 1 1 130 130 SER C C 130 174.445 174.445 174.047 0.398 17927 13980 1 17 . 1 1 130 130 SER CA C 130 58.911 58.911 58.629 0.282 17927 13981 1 17 . 1 1 130 130 SER CB C 130 62.680 62.680 62.596 0.084 17927 13982 1 17 . 1 1 130 130 SER H H 130 8.375 8.375 8.071 0.304 17927 13983 1 17 . 1 1 131 131 ASP N N 131 126.377 126.377 123.722 2.655 17927 13984 1 17 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.887 -0.015 17927 13985 1 17 . 1 1 131 131 ASP C C 131 176.879 176.879 175.344 1.535 17927 13986 1 17 . 1 1 131 131 ASP CA C 131 51.195 51.195 51.239 -0.044 17927 13987 1 17 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.338 0.478 17927 13988 1 17 . 1 1 131 131 ASP H H 131 7.514 7.514 7.540 -0.026 17927 13989 1 17 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.093 0.299 17927 13990 1 17 . 1 1 132 132 PRO C C 132 178.097 178.097 178.206 -0.109 17927 13991 1 17 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.873 0.206 17927 13992 1 17 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.172 0.237 17927 13993 1 17 . 1 1 133 133 LYS N N 133 116.306 116.306 117.000 -0.694 17927 13994 1 17 . 1 1 133 133 LYS HA H 133 3.958 3.958 4.152 -0.194 17927 13995 1 17 . 1 1 133 133 LYS C C 133 179.532 179.532 178.913 0.619 17927 13996 1 17 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.483 -0.962 17927 13997 1 17 . 1 1 133 133 LYS CB C 133 32.191 32.191 32.079 0.112 17927 13998 1 17 . 1 1 133 133 LYS H H 133 8.842 8.842 8.430 0.412 17927 13999 1 17 . 1 1 134 134 THR N N 134 120.833 120.833 115.201 5.632 17927 14000 1 17 . 1 1 134 134 THR HA H 134 3.147 3.147 3.682 -0.535 17927 14001 1 17 . 1 1 134 134 THR C C 134 173.356 173.356 175.304 -1.948 17927 14002 1 17 . 1 1 134 134 THR CA C 134 66.383 66.383 65.699 0.684 17927 14003 1 17 . 1 1 134 134 THR CB C 134 66.847 66.847 68.294 -1.447 17927 14004 1 17 . 1 1 134 134 THR H H 134 8.292 8.292 7.560 0.732 17927 14005 1 17 . 1 1 135 135 ALA N N 135 121.720 121.720 123.531 -1.811 17927 14006 1 17 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.615 -0.032 17927 14007 1 17 . 1 1 135 135 ALA C C 135 178.902 178.902 179.116 -0.214 17927 14008 1 17 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.777 0.222 17927 14009 1 17 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.231 -0.456 17927 14010 1 17 . 1 1 135 135 ALA H H 135 7.030 7.030 7.275 -0.245 17927 14011 1 17 . 1 1 136 136 GLU N N 136 114.623 114.623 117.123 -2.500 17927 14012 1 17 . 1 1 136 136 GLU HA H 136 3.922 3.922 4.170 -0.248 17927 14013 1 17 . 1 1 136 136 GLU C C 136 179.199 179.199 178.766 0.433 17927 14014 1 17 . 1 1 136 136 GLU CA C 136 59.837 59.837 58.390 1.447 17927 14015 1 17 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.109 0.677 17927 14016 1 17 . 1 1 136 136 GLU H H 136 7.216 7.216 8.579 -1.363 17927 14017 1 17 . 1 1 137 137 LYS N N 137 120.789 120.789 120.413 0.376 17927 14018 1 17 . 1 1 137 137 LYS HA H 137 4.204 4.204 3.970 0.234 17927 14019 1 17 . 1 1 137 137 LYS C C 137 178.834 178.834 178.716 0.118 17927 14020 1 17 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.385 -1.042 17927 14021 1 17 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.798 -1.335 17927 14022 1 17 . 1 1 137 137 LYS H H 137 7.681 7.681 7.134 0.547 17927 14023 1 17 . 1 1 138 138 PHE N N 138 118.373 118.373 117.311 1.062 17927 14024 1 17 . 1 1 138 138 PHE HA H 138 4.033 4.033 4.102 -0.069 17927 14025 1 17 . 1 1 138 138 PHE C C 138 178.027 178.027 178.084 -0.057 17927 14026 1 17 . 1 1 138 138 PHE CA C 138 57.507 57.507 59.793 -2.286 17927 14027 1 17 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.570 -1.681 17927 14028 1 17 . 1 1 138 138 PHE H H 138 8.059 8.059 7.100 0.959 17927 14029 1 17 . 1 1 139 139 ASN N N 139 117.611 117.611 115.970 1.641 17927 14030 1 17 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.477 -0.073 17927 14031 1 17 . 1 1 139 139 ASN C C 139 178.190 178.190 176.929 1.261 17927 14032 1 17 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.098 0.126 17927 14033 1 17 . 1 1 139 139 ASN CB C 139 36.734 36.734 38.220 -1.486 17927 14034 1 17 . 1 1 139 139 ASN H H 139 8.683 8.683 8.347 0.336 17927 14035 1 17 . 1 1 140 140 GLU N N 140 121.432 121.432 122.345 -0.913 17927 14036 1 17 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.010 -0.005 17927 14037 1 17 . 1 1 140 140 GLU C C 140 179.751 179.751 178.910 0.841 17927 14038 1 17 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.249 0.061 17927 14039 1 17 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.656 0.399 17927 14040 1 17 . 1 1 140 140 GLU H H 140 7.868 7.868 7.794 0.074 17927 14041 1 17 . 1 1 141 141 LEU N N 141 119.968 119.968 119.095 0.873 17927 14042 1 17 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.058 -0.042 17927 14043 1 17 . 1 1 141 141 LEU C C 141 179.293 179.293 179.205 0.088 17927 14044 1 17 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.430 0.006 17927 14045 1 17 . 1 1 141 141 LEU CB C 141 41.183 41.183 42.081 -0.899 17927 14046 1 17 . 1 1 141 141 LEU H H 141 8.303 8.303 7.686 0.617 17927 14047 1 17 . 1 1 142 142 LEU N N 142 115.040 115.040 117.397 -2.357 17927 14048 1 17 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.366 0.018 17927 14049 1 17 . 1 1 142 142 LEU C C 142 178.002 178.002 177.656 0.346 17927 14050 1 17 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.345 -0.066 17927 14051 1 17 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.479 0.167 17927 14052 1 17 . 1 1 142 142 LEU H H 142 8.230 8.230 7.772 0.458 17927 14053 1 17 . 1 1 143 143 GLY N N 143 108.977 108.977 106.600 2.377 17927 14054 1 17 . 1 1 143 143 GLY C C 143 175.216 175.216 174.234 0.982 17927 14055 1 17 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.564 1.177 17927 14056 1 17 . 1 1 143 143 GLY H H 143 7.762 7.762 7.787 -0.025 17927 14057 1 17 . 1 1 144 144 LEU N N 144 119.660 119.660 119.507 0.153 17927 14058 1 17 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.697 -0.209 17927 14059 1 17 . 1 1 144 144 LEU C C 144 177.375 177.375 175.833 1.542 17927 14060 1 17 . 1 1 144 144 LEU CA C 144 54.525 54.525 53.951 0.574 17927 14061 1 17 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.804 -0.031 17927 14062 1 17 . 1 1 144 144 LEU H H 144 8.241 8.241 8.344 -0.103 17927 14063 1 17 . 1 1 145 145 GLU N N 145 119.959 119.959 119.485 0.474 17927 14064 1 17 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.329 -0.088 17927 14065 1 17 . 1 1 145 145 GLU C C 145 177.075 177.075 177.373 -0.298 17927 14066 1 17 . 1 1 145 145 GLU CA C 145 56.799 56.799 55.097 1.702 17927 14067 1 17 . 1 1 145 145 GLU CB C 145 30.168 30.168 29.832 0.335 17927 14068 1 17 . 1 1 145 145 GLU H H 145 8.410 8.410 7.328 1.082 17927 14069 1 17 . 1 1 146 146 GLY N N 146 109.412 109.412 105.705 3.707 17927 14070 1 17 . 1 1 146 146 GLY C C 146 174.276 174.276 173.799 0.477 17927 14071 1 17 . 1 1 146 146 GLY CA C 146 45.445 45.445 45.073 0.372 17927 14072 1 17 . 1 1 146 146 GLY H H 146 8.422 8.422 8.634 -0.212 17927 14073 1 17 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.690 -0.034 17927 14074 1 17 . 1 1 151 151 HIS C C 151 173.990 173.990 174.854 -0.864 17927 14075 1 17 . 1 1 151 151 HIS CA C 151 56.044 56.044 56.080 -0.036 17927 14076 1 17 . 1 1 151 151 HIS CB C 151 30.076 30.076 30.598 -0.522 17927 14077 1 18 . 1 1 2 2 SER HA H 2 4.121 4.121 4.567 -0.446 17927 14078 1 18 . 1 1 2 2 SER CA C 2 57.293 57.293 57.863 -0.570 17927 14079 1 18 . 1 1 2 2 SER CB C 2 63.545 63.545 63.406 0.139 17927 14080 1 18 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.275 0.157 17927 14081 1 18 . 1 1 3 3 LEU C C 3 177.383 177.383 178.223 -0.840 17927 14082 1 18 . 1 1 3 3 LEU CA C 3 55.575 55.575 56.600 -1.025 17927 14083 1 18 . 1 1 3 3 LEU CB C 3 42.584 42.584 41.408 1.176 17927 14084 1 18 . 1 1 4 4 ARG N N 4 122.080 122.080 116.150 5.930 17927 14085 1 18 . 1 1 4 4 ARG HA H 4 4.384 4.384 3.875 0.509 17927 14086 1 18 . 1 1 4 4 ARG C C 4 176.410 176.410 177.760 -1.350 17927 14087 1 18 . 1 1 4 4 ARG CA C 4 56.269 56.269 58.269 -2.000 17927 14088 1 18 . 1 1 4 4 ARG CB C 4 30.842 30.842 28.026 2.816 17927 14089 1 18 . 1 1 4 4 ARG H H 4 8.410 8.410 8.778 -0.368 17927 14090 1 18 . 1 1 5 5 SER N N 5 117.023 117.023 116.745 0.278 17927 14091 1 18 . 1 1 5 5 SER HA H 5 4.423 4.423 4.233 0.190 17927 14092 1 18 . 1 1 5 5 SER C C 5 175.039 175.039 175.891 -0.852 17927 14093 1 18 . 1 1 5 5 SER CA C 5 58.605 58.605 60.824 -2.219 17927 14094 1 18 . 1 1 5 5 SER CB C 5 64.044 64.044 63.113 0.931 17927 14095 1 18 . 1 1 5 5 SER H H 5 8.292 8.292 8.184 0.108 17927 14096 1 18 . 1 1 6 6 GLY N N 6 110.718 110.718 107.495 3.223 17927 14097 1 18 . 1 1 6 6 GLY C C 6 173.654 173.654 173.031 0.623 17927 14098 1 18 . 1 1 6 6 GLY CA C 6 45.273 45.273 44.128 1.145 17927 14099 1 18 . 1 1 6 6 GLY H H 6 8.446 8.446 8.309 0.137 17927 14100 1 18 . 1 1 7 7 ASN N N 7 119.287 119.287 116.843 2.444 17927 14101 1 18 . 1 1 7 7 ASN HA H 7 5.024 5.024 4.432 0.592 17927 14102 1 18 . 1 1 7 7 ASN C C 7 173.672 173.672 173.554 0.118 17927 14103 1 18 . 1 1 7 7 ASN CA C 7 51.357 51.357 54.705 -3.348 17927 14104 1 18 . 1 1 7 7 ASN CB C 7 38.927 38.927 36.434 2.493 17927 14105 1 18 . 1 1 7 7 ASN H H 7 8.273 8.273 7.744 0.529 17927 14106 1 18 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.289 0.158 17927 14107 1 18 . 1 1 8 8 PRO C C 8 176.899 176.899 177.338 -0.439 17927 14108 1 18 . 1 1 8 8 PRO CA C 8 63.429 63.429 65.297 -1.868 17927 14109 1 18 . 1 1 8 8 PRO CB C 8 32.216 32.216 32.035 0.181 17927 14110 1 18 . 1 1 9 9 SER N N 9 115.642 115.642 115.284 0.358 17927 14111 1 18 . 1 1 9 9 SER HA H 9 4.415 4.415 4.310 0.105 17927 14112 1 18 . 1 1 9 9 SER C C 9 174.714 174.714 176.187 -1.473 17927 14113 1 18 . 1 1 9 9 SER CA C 9 58.488 58.488 58.992 -0.504 17927 14114 1 18 . 1 1 9 9 SER CB C 9 64.048 64.048 63.114 0.933 17927 14115 1 18 . 1 1 9 9 SER H H 9 8.336 8.336 8.104 0.232 17927 14116 1 18 . 1 1 10 10 ALA N N 10 126.808 126.808 125.387 1.421 17927 14117 1 18 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.579 -0.317 17927 14118 1 18 . 1 1 10 10 ALA C C 10 177.233 177.233 177.716 -0.483 17927 14119 1 18 . 1 1 10 10 ALA CA C 10 53.230 53.230 54.569 -1.339 17927 14120 1 18 . 1 1 10 10 ALA CB C 10 19.187 19.187 17.665 1.522 17927 14121 1 18 . 1 1 10 10 ALA H H 10 8.137 8.137 9.036 -0.899 17927 14122 1 18 . 1 1 11 11 ALA N N 11 120.449 120.449 119.647 0.802 17927 14123 1 18 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.232 0.029 17927 14124 1 18 . 1 1 11 11 ALA C C 11 177.469 177.469 176.909 0.560 17927 14125 1 18 . 1 1 11 11 ALA CA C 11 52.475 52.475 53.416 -0.941 17927 14126 1 18 . 1 1 11 11 ALA CB C 11 19.485 19.485 20.205 -0.720 17927 14127 1 18 . 1 1 11 11 ALA H H 11 7.851 7.851 8.094 -0.243 17927 14128 1 18 . 1 1 12 12 SER N N 12 114.186 114.186 111.449 2.737 17927 14129 1 18 . 1 1 12 12 SER HA H 12 4.312 4.312 4.427 -0.115 17927 14130 1 18 . 1 1 12 12 SER C C 12 173.593 173.593 172.835 0.758 17927 14131 1 18 . 1 1 12 12 SER CA C 12 58.099 58.099 58.098 0.001 17927 14132 1 18 . 1 1 12 12 SER CB C 12 63.320 63.320 62.207 1.113 17927 14133 1 18 . 1 1 12 12 SER H H 12 7.990 7.990 7.604 0.386 17927 14134 1 18 . 1 1 13 13 PHE N N 13 118.092 118.092 121.428 -3.336 17927 14135 1 18 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.726 0.054 17927 14136 1 18 . 1 1 13 13 PHE C C 13 174.220 174.220 173.158 1.062 17927 14137 1 18 . 1 1 13 13 PHE CA C 13 56.717 56.717 55.996 0.721 17927 14138 1 18 . 1 1 13 13 PHE CB C 13 41.151 41.151 40.165 0.986 17927 14139 1 18 . 1 1 13 13 PHE H H 13 7.147 7.147 7.591 -0.444 17927 14140 1 18 . 1 1 14 14 SER N N 14 116.456 116.456 115.376 1.080 17927 14141 1 18 . 1 1 14 14 SER HA H 14 5.162 5.162 5.179 -0.017 17927 14142 1 18 . 1 1 14 14 SER C C 14 172.626 172.626 172.993 -0.367 17927 14143 1 18 . 1 1 14 14 SER CA C 14 57.390 57.390 57.611 -0.221 17927 14144 1 18 . 1 1 14 14 SER CB C 14 64.518 64.518 64.879 -0.361 17927 14145 1 18 . 1 1 14 14 SER H H 14 7.616 7.616 8.271 -0.655 17927 14146 1 18 . 1 1 15 15 TYR N N 15 122.384 122.384 122.966 -0.582 17927 14147 1 18 . 1 1 15 15 TYR HA H 15 5.206 5.206 5.007 0.199 17927 14148 1 18 . 1 1 15 15 TYR C C 15 172.543 172.543 173.451 -0.908 17927 14149 1 18 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.404 -0.458 17927 14150 1 18 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.803 0.424 17927 14151 1 18 . 1 1 15 15 TYR H H 15 8.558 8.558 9.387 -0.829 17927 14152 1 18 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.891 0.218 17927 14153 1 18 . 1 1 16 16 PRO C C 16 176.475 176.475 176.663 -0.188 17927 14154 1 18 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.216 -0.235 17927 14155 1 18 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.020 0.642 17927 14156 1 18 . 1 1 17 17 ASP N N 17 119.834 119.834 125.268 -5.434 17927 14157 1 18 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.915 0.824 17927 14158 1 18 . 1 1 17 17 ASP C C 17 180.740 180.740 178.236 2.504 17927 14159 1 18 . 1 1 17 17 ASP CA C 17 51.717 51.717 54.654 -2.937 17927 14160 1 18 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.404 -0.843 17927 14161 1 18 . 1 1 17 17 ASP H H 17 8.643 8.643 8.969 -0.326 17927 14162 1 18 . 1 1 18 18 ILE N N 18 118.340 118.340 123.048 -4.708 17927 14163 1 18 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.867 0.584 17927 14164 1 18 . 1 1 18 18 ILE C C 18 175.742 175.742 176.380 -0.638 17927 14165 1 18 . 1 1 18 18 ILE CA C 18 61.894 61.894 63.218 -1.324 17927 14166 1 18 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.247 0.993 17927 14167 1 18 . 1 1 18 18 ILE H H 18 8.450 8.450 8.392 0.058 17927 14168 1 18 . 1 1 19 19 ASN N N 19 119.377 119.377 116.579 2.798 17927 14169 1 18 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.597 0.418 17927 14170 1 18 . 1 1 19 19 ASN C C 19 175.892 175.892 176.237 -0.345 17927 14171 1 18 . 1 1 19 19 ASN CA C 19 53.307 53.307 53.966 -0.659 17927 14172 1 18 . 1 1 19 19 ASN CB C 19 39.825 39.825 39.452 0.373 17927 14173 1 18 . 1 1 19 19 ASN H H 19 8.376 8.376 7.960 0.416 17927 14174 1 18 . 1 1 20 20 GLY N N 20 109.535 109.535 109.146 0.389 17927 14175 1 18 . 1 1 20 20 GLY C C 20 174.285 174.285 173.056 1.229 17927 14176 1 18 . 1 1 20 20 GLY CA C 20 45.793 45.793 44.768 1.025 17927 14177 1 18 . 1 1 20 20 GLY H H 20 8.539 8.539 8.613 -0.074 17927 14178 1 18 . 1 1 21 21 LYS N N 21 124.675 124.675 121.439 3.236 17927 14179 1 18 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.565 -0.122 17927 14180 1 18 . 1 1 21 21 LYS C C 21 176.537 176.537 175.944 0.593 17927 14181 1 18 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.466 0.978 17927 14182 1 18 . 1 1 21 21 LYS CB C 21 32.754 32.754 33.457 -0.703 17927 14183 1 18 . 1 1 21 21 LYS H H 21 8.608 8.608 7.579 1.029 17927 14184 1 18 . 1 1 22 22 THR N N 22 120.666 120.666 124.496 -3.830 17927 14185 1 18 . 1 1 22 22 THR HA H 22 4.087 4.087 4.181 -0.094 17927 14186 1 18 . 1 1 22 22 THR C C 22 174.431 174.431 173.312 1.119 17927 14187 1 18 . 1 1 22 22 THR CA C 22 64.292 64.292 63.771 0.521 17927 14188 1 18 . 1 1 22 22 THR CB C 22 69.069 69.069 68.724 0.345 17927 14189 1 18 . 1 1 22 22 THR H H 22 8.595 8.595 8.833 -0.238 17927 14190 1 18 . 1 1 23 23 VAL N N 23 131.207 131.207 129.678 1.529 17927 14191 1 18 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.352 -0.160 17927 14192 1 18 . 1 1 23 23 VAL C C 23 174.244 174.244 175.074 -0.830 17927 14193 1 18 . 1 1 23 23 VAL CA C 23 62.456 62.456 60.760 1.696 17927 14194 1 18 . 1 1 23 23 VAL CB C 23 33.791 33.791 32.394 1.397 17927 14195 1 18 . 1 1 23 23 VAL H H 23 8.937 8.937 8.835 0.102 17927 14196 1 18 . 1 1 24 24 SER N N 24 120.787 120.787 123.134 -2.347 17927 14197 1 18 . 1 1 24 24 SER HA H 24 5.407 5.407 5.084 0.323 17927 14198 1 18 . 1 1 24 24 SER C C 24 176.169 176.169 175.642 0.527 17927 14199 1 18 . 1 1 24 24 SER CA C 24 55.135 55.135 56.776 -1.641 17927 14200 1 18 . 1 1 24 24 SER CB C 24 65.646 65.646 65.375 0.271 17927 14201 1 18 . 1 1 24 24 SER H H 24 8.554 8.554 8.549 0.005 17927 14202 1 18 . 1 1 25 25 LEU N N 25 124.332 124.332 121.773 2.559 17927 14203 1 18 . 1 1 25 25 LEU HA H 25 3.687 3.687 3.801 -0.114 17927 14204 1 18 . 1 1 25 25 LEU C C 25 179.364 179.364 177.728 1.636 17927 14205 1 18 . 1 1 25 25 LEU CA C 25 58.217 58.217 57.087 1.130 17927 14206 1 18 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.403 -0.865 17927 14207 1 18 . 1 1 25 25 LEU H H 25 7.811 7.811 8.379 -0.568 17927 14208 1 18 . 1 1 26 26 ALA N N 26 119.799 119.799 119.268 0.531 17927 14209 1 18 . 1 1 26 26 ALA HA H 26 3.993 3.993 3.994 -0.001 17927 14210 1 18 . 1 1 26 26 ALA C C 26 179.719 179.719 178.992 0.727 17927 14211 1 18 . 1 1 26 26 ALA CA C 26 54.663 54.663 54.180 0.483 17927 14212 1 18 . 1 1 26 26 ALA CB C 26 18.323 18.323 18.275 0.048 17927 14213 1 18 . 1 1 26 26 ALA H H 26 8.099 8.099 7.762 0.337 17927 14214 1 18 . 1 1 27 27 ASP N N 27 116.553 116.553 119.536 -2.983 17927 14215 1 18 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.436 0.037 17927 14216 1 18 . 1 1 27 27 ASP C C 27 176.915 176.915 176.765 0.150 17927 14217 1 18 . 1 1 27 27 ASP CA C 27 56.251 56.251 56.363 -0.112 17927 14218 1 18 . 1 1 27 27 ASP CB C 27 40.788 40.788 41.174 -0.386 17927 14219 1 18 . 1 1 27 27 ASP H H 27 7.572 7.572 7.752 -0.180 17927 14220 1 18 . 1 1 28 28 LEU N N 28 118.950 118.950 117.282 1.668 17927 14221 1 18 . 1 1 28 28 LEU HA H 28 4.233 4.233 4.234 -0.001 17927 14222 1 18 . 1 1 28 28 LEU C C 28 175.542 175.542 175.269 0.273 17927 14223 1 18 . 1 1 28 28 LEU CA C 28 53.706 53.706 53.241 0.465 17927 14224 1 18 . 1 1 28 28 LEU CB C 28 41.049 41.049 42.707 -1.658 17927 14225 1 18 . 1 1 28 28 LEU H H 28 7.363 7.363 7.082 0.281 17927 14226 1 18 . 1 1 29 29 LYS N N 29 118.429 118.429 120.131 -1.702 17927 14227 1 18 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.128 0.224 17927 14228 1 18 . 1 1 29 29 LYS C C 29 178.063 178.063 177.274 0.789 17927 14229 1 18 . 1 1 29 29 LYS CA C 29 57.777 57.777 56.753 1.024 17927 14230 1 18 . 1 1 29 29 LYS CB C 29 33.440 33.440 33.624 -0.184 17927 14231 1 18 . 1 1 29 29 LYS H H 29 6.780 6.780 7.115 -0.335 17927 14232 1 18 . 1 1 30 30 GLY N N 30 112.426 112.426 112.506 -0.080 17927 14233 1 18 . 1 1 30 30 GLY C C 30 173.801 173.801 173.944 -0.143 17927 14234 1 18 . 1 1 30 30 GLY CA C 30 44.611 44.611 45.114 -0.503 17927 14235 1 18 . 1 1 30 30 GLY H H 30 9.398 9.398 8.833 0.565 17927 14236 1 18 . 1 1 31 31 LYS N N 31 119.295 119.295 120.472 -1.177 17927 14237 1 18 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.760 -0.608 17927 14238 1 18 . 1 1 31 31 LYS C C 31 173.862 173.862 176.626 -2.764 17927 14239 1 18 . 1 1 31 31 LYS CA C 31 55.188 55.188 53.866 1.322 17927 14240 1 18 . 1 1 31 31 LYS CB C 31 36.968 36.968 36.127 0.841 17927 14241 1 18 . 1 1 31 31 LYS H H 31 7.496 7.496 7.679 -0.183 17927 14242 1 18 . 1 1 32 32 TYR N N 32 116.984 116.984 119.257 -2.273 17927 14243 1 18 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.556 -0.399 17927 14244 1 18 . 1 1 32 32 TYR C C 32 175.226 175.226 176.082 -0.856 17927 14245 1 18 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.334 0.256 17927 14246 1 18 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.177 -0.056 17927 14247 1 18 . 1 1 32 32 TYR H H 32 7.521 7.521 7.993 -0.472 17927 14248 1 18 . 1 1 33 33 ILE N N 33 118.052 118.052 118.241 -0.189 17927 14249 1 18 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.645 0.262 17927 14250 1 18 . 1 1 33 33 ILE C C 33 174.308 174.308 174.322 -0.014 17927 14251 1 18 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.167 0.535 17927 14252 1 18 . 1 1 33 33 ILE CB C 33 41.616 41.616 41.903 -0.287 17927 14253 1 18 . 1 1 33 33 ILE H H 33 8.467 8.467 9.106 -0.639 17927 14254 1 18 . 1 1 34 34 TYR N N 34 130.242 130.242 128.062 2.180 17927 14255 1 18 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.326 0.200 17927 14256 1 18 . 1 1 34 34 TYR C C 34 174.245 174.245 173.549 0.696 17927 14257 1 18 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.727 0.431 17927 14258 1 18 . 1 1 34 34 TYR CB C 34 40.133 40.133 40.687 -0.554 17927 14259 1 18 . 1 1 34 34 TYR H H 34 8.905 8.905 9.237 -0.332 17927 14260 1 18 . 1 1 35 35 ILE N N 35 128.697 128.697 129.856 -1.159 17927 14261 1 18 . 1 1 35 35 ILE HA H 35 5.342 5.342 4.939 0.403 17927 14262 1 18 . 1 1 35 35 ILE C C 35 174.520 174.520 174.285 0.235 17927 14263 1 18 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.994 -0.245 17927 14264 1 18 . 1 1 35 35 ILE CB C 35 40.899 40.899 39.645 1.254 17927 14265 1 18 . 1 1 35 35 ILE H H 35 9.445 9.445 8.421 1.024 17927 14266 1 18 . 1 1 36 36 ASP N N 36 123.675 123.675 125.673 -1.998 17927 14267 1 18 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.469 -0.621 17927 14268 1 18 . 1 1 36 36 ASP C C 36 174.385 174.385 175.384 -0.999 17927 14269 1 18 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.529 -0.235 17927 14270 1 18 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.329 -2.551 17927 14271 1 18 . 1 1 36 36 ASP H H 36 8.875 8.875 8.592 0.283 17927 14272 1 18 . 1 1 37 37 VAL N N 37 127.159 127.159 119.606 7.553 17927 14273 1 18 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.877 0.082 17927 14274 1 18 . 1 1 37 37 VAL C C 37 175.046 175.046 175.333 -0.287 17927 14275 1 18 . 1 1 37 37 VAL CA C 37 62.245 62.245 61.425 0.820 17927 14276 1 18 . 1 1 37 37 VAL CB C 37 31.807 31.807 33.008 -1.201 17927 14277 1 18 . 1 1 37 37 VAL H H 37 8.603 8.603 7.878 0.725 17927 14278 1 18 . 1 1 38 38 TRP N N 38 124.161 124.161 125.789 -1.628 17927 14279 1 18 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.363 -0.126 17927 14280 1 18 . 1 1 38 38 TRP C C 38 171.995 171.995 173.410 -1.415 17927 14281 1 18 . 1 1 38 38 TRP CA C 38 55.207 55.207 54.007 1.200 17927 14282 1 18 . 1 1 38 38 TRP CB C 38 33.187 33.187 31.892 1.295 17927 14283 1 18 . 1 1 38 38 TRP H H 38 8.562 8.562 8.575 -0.013 17927 14284 1 18 . 1 1 39 39 ALA N N 39 116.252 116.252 124.361 -8.109 17927 14285 1 18 . 1 1 39 39 ALA HA H 39 3.678 3.678 3.547 0.131 17927 14286 1 18 . 1 1 39 39 ALA C C 39 178.664 178.664 175.322 3.342 17927 14287 1 18 . 1 1 39 39 ALA CA C 39 51.466 51.466 49.926 1.540 17927 14288 1 18 . 1 1 39 39 ALA CB C 39 22.341 22.341 20.959 1.382 17927 14289 1 18 . 1 1 39 39 ALA H H 39 6.757 6.757 7.571 -0.814 17927 14290 1 18 . 1 1 40 40 THR N N 40 114.321 114.321 113.088 1.233 17927 14291 1 18 . 1 1 40 40 THR HA H 40 3.907 3.907 4.119 -0.212 17927 14292 1 18 . 1 1 40 40 THR C C 40 175.885 175.885 174.165 1.720 17927 14293 1 18 . 1 1 40 40 THR CA C 40 65.447 65.447 62.691 2.756 17927 14294 1 18 . 1 1 40 40 THR CB C 40 70.106 70.106 68.568 1.538 17927 14295 1 18 . 1 1 40 40 THR H H 40 9.639 9.639 7.856 1.783 17927 14296 1 18 . 1 1 41 41 TRP N N 41 114.483 114.483 119.246 -4.763 17927 14297 1 18 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.887 -0.324 17927 14298 1 18 . 1 1 41 41 TRP C C 41 176.189 176.189 175.022 1.167 17927 14299 1 18 . 1 1 41 41 TRP CA C 41 54.698 54.698 53.733 0.965 17927 14300 1 18 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.230 1.747 17927 14301 1 18 . 1 1 41 41 TRP H H 41 6.401 6.401 6.991 -0.590 17927 14302 1 18 . 1 1 42 42 CYS N N 42 123.536 123.536 119.932 3.604 17927 14303 1 18 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.852 -0.284 17927 14304 1 18 . 1 1 42 42 CYS C C 42 175.726 175.726 175.522 0.204 17927 14305 1 18 . 1 1 42 42 CYS CA C 42 58.700 58.700 56.426 2.274 17927 14306 1 18 . 1 1 42 42 CYS CB C 42 27.121 27.121 27.533 -0.412 17927 14307 1 18 . 1 1 42 42 CYS H H 42 6.883 6.883 7.197 -0.314 17927 14308 1 18 . 1 1 43 43 GLY N N 43 120.977 120.977 112.296 8.681 17927 14309 1 18 . 1 1 43 43 GLY CA C 43 49.204 49.204 47.049 2.155 17927 14310 1 18 . 1 1 43 43 GLY H H 43 9.653 9.653 8.979 0.674 17927 14311 1 18 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.294 0.193 17927 14312 1 18 . 1 1 44 44 PRO C C 44 179.956 179.956 178.695 1.261 17927 14313 1 18 . 1 1 44 44 PRO CA C 44 65.642 65.642 64.936 0.706 17927 14314 1 18 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.429 1.149 17927 14315 1 18 . 1 1 45 45 CYS N N 45 113.925 113.925 115.732 -1.807 17927 14316 1 18 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.220 0.093 17927 14317 1 18 . 1 1 45 45 CYS C C 45 178.325 178.325 176.295 2.030 17927 14318 1 18 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.514 1.877 17927 14319 1 18 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.678 0.827 17927 14320 1 18 . 1 1 45 45 CYS H H 45 7.676 7.676 8.297 -0.621 17927 14321 1 18 . 1 1 46 46 ARG N N 46 120.336 120.336 119.785 0.551 17927 14322 1 18 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.251 -0.182 17927 14323 1 18 . 1 1 46 46 ARG C C 46 180.446 180.446 177.430 3.016 17927 14324 1 18 . 1 1 46 46 ARG CA C 46 59.785 59.785 57.282 2.503 17927 14325 1 18 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.865 0.003 17927 14326 1 18 . 1 1 46 46 ARG H H 46 8.109 8.109 7.708 0.401 17927 14327 1 18 . 1 1 47 47 GLY N N 47 105.408 105.408 108.070 -2.662 17927 14328 1 18 . 1 1 47 47 GLY C C 47 175.258 175.258 175.073 0.185 17927 14329 1 18 . 1 1 47 47 GLY CA C 47 46.594 46.594 46.324 0.270 17927 14330 1 18 . 1 1 47 47 GLY H H 47 8.466 8.466 7.824 0.642 17927 14331 1 18 . 1 1 48 48 GLU N N 48 116.343 116.343 119.385 -3.042 17927 14332 1 18 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.587 -0.062 17927 14333 1 18 . 1 1 48 48 GLU C C 48 176.535 176.535 177.877 -1.342 17927 14334 1 18 . 1 1 48 48 GLU CA C 48 55.792 55.792 55.158 0.634 17927 14335 1 18 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.791 1.192 17927 14336 1 18 . 1 1 48 48 GLU H H 48 7.050 7.050 7.808 -0.758 17927 14337 1 18 . 1 1 49 49 LEU N N 49 118.652 118.652 122.485 -3.833 17927 14338 1 18 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.144 0.008 17927 14339 1 18 . 1 1 49 49 LEU C C 49 176.832 176.832 176.578 0.254 17927 14340 1 18 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.235 -0.890 17927 14341 1 18 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.468 -0.973 17927 14342 1 18 . 1 1 49 49 LEU H H 49 7.385 7.385 7.812 -0.427 17927 14343 1 18 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.150 0.103 17927 14344 1 18 . 1 1 50 50 PRO C C 50 179.744 179.744 178.380 1.364 17927 14345 1 18 . 1 1 50 50 PRO CA C 50 66.559 66.559 65.999 0.560 17927 14346 1 18 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.853 -0.091 17927 14347 1 18 . 1 1 51 51 ALA N N 51 120.418 120.418 118.879 1.539 17927 14348 1 18 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.230 -0.085 17927 14349 1 18 . 1 1 51 51 ALA C C 51 180.329 180.329 179.932 0.397 17927 14350 1 18 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.476 -0.042 17927 14351 1 18 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.142 0.228 17927 14352 1 18 . 1 1 51 51 ALA H H 51 7.731 7.731 7.546 0.185 17927 14353 1 18 . 1 1 52 52 LEU N N 52 121.506 121.506 119.836 1.670 17927 14354 1 18 . 1 1 52 52 LEU HA H 52 3.988 3.988 4.028 -0.040 17927 14355 1 18 . 1 1 52 52 LEU C C 52 177.944 177.944 178.418 -0.474 17927 14356 1 18 . 1 1 52 52 LEU CA C 52 58.327 58.327 57.980 0.347 17927 14357 1 18 . 1 1 52 52 LEU CB C 52 42.382 42.382 42.158 0.224 17927 14358 1 18 . 1 1 52 52 LEU H H 52 8.355 8.355 7.736 0.619 17927 14359 1 18 . 1 1 53 53 LYS N N 53 119.732 119.732 119.422 0.310 17927 14360 1 18 . 1 1 53 53 LYS HA H 53 3.903 3.903 4.104 -0.201 17927 14361 1 18 . 1 1 53 53 LYS C C 53 179.030 179.030 179.058 -0.028 17927 14362 1 18 . 1 1 53 53 LYS CA C 53 59.846 59.846 58.691 1.155 17927 14363 1 18 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.545 0.666 17927 14364 1 18 . 1 1 53 53 LYS H H 53 8.148 8.148 7.601 0.547 17927 14365 1 18 . 1 1 54 54 GLU N N 54 117.779 117.779 120.790 -3.011 17927 14366 1 18 . 1 1 54 54 GLU HA H 54 4.059 4.059 3.968 0.091 17927 14367 1 18 . 1 1 54 54 GLU C C 54 179.646 179.646 178.903 0.743 17927 14368 1 18 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.663 -0.038 17927 14369 1 18 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.556 0.011 17927 14370 1 18 . 1 1 54 54 GLU H H 54 7.585 7.585 8.080 -0.495 17927 14371 1 18 . 1 1 55 55 LEU N N 55 120.581 120.581 120.127 0.454 17927 14372 1 18 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.069 0.124 17927 14373 1 18 . 1 1 55 55 LEU C C 55 178.557 178.557 178.515 0.042 17927 14374 1 18 . 1 1 55 55 LEU CA C 55 58.235 58.235 58.026 0.209 17927 14375 1 18 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.934 1.077 17927 14376 1 18 . 1 1 55 55 LEU H H 55 8.096 8.096 7.847 0.249 17927 14377 1 18 . 1 1 56 56 GLU N N 56 118.023 118.023 118.753 -0.730 17927 14378 1 18 . 1 1 56 56 GLU HA H 56 3.177 3.177 3.193 -0.016 17927 14379 1 18 . 1 1 56 56 GLU C C 56 179.650 179.650 178.983 0.667 17927 14380 1 18 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.280 -0.409 17927 14381 1 18 . 1 1 56 56 GLU CB C 56 26.985 26.985 28.924 -1.939 17927 14382 1 18 . 1 1 56 56 GLU H H 56 8.181 8.181 7.780 0.401 17927 14383 1 18 . 1 1 57 57 GLU N N 57 117.828 117.828 118.387 -0.559 17927 14384 1 18 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.025 0.079 17927 14385 1 18 . 1 1 57 57 GLU C C 57 179.700 179.700 179.397 0.303 17927 14386 1 18 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.828 0.199 17927 14387 1 18 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.352 0.313 17927 14388 1 18 . 1 1 57 57 GLU H H 57 7.762 7.762 8.237 -0.475 17927 14389 1 18 . 1 1 58 58 LYS N N 58 120.896 120.896 119.776 1.120 17927 14390 1 18 . 1 1 58 58 LYS HA H 58 3.979 3.979 3.957 0.022 17927 14391 1 18 . 1 1 58 58 LYS C C 58 178.715 178.715 178.789 -0.074 17927 14392 1 18 . 1 1 58 58 LYS CA C 58 59.078 59.078 59.041 0.037 17927 14393 1 18 . 1 1 58 58 LYS CB C 58 32.980 32.980 32.711 0.270 17927 14394 1 18 . 1 1 58 58 LYS H H 58 8.410 8.410 7.681 0.729 17927 14395 1 18 . 1 1 59 59 TYR N N 59 113.713 113.713 116.334 -2.621 17927 14396 1 18 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.492 -0.180 17927 14397 1 18 . 1 1 59 59 TYR C C 59 175.025 175.025 174.706 0.319 17927 14398 1 18 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.736 2.236 17927 14399 1 18 . 1 1 59 59 TYR CB C 59 37.434 37.434 37.831 -0.397 17927 14400 1 18 . 1 1 59 59 TYR H H 59 8.102 8.102 7.815 0.287 17927 14401 1 18 . 1 1 60 60 ALA N N 60 126.637 126.637 122.825 3.812 17927 14402 1 18 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.360 0.058 17927 14403 1 18 . 1 1 60 60 ALA C C 60 179.208 179.208 178.023 1.185 17927 14404 1 18 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.436 1.098 17927 14405 1 18 . 1 1 60 60 ALA CB C 60 18.589 18.589 18.992 -0.403 17927 14406 1 18 . 1 1 60 60 ALA H H 60 7.201 7.201 7.566 -0.365 17927 14407 1 18 . 1 1 61 61 GLY N N 61 111.816 111.816 110.169 1.647 17927 14408 1 18 . 1 1 61 61 GLY C C 61 174.698 174.698 174.765 -0.067 17927 14409 1 18 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.554 0.350 17927 14410 1 18 . 1 1 61 61 GLY H H 61 9.184 9.184 8.776 0.408 17927 14411 1 18 . 1 1 62 62 LYS N N 62 118.497 118.497 120.286 -1.789 17927 14412 1 18 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.456 0.423 17927 14413 1 18 . 1 1 62 62 LYS C C 62 179.019 179.019 175.655 3.364 17927 14414 1 18 . 1 1 62 62 LYS CA C 62 53.988 53.988 54.720 -0.732 17927 14415 1 18 . 1 1 62 62 LYS CB C 62 33.840 33.840 33.347 0.493 17927 14416 1 18 . 1 1 62 62 LYS H H 62 8.019 8.019 7.598 0.421 17927 14417 1 18 . 1 1 63 63 ASP N N 63 122.982 122.982 120.828 2.154 17927 14418 1 18 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.817 -0.290 17927 14419 1 18 . 1 1 63 63 ASP C C 63 174.065 174.065 174.377 -0.312 17927 14420 1 18 . 1 1 63 63 ASP CA C 63 55.055 55.055 53.422 1.633 17927 14421 1 18 . 1 1 63 63 ASP CB C 63 38.582 38.582 40.364 -1.782 17927 14422 1 18 . 1 1 63 63 ASP H H 63 8.709 8.709 8.579 0.130 17927 14423 1 18 . 1 1 64 64 ILE N N 64 122.219 122.219 118.057 4.162 17927 14424 1 18 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.584 0.023 17927 14425 1 18 . 1 1 64 64 ILE C C 64 174.627 174.627 173.472 1.155 17927 14426 1 18 . 1 1 64 64 ILE CA C 64 59.712 59.712 59.615 0.097 17927 14427 1 18 . 1 1 64 64 ILE CB C 64 42.133 42.133 41.584 0.549 17927 14428 1 18 . 1 1 64 64 ILE H H 64 8.678 8.678 7.288 1.390 17927 14429 1 18 . 1 1 65 65 HIS N N 65 125.584 125.584 122.481 3.103 17927 14430 1 18 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.998 0.045 17927 14431 1 18 . 1 1 65 65 HIS C C 65 174.153 174.153 173.965 0.188 17927 14432 1 18 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.538 0.421 17927 14433 1 18 . 1 1 65 65 HIS CB C 65 34.156 34.156 32.042 2.114 17927 14434 1 18 . 1 1 65 65 HIS H H 65 9.204 9.204 8.417 0.787 17927 14435 1 18 . 1 1 66 66 PHE N N 66 123.244 123.244 125.155 -1.911 17927 14436 1 18 . 1 1 66 66 PHE HA H 66 5.210 5.210 5.196 0.014 17927 14437 1 18 . 1 1 66 66 PHE C C 66 175.463 175.463 175.319 0.144 17927 14438 1 18 . 1 1 66 66 PHE CA C 66 58.088 58.088 58.637 -0.549 17927 14439 1 18 . 1 1 66 66 PHE CB C 66 39.637 39.637 39.231 0.406 17927 14440 1 18 . 1 1 66 66 PHE H H 66 9.262 9.262 9.237 0.025 17927 14441 1 18 . 1 1 67 67 VAL N N 67 126.201 126.201 125.920 0.281 17927 14442 1 18 . 1 1 67 67 VAL HA H 67 4.834 4.834 4.939 -0.105 17927 14443 1 18 . 1 1 67 67 VAL C C 67 174.364 174.364 175.558 -1.194 17927 14444 1 18 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.778 -0.054 17927 14445 1 18 . 1 1 67 67 VAL CB C 67 34.893 34.893 34.114 0.779 17927 14446 1 18 . 1 1 67 67 VAL H H 67 8.843 8.843 9.203 -0.360 17927 14447 1 18 . 1 1 68 68 SER N N 68 124.528 124.528 123.485 1.043 17927 14448 1 18 . 1 1 68 68 SER HA H 68 5.585 5.585 5.474 0.111 17927 14449 1 18 . 1 1 68 68 SER C C 68 172.858 172.858 173.528 -0.670 17927 14450 1 18 . 1 1 68 68 SER CA C 68 57.282 57.282 57.519 -0.237 17927 14451 1 18 . 1 1 68 68 SER CB C 68 65.032 65.032 63.830 1.202 17927 14452 1 18 . 1 1 68 68 SER H H 68 9.243 9.243 8.831 0.412 17927 14453 1 18 . 1 1 69 69 LEU N N 69 126.695 126.695 124.530 2.165 17927 14454 1 18 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.457 -0.940 17927 14455 1 18 . 1 1 69 69 LEU C C 69 174.652 174.652 175.946 -1.294 17927 14456 1 18 . 1 1 69 69 LEU CA C 69 52.827 52.827 54.761 -1.934 17927 14457 1 18 . 1 1 69 69 LEU CB C 69 43.895 43.895 45.911 -2.016 17927 14458 1 18 . 1 1 69 69 LEU H H 69 9.360 9.360 9.284 0.076 17927 14459 1 18 . 1 1 70 70 SER N N 70 116.379 116.379 118.996 -2.617 17927 14460 1 18 . 1 1 70 70 SER HA H 70 4.905 4.905 5.076 -0.171 17927 14461 1 18 . 1 1 70 70 SER C C 70 176.307 176.307 175.067 1.240 17927 14462 1 18 . 1 1 70 70 SER CA C 70 55.213 55.213 55.636 -0.423 17927 14463 1 18 . 1 1 70 70 SER CB C 70 63.519 63.519 63.821 -0.302 17927 14464 1 18 . 1 1 70 70 SER H H 70 7.981 7.981 8.757 -0.776 17927 14465 1 18 . 1 1 71 71 CYS N N 71 124.670 124.670 127.501 -2.831 17927 14466 1 18 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.281 0.677 17927 14467 1 18 . 1 1 71 71 CYS C C 71 173.996 173.996 174.472 -0.476 17927 14468 1 18 . 1 1 71 71 CYS CA C 71 55.483 55.483 59.417 -3.934 17927 14469 1 18 . 1 1 71 71 CYS CB C 71 28.112 28.112 26.759 1.353 17927 14470 1 18 . 1 1 71 71 CYS H H 71 8.609 8.609 9.058 -0.449 17927 14471 1 18 . 1 1 72 72 ASP N N 72 122.398 122.398 121.196 1.202 17927 14472 1 18 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.752 -0.460 17927 14473 1 18 . 1 1 72 72 ASP C C 72 176.653 176.653 175.817 0.836 17927 14474 1 18 . 1 1 72 72 ASP CA C 72 56.782 56.782 54.924 1.858 17927 14475 1 18 . 1 1 72 72 ASP CB C 72 41.526 41.526 42.592 -1.066 17927 14476 1 18 . 1 1 72 72 ASP H H 72 8.557 8.557 7.352 1.205 17927 14477 1 18 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.377 -0.312 17927 14478 1 18 . 1 1 73 73 LYS C C 73 176.545 176.545 176.565 -0.020 17927 14479 1 18 . 1 1 73 73 LYS CA C 73 58.458 58.458 56.831 1.627 17927 14480 1 18 . 1 1 73 73 LYS CB C 73 32.641 32.641 33.620 -0.979 17927 14481 1 18 . 1 1 74 74 ASN N N 74 117.616 117.616 121.483 -3.867 17927 14482 1 18 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.935 -0.030 17927 14483 1 18 . 1 1 74 74 ASN C C 74 174.894 174.894 174.905 -0.011 17927 14484 1 18 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.469 -0.948 17927 14485 1 18 . 1 1 74 74 ASN CB C 74 38.109 38.109 37.889 0.220 17927 14486 1 18 . 1 1 74 74 ASN H H 74 8.625 8.625 8.554 0.071 17927 14487 1 18 . 1 1 75 75 LYS N N 75 126.797 126.797 122.955 3.842 17927 14488 1 18 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.784 -0.361 17927 14489 1 18 . 1 1 75 75 LYS C C 75 178.058 178.058 178.080 -0.022 17927 14490 1 18 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.669 -0.496 17927 14491 1 18 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.335 0.956 17927 14492 1 18 . 1 1 75 75 LYS H H 75 8.588 8.588 7.581 1.007 17927 14493 1 18 . 1 1 76 76 LYS N N 76 117.875 117.875 118.473 -0.598 17927 14494 1 18 . 1 1 76 76 LYS HA H 76 4.200 4.200 4.284 -0.084 17927 14495 1 18 . 1 1 76 76 LYS C C 76 178.791 178.791 178.667 0.124 17927 14496 1 18 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.144 -0.536 17927 14497 1 18 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.452 0.038 17927 14498 1 18 . 1 1 76 76 LYS H H 76 8.041 8.041 8.331 -0.290 17927 14499 1 18 . 1 1 77 77 ALA N N 77 121.567 121.567 121.621 -0.054 17927 14500 1 18 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.143 -0.020 17927 14501 1 18 . 1 1 77 77 ALA C C 77 181.191 181.191 179.491 1.700 17927 14502 1 18 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.882 0.075 17927 14503 1 18 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.092 -0.333 17927 14504 1 18 . 1 1 77 77 ALA H H 77 7.366 7.366 7.674 -0.308 17927 14505 1 18 . 1 1 78 78 TRP N N 78 119.497 119.497 120.176 -0.679 17927 14506 1 18 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.151 -0.074 17927 14507 1 18 . 1 1 78 78 TRP C C 78 175.942 175.942 177.710 -1.768 17927 14508 1 18 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.447 2.314 17927 14509 1 18 . 1 1 78 78 TRP CB C 78 27.272 27.272 29.818 -2.546 17927 14510 1 18 . 1 1 78 78 TRP H H 78 7.187 7.187 8.104 -0.917 17927 14511 1 18 . 1 1 79 79 GLU N N 79 118.771 118.771 118.748 0.023 17927 14512 1 18 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.573 -0.559 17927 14513 1 18 . 1 1 79 79 GLU C C 79 179.863 179.863 179.031 0.832 17927 14514 1 18 . 1 1 79 79 GLU CA C 79 59.110 59.110 60.223 -1.113 17927 14515 1 18 . 1 1 79 79 GLU CB C 79 30.220 30.220 29.188 1.032 17927 14516 1 18 . 1 1 79 79 GLU H H 79 8.813 8.813 8.439 0.374 17927 14517 1 18 . 1 1 80 80 ASN N N 80 115.964 115.964 117.632 -1.668 17927 14518 1 18 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.410 -0.071 17927 14519 1 18 . 1 1 80 80 ASN C C 80 176.749 176.749 177.533 -0.784 17927 14520 1 18 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.978 0.057 17927 14521 1 18 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.331 0.158 17927 14522 1 18 . 1 1 80 80 ASN H H 80 8.491 8.491 7.678 0.813 17927 14523 1 18 . 1 1 81 81 MET N N 81 119.670 119.670 120.692 -1.022 17927 14524 1 18 . 1 1 81 81 MET HA H 81 4.149 4.149 4.247 -0.098 17927 14525 1 18 . 1 1 81 81 MET C C 81 177.933 177.933 178.008 -0.075 17927 14526 1 18 . 1 1 81 81 MET CA C 81 60.276 60.276 59.049 1.227 17927 14527 1 18 . 1 1 81 81 MET CB C 81 32.518 32.518 32.977 -0.459 17927 14528 1 18 . 1 1 81 81 MET H H 81 7.667 7.667 7.760 -0.093 17927 14529 1 18 . 1 1 82 82 VAL N N 82 117.634 117.634 119.001 -1.367 17927 14530 1 18 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.534 -0.231 17927 14531 1 18 . 1 1 82 82 VAL C C 82 179.005 179.005 177.500 1.505 17927 14532 1 18 . 1 1 82 82 VAL CA C 82 67.037 67.037 65.979 1.058 17927 14533 1 18 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.089 0.676 17927 14534 1 18 . 1 1 82 82 VAL H H 82 8.338 8.338 7.755 0.583 17927 14535 1 18 . 1 1 83 83 THR N N 83 110.519 110.519 116.399 -5.880 17927 14536 1 18 . 1 1 83 83 THR HA H 83 3.983 3.983 3.989 -0.006 17927 14537 1 18 . 1 1 83 83 THR C C 83 177.591 177.591 176.586 1.005 17927 14538 1 18 . 1 1 83 83 THR CA C 83 65.431 65.431 66.772 -1.341 17927 14539 1 18 . 1 1 83 83 THR CB C 83 69.156 69.156 68.752 0.404 17927 14540 1 18 . 1 1 83 83 THR H H 83 7.659 7.659 7.795 -0.136 17927 14541 1 18 . 1 1 84 84 LYS N N 84 123.927 123.927 120.522 3.405 17927 14542 1 18 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.225 -0.156 17927 14543 1 18 . 1 1 84 84 LYS C C 84 178.582 178.582 177.949 0.633 17927 14544 1 18 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.108 1.768 17927 14545 1 18 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.422 -0.099 17927 14546 1 18 . 1 1 84 84 LYS H H 84 8.665 8.665 7.704 0.961 17927 14547 1 18 . 1 1 85 85 ASP N N 85 116.280 116.280 117.401 -1.121 17927 14548 1 18 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.663 0.087 17927 14549 1 18 . 1 1 85 85 ASP C C 85 175.086 175.086 175.583 -0.497 17927 14550 1 18 . 1 1 85 85 ASP CA C 85 54.693 54.693 54.575 0.118 17927 14551 1 18 . 1 1 85 85 ASP CB C 85 39.685 39.685 41.171 -1.486 17927 14552 1 18 . 1 1 85 85 ASP H H 85 8.179 8.179 8.214 -0.035 17927 14553 1 18 . 1 1 86 86 GLN N N 86 116.258 116.258 112.712 3.546 17927 14554 1 18 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.919 -0.011 17927 14555 1 18 . 1 1 86 86 GLN C C 86 175.659 175.659 175.780 -0.121 17927 14556 1 18 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.569 -0.398 17927 14557 1 18 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.105 0.185 17927 14558 1 18 . 1 1 86 86 GLN H H 86 7.431 7.431 7.550 -0.119 17927 14559 1 18 . 1 1 87 87 LEU N N 87 117.031 117.031 120.970 -3.939 17927 14560 1 18 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.089 0.001 17927 14561 1 18 . 1 1 87 87 LEU C C 87 178.225 178.225 176.045 2.180 17927 14562 1 18 . 1 1 87 87 LEU CA C 87 55.932 55.932 55.779 0.153 17927 14563 1 18 . 1 1 87 87 LEU CB C 87 41.202 41.202 40.631 0.571 17927 14564 1 18 . 1 1 87 87 LEU H H 87 7.736 7.736 7.607 0.129 17927 14565 1 18 . 1 1 88 88 LYS N N 88 122.367 122.367 122.134 0.233 17927 14566 1 18 . 1 1 88 88 LYS HA H 88 4.636 4.636 5.158 -0.522 17927 14567 1 18 . 1 1 88 88 LYS C C 88 177.538 177.538 176.730 0.808 17927 14568 1 18 . 1 1 88 88 LYS CA C 88 54.930 54.930 53.343 1.587 17927 14569 1 18 . 1 1 88 88 LYS CB C 88 33.316 33.316 35.169 -1.853 17927 14570 1 18 . 1 1 88 88 LYS H H 88 8.496 8.496 7.761 0.735 17927 14571 1 18 . 1 1 89 89 GLY N N 89 108.452 108.452 106.351 2.101 17927 14572 1 18 . 1 1 89 89 GLY C C 89 173.781 173.781 173.195 0.586 17927 14573 1 18 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.515 0.843 17927 14574 1 18 . 1 1 89 89 GLY H H 89 8.497 8.497 8.197 0.300 17927 14575 1 18 . 1 1 90 90 ILE N N 90 123.295 123.295 123.356 -0.061 17927 14576 1 18 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.357 0.014 17927 14577 1 18 . 1 1 90 90 ILE C C 90 175.606 175.606 174.278 1.328 17927 14578 1 18 . 1 1 90 90 ILE CA C 90 62.001 62.001 59.406 2.595 17927 14579 1 18 . 1 1 90 90 ILE CB C 90 38.036 38.036 37.153 0.883 17927 14580 1 18 . 1 1 90 90 ILE H H 90 8.728 8.728 7.997 0.731 17927 14581 1 18 . 1 1 91 91 GLN N N 91 128.632 128.632 125.675 2.957 17927 14582 1 18 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.772 -0.006 17927 14583 1 18 . 1 1 91 91 GLN C C 91 174.618 174.618 174.119 0.499 17927 14584 1 18 . 1 1 91 91 GLN CA C 91 54.850 54.850 54.071 0.779 17927 14585 1 18 . 1 1 91 91 GLN CB C 91 28.341 28.341 29.808 -1.467 17927 14586 1 18 . 1 1 91 91 GLN H H 91 8.762 8.762 9.345 -0.583 17927 14587 1 18 . 1 1 92 92 LEU N N 92 120.830 120.830 124.868 -4.038 17927 14588 1 18 . 1 1 92 92 LEU HA H 92 5.580 5.580 4.859 0.721 17927 14589 1 18 . 1 1 92 92 LEU C C 92 176.828 176.828 175.719 1.109 17927 14590 1 18 . 1 1 92 92 LEU CA C 92 52.801 52.801 54.362 -1.561 17927 14591 1 18 . 1 1 92 92 LEU CB C 92 44.210 44.210 43.911 0.299 17927 14592 1 18 . 1 1 92 92 LEU H H 92 9.011 9.011 9.147 -0.136 17927 14593 1 18 . 1 1 93 93 HIS N N 93 121.481 121.481 121.811 -0.330 17927 14594 1 18 . 1 1 93 93 HIS HA H 93 3.931 3.931 5.021 -1.090 17927 14595 1 18 . 1 1 93 93 HIS C C 93 173.590 173.590 173.671 -0.081 17927 14596 1 18 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.264 1.319 17927 14597 1 18 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.508 -1.258 17927 14598 1 18 . 1 1 93 93 HIS H H 93 8.038 8.038 8.987 -0.949 17927 14599 1 18 . 1 1 94 94 MET N N 94 121.881 121.881 125.593 -3.712 17927 14600 1 18 . 1 1 94 94 MET HA H 94 3.866 3.866 4.453 -0.587 17927 14601 1 18 . 1 1 94 94 MET C C 94 177.035 177.035 176.209 0.826 17927 14602 1 18 . 1 1 94 94 MET CA C 94 55.189 55.189 57.367 -2.178 17927 14603 1 18 . 1 1 94 94 MET CB C 94 33.993 33.993 33.996 -0.003 17927 14604 1 18 . 1 1 94 94 MET H H 94 8.039 8.039 8.607 -0.568 17927 14605 1 18 . 1 1 95 95 GLY N N 95 104.041 104.041 106.110 -2.069 17927 14606 1 18 . 1 1 95 95 GLY C C 95 174.251 174.251 174.358 -0.107 17927 14607 1 18 . 1 1 95 95 GLY CA C 95 46.580 46.580 44.665 1.915 17927 14608 1 18 . 1 1 95 95 GLY H H 95 5.666 5.666 7.848 -2.182 17927 14609 1 18 . 1 1 96 96 THR N N 96 114.114 114.114 109.502 4.612 17927 14610 1 18 . 1 1 96 96 THR HA H 96 4.211 4.211 3.766 0.445 17927 14611 1 18 . 1 1 96 96 THR C C 96 175.122 175.122 174.529 0.593 17927 14612 1 18 . 1 1 96 96 THR CA C 96 61.339 61.339 63.548 -2.209 17927 14613 1 18 . 1 1 96 96 THR CB C 96 68.615 68.615 68.042 0.573 17927 14614 1 18 . 1 1 96 96 THR H H 96 8.517 8.517 7.847 0.670 17927 14615 1 18 . 1 1 97 97 ASP N N 97 121.892 121.892 120.914 0.978 17927 14616 1 18 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.672 -0.087 17927 14617 1 18 . 1 1 97 97 ASP C C 97 178.241 178.241 176.346 1.895 17927 14618 1 18 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.368 1.432 17927 14619 1 18 . 1 1 97 97 ASP CB C 97 43.129 43.129 39.135 3.994 17927 14620 1 18 . 1 1 97 97 ASP H H 97 7.563 7.563 8.618 -1.055 17927 14621 1 18 . 1 1 98 98 ARG N N 98 127.508 127.508 118.322 9.186 17927 14622 1 18 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.417 -0.025 17927 14623 1 18 . 1 1 98 98 ARG C C 98 176.724 176.724 176.937 -0.213 17927 14624 1 18 . 1 1 98 98 ARG CA C 98 55.939 55.939 56.675 -0.736 17927 14625 1 18 . 1 1 98 98 ARG CB C 98 30.291 30.291 28.948 1.343 17927 14626 1 18 . 1 1 98 98 ARG H H 98 9.225 9.225 7.748 1.477 17927 14627 1 18 . 1 1 99 99 THR N N 99 116.384 116.384 116.980 -0.596 17927 14628 1 18 . 1 1 99 99 THR HA H 99 3.987 3.987 4.431 -0.444 17927 14629 1 18 . 1 1 99 99 THR C C 99 176.969 176.969 175.377 1.592 17927 14630 1 18 . 1 1 99 99 THR CA C 99 67.714 67.714 66.483 1.231 17927 14631 1 18 . 1 1 99 99 THR CB C 99 68.777 68.777 68.638 0.139 17927 14632 1 18 . 1 1 99 99 THR H H 99 8.382 8.382 7.877 0.505 17927 14633 1 18 . 1 1 100 100 PHE N N 100 123.232 123.232 121.617 1.615 17927 14634 1 18 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.286 -0.113 17927 14635 1 18 . 1 1 100 100 PHE C C 100 177.010 177.010 176.089 0.921 17927 14636 1 18 . 1 1 100 100 PHE CA C 100 61.923 61.923 59.430 2.493 17927 14637 1 18 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.272 1.490 17927 14638 1 18 . 1 1 100 100 PHE H H 100 7.998 7.998 7.790 0.208 17927 14639 1 18 . 1 1 101 101 MET N N 101 115.968 115.968 117.782 -1.814 17927 14640 1 18 . 1 1 101 101 MET HA H 101 3.975 3.975 4.165 -0.190 17927 14641 1 18 . 1 1 101 101 MET C C 101 178.763 178.763 178.042 0.721 17927 14642 1 18 . 1 1 101 101 MET CA C 101 58.552 58.552 57.632 0.920 17927 14643 1 18 . 1 1 101 101 MET CB C 101 32.593 32.593 32.199 0.394 17927 14644 1 18 . 1 1 101 101 MET H H 101 7.828 7.828 8.030 -0.202 17927 14645 1 18 . 1 1 102 102 ASP N N 102 117.553 117.553 120.162 -2.609 17927 14646 1 18 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.661 -0.139 17927 14647 1 18 . 1 1 102 102 ASP C C 102 179.503 179.503 178.089 1.414 17927 14648 1 18 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.101 -0.211 17927 14649 1 18 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.530 -0.604 17927 14650 1 18 . 1 1 102 102 ASP H H 102 8.828 8.828 7.856 0.972 17927 14651 1 18 . 1 1 103 103 ALA N N 103 122.984 122.984 122.305 0.679 17927 14652 1 18 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.093 -0.107 17927 14653 1 18 . 1 1 103 103 ALA C C 103 178.782 178.782 177.872 0.910 17927 14654 1 18 . 1 1 103 103 ALA CA C 103 55.094 55.094 53.987 1.107 17927 14655 1 18 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.076 0.487 17927 14656 1 18 . 1 1 103 103 ALA H H 103 7.567 7.567 7.204 0.363 17927 14657 1 18 . 1 1 104 104 TYR N N 104 112.159 112.159 116.879 -4.720 17927 14658 1 18 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.455 -0.231 17927 14659 1 18 . 1 1 104 104 TYR C C 104 173.821 173.821 175.394 -1.573 17927 14660 1 18 . 1 1 104 104 TYR CA C 104 58.498 58.498 57.396 1.102 17927 14661 1 18 . 1 1 104 104 TYR CB C 104 38.393 38.393 38.261 0.132 17927 14662 1 18 . 1 1 104 104 TYR H H 104 7.203 7.203 7.351 -0.148 17927 14663 1 18 . 1 1 105 105 LEU N N 105 119.433 119.433 113.473 5.960 17927 14664 1 18 . 1 1 105 105 LEU HA H 105 3.985 3.985 4.018 -0.033 17927 14665 1 18 . 1 1 105 105 LEU C C 105 176.721 176.721 175.881 0.840 17927 14666 1 18 . 1 1 105 105 LEU CA C 105 55.785 55.785 56.458 -0.673 17927 14667 1 18 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.089 -0.646 17927 14668 1 18 . 1 1 105 105 LEU H H 105 7.582 7.582 7.469 0.113 17927 14669 1 18 . 1 1 106 106 ILE N N 106 119.575 119.575 120.316 -0.741 17927 14670 1 18 . 1 1 106 106 ILE HA H 106 4.002 4.002 4.194 -0.192 17927 14671 1 18 . 1 1 106 106 ILE C C 106 175.459 175.459 175.124 0.335 17927 14672 1 18 . 1 1 106 106 ILE CA C 106 62.043 62.043 58.998 3.045 17927 14673 1 18 . 1 1 106 106 ILE CB C 106 36.335 36.335 36.420 -0.086 17927 14674 1 18 . 1 1 106 106 ILE H H 106 8.774 8.774 7.753 1.021 17927 14675 1 18 . 1 1 107 107 ASN N N 107 126.514 126.514 123.468 3.046 17927 14676 1 18 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.672 0.191 17927 14677 1 18 . 1 1 107 107 ASN C C 107 174.584 174.584 175.060 -0.476 17927 14678 1 18 . 1 1 107 107 ASN CA C 107 53.112 53.112 52.991 0.121 17927 14679 1 18 . 1 1 107 107 ASN CB C 107 38.977 38.977 38.993 -0.016 17927 14680 1 18 . 1 1 107 107 ASN H H 107 8.364 8.364 8.410 -0.046 17927 14681 1 18 . 1 1 108 108 GLY N N 108 108.469 108.469 106.778 1.691 17927 14682 1 18 . 1 1 108 108 GLY C C 108 171.245 171.245 172.957 -1.712 17927 14683 1 18 . 1 1 108 108 GLY CA C 108 45.269 45.269 43.930 1.339 17927 14684 1 18 . 1 1 108 108 GLY H H 108 7.678 7.678 7.540 0.138 17927 14685 1 18 . 1 1 109 109 ILE N N 109 112.817 112.817 124.072 -11.255 17927 14686 1 18 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.248 0.158 17927 14687 1 18 . 1 1 109 109 ILE C C 109 173.498 173.498 174.392 -0.894 17927 14688 1 18 . 1 1 109 109 ILE CA C 109 58.384 58.384 58.751 -0.367 17927 14689 1 18 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.363 1.959 17927 14690 1 18 . 1 1 109 109 ILE H H 109 7.868 7.868 8.300 -0.432 17927 14691 1 18 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.466 0.276 17927 14692 1 18 . 1 1 110 110 PRO C C 110 175.715 175.715 174.982 0.733 17927 14693 1 18 . 1 1 110 110 PRO CA C 110 62.277 62.277 61.715 0.562 17927 14694 1 18 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.460 3.908 17927 14695 1 18 . 1 1 111 111 ARG N N 111 122.358 122.358 120.980 1.378 17927 14696 1 18 . 1 1 111 111 ARG HA H 111 4.469 4.469 4.071 0.398 17927 14697 1 18 . 1 1 111 111 ARG C C 111 171.541 171.541 174.711 -3.170 17927 14698 1 18 . 1 1 111 111 ARG CA C 111 54.356 54.356 54.065 0.291 17927 14699 1 18 . 1 1 111 111 ARG CB C 111 33.430 33.430 31.851 1.579 17927 14700 1 18 . 1 1 111 111 ARG H H 111 7.732 7.732 8.214 -0.482 17927 14701 1 18 . 1 1 112 112 PHE N N 112 125.103 125.103 122.678 2.425 17927 14702 1 18 . 1 1 112 112 PHE HA H 112 5.773 5.773 4.888 0.885 17927 14703 1 18 . 1 1 112 112 PHE C C 112 175.097 175.097 175.347 -0.250 17927 14704 1 18 . 1 1 112 112 PHE CA C 112 55.791 55.791 56.554 -0.763 17927 14705 1 18 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.852 1.076 17927 14706 1 18 . 1 1 112 112 PHE H H 112 8.929 8.929 8.370 0.559 17927 14707 1 18 . 1 1 113 113 ILE N N 113 123.778 123.778 121.373 2.405 17927 14708 1 18 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.842 -0.299 17927 14709 1 18 . 1 1 113 113 ILE C C 113 173.197 173.197 174.184 -0.987 17927 14710 1 18 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.655 0.631 17927 14711 1 18 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.313 1.933 17927 14712 1 18 . 1 1 113 113 ILE H H 113 8.873 8.873 8.737 0.136 17927 14713 1 18 . 1 1 114 114 LEU N N 114 127.146 127.146 126.436 0.710 17927 14714 1 18 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.477 0.537 17927 14715 1 18 . 1 1 114 114 LEU C C 114 175.080 175.080 174.589 0.491 17927 14716 1 18 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.447 -0.046 17927 14717 1 18 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.384 0.986 17927 14718 1 18 . 1 1 114 114 LEU H H 114 8.974 8.974 8.820 0.154 17927 14719 1 18 . 1 1 115 115 LEU N N 115 128.323 128.323 125.273 3.050 17927 14720 1 18 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.217 0.215 17927 14721 1 18 . 1 1 115 115 LEU C C 115 176.660 176.660 175.859 0.801 17927 14722 1 18 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.578 -0.501 17927 14723 1 18 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.464 -1.880 17927 14724 1 18 . 1 1 115 115 LEU H H 115 9.874 9.874 9.321 0.553 17927 14725 1 18 . 1 1 116 116 ASP N N 116 119.834 119.834 122.021 -2.187 17927 14726 1 18 . 1 1 116 116 ASP HA H 116 4.935 4.935 5.161 -0.226 17927 14727 1 18 . 1 1 116 116 ASP C C 116 176.898 176.898 177.669 -0.771 17927 14728 1 18 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.192 -0.887 17927 14729 1 18 . 1 1 116 116 ASP CB C 116 41.028 41.028 41.844 -0.816 17927 14730 1 18 . 1 1 116 116 ASP H H 116 9.357 9.357 9.154 0.203 17927 14731 1 18 . 1 1 117 117 ARG N N 117 113.356 113.356 117.659 -4.303 17927 14732 1 18 . 1 1 117 117 ARG HA H 117 3.717 3.717 4.020 -0.303 17927 14733 1 18 . 1 1 117 117 ARG C C 117 177.105 177.105 177.675 -0.570 17927 14734 1 18 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.061 -0.876 17927 14735 1 18 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.872 0.565 17927 14736 1 18 . 1 1 117 117 ARG H H 117 7.697 7.697 8.434 -0.737 17927 14737 1 18 . 1 1 118 118 ASP N N 118 117.226 117.226 117.123 0.103 17927 14738 1 18 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.570 0.325 17927 14739 1 18 . 1 1 118 118 ASP C C 118 176.657 176.657 176.083 0.574 17927 14740 1 18 . 1 1 118 118 ASP CA C 118 53.517 53.517 53.978 -0.461 17927 14741 1 18 . 1 1 118 118 ASP CB C 118 42.556 42.556 41.240 1.316 17927 14742 1 18 . 1 1 118 118 ASP H H 118 8.456 8.456 8.393 0.063 17927 14743 1 18 . 1 1 119 119 GLY N N 119 109.074 109.074 107.475 1.599 17927 14744 1 18 . 1 1 119 119 GLY C C 119 173.355 173.355 174.083 -0.728 17927 14745 1 18 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.530 0.726 17927 14746 1 18 . 1 1 119 119 GLY H H 119 8.183 8.183 8.139 0.044 17927 14747 1 18 . 1 1 120 120 LYS N N 120 120.744 120.744 120.314 0.430 17927 14748 1 18 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.774 -0.241 17927 14749 1 18 . 1 1 120 120 LYS C C 120 177.229 177.229 176.585 0.644 17927 14750 1 18 . 1 1 120 120 LYS CA C 120 55.287 55.287 53.353 1.933 17927 14751 1 18 . 1 1 120 120 LYS CB C 120 32.581 32.581 33.333 -0.751 17927 14752 1 18 . 1 1 120 120 LYS H H 120 8.449 8.449 7.891 0.558 17927 14753 1 18 . 1 1 121 121 ILE N N 121 121.221 121.221 127.505 -6.284 17927 14754 1 18 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.983 -0.097 17927 14755 1 18 . 1 1 121 121 ILE C C 121 177.819 177.819 176.808 1.011 17927 14756 1 18 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.664 0.251 17927 14757 1 18 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.364 2.026 17927 14758 1 18 . 1 1 121 121 ILE H H 121 8.715 8.715 9.055 -0.340 17927 14759 1 18 . 1 1 122 122 ILE N N 122 127.165 127.165 128.122 -0.957 17927 14760 1 18 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.176 0.165 17927 14761 1 18 . 1 1 122 122 ILE C C 122 176.978 176.978 176.137 0.841 17927 14762 1 18 . 1 1 122 122 ILE CA C 122 63.719 63.719 62.529 1.190 17927 14763 1 18 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.849 -0.197 17927 14764 1 18 . 1 1 122 122 ILE H H 122 8.974 8.974 8.772 0.202 17927 14765 1 18 . 1 1 123 123 SER N N 123 111.227 111.227 114.924 -3.697 17927 14766 1 18 . 1 1 123 123 SER HA H 123 4.738 4.738 4.749 -0.011 17927 14767 1 18 . 1 1 123 123 SER C C 123 174.184 174.184 173.774 0.410 17927 14768 1 18 . 1 1 123 123 SER CA C 123 57.383 57.383 57.295 0.088 17927 14769 1 18 . 1 1 123 123 SER CB C 123 65.326 65.326 64.883 0.443 17927 14770 1 18 . 1 1 123 123 SER H H 123 7.850 7.850 8.250 -0.400 17927 14771 1 18 . 1 1 124 124 ALA N N 124 131.373 131.373 129.098 2.275 17927 14772 1 18 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.158 0.327 17927 14773 1 18 . 1 1 124 124 ALA C C 124 175.147 175.147 177.110 -1.963 17927 14774 1 18 . 1 1 124 124 ALA CA C 124 53.035 53.035 54.580 -1.545 17927 14775 1 18 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.184 -0.522 17927 14776 1 18 . 1 1 124 124 ALA H H 124 9.384 9.384 8.719 0.665 17927 14777 1 18 . 1 1 125 125 ASN N N 125 119.476 119.476 116.448 3.028 17927 14778 1 18 . 1 1 125 125 ASN HA H 125 5.056 5.056 4.826 0.230 17927 14779 1 18 . 1 1 125 125 ASN C C 125 173.593 173.593 174.113 -0.520 17927 14780 1 18 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.657 -0.305 17927 14781 1 18 . 1 1 125 125 ASN CB C 125 38.304 38.304 38.897 -0.593 17927 14782 1 18 . 1 1 125 125 ASN H H 125 8.191 8.191 7.923 0.268 17927 14783 1 18 . 1 1 126 126 MET N N 126 122.705 122.705 124.428 -1.723 17927 14784 1 18 . 1 1 126 126 MET HA H 126 4.585 4.585 4.921 -0.336 17927 14785 1 18 . 1 1 126 126 MET C C 126 175.215 175.215 174.803 0.412 17927 14786 1 18 . 1 1 126 126 MET CA C 126 53.849 53.849 52.925 0.924 17927 14787 1 18 . 1 1 126 126 MET CB C 126 31.312 31.312 36.255 -4.943 17927 14788 1 18 . 1 1 126 126 MET H H 126 8.376 8.376 9.003 -0.627 17927 14789 1 18 . 1 1 127 127 THR N N 127 111.016 111.016 112.723 -1.707 17927 14790 1 18 . 1 1 127 127 THR HA H 127 4.291 4.291 4.581 -0.290 17927 14791 1 18 . 1 1 127 127 THR C C 127 174.574 174.574 173.622 0.952 17927 14792 1 18 . 1 1 127 127 THR CA C 127 62.085 62.085 60.356 1.729 17927 14793 1 18 . 1 1 127 127 THR CB C 127 69.733 69.733 69.701 0.032 17927 14794 1 18 . 1 1 127 127 THR H H 127 7.714 7.714 8.435 -0.721 17927 14795 1 18 . 1 1 128 128 ARG N N 128 118.722 118.722 122.657 -3.935 17927 14796 1 18 . 1 1 128 128 ARG HA H 128 3.308 3.308 2.951 0.357 17927 14797 1 18 . 1 1 128 128 ARG C C 128 176.978 176.978 176.064 0.914 17927 14798 1 18 . 1 1 128 128 ARG CA C 128 54.727 54.727 55.471 -0.744 17927 14799 1 18 . 1 1 128 128 ARG CB C 128 29.598 29.598 28.016 1.582 17927 14800 1 18 . 1 1 128 128 ARG H H 128 8.658 8.658 8.026 0.632 17927 14801 1 18 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.266 -0.333 17927 14802 1 18 . 1 1 129 129 PRO C C 129 175.794 175.794 177.422 -1.628 17927 14803 1 18 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.192 1.357 17927 14804 1 18 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.690 -0.013 17927 14805 1 18 . 1 1 130 130 SER N N 130 108.696 108.696 112.699 -4.003 17927 14806 1 18 . 1 1 130 130 SER HA H 130 3.988 3.988 4.385 -0.397 17927 14807 1 18 . 1 1 130 130 SER C C 130 174.445 174.445 173.997 0.448 17927 14808 1 18 . 1 1 130 130 SER CA C 130 58.911 58.911 58.353 0.558 17927 14809 1 18 . 1 1 130 130 SER CB C 130 62.680 62.680 63.419 -0.739 17927 14810 1 18 . 1 1 130 130 SER H H 130 8.375 8.375 7.952 0.423 17927 14811 1 18 . 1 1 131 131 ASP N N 131 126.377 126.377 122.456 3.921 17927 14812 1 18 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.862 0.010 17927 14813 1 18 . 1 1 131 131 ASP C C 131 176.879 176.879 175.555 1.324 17927 14814 1 18 . 1 1 131 131 ASP CA C 131 51.195 51.195 51.504 -0.309 17927 14815 1 18 . 1 1 131 131 ASP CB C 131 42.816 42.816 43.069 -0.253 17927 14816 1 18 . 1 1 131 131 ASP H H 131 7.514 7.514 7.506 0.008 17927 14817 1 18 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.325 0.067 17927 14818 1 18 . 1 1 132 132 PRO C C 132 178.097 178.097 178.245 -0.148 17927 14819 1 18 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.702 0.377 17927 14820 1 18 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.265 0.144 17927 14821 1 18 . 1 1 133 133 LYS N N 133 116.306 116.306 118.534 -2.228 17927 14822 1 18 . 1 1 133 133 LYS HA H 133 3.958 3.958 4.137 -0.179 17927 14823 1 18 . 1 1 133 133 LYS C C 133 179.532 179.532 178.722 0.810 17927 14824 1 18 . 1 1 133 133 LYS CA C 133 58.521 58.521 58.382 0.139 17927 14825 1 18 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.501 0.690 17927 14826 1 18 . 1 1 133 133 LYS H H 133 8.842 8.842 8.470 0.372 17927 14827 1 18 . 1 1 134 134 THR N N 134 120.833 120.833 116.710 4.123 17927 14828 1 18 . 1 1 134 134 THR HA H 134 3.147 3.147 3.607 -0.460 17927 14829 1 18 . 1 1 134 134 THR C C 134 173.356 173.356 175.420 -2.064 17927 14830 1 18 . 1 1 134 134 THR CA C 134 66.383 66.383 66.328 0.055 17927 14831 1 18 . 1 1 134 134 THR CB C 134 66.847 66.847 68.071 -1.224 17927 14832 1 18 . 1 1 134 134 THR H H 134 8.292 8.292 7.497 0.795 17927 14833 1 18 . 1 1 135 135 ALA N N 135 121.720 121.720 122.842 -1.122 17927 14834 1 18 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.857 -0.274 17927 14835 1 18 . 1 1 135 135 ALA C C 135 178.902 178.902 179.299 -0.397 17927 14836 1 18 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.927 0.072 17927 14837 1 18 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.065 -0.290 17927 14838 1 18 . 1 1 135 135 ALA H H 135 7.030 7.030 7.340 -0.310 17927 14839 1 18 . 1 1 136 136 GLU N N 136 114.623 114.623 118.304 -3.681 17927 14840 1 18 . 1 1 136 136 GLU HA H 136 3.922 3.922 3.867 0.055 17927 14841 1 18 . 1 1 136 136 GLU C C 136 179.199 179.199 179.297 -0.098 17927 14842 1 18 . 1 1 136 136 GLU CA C 136 59.837 59.837 59.524 0.313 17927 14843 1 18 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.351 0.435 17927 14844 1 18 . 1 1 136 136 GLU H H 136 7.216 7.216 7.732 -0.516 17927 14845 1 18 . 1 1 137 137 LYS N N 137 120.789 120.789 118.726 2.063 17927 14846 1 18 . 1 1 137 137 LYS HA H 137 4.204 4.204 3.908 0.296 17927 14847 1 18 . 1 1 137 137 LYS C C 137 178.834 178.834 179.098 -0.264 17927 14848 1 18 . 1 1 137 137 LYS CA C 137 57.343 57.343 59.327 -1.984 17927 14849 1 18 . 1 1 137 137 LYS CB C 137 30.463 30.463 32.062 -1.599 17927 14850 1 18 . 1 1 137 137 LYS H H 137 7.681 7.681 7.753 -0.072 17927 14851 1 18 . 1 1 138 138 PHE N N 138 118.373 118.373 118.294 0.079 17927 14852 1 18 . 1 1 138 138 PHE HA H 138 4.033 4.033 3.962 0.071 17927 14853 1 18 . 1 1 138 138 PHE C C 138 178.027 178.027 177.622 0.405 17927 14854 1 18 . 1 1 138 138 PHE CA C 138 57.507 57.507 60.206 -2.700 17927 14855 1 18 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.699 -1.810 17927 14856 1 18 . 1 1 138 138 PHE H H 138 8.059 8.059 7.271 0.788 17927 14857 1 18 . 1 1 139 139 ASN N N 139 117.611 117.611 116.377 1.234 17927 14858 1 18 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.481 -0.077 17927 14859 1 18 . 1 1 139 139 ASN C C 139 178.190 178.190 177.628 0.562 17927 14860 1 18 . 1 1 139 139 ASN CA C 139 56.224 56.224 55.828 0.396 17927 14861 1 18 . 1 1 139 139 ASN CB C 139 36.734 36.734 38.336 -1.602 17927 14862 1 18 . 1 1 139 139 ASN H H 139 8.683 8.683 8.454 0.229 17927 14863 1 18 . 1 1 140 140 GLU N N 140 121.432 121.432 122.368 -0.936 17927 14864 1 18 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.289 -0.284 17927 14865 1 18 . 1 1 140 140 GLU C C 140 179.751 179.751 178.845 0.906 17927 14866 1 18 . 1 1 140 140 GLU CA C 140 59.310 59.310 58.848 0.462 17927 14867 1 18 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.918 0.137 17927 14868 1 18 . 1 1 140 140 GLU H H 140 7.868 7.868 8.253 -0.385 17927 14869 1 18 . 1 1 141 141 LEU N N 141 119.968 119.968 119.115 0.853 17927 14870 1 18 . 1 1 141 141 LEU HA H 141 4.016 4.016 3.984 0.032 17927 14871 1 18 . 1 1 141 141 LEU C C 141 179.293 179.293 179.163 0.130 17927 14872 1 18 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.039 0.397 17927 14873 1 18 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.828 -0.645 17927 14874 1 18 . 1 1 141 141 LEU H H 141 8.303 8.303 7.827 0.476 17927 14875 1 18 . 1 1 142 142 LEU N N 142 115.040 115.040 114.989 0.051 17927 14876 1 18 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.233 0.151 17927 14877 1 18 . 1 1 142 142 LEU C C 142 178.002 178.002 177.477 0.525 17927 14878 1 18 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.235 0.044 17927 14879 1 18 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.346 0.300 17927 14880 1 18 . 1 1 142 142 LEU H H 142 8.230 8.230 7.788 0.442 17927 14881 1 18 . 1 1 143 143 GLY N N 143 108.977 108.977 106.865 2.112 17927 14882 1 18 . 1 1 143 143 GLY C C 143 175.216 175.216 174.937 0.279 17927 14883 1 18 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.605 1.137 17927 14884 1 18 . 1 1 143 143 GLY H H 143 7.762 7.762 7.431 0.331 17927 14885 1 18 . 1 1 144 144 LEU N N 144 119.660 119.660 120.220 -0.560 17927 14886 1 18 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.009 0.479 17927 14887 1 18 . 1 1 144 144 LEU C C 144 177.375 177.375 176.077 1.298 17927 14888 1 18 . 1 1 144 144 LEU CA C 144 54.525 54.525 54.235 0.290 17927 14889 1 18 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.300 0.473 17927 14890 1 18 . 1 1 144 144 LEU H H 144 8.241 8.241 8.104 0.137 17927 14891 1 18 . 1 1 145 145 GLU N N 145 119.959 119.959 118.923 1.036 17927 14892 1 18 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.374 -0.133 17927 14893 1 18 . 1 1 145 145 GLU C C 145 177.075 177.075 177.573 -0.498 17927 14894 1 18 . 1 1 145 145 GLU CA C 145 56.799 56.799 56.652 0.147 17927 14895 1 18 . 1 1 145 145 GLU CB C 145 30.168 30.168 30.974 -0.807 17927 14896 1 18 . 1 1 145 145 GLU H H 145 8.410 8.410 7.446 0.964 17927 14897 1 18 . 1 1 146 146 GLY N N 146 109.412 109.412 108.062 1.350 17927 14898 1 18 . 1 1 146 146 GLY C C 146 174.276 174.276 173.969 0.307 17927 14899 1 18 . 1 1 146 146 GLY CA C 146 45.445 45.445 45.126 0.319 17927 14900 1 18 . 1 1 146 146 GLY H H 146 8.422 8.422 8.774 -0.352 17927 14901 1 18 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.459 0.197 17927 14902 1 18 . 1 1 151 151 HIS C C 151 173.990 173.990 174.737 -0.747 17927 14903 1 18 . 1 1 151 151 HIS CA C 151 56.044 56.044 57.149 -1.105 17927 14904 1 18 . 1 1 151 151 HIS CB C 151 30.076 30.076 30.195 -0.118 17927 14905 1 19 . 1 1 2 2 SER HA H 2 4.121 4.121 4.528 -0.407 17927 14906 1 19 . 1 1 2 2 SER CA C 2 57.293 57.293 58.079 -0.786 17927 14907 1 19 . 1 1 2 2 SER CB C 2 63.545 63.545 63.533 0.012 17927 14908 1 19 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.443 -0.011 17927 14909 1 19 . 1 1 3 3 LEU C C 3 177.383 177.383 176.487 0.896 17927 14910 1 19 . 1 1 3 3 LEU CA C 3 55.575 55.575 55.335 0.240 17927 14911 1 19 . 1 1 3 3 LEU CB C 3 42.584 42.584 40.014 2.570 17927 14912 1 19 . 1 1 4 4 ARG N N 4 122.080 122.080 121.642 0.438 17927 14913 1 19 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.477 -0.093 17927 14914 1 19 . 1 1 4 4 ARG C C 4 176.410 176.410 176.053 0.357 17927 14915 1 19 . 1 1 4 4 ARG CA C 4 56.269 56.269 56.064 0.205 17927 14916 1 19 . 1 1 4 4 ARG CB C 4 30.842 30.842 31.367 -0.525 17927 14917 1 19 . 1 1 4 4 ARG H H 4 8.410 8.410 8.237 0.173 17927 14918 1 19 . 1 1 5 5 SER N N 5 117.023 117.023 114.423 2.600 17927 14919 1 19 . 1 1 5 5 SER HA H 5 4.423 4.423 4.666 -0.243 17927 14920 1 19 . 1 1 5 5 SER C C 5 175.039 175.039 175.278 -0.239 17927 14921 1 19 . 1 1 5 5 SER CA C 5 58.605 58.605 57.256 1.349 17927 14922 1 19 . 1 1 5 5 SER CB C 5 64.044 64.044 64.896 -0.852 17927 14923 1 19 . 1 1 5 5 SER H H 5 8.292 8.292 7.507 0.785 17927 14924 1 19 . 1 1 6 6 GLY N N 6 110.718 110.718 111.903 -1.185 17927 14925 1 19 . 1 1 6 6 GLY C C 6 173.654 173.654 174.650 -0.996 17927 14926 1 19 . 1 1 6 6 GLY CA C 6 45.273 45.273 45.750 -0.477 17927 14927 1 19 . 1 1 6 6 GLY H H 6 8.446 8.446 8.629 -0.183 17927 14928 1 19 . 1 1 7 7 ASN N N 7 119.287 119.287 117.867 1.420 17927 14929 1 19 . 1 1 7 7 ASN HA H 7 5.024 5.024 5.114 -0.090 17927 14930 1 19 . 1 1 7 7 ASN C C 7 173.672 173.672 173.365 0.307 17927 14931 1 19 . 1 1 7 7 ASN CA C 7 51.357 51.357 50.877 0.480 17927 14932 1 19 . 1 1 7 7 ASN CB C 7 38.927 38.927 40.044 -1.117 17927 14933 1 19 . 1 1 7 7 ASN H H 7 8.273 8.273 8.323 -0.050 17927 14934 1 19 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.466 -0.019 17927 14935 1 19 . 1 1 8 8 PRO C C 8 176.899 176.899 176.344 0.555 17927 14936 1 19 . 1 1 8 8 PRO CA C 8 63.429 63.429 63.371 0.058 17927 14937 1 19 . 1 1 8 8 PRO CB C 8 32.216 32.216 31.164 1.052 17927 14938 1 19 . 1 1 9 9 SER N N 9 115.642 115.642 121.424 -5.782 17927 14939 1 19 . 1 1 9 9 SER HA H 9 4.415 4.415 4.545 -0.130 17927 14940 1 19 . 1 1 9 9 SER C C 9 174.714 174.714 175.776 -1.062 17927 14941 1 19 . 1 1 9 9 SER CA C 9 58.488 58.488 58.880 -0.392 17927 14942 1 19 . 1 1 9 9 SER CB C 9 64.048 64.048 63.734 0.314 17927 14943 1 19 . 1 1 9 9 SER H H 9 8.336 8.336 8.076 0.260 17927 14944 1 19 . 1 1 10 10 ALA N N 10 126.808 126.808 128.831 -2.023 17927 14945 1 19 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.800 -0.538 17927 14946 1 19 . 1 1 10 10 ALA C C 10 177.233 177.233 177.811 -0.578 17927 14947 1 19 . 1 1 10 10 ALA CA C 10 53.230 53.230 54.520 -1.290 17927 14948 1 19 . 1 1 10 10 ALA CB C 10 19.187 19.187 17.615 1.572 17927 14949 1 19 . 1 1 10 10 ALA H H 10 8.137 8.137 9.196 -1.059 17927 14950 1 19 . 1 1 11 11 ALA N N 11 120.449 120.449 120.093 0.356 17927 14951 1 19 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.558 -0.297 17927 14952 1 19 . 1 1 11 11 ALA C C 11 177.469 177.469 176.587 0.882 17927 14953 1 19 . 1 1 11 11 ALA CA C 11 52.475 52.475 52.759 -0.284 17927 14954 1 19 . 1 1 11 11 ALA CB C 11 19.485 19.485 20.038 -0.553 17927 14955 1 19 . 1 1 11 11 ALA H H 11 7.851 7.851 7.998 -0.147 17927 14956 1 19 . 1 1 12 12 SER N N 12 114.186 114.186 112.346 1.840 17927 14957 1 19 . 1 1 12 12 SER HA H 12 4.312 4.312 4.469 -0.157 17927 14958 1 19 . 1 1 12 12 SER C C 12 173.593 173.593 173.040 0.553 17927 14959 1 19 . 1 1 12 12 SER CA C 12 58.099 58.099 57.168 0.931 17927 14960 1 19 . 1 1 12 12 SER CB C 12 63.320 63.320 62.894 0.426 17927 14961 1 19 . 1 1 12 12 SER H H 12 7.990 7.990 7.609 0.381 17927 14962 1 19 . 1 1 13 13 PHE N N 13 118.092 118.092 120.784 -2.692 17927 14963 1 19 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.743 0.037 17927 14964 1 19 . 1 1 13 13 PHE C C 13 174.220 174.220 173.813 0.407 17927 14965 1 19 . 1 1 13 13 PHE CA C 13 56.717 56.717 55.592 1.125 17927 14966 1 19 . 1 1 13 13 PHE CB C 13 41.151 41.151 40.593 0.558 17927 14967 1 19 . 1 1 13 13 PHE H H 13 7.147 7.147 7.581 -0.434 17927 14968 1 19 . 1 1 14 14 SER N N 14 116.456 116.456 115.040 1.416 17927 14969 1 19 . 1 1 14 14 SER HA H 14 5.162 5.162 4.939 0.223 17927 14970 1 19 . 1 1 14 14 SER C C 14 172.626 172.626 172.738 -0.112 17927 14971 1 19 . 1 1 14 14 SER CA C 14 57.390 57.390 56.831 0.559 17927 14972 1 19 . 1 1 14 14 SER CB C 14 64.518 64.518 64.214 0.304 17927 14973 1 19 . 1 1 14 14 SER H H 14 7.616 7.616 8.079 -0.463 17927 14974 1 19 . 1 1 15 15 TYR N N 15 122.384 122.384 122.492 -0.108 17927 14975 1 19 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.981 0.225 17927 14976 1 19 . 1 1 15 15 TYR C C 15 172.543 172.543 173.333 -0.790 17927 14977 1 19 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.181 -0.235 17927 14978 1 19 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.334 0.893 17927 14979 1 19 . 1 1 15 15 TYR H H 15 8.558 8.558 9.143 -0.585 17927 14980 1 19 . 1 1 16 16 PRO HA H 16 5.109 5.109 5.072 0.037 17927 14981 1 19 . 1 1 16 16 PRO C C 16 176.475 176.475 176.244 0.231 17927 14982 1 19 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.212 -0.231 17927 14983 1 19 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.572 0.090 17927 14984 1 19 . 1 1 17 17 ASP N N 17 119.834 119.834 123.761 -3.927 17927 14985 1 19 . 1 1 17 17 ASP HA H 17 5.739 5.739 5.163 0.576 17927 14986 1 19 . 1 1 17 17 ASP C C 17 180.740 180.740 178.499 2.241 17927 14987 1 19 . 1 1 17 17 ASP CA C 17 51.717 51.717 52.478 -0.761 17927 14988 1 19 . 1 1 17 17 ASP CB C 17 42.561 42.561 44.001 -1.440 17927 14989 1 19 . 1 1 17 17 ASP H H 17 8.643 8.643 8.827 -0.184 17927 14990 1 19 . 1 1 18 18 ILE N N 18 118.340 118.340 122.667 -4.327 17927 14991 1 19 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.807 0.644 17927 14992 1 19 . 1 1 18 18 ILE C C 18 175.742 175.742 176.236 -0.494 17927 14993 1 19 . 1 1 18 18 ILE CA C 18 61.894 61.894 64.264 -2.370 17927 14994 1 19 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.232 1.008 17927 14995 1 19 . 1 1 18 18 ILE H H 18 8.450 8.450 8.290 0.160 17927 14996 1 19 . 1 1 19 19 ASN N N 19 119.377 119.377 116.913 2.464 17927 14997 1 19 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.612 0.403 17927 14998 1 19 . 1 1 19 19 ASN C C 19 175.892 175.892 176.039 -0.147 17927 14999 1 19 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.432 -1.125 17927 15000 1 19 . 1 1 19 19 ASN CB C 19 39.825 39.825 39.477 0.348 17927 15001 1 19 . 1 1 19 19 ASN H H 19 8.376 8.376 8.668 -0.292 17927 15002 1 19 . 1 1 20 20 GLY N N 20 109.535 109.535 107.851 1.684 17927 15003 1 19 . 1 1 20 20 GLY C C 20 174.285 174.285 173.211 1.074 17927 15004 1 19 . 1 1 20 20 GLY CA C 20 45.793 45.793 44.983 0.811 17927 15005 1 19 . 1 1 20 20 GLY H H 20 8.539 8.539 8.499 0.040 17927 15006 1 19 . 1 1 21 21 LYS N N 21 124.675 124.675 120.785 3.890 17927 15007 1 19 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.628 -0.185 17927 15008 1 19 . 1 1 21 21 LYS C C 21 176.537 176.537 176.015 0.522 17927 15009 1 19 . 1 1 21 21 LYS CA C 21 55.444 55.444 53.491 1.953 17927 15010 1 19 . 1 1 21 21 LYS CB C 21 32.754 32.754 33.915 -1.161 17927 15011 1 19 . 1 1 21 21 LYS H H 21 8.608 8.608 7.500 1.108 17927 15012 1 19 . 1 1 22 22 THR N N 22 120.666 120.666 124.338 -3.672 17927 15013 1 19 . 1 1 22 22 THR HA H 22 4.087 4.087 4.490 -0.404 17927 15014 1 19 . 1 1 22 22 THR C C 22 174.431 174.431 173.752 0.679 17927 15015 1 19 . 1 1 22 22 THR CA C 22 64.292 64.292 63.171 1.121 17927 15016 1 19 . 1 1 22 22 THR CB C 22 69.069 69.069 68.044 1.024 17927 15017 1 19 . 1 1 22 22 THR H H 22 8.595 8.595 8.720 -0.125 17927 15018 1 19 . 1 1 23 23 VAL N N 23 131.207 131.207 129.170 2.037 17927 15019 1 19 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.438 -0.246 17927 15020 1 19 . 1 1 23 23 VAL C C 23 174.244 174.244 174.881 -0.637 17927 15021 1 19 . 1 1 23 23 VAL CA C 23 62.456 62.456 60.382 2.074 17927 15022 1 19 . 1 1 23 23 VAL CB C 23 33.791 33.791 33.320 0.471 17927 15023 1 19 . 1 1 23 23 VAL H H 23 8.937 8.937 8.888 0.049 17927 15024 1 19 . 1 1 24 24 SER N N 24 120.787 120.787 120.552 0.235 17927 15025 1 19 . 1 1 24 24 SER HA H 24 5.407 5.407 5.151 0.256 17927 15026 1 19 . 1 1 24 24 SER C C 24 176.169 176.169 175.360 0.809 17927 15027 1 19 . 1 1 24 24 SER CA C 24 55.135 55.135 56.203 -1.068 17927 15028 1 19 . 1 1 24 24 SER CB C 24 65.646 65.646 65.665 -0.019 17927 15029 1 19 . 1 1 24 24 SER H H 24 8.554 8.554 8.514 0.040 17927 15030 1 19 . 1 1 25 25 LEU N N 25 124.332 124.332 124.044 0.288 17927 15031 1 19 . 1 1 25 25 LEU HA H 25 3.687 3.687 3.844 -0.157 17927 15032 1 19 . 1 1 25 25 LEU C C 25 179.364 179.364 176.147 3.217 17927 15033 1 19 . 1 1 25 25 LEU CA C 25 58.217 58.217 56.049 2.168 17927 15034 1 19 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.862 -1.324 17927 15035 1 19 . 1 1 25 25 LEU H H 25 7.811 7.811 8.145 -0.334 17927 15036 1 19 . 1 1 26 26 ALA N N 26 119.799 119.799 116.009 3.790 17927 15037 1 19 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.113 -0.120 17927 15038 1 19 . 1 1 26 26 ALA C C 26 179.719 179.719 177.333 2.386 17927 15039 1 19 . 1 1 26 26 ALA CA C 26 54.663 54.663 52.648 2.015 17927 15040 1 19 . 1 1 26 26 ALA CB C 26 18.323 18.323 18.711 -0.388 17927 15041 1 19 . 1 1 26 26 ALA H H 26 8.099 8.099 7.835 0.264 17927 15042 1 19 . 1 1 27 27 ASP N N 27 116.553 116.553 119.786 -3.233 17927 15043 1 19 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.543 -0.070 17927 15044 1 19 . 1 1 27 27 ASP C C 27 176.915 176.915 177.135 -0.220 17927 15045 1 19 . 1 1 27 27 ASP CA C 27 56.251 56.251 55.355 0.896 17927 15046 1 19 . 1 1 27 27 ASP CB C 27 40.788 40.788 41.799 -1.011 17927 15047 1 19 . 1 1 27 27 ASP H H 27 7.572 7.572 7.750 -0.178 17927 15048 1 19 . 1 1 28 28 LEU N N 28 118.950 118.950 118.525 0.425 17927 15049 1 19 . 1 1 28 28 LEU HA H 28 4.233 4.233 4.273 -0.040 17927 15050 1 19 . 1 1 28 28 LEU C C 28 175.542 175.542 175.691 -0.149 17927 15051 1 19 . 1 1 28 28 LEU CA C 28 53.706 53.706 54.013 -0.307 17927 15052 1 19 . 1 1 28 28 LEU CB C 28 41.049 41.049 42.193 -1.144 17927 15053 1 19 . 1 1 28 28 LEU H H 28 7.363 7.363 7.306 0.057 17927 15054 1 19 . 1 1 29 29 LYS N N 29 118.429 118.429 119.885 -1.456 17927 15055 1 19 . 1 1 29 29 LYS HA H 29 4.352 4.352 3.992 0.360 17927 15056 1 19 . 1 1 29 29 LYS C C 29 178.063 178.063 177.704 0.359 17927 15057 1 19 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.928 -0.151 17927 15058 1 19 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.687 0.753 17927 15059 1 19 . 1 1 29 29 LYS H H 29 6.780 6.780 7.470 -0.690 17927 15060 1 19 . 1 1 30 30 GLY N N 30 112.426 112.426 114.682 -2.256 17927 15061 1 19 . 1 1 30 30 GLY C C 30 173.801 173.801 173.741 0.060 17927 15062 1 19 . 1 1 30 30 GLY CA C 30 44.611 44.611 44.756 -0.145 17927 15063 1 19 . 1 1 30 30 GLY H H 30 9.398 9.398 9.055 0.343 17927 15064 1 19 . 1 1 31 31 LYS N N 31 119.295 119.295 119.539 -0.244 17927 15065 1 19 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.534 -0.382 17927 15066 1 19 . 1 1 31 31 LYS C C 31 173.862 173.862 176.214 -2.352 17927 15067 1 19 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.441 0.747 17927 15068 1 19 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.427 1.541 17927 15069 1 19 . 1 1 31 31 LYS H H 31 7.496 7.496 7.329 0.167 17927 15070 1 19 . 1 1 32 32 TYR N N 32 116.984 116.984 120.383 -3.399 17927 15071 1 19 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.433 -0.276 17927 15072 1 19 . 1 1 32 32 TYR C C 32 175.226 175.226 175.464 -0.238 17927 15073 1 19 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.059 0.531 17927 15074 1 19 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.185 -0.064 17927 15075 1 19 . 1 1 32 32 TYR H H 32 7.521 7.521 8.476 -0.955 17927 15076 1 19 . 1 1 33 33 ILE N N 33 118.052 118.052 120.695 -2.643 17927 15077 1 19 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.640 0.267 17927 15078 1 19 . 1 1 33 33 ILE C C 33 174.308 174.308 174.587 -0.279 17927 15079 1 19 . 1 1 33 33 ILE CA C 33 60.702 60.702 58.693 2.009 17927 15080 1 19 . 1 1 33 33 ILE CB C 33 41.616 41.616 39.642 1.974 17927 15081 1 19 . 1 1 33 33 ILE H H 33 8.467 8.467 8.786 -0.319 17927 15082 1 19 . 1 1 34 34 TYR N N 34 130.242 130.242 129.504 0.738 17927 15083 1 19 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.145 0.381 17927 15084 1 19 . 1 1 34 34 TYR C C 34 174.245 174.245 173.498 0.747 17927 15085 1 19 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.944 0.214 17927 15086 1 19 . 1 1 34 34 TYR CB C 34 40.133 40.133 40.853 -0.720 17927 15087 1 19 . 1 1 34 34 TYR H H 34 8.905 8.905 9.126 -0.221 17927 15088 1 19 . 1 1 35 35 ILE N N 35 128.697 128.697 129.341 -0.644 17927 15089 1 19 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.336 0.006 17927 15090 1 19 . 1 1 35 35 ILE C C 35 174.520 174.520 173.966 0.554 17927 15091 1 19 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.652 0.097 17927 15092 1 19 . 1 1 35 35 ILE CB C 35 40.899 40.899 40.347 0.552 17927 15093 1 19 . 1 1 35 35 ILE H H 35 9.445 9.445 8.593 0.852 17927 15094 1 19 . 1 1 36 36 ASP N N 36 123.675 123.675 126.520 -2.845 17927 15095 1 19 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.496 -0.648 17927 15096 1 19 . 1 1 36 36 ASP C C 36 174.385 174.385 175.279 -0.894 17927 15097 1 19 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.958 -0.664 17927 15098 1 19 . 1 1 36 36 ASP CB C 36 41.778 41.778 45.690 -3.912 17927 15099 1 19 . 1 1 36 36 ASP H H 36 8.875 8.875 8.344 0.531 17927 15100 1 19 . 1 1 37 37 VAL N N 37 127.159 127.159 124.491 2.668 17927 15101 1 19 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.959 -0.000 17927 15102 1 19 . 1 1 37 37 VAL C C 37 175.046 175.046 175.970 -0.924 17927 15103 1 19 . 1 1 37 37 VAL CA C 37 62.245 62.245 61.343 0.902 17927 15104 1 19 . 1 1 37 37 VAL CB C 37 31.807 31.807 31.994 -0.187 17927 15105 1 19 . 1 1 37 37 VAL H H 37 8.603 8.603 8.037 0.566 17927 15106 1 19 . 1 1 38 38 TRP N N 38 124.161 124.161 127.806 -3.645 17927 15107 1 19 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.160 0.077 17927 15108 1 19 . 1 1 38 38 TRP C C 38 171.995 171.995 173.756 -1.761 17927 15109 1 19 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.090 2.117 17927 15110 1 19 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.105 3.082 17927 15111 1 19 . 1 1 38 38 TRP H H 38 8.562 8.562 8.498 0.064 17927 15112 1 19 . 1 1 39 39 ALA N N 39 116.252 116.252 125.218 -8.966 17927 15113 1 19 . 1 1 39 39 ALA HA H 39 3.678 3.678 4.003 -0.325 17927 15114 1 19 . 1 1 39 39 ALA C C 39 178.664 178.664 176.092 2.572 17927 15115 1 19 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.422 1.044 17927 15116 1 19 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.200 1.141 17927 15117 1 19 . 1 1 39 39 ALA H H 39 6.757 6.757 8.126 -1.369 17927 15118 1 19 . 1 1 40 40 THR N N 40 114.321 114.321 115.338 -1.017 17927 15119 1 19 . 1 1 40 40 THR HA H 40 3.907 3.907 4.526 -0.619 17927 15120 1 19 . 1 1 40 40 THR C C 40 175.885 175.885 174.732 1.153 17927 15121 1 19 . 1 1 40 40 THR CA C 40 65.447 65.447 62.781 2.666 17927 15122 1 19 . 1 1 40 40 THR CB C 40 70.106 70.106 69.679 0.427 17927 15123 1 19 . 1 1 40 40 THR H H 40 9.639 9.639 8.864 0.775 17927 15124 1 19 . 1 1 41 41 TRP N N 41 114.483 114.483 120.899 -6.416 17927 15125 1 19 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.672 -0.109 17927 15126 1 19 . 1 1 41 41 TRP C C 41 176.189 176.189 176.380 -0.191 17927 15127 1 19 . 1 1 41 41 TRP CA C 41 54.698 54.698 56.013 -1.315 17927 15128 1 19 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.041 1.937 17927 15129 1 19 . 1 1 41 41 TRP H H 41 6.401 6.401 7.587 -1.186 17927 15130 1 19 . 1 1 42 42 CYS N N 42 123.536 123.536 115.546 7.990 17927 15131 1 19 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.085 0.483 17927 15132 1 19 . 1 1 42 42 CYS C C 42 175.726 175.726 175.900 -0.174 17927 15133 1 19 . 1 1 42 42 CYS CA C 42 58.700 58.700 58.470 0.230 17927 15134 1 19 . 1 1 42 42 CYS CB C 42 27.121 27.121 29.185 -2.064 17927 15135 1 19 . 1 1 42 42 CYS H H 42 6.883 6.883 7.054 -0.171 17927 15136 1 19 . 1 1 43 43 GLY N N 43 120.977 120.977 109.826 11.151 17927 15137 1 19 . 1 1 43 43 GLY CA C 43 49.204 49.204 45.188 4.016 17927 15138 1 19 . 1 1 43 43 GLY H H 43 9.653 9.653 8.055 1.598 17927 15139 1 19 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.377 0.110 17927 15140 1 19 . 1 1 44 44 PRO C C 44 179.956 179.956 178.560 1.396 17927 15141 1 19 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.359 0.283 17927 15142 1 19 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.418 1.160 17927 15143 1 19 . 1 1 45 45 CYS N N 45 113.925 113.925 117.128 -3.203 17927 15144 1 19 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.150 0.163 17927 15145 1 19 . 1 1 45 45 CYS C C 45 178.325 178.325 176.208 2.117 17927 15146 1 19 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.502 1.890 17927 15147 1 19 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.484 1.021 17927 15148 1 19 . 1 1 45 45 CYS H H 45 7.676 7.676 8.218 -0.542 17927 15149 1 19 . 1 1 46 46 ARG N N 46 120.336 120.336 118.557 1.779 17927 15150 1 19 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.172 -0.103 17927 15151 1 19 . 1 1 46 46 ARG C C 46 180.446 180.446 178.106 2.340 17927 15152 1 19 . 1 1 46 46 ARG CA C 46 59.785 59.785 58.311 1.474 17927 15153 1 19 . 1 1 46 46 ARG CB C 46 29.868 29.868 30.018 -0.150 17927 15154 1 19 . 1 1 46 46 ARG H H 46 8.109 8.109 7.969 0.140 17927 15155 1 19 . 1 1 47 47 GLY N N 47 105.408 105.408 106.194 -0.786 17927 15156 1 19 . 1 1 47 47 GLY C C 47 175.258 175.258 174.951 0.307 17927 15157 1 19 . 1 1 47 47 GLY CA C 47 46.594 46.594 45.730 0.864 17927 15158 1 19 . 1 1 47 47 GLY H H 47 8.466 8.466 8.073 0.393 17927 15159 1 19 . 1 1 48 48 GLU N N 48 116.343 116.343 119.864 -3.521 17927 15160 1 19 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.563 -0.038 17927 15161 1 19 . 1 1 48 48 GLU C C 48 176.535 176.535 178.204 -1.669 17927 15162 1 19 . 1 1 48 48 GLU CA C 48 55.792 55.792 55.843 -0.051 17927 15163 1 19 . 1 1 48 48 GLU CB C 48 30.982 30.982 30.172 0.810 17927 15164 1 19 . 1 1 48 48 GLU H H 48 7.050 7.050 7.683 -0.633 17927 15165 1 19 . 1 1 49 49 LEU N N 49 118.652 118.652 122.123 -3.471 17927 15166 1 19 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.206 -0.054 17927 15167 1 19 . 1 1 49 49 LEU C C 49 176.832 176.832 176.102 0.730 17927 15168 1 19 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.911 -1.566 17927 15169 1 19 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.314 -0.818 17927 15170 1 19 . 1 1 49 49 LEU H H 49 7.385 7.385 7.974 -0.589 17927 15171 1 19 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.146 0.107 17927 15172 1 19 . 1 1 50 50 PRO C C 50 179.744 179.744 178.120 1.624 17927 15173 1 19 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.076 0.483 17927 15174 1 19 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.952 -0.190 17927 15175 1 19 . 1 1 51 51 ALA N N 51 120.418 120.418 119.085 1.333 17927 15176 1 19 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.197 -0.052 17927 15177 1 19 . 1 1 51 51 ALA C C 51 180.329 180.329 179.718 0.611 17927 15178 1 19 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.669 -0.235 17927 15179 1 19 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.327 0.043 17927 15180 1 19 . 1 1 51 51 ALA H H 51 7.731 7.731 7.882 -0.151 17927 15181 1 19 . 1 1 52 52 LEU N N 52 121.506 121.506 120.452 1.054 17927 15182 1 19 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.985 0.003 17927 15183 1 19 . 1 1 52 52 LEU C C 52 177.944 177.944 177.980 -0.036 17927 15184 1 19 . 1 1 52 52 LEU CA C 52 58.327 58.327 58.260 0.067 17927 15185 1 19 . 1 1 52 52 LEU CB C 52 42.382 42.382 42.105 0.277 17927 15186 1 19 . 1 1 52 52 LEU H H 52 8.355 8.355 8.322 0.033 17927 15187 1 19 . 1 1 53 53 LYS N N 53 119.732 119.732 118.365 1.367 17927 15188 1 19 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.930 -0.027 17927 15189 1 19 . 1 1 53 53 LYS C C 53 179.030 179.030 178.765 0.265 17927 15190 1 19 . 1 1 53 53 LYS CA C 53 59.846 59.846 59.166 0.680 17927 15191 1 19 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.697 0.514 17927 15192 1 19 . 1 1 53 53 LYS H H 53 8.148 8.148 7.939 0.209 17927 15193 1 19 . 1 1 54 54 GLU N N 54 117.779 117.779 120.209 -2.430 17927 15194 1 19 . 1 1 54 54 GLU HA H 54 4.059 4.059 4.059 0.000 17927 15195 1 19 . 1 1 54 54 GLU C C 54 179.646 179.646 179.095 0.551 17927 15196 1 19 . 1 1 54 54 GLU CA C 54 59.625 59.625 58.878 0.747 17927 15197 1 19 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.148 0.419 17927 15198 1 19 . 1 1 54 54 GLU H H 54 7.585 7.585 7.864 -0.279 17927 15199 1 19 . 1 1 55 55 LEU N N 55 120.581 120.581 120.562 0.019 17927 15200 1 19 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.101 0.092 17927 15201 1 19 . 1 1 55 55 LEU C C 55 178.557 178.557 178.582 -0.025 17927 15202 1 19 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.931 0.305 17927 15203 1 19 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.549 1.462 17927 15204 1 19 . 1 1 55 55 LEU H H 55 8.096 8.096 7.980 0.116 17927 15205 1 19 . 1 1 56 56 GLU N N 56 118.023 118.023 119.057 -1.034 17927 15206 1 19 . 1 1 56 56 GLU HA H 56 3.177 3.177 2.420 0.757 17927 15207 1 19 . 1 1 56 56 GLU C C 56 179.650 179.650 178.976 0.674 17927 15208 1 19 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.239 -0.368 17927 15209 1 19 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.177 -2.192 17927 15210 1 19 . 1 1 56 56 GLU H H 56 8.181 8.181 7.983 0.198 17927 15211 1 19 . 1 1 57 57 GLU N N 57 117.828 117.828 116.793 1.035 17927 15212 1 19 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.041 0.063 17927 15213 1 19 . 1 1 57 57 GLU C C 57 179.700 179.700 177.943 1.757 17927 15214 1 19 . 1 1 57 57 GLU CA C 57 59.027 59.027 57.816 1.211 17927 15215 1 19 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.671 -0.006 17927 15216 1 19 . 1 1 57 57 GLU H H 57 7.762 7.762 8.050 -0.288 17927 15217 1 19 . 1 1 58 58 LYS N N 58 120.896 120.896 117.888 3.008 17927 15218 1 19 . 1 1 58 58 LYS HA H 58 3.979 3.979 3.948 0.031 17927 15219 1 19 . 1 1 58 58 LYS C C 58 178.715 178.715 178.051 0.664 17927 15220 1 19 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.661 0.417 17927 15221 1 19 . 1 1 58 58 LYS CB C 58 32.980 32.980 33.109 -0.129 17927 15222 1 19 . 1 1 58 58 LYS H H 58 8.410 8.410 7.643 0.767 17927 15223 1 19 . 1 1 59 59 TYR N N 59 113.713 113.713 115.355 -1.642 17927 15224 1 19 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.606 -0.294 17927 15225 1 19 . 1 1 59 59 TYR C C 59 175.025 175.025 175.271 -0.246 17927 15226 1 19 . 1 1 59 59 TYR CA C 59 58.973 58.973 57.301 1.672 17927 15227 1 19 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.102 -0.668 17927 15228 1 19 . 1 1 59 59 TYR H H 59 8.102 8.102 8.223 -0.121 17927 15229 1 19 . 1 1 60 60 ALA N N 60 126.637 126.637 122.172 4.465 17927 15230 1 19 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.513 -0.095 17927 15231 1 19 . 1 1 60 60 ALA C C 60 179.208 179.208 177.427 1.781 17927 15232 1 19 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.014 1.520 17927 15233 1 19 . 1 1 60 60 ALA CB C 60 18.589 18.589 19.599 -1.010 17927 15234 1 19 . 1 1 60 60 ALA H H 60 7.201 7.201 7.386 -0.185 17927 15235 1 19 . 1 1 61 61 GLY N N 61 111.816 111.816 107.237 4.579 17927 15236 1 19 . 1 1 61 61 GLY C C 61 174.698 174.698 174.861 -0.163 17927 15237 1 19 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.759 0.145 17927 15238 1 19 . 1 1 61 61 GLY H H 61 9.184 9.184 8.967 0.217 17927 15239 1 19 . 1 1 62 62 LYS N N 62 118.497 118.497 120.200 -1.703 17927 15240 1 19 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.579 0.300 17927 15241 1 19 . 1 1 62 62 LYS C C 62 179.019 179.019 175.404 3.615 17927 15242 1 19 . 1 1 62 62 LYS CA C 62 53.988 53.988 54.478 -0.490 17927 15243 1 19 . 1 1 62 62 LYS CB C 62 33.840 33.840 33.226 0.614 17927 15244 1 19 . 1 1 62 62 LYS H H 62 8.019 8.019 7.515 0.504 17927 15245 1 19 . 1 1 63 63 ASP N N 63 122.982 122.982 119.937 3.045 17927 15246 1 19 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.732 -0.205 17927 15247 1 19 . 1 1 63 63 ASP C C 63 174.065 174.065 175.170 -1.105 17927 15248 1 19 . 1 1 63 63 ASP CA C 63 55.055 55.055 55.111 -0.056 17927 15249 1 19 . 1 1 63 63 ASP CB C 63 38.582 38.582 40.389 -1.807 17927 15250 1 19 . 1 1 63 63 ASP H H 63 8.709 8.709 8.532 0.177 17927 15251 1 19 . 1 1 64 64 ILE N N 64 122.219 122.219 113.088 9.131 17927 15252 1 19 . 1 1 64 64 ILE HA H 64 4.607 4.607 5.164 -0.557 17927 15253 1 19 . 1 1 64 64 ILE C C 64 174.627 174.627 173.348 1.279 17927 15254 1 19 . 1 1 64 64 ILE CA C 64 59.712 59.712 58.320 1.392 17927 15255 1 19 . 1 1 64 64 ILE CB C 64 42.133 42.133 42.594 -0.461 17927 15256 1 19 . 1 1 64 64 ILE H H 64 8.678 8.678 7.253 1.425 17927 15257 1 19 . 1 1 65 65 HIS N N 65 125.584 125.584 118.266 7.318 17927 15258 1 19 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.987 0.056 17927 15259 1 19 . 1 1 65 65 HIS C C 65 174.153 174.153 173.562 0.591 17927 15260 1 19 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.639 0.320 17927 15261 1 19 . 1 1 65 65 HIS CB C 65 34.156 34.156 33.940 0.216 17927 15262 1 19 . 1 1 65 65 HIS H H 65 9.204 9.204 8.720 0.484 17927 15263 1 19 . 1 1 66 66 PHE N N 66 123.244 123.244 123.268 -0.024 17927 15264 1 19 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.967 0.243 17927 15265 1 19 . 1 1 66 66 PHE C C 66 175.463 175.463 174.885 0.578 17927 15266 1 19 . 1 1 66 66 PHE CA C 66 58.088 58.088 58.230 -0.142 17927 15267 1 19 . 1 1 66 66 PHE CB C 66 39.637 39.637 39.238 0.399 17927 15268 1 19 . 1 1 66 66 PHE H H 66 9.262 9.262 9.148 0.114 17927 15269 1 19 . 1 1 67 67 VAL N N 67 126.201 126.201 125.895 0.306 17927 15270 1 19 . 1 1 67 67 VAL HA H 67 4.834 4.834 4.780 0.054 17927 15271 1 19 . 1 1 67 67 VAL C C 67 174.364 174.364 175.474 -1.110 17927 15272 1 19 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.969 -0.245 17927 15273 1 19 . 1 1 67 67 VAL CB C 67 34.893 34.893 33.260 1.633 17927 15274 1 19 . 1 1 67 67 VAL H H 67 8.843 8.843 9.338 -0.495 17927 15275 1 19 . 1 1 68 68 SER N N 68 124.528 124.528 123.893 0.635 17927 15276 1 19 . 1 1 68 68 SER HA H 68 5.585 5.585 5.339 0.246 17927 15277 1 19 . 1 1 68 68 SER C C 68 172.858 172.858 173.359 -0.501 17927 15278 1 19 . 1 1 68 68 SER CA C 68 57.282 57.282 57.968 -0.686 17927 15279 1 19 . 1 1 68 68 SER CB C 68 65.032 65.032 63.700 1.332 17927 15280 1 19 . 1 1 68 68 SER H H 68 9.243 9.243 8.883 0.360 17927 15281 1 19 . 1 1 69 69 LEU N N 69 126.695 126.695 125.909 0.786 17927 15282 1 19 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.399 -0.882 17927 15283 1 19 . 1 1 69 69 LEU C C 69 174.652 174.652 176.097 -1.445 17927 15284 1 19 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.681 -0.854 17927 15285 1 19 . 1 1 69 69 LEU CB C 69 43.895 43.895 45.246 -1.351 17927 15286 1 19 . 1 1 69 69 LEU H H 69 9.360 9.360 9.133 0.227 17927 15287 1 19 . 1 1 70 70 SER N N 70 116.379 116.379 116.636 -0.257 17927 15288 1 19 . 1 1 70 70 SER HA H 70 4.905 4.905 5.169 -0.264 17927 15289 1 19 . 1 1 70 70 SER C C 70 176.307 176.307 174.899 1.408 17927 15290 1 19 . 1 1 70 70 SER CA C 70 55.213 55.213 55.912 -0.699 17927 15291 1 19 . 1 1 70 70 SER CB C 70 63.519 63.519 64.277 -0.758 17927 15292 1 19 . 1 1 70 70 SER H H 70 7.981 7.981 8.541 -0.560 17927 15293 1 19 . 1 1 71 71 CYS N N 71 124.670 124.670 125.185 -0.515 17927 15294 1 19 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.555 0.403 17927 15295 1 19 . 1 1 71 71 CYS C C 71 173.996 173.996 174.650 -0.654 17927 15296 1 19 . 1 1 71 71 CYS CA C 71 55.483 55.483 56.699 -1.216 17927 15297 1 19 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.548 0.564 17927 15298 1 19 . 1 1 71 71 CYS H H 71 8.609 8.609 8.957 -0.348 17927 15299 1 19 . 1 1 72 72 ASP N N 72 122.398 122.398 123.747 -1.349 17927 15300 1 19 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.606 -0.314 17927 15301 1 19 . 1 1 72 72 ASP C C 72 176.653 176.653 176.687 -0.034 17927 15302 1 19 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.676 1.106 17927 15303 1 19 . 1 1 72 72 ASP CB C 72 41.526 41.526 41.193 0.333 17927 15304 1 19 . 1 1 72 72 ASP H H 72 8.557 8.557 7.479 1.078 17927 15305 1 19 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.156 -0.091 17927 15306 1 19 . 1 1 73 73 LYS C C 73 176.545 176.545 175.626 0.919 17927 15307 1 19 . 1 1 73 73 LYS CA C 73 58.458 58.458 58.367 0.091 17927 15308 1 19 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.952 -0.311 17927 15309 1 19 . 1 1 74 74 ASN N N 74 117.616 117.616 116.508 1.108 17927 15310 1 19 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.699 0.206 17927 15311 1 19 . 1 1 74 74 ASN C C 74 174.894 174.894 175.677 -0.783 17927 15312 1 19 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.820 -1.299 17927 15313 1 19 . 1 1 74 74 ASN CB C 74 38.109 38.109 38.038 0.071 17927 15314 1 19 . 1 1 74 74 ASN H H 74 8.625 8.625 7.917 0.708 17927 15315 1 19 . 1 1 75 75 LYS N N 75 126.797 126.797 125.436 1.361 17927 15316 1 19 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.751 -0.328 17927 15317 1 19 . 1 1 75 75 LYS C C 75 178.058 178.058 177.595 0.463 17927 15318 1 19 . 1 1 75 75 LYS CA C 75 60.173 60.173 59.619 0.554 17927 15319 1 19 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.604 0.687 17927 15320 1 19 . 1 1 75 75 LYS H H 75 8.588 8.588 8.203 0.385 17927 15321 1 19 . 1 1 76 76 LYS N N 76 117.875 117.875 119.798 -1.923 17927 15322 1 19 . 1 1 76 76 LYS HA H 76 4.200 4.200 4.365 -0.165 17927 15323 1 19 . 1 1 76 76 LYS C C 76 178.791 178.791 178.884 -0.093 17927 15324 1 19 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.368 -0.760 17927 15325 1 19 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.474 0.017 17927 15326 1 19 . 1 1 76 76 LYS H H 76 8.041 8.041 8.404 -0.363 17927 15327 1 19 . 1 1 77 77 ALA N N 77 121.567 121.567 120.712 0.855 17927 15328 1 19 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.351 -0.228 17927 15329 1 19 . 1 1 77 77 ALA C C 77 181.191 181.191 179.806 1.385 17927 15330 1 19 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.637 0.320 17927 15331 1 19 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.158 -0.399 17927 15332 1 19 . 1 1 77 77 ALA H H 77 7.366 7.366 8.416 -1.050 17927 15333 1 19 . 1 1 78 78 TRP N N 78 119.497 119.497 120.490 -0.993 17927 15334 1 19 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.212 -0.135 17927 15335 1 19 . 1 1 78 78 TRP C C 78 175.942 175.942 177.055 -1.113 17927 15336 1 19 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.176 2.584 17927 15337 1 19 . 1 1 78 78 TRP CB C 78 27.272 27.272 29.950 -2.678 17927 15338 1 19 . 1 1 78 78 TRP H H 78 7.187 7.187 7.484 -0.297 17927 15339 1 19 . 1 1 79 79 GLU N N 79 118.771 118.771 119.163 -0.392 17927 15340 1 19 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.443 -0.429 17927 15341 1 19 . 1 1 79 79 GLU C C 79 179.863 179.863 178.279 1.584 17927 15342 1 19 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.503 -0.393 17927 15343 1 19 . 1 1 79 79 GLU CB C 79 30.220 30.220 29.013 1.207 17927 15344 1 19 . 1 1 79 79 GLU H H 79 8.813 8.813 8.833 -0.020 17927 15345 1 19 . 1 1 80 80 ASN N N 80 115.964 115.964 116.772 -0.808 17927 15346 1 19 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.511 -0.172 17927 15347 1 19 . 1 1 80 80 ASN C C 80 176.749 176.749 177.391 -0.642 17927 15348 1 19 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.129 0.906 17927 15349 1 19 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.626 -0.137 17927 15350 1 19 . 1 1 80 80 ASN H H 80 8.491 8.491 8.116 0.375 17927 15351 1 19 . 1 1 81 81 MET N N 81 119.670 119.670 122.232 -2.562 17927 15352 1 19 . 1 1 81 81 MET HA H 81 4.149 4.149 4.152 -0.003 17927 15353 1 19 . 1 1 81 81 MET C C 81 177.933 177.933 177.555 0.378 17927 15354 1 19 . 1 1 81 81 MET CA C 81 60.276 60.276 59.160 1.116 17927 15355 1 19 . 1 1 81 81 MET CB C 81 32.518 32.518 32.812 -0.294 17927 15356 1 19 . 1 1 81 81 MET H H 81 7.667 7.667 7.586 0.081 17927 15357 1 19 . 1 1 82 82 VAL N N 82 117.634 117.634 118.832 -1.198 17927 15358 1 19 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.435 -0.132 17927 15359 1 19 . 1 1 82 82 VAL C C 82 179.005 179.005 177.091 1.914 17927 15360 1 19 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.506 0.531 17927 15361 1 19 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.556 0.209 17927 15362 1 19 . 1 1 82 82 VAL H H 82 8.338 8.338 8.113 0.225 17927 15363 1 19 . 1 1 83 83 THR N N 83 110.519 110.519 115.353 -4.834 17927 15364 1 19 . 1 1 83 83 THR HA H 83 3.983 3.983 3.962 0.021 17927 15365 1 19 . 1 1 83 83 THR C C 83 177.591 177.591 176.431 1.160 17927 15366 1 19 . 1 1 83 83 THR CA C 83 65.431 65.431 66.479 -1.048 17927 15367 1 19 . 1 1 83 83 THR CB C 83 69.156 69.156 68.299 0.857 17927 15368 1 19 . 1 1 83 83 THR H H 83 7.659 7.659 7.647 0.012 17927 15369 1 19 . 1 1 84 84 LYS N N 84 123.927 123.927 121.285 2.642 17927 15370 1 19 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.146 -0.077 17927 15371 1 19 . 1 1 84 84 LYS C C 84 178.582 178.582 177.963 0.619 17927 15372 1 19 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.369 1.508 17927 15373 1 19 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.203 0.120 17927 15374 1 19 . 1 1 84 84 LYS H H 84 8.665 8.665 7.713 0.952 17927 15375 1 19 . 1 1 85 85 ASP N N 85 116.280 116.280 116.821 -0.541 17927 15376 1 19 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.628 0.122 17927 15377 1 19 . 1 1 85 85 ASP C C 85 175.086 175.086 175.307 -0.221 17927 15378 1 19 . 1 1 85 85 ASP CA C 85 54.693 54.693 55.376 -0.683 17927 15379 1 19 . 1 1 85 85 ASP CB C 85 39.685 39.685 41.092 -1.407 17927 15380 1 19 . 1 1 85 85 ASP H H 85 8.179 8.179 8.267 -0.088 17927 15381 1 19 . 1 1 86 86 GLN N N 86 116.258 116.258 114.198 2.060 17927 15382 1 19 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.856 0.052 17927 15383 1 19 . 1 1 86 86 GLN C C 86 175.659 175.659 174.529 1.130 17927 15384 1 19 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.450 -0.279 17927 15385 1 19 . 1 1 86 86 GLN CB C 86 26.290 26.290 25.766 0.524 17927 15386 1 19 . 1 1 86 86 GLN H H 86 7.431 7.431 7.641 -0.210 17927 15387 1 19 . 1 1 87 87 LEU N N 87 117.031 117.031 120.904 -3.873 17927 15388 1 19 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.472 -0.382 17927 15389 1 19 . 1 1 87 87 LEU C C 87 178.225 178.225 175.573 2.652 17927 15390 1 19 . 1 1 87 87 LEU CA C 87 55.932 55.932 54.347 1.585 17927 15391 1 19 . 1 1 87 87 LEU CB C 87 41.202 41.202 42.480 -1.278 17927 15392 1 19 . 1 1 87 87 LEU H H 87 7.736 7.736 7.853 -0.117 17927 15393 1 19 . 1 1 88 88 LYS N N 88 122.367 122.367 120.708 1.659 17927 15394 1 19 . 1 1 88 88 LYS HA H 88 4.636 4.636 5.520 -0.884 17927 15395 1 19 . 1 1 88 88 LYS C C 88 177.538 177.538 175.876 1.662 17927 15396 1 19 . 1 1 88 88 LYS CA C 88 54.930 54.930 53.899 1.031 17927 15397 1 19 . 1 1 88 88 LYS CB C 88 33.316 33.316 35.636 -2.320 17927 15398 1 19 . 1 1 88 88 LYS H H 88 8.496 8.496 8.147 0.349 17927 15399 1 19 . 1 1 89 89 GLY N N 89 108.452 108.452 106.635 1.817 17927 15400 1 19 . 1 1 89 89 GLY C C 89 173.781 173.781 173.145 0.636 17927 15401 1 19 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.780 0.578 17927 15402 1 19 . 1 1 89 89 GLY H H 89 8.497 8.497 7.766 0.731 17927 15403 1 19 . 1 1 90 90 ILE N N 90 123.295 123.295 123.681 -0.386 17927 15404 1 19 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.374 -0.003 17927 15405 1 19 . 1 1 90 90 ILE C C 90 175.606 175.606 173.959 1.647 17927 15406 1 19 . 1 1 90 90 ILE CA C 90 62.001 62.001 59.234 2.767 17927 15407 1 19 . 1 1 90 90 ILE CB C 90 38.036 38.036 37.234 0.802 17927 15408 1 19 . 1 1 90 90 ILE H H 90 8.728 8.728 7.962 0.766 17927 15409 1 19 . 1 1 91 91 GLN N N 91 128.632 128.632 125.717 2.915 17927 15410 1 19 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.807 -0.041 17927 15411 1 19 . 1 1 91 91 GLN C C 91 174.618 174.618 174.217 0.401 17927 15412 1 19 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.909 0.941 17927 15413 1 19 . 1 1 91 91 GLN CB C 91 28.341 28.341 30.677 -2.336 17927 15414 1 19 . 1 1 91 91 GLN H H 91 8.762 8.762 9.052 -0.290 17927 15415 1 19 . 1 1 92 92 LEU N N 92 120.830 120.830 124.652 -3.822 17927 15416 1 19 . 1 1 92 92 LEU HA H 92 5.580 5.580 5.181 0.399 17927 15417 1 19 . 1 1 92 92 LEU C C 92 176.828 176.828 176.020 0.808 17927 15418 1 19 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.469 -0.668 17927 15419 1 19 . 1 1 92 92 LEU CB C 92 44.210 44.210 44.665 -0.455 17927 15420 1 19 . 1 1 92 92 LEU H H 92 9.011 9.011 9.292 -0.281 17927 15421 1 19 . 1 1 93 93 HIS N N 93 121.481 121.481 120.613 0.868 17927 15422 1 19 . 1 1 93 93 HIS HA H 93 3.931 3.931 4.937 -1.006 17927 15423 1 19 . 1 1 93 93 HIS C C 93 173.590 173.590 173.766 -0.176 17927 15424 1 19 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.229 1.354 17927 15425 1 19 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.076 -0.826 17927 15426 1 19 . 1 1 93 93 HIS H H 93 8.038 8.038 8.372 -0.334 17927 15427 1 19 . 1 1 94 94 MET N N 94 121.881 121.881 124.277 -2.396 17927 15428 1 19 . 1 1 94 94 MET HA H 94 3.866 3.866 3.102 0.764 17927 15429 1 19 . 1 1 94 94 MET C C 94 177.035 177.035 176.044 0.991 17927 15430 1 19 . 1 1 94 94 MET CA C 94 55.189 55.189 57.367 -2.178 17927 15431 1 19 . 1 1 94 94 MET CB C 94 33.993 33.993 33.382 0.611 17927 15432 1 19 . 1 1 94 94 MET H H 94 8.039 8.039 8.638 -0.599 17927 15433 1 19 . 1 1 95 95 GLY N N 95 104.041 104.041 105.671 -1.630 17927 15434 1 19 . 1 1 95 95 GLY C C 95 174.251 174.251 174.553 -0.302 17927 15435 1 19 . 1 1 95 95 GLY CA C 95 46.580 46.580 45.581 0.999 17927 15436 1 19 . 1 1 95 95 GLY H H 95 5.666 5.666 7.339 -1.673 17927 15437 1 19 . 1 1 96 96 THR N N 96 114.114 114.114 114.925 -0.811 17927 15438 1 19 . 1 1 96 96 THR HA H 96 4.211 4.211 4.391 -0.180 17927 15439 1 19 . 1 1 96 96 THR C C 96 175.122 175.122 174.425 0.697 17927 15440 1 19 . 1 1 96 96 THR CA C 96 61.339 61.339 61.697 -0.358 17927 15441 1 19 . 1 1 96 96 THR CB C 96 68.615 68.615 69.130 -0.515 17927 15442 1 19 . 1 1 96 96 THR H H 96 8.517 8.517 8.058 0.459 17927 15443 1 19 . 1 1 97 97 ASP N N 97 121.892 121.892 123.153 -1.261 17927 15444 1 19 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.909 -0.324 17927 15445 1 19 . 1 1 97 97 ASP C C 97 178.241 178.241 176.221 2.020 17927 15446 1 19 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.560 1.240 17927 15447 1 19 . 1 1 97 97 ASP CB C 97 43.129 43.129 39.931 3.198 17927 15448 1 19 . 1 1 97 97 ASP H H 97 7.563 7.563 8.336 -0.773 17927 15449 1 19 . 1 1 98 98 ARG N N 98 127.508 127.508 119.332 8.176 17927 15450 1 19 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.264 0.128 17927 15451 1 19 . 1 1 98 98 ARG C C 98 176.724 176.724 177.496 -0.772 17927 15452 1 19 . 1 1 98 98 ARG CA C 98 55.939 55.939 58.111 -2.172 17927 15453 1 19 . 1 1 98 98 ARG CB C 98 30.291 30.291 29.296 0.995 17927 15454 1 19 . 1 1 98 98 ARG H H 98 9.225 9.225 7.450 1.775 17927 15455 1 19 . 1 1 99 99 THR N N 99 116.384 116.384 117.886 -1.502 17927 15456 1 19 . 1 1 99 99 THR HA H 99 3.987 3.987 4.021 -0.034 17927 15457 1 19 . 1 1 99 99 THR C C 99 176.969 176.969 176.266 0.703 17927 15458 1 19 . 1 1 99 99 THR CA C 99 67.714 67.714 66.581 1.133 17927 15459 1 19 . 1 1 99 99 THR CB C 99 68.777 68.777 68.511 0.266 17927 15460 1 19 . 1 1 99 99 THR H H 99 8.382 8.382 7.909 0.473 17927 15461 1 19 . 1 1 100 100 PHE N N 100 123.232 123.232 122.627 0.605 17927 15462 1 19 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.423 -0.250 17927 15463 1 19 . 1 1 100 100 PHE C C 100 177.010 177.010 176.677 0.333 17927 15464 1 19 . 1 1 100 100 PHE CA C 100 61.923 61.923 61.211 0.712 17927 15465 1 19 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.396 1.366 17927 15466 1 19 . 1 1 100 100 PHE H H 100 7.998 7.998 8.264 -0.266 17927 15467 1 19 . 1 1 101 101 MET N N 101 115.968 115.968 119.851 -3.883 17927 15468 1 19 . 1 1 101 101 MET HA H 101 3.975 3.975 3.906 0.069 17927 15469 1 19 . 1 1 101 101 MET C C 101 178.763 178.763 177.526 1.237 17927 15470 1 19 . 1 1 101 101 MET CA C 101 58.552 58.552 59.304 -0.752 17927 15471 1 19 . 1 1 101 101 MET CB C 101 32.593 32.593 32.416 0.177 17927 15472 1 19 . 1 1 101 101 MET H H 101 7.828 7.828 7.637 0.191 17927 15473 1 19 . 1 1 102 102 ASP N N 102 117.553 117.553 119.344 -1.791 17927 15474 1 19 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.411 0.111 17927 15475 1 19 . 1 1 102 102 ASP C C 102 179.503 179.503 178.758 0.745 17927 15476 1 19 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.329 -0.439 17927 15477 1 19 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.891 -0.965 17927 15478 1 19 . 1 1 102 102 ASP H H 102 8.828 8.828 8.314 0.514 17927 15479 1 19 . 1 1 103 103 ALA N N 103 122.984 122.984 122.459 0.525 17927 15480 1 19 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.065 -0.079 17927 15481 1 19 . 1 1 103 103 ALA C C 103 178.782 178.782 178.981 -0.199 17927 15482 1 19 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.590 0.504 17927 15483 1 19 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.323 0.240 17927 15484 1 19 . 1 1 103 103 ALA H H 103 7.567 7.567 7.764 -0.197 17927 15485 1 19 . 1 1 104 104 TYR N N 104 112.159 112.159 114.093 -1.934 17927 15486 1 19 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.514 -0.290 17927 15487 1 19 . 1 1 104 104 TYR C C 104 173.821 173.821 174.881 -1.060 17927 15488 1 19 . 1 1 104 104 TYR CA C 104 58.498 58.498 58.677 -0.179 17927 15489 1 19 . 1 1 104 104 TYR CB C 104 38.393 38.393 38.675 -0.282 17927 15490 1 19 . 1 1 104 104 TYR H H 104 7.203 7.203 7.602 -0.399 17927 15491 1 19 . 1 1 105 105 LEU N N 105 119.433 119.433 116.225 3.208 17927 15492 1 19 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.992 -0.007 17927 15493 1 19 . 1 1 105 105 LEU C C 105 176.721 176.721 176.289 0.432 17927 15494 1 19 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.096 0.689 17927 15495 1 19 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.544 -1.101 17927 15496 1 19 . 1 1 105 105 LEU H H 105 7.582 7.582 7.444 0.138 17927 15497 1 19 . 1 1 106 106 ILE N N 106 119.575 119.575 115.587 3.988 17927 15498 1 19 . 1 1 106 106 ILE HA H 106 4.002 4.002 4.063 -0.061 17927 15499 1 19 . 1 1 106 106 ILE C C 106 175.459 175.459 174.863 0.596 17927 15500 1 19 . 1 1 106 106 ILE CA C 106 62.043 62.043 61.365 0.677 17927 15501 1 19 . 1 1 106 106 ILE CB C 106 36.335 36.335 35.781 0.554 17927 15502 1 19 . 1 1 106 106 ILE H H 106 8.774 8.774 7.645 1.129 17927 15503 1 19 . 1 1 107 107 ASN N N 107 126.514 126.514 123.093 3.421 17927 15504 1 19 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.691 0.172 17927 15505 1 19 . 1 1 107 107 ASN C C 107 174.584 174.584 176.695 -2.111 17927 15506 1 19 . 1 1 107 107 ASN CA C 107 53.112 53.112 54.280 -1.168 17927 15507 1 19 . 1 1 107 107 ASN CB C 107 38.977 38.977 38.419 0.558 17927 15508 1 19 . 1 1 107 107 ASN H H 107 8.364 8.364 8.092 0.272 17927 15509 1 19 . 1 1 108 108 GLY N N 108 108.469 108.469 110.337 -1.868 17927 15510 1 19 . 1 1 108 108 GLY C C 108 171.245 171.245 173.404 -2.159 17927 15511 1 19 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.097 1.172 17927 15512 1 19 . 1 1 108 108 GLY H H 108 7.678 7.678 8.404 -0.726 17927 15513 1 19 . 1 1 109 109 ILE N N 109 112.817 112.817 119.815 -6.998 17927 15514 1 19 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.347 0.059 17927 15515 1 19 . 1 1 109 109 ILE C C 109 173.498 173.498 174.069 -0.571 17927 15516 1 19 . 1 1 109 109 ILE CA C 109 58.384 58.384 58.336 0.048 17927 15517 1 19 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.296 2.026 17927 15518 1 19 . 1 1 109 109 ILE H H 109 7.868 7.868 7.657 0.211 17927 15519 1 19 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.526 0.216 17927 15520 1 19 . 1 1 110 110 PRO C C 110 175.715 175.715 175.589 0.126 17927 15521 1 19 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.620 -0.343 17927 15522 1 19 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.395 3.973 17927 15523 1 19 . 1 1 111 111 ARG N N 111 122.358 122.358 122.172 0.186 17927 15524 1 19 . 1 1 111 111 ARG HA H 111 4.469 4.469 4.102 0.367 17927 15525 1 19 . 1 1 111 111 ARG C C 111 171.541 171.541 174.723 -3.182 17927 15526 1 19 . 1 1 111 111 ARG CA C 111 54.356 54.356 53.999 0.357 17927 15527 1 19 . 1 1 111 111 ARG CB C 111 33.430 33.430 33.538 -0.107 17927 15528 1 19 . 1 1 111 111 ARG H H 111 7.732 7.732 8.378 -0.646 17927 15529 1 19 . 1 1 112 112 PHE N N 112 125.103 125.103 120.313 4.790 17927 15530 1 19 . 1 1 112 112 PHE HA H 112 5.773 5.773 5.112 0.661 17927 15531 1 19 . 1 1 112 112 PHE C C 112 175.097 175.097 175.194 -0.097 17927 15532 1 19 . 1 1 112 112 PHE CA C 112 55.791 55.791 55.711 0.080 17927 15533 1 19 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.359 1.569 17927 15534 1 19 . 1 1 112 112 PHE H H 112 8.929 8.929 7.335 1.594 17927 15535 1 19 . 1 1 113 113 ILE N N 113 123.778 123.778 122.756 1.022 17927 15536 1 19 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.883 -0.340 17927 15537 1 19 . 1 1 113 113 ILE C C 113 173.197 173.197 174.147 -0.950 17927 15538 1 19 . 1 1 113 113 ILE CA C 113 60.286 60.286 60.108 0.178 17927 15539 1 19 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.822 1.424 17927 15540 1 19 . 1 1 113 113 ILE H H 113 8.873 8.873 8.979 -0.106 17927 15541 1 19 . 1 1 114 114 LEU N N 114 127.146 127.146 126.294 0.852 17927 15542 1 19 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.468 0.546 17927 15543 1 19 . 1 1 114 114 LEU C C 114 175.080 175.080 174.480 0.600 17927 15544 1 19 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.851 -0.450 17927 15545 1 19 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.769 0.601 17927 15546 1 19 . 1 1 114 114 LEU H H 114 8.974 8.974 8.747 0.227 17927 15547 1 19 . 1 1 115 115 LEU N N 115 128.323 128.323 124.016 4.307 17927 15548 1 19 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.269 0.163 17927 15549 1 19 . 1 1 115 115 LEU C C 115 176.660 176.660 175.630 1.030 17927 15550 1 19 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.614 -0.537 17927 15551 1 19 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.116 -1.532 17927 15552 1 19 . 1 1 115 115 LEU H H 115 9.874 9.874 9.426 0.448 17927 15553 1 19 . 1 1 116 116 ASP N N 116 119.834 119.834 121.704 -1.870 17927 15554 1 19 . 1 1 116 116 ASP HA H 116 4.935 4.935 5.007 -0.072 17927 15555 1 19 . 1 1 116 116 ASP C C 116 176.898 176.898 177.382 -0.484 17927 15556 1 19 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.297 -0.992 17927 15557 1 19 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.788 -1.760 17927 15558 1 19 . 1 1 116 116 ASP H H 116 9.357 9.357 8.844 0.513 17927 15559 1 19 . 1 1 117 117 ARG N N 117 113.356 113.356 121.935 -8.579 17927 15560 1 19 . 1 1 117 117 ARG HA H 117 3.717 3.717 3.956 -0.239 17927 15561 1 19 . 1 1 117 117 ARG C C 117 177.105 177.105 178.153 -1.048 17927 15562 1 19 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.474 -1.290 17927 15563 1 19 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.885 0.552 17927 15564 1 19 . 1 1 117 117 ARG H H 117 7.697 7.697 8.301 -0.604 17927 15565 1 19 . 1 1 118 118 ASP N N 118 117.226 117.226 116.795 0.431 17927 15566 1 19 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.520 0.375 17927 15567 1 19 . 1 1 118 118 ASP C C 118 176.657 176.657 176.360 0.297 17927 15568 1 19 . 1 1 118 118 ASP CA C 118 53.517 53.517 54.711 -1.194 17927 15569 1 19 . 1 1 118 118 ASP CB C 118 42.556 42.556 41.429 1.127 17927 15570 1 19 . 1 1 118 118 ASP H H 118 8.456 8.456 8.143 0.313 17927 15571 1 19 . 1 1 119 119 GLY N N 119 109.074 109.074 106.554 2.520 17927 15572 1 19 . 1 1 119 119 GLY C C 119 173.355 173.355 174.074 -0.719 17927 15573 1 19 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.130 1.126 17927 15574 1 19 . 1 1 119 119 GLY H H 119 8.183 8.183 8.348 -0.165 17927 15575 1 19 . 1 1 120 120 LYS N N 120 120.744 120.744 121.475 -0.731 17927 15576 1 19 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.474 0.059 17927 15577 1 19 . 1 1 120 120 LYS C C 120 177.229 177.229 176.245 0.984 17927 15578 1 19 . 1 1 120 120 LYS CA C 120 55.287 55.287 55.253 0.034 17927 15579 1 19 . 1 1 120 120 LYS CB C 120 32.581 32.581 32.538 0.043 17927 15580 1 19 . 1 1 120 120 LYS H H 120 8.449 8.449 7.529 0.920 17927 15581 1 19 . 1 1 121 121 ILE N N 121 121.221 121.221 127.740 -6.519 17927 15582 1 19 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.921 -0.035 17927 15583 1 19 . 1 1 121 121 ILE C C 121 177.819 177.819 176.544 1.275 17927 15584 1 19 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.320 0.595 17927 15585 1 19 . 1 1 121 121 ILE CB C 121 39.390 39.390 36.902 2.488 17927 15586 1 19 . 1 1 121 121 ILE H H 121 8.715 8.715 8.789 -0.074 17927 15587 1 19 . 1 1 122 122 ILE N N 122 127.165 127.165 128.260 -1.095 17927 15588 1 19 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.089 0.252 17927 15589 1 19 . 1 1 122 122 ILE C C 122 176.978 176.978 176.682 0.296 17927 15590 1 19 . 1 1 122 122 ILE CA C 122 63.719 63.719 63.387 0.332 17927 15591 1 19 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.629 0.023 17927 15592 1 19 . 1 1 122 122 ILE H H 122 8.974 8.974 8.507 0.467 17927 15593 1 19 . 1 1 123 123 SER N N 123 111.227 111.227 115.083 -3.856 17927 15594 1 19 . 1 1 123 123 SER HA H 123 4.738 4.738 4.747 -0.009 17927 15595 1 19 . 1 1 123 123 SER C C 123 174.184 174.184 173.561 0.623 17927 15596 1 19 . 1 1 123 123 SER CA C 123 57.383 57.383 56.739 0.644 17927 15597 1 19 . 1 1 123 123 SER CB C 123 65.326 65.326 65.629 -0.303 17927 15598 1 19 . 1 1 123 123 SER H H 123 7.850 7.850 8.260 -0.410 17927 15599 1 19 . 1 1 124 124 ALA N N 124 131.373 131.373 126.972 4.401 17927 15600 1 19 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.327 0.158 17927 15601 1 19 . 1 1 124 124 ALA C C 124 175.147 175.147 175.628 -0.481 17927 15602 1 19 . 1 1 124 124 ALA CA C 124 53.035 53.035 53.792 -0.757 17927 15603 1 19 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.279 -0.616 17927 15604 1 19 . 1 1 124 124 ALA H H 124 9.384 9.384 8.912 0.472 17927 15605 1 19 . 1 1 125 125 ASN N N 125 119.476 119.476 111.257 8.219 17927 15606 1 19 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.750 -0.694 17927 15607 1 19 . 1 1 125 125 ASN C C 125 173.593 173.593 174.137 -0.544 17927 15608 1 19 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.128 0.224 17927 15609 1 19 . 1 1 125 125 ASN CB C 125 38.304 38.304 40.749 -2.445 17927 15610 1 19 . 1 1 125 125 ASN H H 125 8.191 8.191 7.721 0.470 17927 15611 1 19 . 1 1 126 126 MET N N 126 122.705 122.705 121.986 0.719 17927 15612 1 19 . 1 1 126 126 MET HA H 126 4.585 4.585 4.727 -0.142 17927 15613 1 19 . 1 1 126 126 MET C C 126 175.215 175.215 174.533 0.682 17927 15614 1 19 . 1 1 126 126 MET CA C 126 53.849 53.849 54.472 -0.623 17927 15615 1 19 . 1 1 126 126 MET CB C 126 31.312 31.312 35.178 -3.866 17927 15616 1 19 . 1 1 126 126 MET H H 126 8.376 8.376 9.132 -0.756 17927 15617 1 19 . 1 1 127 127 THR N N 127 111.016 111.016 111.808 -0.792 17927 15618 1 19 . 1 1 127 127 THR HA H 127 4.291 4.291 3.771 0.520 17927 15619 1 19 . 1 1 127 127 THR C C 127 174.574 174.574 173.344 1.230 17927 15620 1 19 . 1 1 127 127 THR CA C 127 62.085 62.085 60.025 2.060 17927 15621 1 19 . 1 1 127 127 THR CB C 127 69.733 69.733 71.252 -1.519 17927 15622 1 19 . 1 1 127 127 THR H H 127 7.714 7.714 7.893 -0.179 17927 15623 1 19 . 1 1 128 128 ARG N N 128 118.722 118.722 122.963 -4.241 17927 15624 1 19 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.737 -1.429 17927 15625 1 19 . 1 1 128 128 ARG C C 128 176.978 176.978 176.880 0.098 17927 15626 1 19 . 1 1 128 128 ARG CA C 128 54.727 54.727 55.516 -0.789 17927 15627 1 19 . 1 1 128 128 ARG CB C 128 29.598 29.598 29.936 -0.338 17927 15628 1 19 . 1 1 128 128 ARG H H 128 8.658 8.658 8.371 0.287 17927 15629 1 19 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.290 -0.357 17927 15630 1 19 . 1 1 129 129 PRO C C 129 175.794 175.794 177.395 -1.601 17927 15631 1 19 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.614 0.935 17927 15632 1 19 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.722 -0.045 17927 15633 1 19 . 1 1 130 130 SER N N 130 108.696 108.696 112.124 -3.428 17927 15634 1 19 . 1 1 130 130 SER HA H 130 3.988 3.988 4.362 -0.374 17927 15635 1 19 . 1 1 130 130 SER C C 130 174.445 174.445 174.524 -0.079 17927 15636 1 19 . 1 1 130 130 SER CA C 130 58.911 58.911 58.759 0.152 17927 15637 1 19 . 1 1 130 130 SER CB C 130 62.680 62.680 63.659 -0.979 17927 15638 1 19 . 1 1 130 130 SER H H 130 8.375 8.375 7.900 0.475 17927 15639 1 19 . 1 1 131 131 ASP N N 131 126.377 126.377 122.314 4.063 17927 15640 1 19 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.832 0.040 17927 15641 1 19 . 1 1 131 131 ASP C C 131 176.879 176.879 175.284 1.595 17927 15642 1 19 . 1 1 131 131 ASP CA C 131 51.195 51.195 51.971 -0.776 17927 15643 1 19 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.436 0.380 17927 15644 1 19 . 1 1 131 131 ASP H H 131 7.514 7.514 7.651 -0.137 17927 15645 1 19 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.214 0.178 17927 15646 1 19 . 1 1 132 132 PRO C C 132 178.097 178.097 177.978 0.119 17927 15647 1 19 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.505 0.574 17927 15648 1 19 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.118 0.291 17927 15649 1 19 . 1 1 133 133 LYS N N 133 116.306 116.306 117.331 -1.025 17927 15650 1 19 . 1 1 133 133 LYS HA H 133 3.958 3.958 4.101 -0.143 17927 15651 1 19 . 1 1 133 133 LYS C C 133 179.532 179.532 178.925 0.607 17927 15652 1 19 . 1 1 133 133 LYS CA C 133 58.521 58.521 58.763 -0.242 17927 15653 1 19 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.596 0.595 17927 15654 1 19 . 1 1 133 133 LYS H H 133 8.842 8.842 8.840 0.002 17927 15655 1 19 . 1 1 134 134 THR N N 134 120.833 120.833 116.058 4.775 17927 15656 1 19 . 1 1 134 134 THR HA H 134 3.147 3.147 3.576 -0.429 17927 15657 1 19 . 1 1 134 134 THR C C 134 173.356 173.356 175.254 -1.898 17927 15658 1 19 . 1 1 134 134 THR CA C 134 66.383 66.383 66.250 0.133 17927 15659 1 19 . 1 1 134 134 THR CB C 134 66.847 66.847 68.145 -1.298 17927 15660 1 19 . 1 1 134 134 THR H H 134 8.292 8.292 7.394 0.898 17927 15661 1 19 . 1 1 135 135 ALA N N 135 121.720 121.720 122.759 -1.039 17927 15662 1 19 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.693 -0.110 17927 15663 1 19 . 1 1 135 135 ALA C C 135 178.902 178.902 179.142 -0.240 17927 15664 1 19 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.699 0.300 17927 15665 1 19 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.320 -0.545 17927 15666 1 19 . 1 1 135 135 ALA H H 135 7.030 7.030 7.511 -0.480 17927 15667 1 19 . 1 1 136 136 GLU N N 136 114.623 114.623 116.404 -1.781 17927 15668 1 19 . 1 1 136 136 GLU HA H 136 3.922 3.922 3.980 -0.058 17927 15669 1 19 . 1 1 136 136 GLU C C 136 179.199 179.199 178.621 0.578 17927 15670 1 19 . 1 1 136 136 GLU CA C 136 59.837 59.837 58.470 1.367 17927 15671 1 19 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.083 0.703 17927 15672 1 19 . 1 1 136 136 GLU H H 136 7.216 7.216 8.298 -1.082 17927 15673 1 19 . 1 1 137 137 LYS N N 137 120.789 120.789 121.006 -0.217 17927 15674 1 19 . 1 1 137 137 LYS HA H 137 4.204 4.204 3.975 0.229 17927 15675 1 19 . 1 1 137 137 LYS C C 137 178.834 178.834 178.753 0.081 17927 15676 1 19 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.419 -1.076 17927 15677 1 19 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.745 -1.282 17927 15678 1 19 . 1 1 137 137 LYS H H 137 7.681 7.681 7.549 0.132 17927 15679 1 19 . 1 1 138 138 PHE N N 138 118.373 118.373 118.251 0.122 17927 15680 1 19 . 1 1 138 138 PHE HA H 138 4.033 4.033 3.965 0.068 17927 15681 1 19 . 1 1 138 138 PHE C C 138 178.027 178.027 178.028 -0.001 17927 15682 1 19 . 1 1 138 138 PHE CA C 138 57.507 57.507 60.486 -2.979 17927 15683 1 19 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.171 -1.282 17927 15684 1 19 . 1 1 138 138 PHE H H 138 8.059 8.059 7.289 0.770 17927 15685 1 19 . 1 1 139 139 ASN N N 139 117.611 117.611 117.077 0.534 17927 15686 1 19 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.468 -0.064 17927 15687 1 19 . 1 1 139 139 ASN C C 139 178.190 178.190 177.964 0.226 17927 15688 1 19 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.188 0.036 17927 15689 1 19 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.887 -1.153 17927 15690 1 19 . 1 1 139 139 ASN H H 139 8.683 8.683 7.986 0.697 17927 15691 1 19 . 1 1 140 140 GLU N N 140 121.432 121.432 121.826 -0.394 17927 15692 1 19 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.195 -0.190 17927 15693 1 19 . 1 1 140 140 GLU C C 140 179.751 179.751 179.298 0.453 17927 15694 1 19 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.181 0.129 17927 15695 1 19 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.616 0.439 17927 15696 1 19 . 1 1 140 140 GLU H H 140 7.868 7.868 8.154 -0.286 17927 15697 1 19 . 1 1 141 141 LEU N N 141 119.968 119.968 118.935 1.033 17927 15698 1 19 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.013 0.003 17927 15699 1 19 . 1 1 141 141 LEU C C 141 179.293 179.293 178.567 0.726 17927 15700 1 19 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.271 0.165 17927 15701 1 19 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.982 -0.799 17927 15702 1 19 . 1 1 141 141 LEU H H 141 8.303 8.303 8.038 0.265 17927 15703 1 19 . 1 1 142 142 LEU N N 142 115.040 115.040 115.012 0.028 17927 15704 1 19 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.418 -0.034 17927 15705 1 19 . 1 1 142 142 LEU C C 142 178.002 178.002 177.689 0.313 17927 15706 1 19 . 1 1 142 142 LEU CA C 142 55.279 55.279 54.421 0.858 17927 15707 1 19 . 1 1 142 142 LEU CB C 142 42.646 42.646 41.692 0.954 17927 15708 1 19 . 1 1 142 142 LEU H H 142 8.230 8.230 7.759 0.471 17927 15709 1 19 . 1 1 143 143 GLY N N 143 108.977 108.977 107.608 1.369 17927 15710 1 19 . 1 1 143 143 GLY C C 143 175.216 175.216 174.993 0.223 17927 15711 1 19 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.960 0.781 17927 15712 1 19 . 1 1 143 143 GLY H H 143 7.762 7.762 7.705 0.057 17927 15713 1 19 . 1 1 144 144 LEU N N 144 119.660 119.660 120.222 -0.562 17927 15714 1 19 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.468 0.019 17927 15715 1 19 . 1 1 144 144 LEU C C 144 177.375 177.375 176.760 0.615 17927 15716 1 19 . 1 1 144 144 LEU CA C 144 54.525 54.525 54.912 -0.387 17927 15717 1 19 . 1 1 144 144 LEU CB C 144 42.773 42.773 41.943 0.830 17927 15718 1 19 . 1 1 144 144 LEU H H 144 8.241 8.241 8.164 0.077 17927 15719 1 19 . 1 1 145 145 GLU N N 145 119.959 119.959 118.851 1.108 17927 15720 1 19 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.245 -0.004 17927 15721 1 19 . 1 1 145 145 GLU C C 145 177.075 177.075 176.592 0.483 17927 15722 1 19 . 1 1 145 145 GLU CA C 145 56.799 56.799 56.555 0.244 17927 15723 1 19 . 1 1 145 145 GLU CB C 145 30.168 30.168 30.358 -0.191 17927 15724 1 19 . 1 1 145 145 GLU H H 145 8.410 8.410 7.724 0.686 17927 15725 1 19 . 1 1 146 146 GLY N N 146 109.412 109.412 109.853 -0.441 17927 15726 1 19 . 1 1 146 146 GLY C C 146 174.276 174.276 173.291 0.985 17927 15727 1 19 . 1 1 146 146 GLY CA C 146 45.445 45.445 44.743 0.702 17927 15728 1 19 . 1 1 146 146 GLY H H 146 8.422 8.422 8.078 0.344 17927 15729 1 19 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.455 0.201 17927 15730 1 19 . 1 1 151 151 HIS C C 151 173.990 173.990 174.010 -0.020 17927 15731 1 19 . 1 1 151 151 HIS CA C 151 56.044 56.044 56.702 -0.658 17927 15732 1 19 . 1 1 151 151 HIS CB C 151 30.076 30.076 29.890 0.186 17927 15733 1 20 . 1 1 2 2 SER HA H 2 4.121 4.121 4.769 -0.648 17927 15734 1 20 . 1 1 2 2 SER CA C 2 57.293 57.293 57.986 -0.693 17927 15735 1 20 . 1 1 2 2 SER CB C 2 63.545 63.545 63.564 -0.019 17927 15736 1 20 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.628 -0.196 17927 15737 1 20 . 1 1 3 3 LEU C C 3 177.383 177.383 176.070 1.313 17927 15738 1 20 . 1 1 3 3 LEU CA C 3 55.575 55.575 55.522 0.053 17927 15739 1 20 . 1 1 3 3 LEU CB C 3 42.584 42.584 45.228 -2.644 17927 15740 1 20 . 1 1 4 4 ARG N N 4 122.080 122.080 123.966 -1.886 17927 15741 1 20 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.306 0.078 17927 15742 1 20 . 1 1 4 4 ARG C C 4 176.410 176.410 175.681 0.729 17927 15743 1 20 . 1 1 4 4 ARG CA C 4 56.269 56.269 57.464 -1.195 17927 15744 1 20 . 1 1 4 4 ARG CB C 4 30.842 30.842 30.256 0.586 17927 15745 1 20 . 1 1 4 4 ARG H H 4 8.410 8.410 8.731 -0.321 17927 15746 1 20 . 1 1 5 5 SER N N 5 117.023 117.023 113.611 3.412 17927 15747 1 20 . 1 1 5 5 SER HA H 5 4.423 4.423 4.606 -0.183 17927 15748 1 20 . 1 1 5 5 SER C C 5 175.039 175.039 175.124 -0.085 17927 15749 1 20 . 1 1 5 5 SER CA C 5 58.605 58.605 58.078 0.527 17927 15750 1 20 . 1 1 5 5 SER CB C 5 64.044 64.044 63.848 0.196 17927 15751 1 20 . 1 1 5 5 SER H H 5 8.292 8.292 7.726 0.566 17927 15752 1 20 . 1 1 6 6 GLY N N 6 110.718 110.718 111.414 -0.696 17927 15753 1 20 . 1 1 6 6 GLY C C 6 173.654 173.654 173.693 -0.039 17927 15754 1 20 . 1 1 6 6 GLY CA C 6 45.273 45.273 46.007 -0.734 17927 15755 1 20 . 1 1 6 6 GLY H H 6 8.446 8.446 8.293 0.153 17927 15756 1 20 . 1 1 7 7 ASN N N 7 119.287 119.287 122.620 -3.333 17927 15757 1 20 . 1 1 7 7 ASN HA H 7 5.024 5.024 5.015 0.009 17927 15758 1 20 . 1 1 7 7 ASN C C 7 173.672 173.672 173.074 0.598 17927 15759 1 20 . 1 1 7 7 ASN CA C 7 51.357 51.357 50.623 0.734 17927 15760 1 20 . 1 1 7 7 ASN CB C 7 38.927 38.927 38.809 0.118 17927 15761 1 20 . 1 1 7 7 ASN H H 7 8.273 8.273 8.073 0.200 17927 15762 1 20 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.628 -0.181 17927 15763 1 20 . 1 1 8 8 PRO C C 8 176.899 176.899 176.212 0.687 17927 15764 1 20 . 1 1 8 8 PRO CA C 8 63.429 63.429 62.831 0.598 17927 15765 1 20 . 1 1 8 8 PRO CB C 8 32.216 32.216 31.212 1.004 17927 15766 1 20 . 1 1 9 9 SER N N 9 115.642 115.642 122.357 -6.715 17927 15767 1 20 . 1 1 9 9 SER HA H 9 4.415 4.415 4.615 -0.200 17927 15768 1 20 . 1 1 9 9 SER C C 9 174.714 174.714 175.204 -0.490 17927 15769 1 20 . 1 1 9 9 SER CA C 9 58.488 58.488 58.603 -0.115 17927 15770 1 20 . 1 1 9 9 SER CB C 9 64.048 64.048 62.041 2.007 17927 15771 1 20 . 1 1 9 9 SER H H 9 8.336 8.336 8.012 0.324 17927 15772 1 20 . 1 1 10 10 ALA N N 10 126.808 126.808 131.567 -4.759 17927 15773 1 20 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.176 0.086 17927 15774 1 20 . 1 1 10 10 ALA C C 10 177.233 177.233 178.134 -0.901 17927 15775 1 20 . 1 1 10 10 ALA CA C 10 53.230 53.230 54.944 -1.714 17927 15776 1 20 . 1 1 10 10 ALA CB C 10 19.187 19.187 17.975 1.212 17927 15777 1 20 . 1 1 10 10 ALA H H 10 8.137 8.137 8.846 -0.709 17927 15778 1 20 . 1 1 11 11 ALA N N 11 120.449 120.449 119.858 0.591 17927 15779 1 20 . 1 1 11 11 ALA HA H 11 4.261 4.261 3.900 0.361 17927 15780 1 20 . 1 1 11 11 ALA C C 11 177.469 177.469 176.069 1.400 17927 15781 1 20 . 1 1 11 11 ALA CA C 11 52.475 52.475 54.375 -1.900 17927 15782 1 20 . 1 1 11 11 ALA CB C 11 19.485 19.485 18.075 1.410 17927 15783 1 20 . 1 1 11 11 ALA H H 11 7.851 7.851 8.699 -0.848 17927 15784 1 20 . 1 1 12 12 SER N N 12 114.186 114.186 114.654 -0.468 17927 15785 1 20 . 1 1 12 12 SER HA H 12 4.312 4.312 4.557 -0.245 17927 15786 1 20 . 1 1 12 12 SER C C 12 173.593 173.593 173.127 0.466 17927 15787 1 20 . 1 1 12 12 SER CA C 12 58.099 58.099 57.741 0.358 17927 15788 1 20 . 1 1 12 12 SER CB C 12 63.320 63.320 64.438 -1.118 17927 15789 1 20 . 1 1 12 12 SER H H 12 7.990 7.990 8.041 -0.051 17927 15790 1 20 . 1 1 13 13 PHE N N 13 118.092 118.092 122.299 -4.207 17927 15791 1 20 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.855 -0.075 17927 15792 1 20 . 1 1 13 13 PHE C C 13 174.220 174.220 173.318 0.902 17927 15793 1 20 . 1 1 13 13 PHE CA C 13 56.717 56.717 56.201 0.516 17927 15794 1 20 . 1 1 13 13 PHE CB C 13 41.151 41.151 41.630 -0.479 17927 15795 1 20 . 1 1 13 13 PHE H H 13 7.147 7.147 7.308 -0.161 17927 15796 1 20 . 1 1 14 14 SER N N 14 116.456 116.456 113.603 2.853 17927 15797 1 20 . 1 1 14 14 SER HA H 14 5.162 5.162 4.933 0.229 17927 15798 1 20 . 1 1 14 14 SER C C 14 172.626 172.626 172.644 -0.018 17927 15799 1 20 . 1 1 14 14 SER CA C 14 57.390 57.390 57.729 -0.339 17927 15800 1 20 . 1 1 14 14 SER CB C 14 64.518 64.518 65.460 -0.942 17927 15801 1 20 . 1 1 14 14 SER H H 14 7.616 7.616 8.023 -0.407 17927 15802 1 20 . 1 1 15 15 TYR N N 15 122.384 122.384 122.483 -0.099 17927 15803 1 20 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.833 0.373 17927 15804 1 20 . 1 1 15 15 TYR C C 15 172.543 172.543 173.325 -0.782 17927 15805 1 20 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.303 -0.357 17927 15806 1 20 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.180 1.047 17927 15807 1 20 . 1 1 15 15 TYR H H 15 8.558 8.558 9.153 -0.595 17927 15808 1 20 . 1 1 16 16 PRO HA H 16 5.109 5.109 5.339 -0.230 17927 15809 1 20 . 1 1 16 16 PRO C C 16 176.475 176.475 176.844 -0.369 17927 15810 1 20 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.085 -0.104 17927 15811 1 20 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.220 0.442 17927 15812 1 20 . 1 1 17 17 ASP N N 17 119.834 119.834 124.614 -4.780 17927 15813 1 20 . 1 1 17 17 ASP HA H 17 5.739 5.739 5.072 0.667 17927 15814 1 20 . 1 1 17 17 ASP C C 17 180.740 180.740 178.918 1.822 17927 15815 1 20 . 1 1 17 17 ASP CA C 17 51.717 51.717 52.952 -1.235 17927 15816 1 20 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.389 -0.828 17927 15817 1 20 . 1 1 17 17 ASP H H 17 8.643 8.643 8.908 -0.265 17927 15818 1 20 . 1 1 18 18 ILE N N 18 118.340 118.340 119.002 -0.662 17927 15819 1 20 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.685 0.766 17927 15820 1 20 . 1 1 18 18 ILE C C 18 175.742 175.742 177.072 -1.330 17927 15821 1 20 . 1 1 18 18 ILE CA C 18 61.894 61.894 64.672 -2.778 17927 15822 1 20 . 1 1 18 18 ILE CB C 18 39.240 39.240 37.489 1.751 17927 15823 1 20 . 1 1 18 18 ILE H H 18 8.450 8.450 8.409 0.041 17927 15824 1 20 . 1 1 19 19 ASN N N 19 119.377 119.377 118.153 1.224 17927 15825 1 20 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.551 0.464 17927 15826 1 20 . 1 1 19 19 ASN C C 19 175.892 175.892 176.224 -0.332 17927 15827 1 20 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.599 -1.292 17927 15828 1 20 . 1 1 19 19 ASN CB C 19 39.825 39.825 39.453 0.372 17927 15829 1 20 . 1 1 19 19 ASN H H 19 8.376 8.376 8.620 -0.244 17927 15830 1 20 . 1 1 20 20 GLY N N 20 109.535 109.535 108.206 1.329 17927 15831 1 20 . 1 1 20 20 GLY C C 20 174.285 174.285 173.245 1.040 17927 15832 1 20 . 1 1 20 20 GLY CA C 20 45.793 45.793 44.840 0.952 17927 15833 1 20 . 1 1 20 20 GLY H H 20 8.539 8.539 8.618 -0.079 17927 15834 1 20 . 1 1 21 21 LYS N N 21 124.675 124.675 120.812 3.863 17927 15835 1 20 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.529 -0.086 17927 15836 1 20 . 1 1 21 21 LYS C C 21 176.537 176.537 175.705 0.832 17927 15837 1 20 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.406 1.038 17927 15838 1 20 . 1 1 21 21 LYS CB C 21 32.754 32.754 33.681 -0.927 17927 15839 1 20 . 1 1 21 21 LYS H H 21 8.608 8.608 7.487 1.121 17927 15840 1 20 . 1 1 22 22 THR N N 22 120.666 120.666 123.004 -2.338 17927 15841 1 20 . 1 1 22 22 THR HA H 22 4.087 4.087 4.356 -0.269 17927 15842 1 20 . 1 1 22 22 THR C C 22 174.431 174.431 173.545 0.886 17927 15843 1 20 . 1 1 22 22 THR CA C 22 64.292 64.292 62.466 1.826 17927 15844 1 20 . 1 1 22 22 THR CB C 22 69.069 69.069 69.009 0.060 17927 15845 1 20 . 1 1 22 22 THR H H 22 8.595 8.595 8.537 0.058 17927 15846 1 20 . 1 1 23 23 VAL N N 23 131.207 131.207 129.913 1.294 17927 15847 1 20 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.503 -0.311 17927 15848 1 20 . 1 1 23 23 VAL C C 23 174.244 174.244 175.242 -0.998 17927 15849 1 20 . 1 1 23 23 VAL CA C 23 62.456 62.456 60.713 1.743 17927 15850 1 20 . 1 1 23 23 VAL CB C 23 33.791 33.791 31.890 1.901 17927 15851 1 20 . 1 1 23 23 VAL H H 23 8.937 8.937 8.932 0.005 17927 15852 1 20 . 1 1 24 24 SER N N 24 120.787 120.787 122.879 -2.092 17927 15853 1 20 . 1 1 24 24 SER HA H 24 5.407 5.407 5.093 0.314 17927 15854 1 20 . 1 1 24 24 SER C C 24 176.169 176.169 174.912 1.257 17927 15855 1 20 . 1 1 24 24 SER CA C 24 55.135 55.135 57.056 -1.921 17927 15856 1 20 . 1 1 24 24 SER CB C 24 65.646 65.646 65.332 0.314 17927 15857 1 20 . 1 1 24 24 SER H H 24 8.554 8.554 8.672 -0.118 17927 15858 1 20 . 1 1 25 25 LEU N N 25 124.332 124.332 122.999 1.333 17927 15859 1 20 . 1 1 25 25 LEU HA H 25 3.687 3.687 3.766 -0.079 17927 15860 1 20 . 1 1 25 25 LEU C C 25 179.364 179.364 178.373 0.991 17927 15861 1 20 . 1 1 25 25 LEU CA C 25 58.217 58.217 57.747 0.470 17927 15862 1 20 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.122 -0.584 17927 15863 1 20 . 1 1 25 25 LEU H H 25 7.811 7.811 8.727 -0.916 17927 15864 1 20 . 1 1 26 26 ALA N N 26 119.799 119.799 118.320 1.479 17927 15865 1 20 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.033 -0.040 17927 15866 1 20 . 1 1 26 26 ALA C C 26 179.719 179.719 177.604 2.115 17927 15867 1 20 . 1 1 26 26 ALA CA C 26 54.663 54.663 53.672 0.991 17927 15868 1 20 . 1 1 26 26 ALA CB C 26 18.323 18.323 18.424 -0.101 17927 15869 1 20 . 1 1 26 26 ALA H H 26 8.099 8.099 8.237 -0.138 17927 15870 1 20 . 1 1 27 27 ASP N N 27 116.553 116.553 117.422 -0.869 17927 15871 1 20 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.494 -0.021 17927 15872 1 20 . 1 1 27 27 ASP C C 27 176.915 176.915 177.315 -0.400 17927 15873 1 20 . 1 1 27 27 ASP CA C 27 56.251 56.251 55.748 0.503 17927 15874 1 20 . 1 1 27 27 ASP CB C 27 40.788 40.788 40.927 -0.139 17927 15875 1 20 . 1 1 27 27 ASP H H 27 7.572 7.572 7.486 0.086 17927 15876 1 20 . 1 1 28 28 LEU N N 28 118.950 118.950 117.026 1.924 17927 15877 1 20 . 1 1 28 28 LEU HA H 28 4.233 4.233 4.457 -0.224 17927 15878 1 20 . 1 1 28 28 LEU C C 28 175.542 175.542 176.314 -0.772 17927 15879 1 20 . 1 1 28 28 LEU CA C 28 53.706 53.706 53.796 -0.090 17927 15880 1 20 . 1 1 28 28 LEU CB C 28 41.049 41.049 42.809 -1.760 17927 15881 1 20 . 1 1 28 28 LEU H H 28 7.363 7.363 7.193 0.170 17927 15882 1 20 . 1 1 29 29 LYS N N 29 118.429 118.429 120.539 -2.110 17927 15883 1 20 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.013 0.339 17927 15884 1 20 . 1 1 29 29 LYS C C 29 178.063 178.063 177.538 0.525 17927 15885 1 20 . 1 1 29 29 LYS CA C 29 57.777 57.777 58.084 -0.307 17927 15886 1 20 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.794 0.646 17927 15887 1 20 . 1 1 29 29 LYS H H 29 6.780 6.780 7.337 -0.557 17927 15888 1 20 . 1 1 30 30 GLY N N 30 112.426 112.426 114.102 -1.676 17927 15889 1 20 . 1 1 30 30 GLY C C 30 173.801 173.801 173.387 0.414 17927 15890 1 20 . 1 1 30 30 GLY CA C 30 44.611 44.611 44.950 -0.339 17927 15891 1 20 . 1 1 30 30 GLY H H 30 9.398 9.398 9.113 0.285 17927 15892 1 20 . 1 1 31 31 LYS N N 31 119.295 119.295 120.965 -1.670 17927 15893 1 20 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.561 -0.409 17927 15894 1 20 . 1 1 31 31 LYS C C 31 173.862 173.862 175.899 -2.037 17927 15895 1 20 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.116 1.072 17927 15896 1 20 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.575 1.393 17927 15897 1 20 . 1 1 31 31 LYS H H 31 7.496 7.496 7.273 0.223 17927 15898 1 20 . 1 1 32 32 TYR N N 32 116.984 116.984 122.819 -5.835 17927 15899 1 20 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.530 -0.373 17927 15900 1 20 . 1 1 32 32 TYR C C 32 175.226 175.226 175.447 -0.221 17927 15901 1 20 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.071 0.519 17927 15902 1 20 . 1 1 32 32 TYR CB C 32 39.121 39.121 38.400 0.721 17927 15903 1 20 . 1 1 32 32 TYR H H 32 7.521 7.521 8.453 -0.932 17927 15904 1 20 . 1 1 33 33 ILE N N 33 118.052 118.052 125.460 -7.408 17927 15905 1 20 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.333 0.574 17927 15906 1 20 . 1 1 33 33 ILE C C 33 174.308 174.308 174.818 -0.510 17927 15907 1 20 . 1 1 33 33 ILE CA C 33 60.702 60.702 60.444 0.258 17927 15908 1 20 . 1 1 33 33 ILE CB C 33 41.616 41.616 38.917 2.699 17927 15909 1 20 . 1 1 33 33 ILE H H 33 8.467 8.467 8.345 0.122 17927 15910 1 20 . 1 1 34 34 TYR N N 34 130.242 130.242 130.343 -0.101 17927 15911 1 20 . 1 1 34 34 TYR HA H 34 5.526 5.526 4.980 0.546 17927 15912 1 20 . 1 1 34 34 TYR C C 34 174.245 174.245 173.653 0.592 17927 15913 1 20 . 1 1 34 34 TYR CA C 34 56.158 56.158 56.731 -0.573 17927 15914 1 20 . 1 1 34 34 TYR CB C 34 40.133 40.133 39.688 0.445 17927 15915 1 20 . 1 1 34 34 TYR H H 34 8.905 8.905 9.119 -0.214 17927 15916 1 20 . 1 1 35 35 ILE N N 35 128.697 128.697 129.751 -1.054 17927 15917 1 20 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.295 0.047 17927 15918 1 20 . 1 1 35 35 ILE C C 35 174.520 174.520 174.211 0.309 17927 15919 1 20 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.804 -0.055 17927 15920 1 20 . 1 1 35 35 ILE CB C 35 40.899 40.899 39.823 1.076 17927 15921 1 20 . 1 1 35 35 ILE H H 35 9.445 9.445 8.700 0.745 17927 15922 1 20 . 1 1 36 36 ASP N N 36 123.675 123.675 127.074 -3.399 17927 15923 1 20 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.750 -0.902 17927 15924 1 20 . 1 1 36 36 ASP C C 36 174.385 174.385 174.899 -0.514 17927 15925 1 20 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.479 -0.185 17927 15926 1 20 . 1 1 36 36 ASP CB C 36 41.778 41.778 45.931 -4.153 17927 15927 1 20 . 1 1 36 36 ASP H H 36 8.875 8.875 8.785 0.090 17927 15928 1 20 . 1 1 37 37 VAL N N 37 127.159 127.159 122.079 5.080 17927 15929 1 20 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.803 0.156 17927 15930 1 20 . 1 1 37 37 VAL C C 37 175.046 175.046 175.698 -0.652 17927 15931 1 20 . 1 1 37 37 VAL CA C 37 62.245 62.245 61.123 1.122 17927 15932 1 20 . 1 1 37 37 VAL CB C 37 31.807 31.807 32.141 -0.334 17927 15933 1 20 . 1 1 37 37 VAL H H 37 8.603 8.603 8.010 0.593 17927 15934 1 20 . 1 1 38 38 TRP N N 38 124.161 124.161 127.834 -3.673 17927 15935 1 20 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.235 0.002 17927 15936 1 20 . 1 1 38 38 TRP C C 38 171.995 171.995 173.801 -1.806 17927 15937 1 20 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.558 1.649 17927 15938 1 20 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.637 2.550 17927 15939 1 20 . 1 1 38 38 TRP H H 38 8.562 8.562 8.345 0.217 17927 15940 1 20 . 1 1 39 39 ALA N N 39 116.252 116.252 126.244 -9.992 17927 15941 1 20 . 1 1 39 39 ALA HA H 39 3.678 3.678 4.097 -0.419 17927 15942 1 20 . 1 1 39 39 ALA C C 39 178.664 178.664 176.949 1.715 17927 15943 1 20 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.188 1.278 17927 15944 1 20 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.348 0.994 17927 15945 1 20 . 1 1 39 39 ALA H H 39 6.757 6.757 7.532 -0.775 17927 15946 1 20 . 1 1 40 40 THR N N 40 114.321 114.321 115.087 -0.766 17927 15947 1 20 . 1 1 40 40 THR HA H 40 3.907 3.907 4.101 -0.194 17927 15948 1 20 . 1 1 40 40 THR C C 40 175.885 175.885 175.075 0.810 17927 15949 1 20 . 1 1 40 40 THR CA C 40 65.447 65.447 64.535 0.912 17927 15950 1 20 . 1 1 40 40 THR CB C 40 70.106 70.106 69.364 0.742 17927 15951 1 20 . 1 1 40 40 THR H H 40 9.639 9.639 8.811 0.828 17927 15952 1 20 . 1 1 41 41 TRP N N 41 114.483 114.483 118.533 -4.050 17927 15953 1 20 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.876 -0.313 17927 15954 1 20 . 1 1 41 41 TRP C C 41 176.189 176.189 175.197 0.992 17927 15955 1 20 . 1 1 41 41 TRP CA C 41 54.698 54.698 53.867 0.831 17927 15956 1 20 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.295 1.682 17927 15957 1 20 . 1 1 41 41 TRP H H 41 6.401 6.401 6.885 -0.484 17927 15958 1 20 . 1 1 42 42 CYS N N 42 123.536 123.536 119.235 4.301 17927 15959 1 20 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.861 -0.293 17927 15960 1 20 . 1 1 42 42 CYS C C 42 175.726 175.726 175.453 0.273 17927 15961 1 20 . 1 1 42 42 CYS CA C 42 58.700 58.700 56.492 2.208 17927 15962 1 20 . 1 1 42 42 CYS CB C 42 27.121 27.121 28.578 -1.457 17927 15963 1 20 . 1 1 42 42 CYS H H 42 6.883 6.883 6.999 -0.116 17927 15964 1 20 . 1 1 43 43 GLY N N 43 120.977 120.977 112.048 8.929 17927 15965 1 20 . 1 1 43 43 GLY CA C 43 49.204 49.204 47.455 1.749 17927 15966 1 20 . 1 1 43 43 GLY H H 43 9.653 9.653 9.010 0.643 17927 15967 1 20 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.255 0.232 17927 15968 1 20 . 1 1 44 44 PRO C C 44 179.956 179.956 178.605 1.351 17927 15969 1 20 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.210 0.432 17927 15970 1 20 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.490 1.088 17927 15971 1 20 . 1 1 45 45 CYS N N 45 113.925 113.925 115.441 -1.516 17927 15972 1 20 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.231 0.082 17927 15973 1 20 . 1 1 45 45 CYS C C 45 178.325 178.325 175.983 2.342 17927 15974 1 20 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.575 1.817 17927 15975 1 20 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.619 0.886 17927 15976 1 20 . 1 1 45 45 CYS H H 45 7.676 7.676 7.781 -0.105 17927 15977 1 20 . 1 1 46 46 ARG N N 46 120.336 120.336 119.116 1.220 17927 15978 1 20 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.254 -0.185 17927 15979 1 20 . 1 1 46 46 ARG C C 46 180.446 180.446 177.696 2.750 17927 15980 1 20 . 1 1 46 46 ARG CA C 46 59.785 59.785 57.466 2.319 17927 15981 1 20 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.828 0.040 17927 15982 1 20 . 1 1 46 46 ARG H H 46 8.109 8.109 7.890 0.219 17927 15983 1 20 . 1 1 47 47 GLY N N 47 105.408 105.408 108.380 -2.972 17927 15984 1 20 . 1 1 47 47 GLY C C 47 175.258 175.258 175.087 0.171 17927 15985 1 20 . 1 1 47 47 GLY CA C 47 46.594 46.594 46.240 0.354 17927 15986 1 20 . 1 1 47 47 GLY H H 47 8.466 8.466 8.296 0.170 17927 15987 1 20 . 1 1 48 48 GLU N N 48 116.343 116.343 120.830 -4.487 17927 15988 1 20 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.437 0.088 17927 15989 1 20 . 1 1 48 48 GLU C C 48 176.535 176.535 178.366 -1.831 17927 15990 1 20 . 1 1 48 48 GLU CA C 48 55.792 55.792 56.841 -1.049 17927 15991 1 20 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.244 1.738 17927 15992 1 20 . 1 1 48 48 GLU H H 48 7.050 7.050 7.823 -0.773 17927 15993 1 20 . 1 1 49 49 LEU N N 49 118.652 118.652 122.862 -4.210 17927 15994 1 20 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.215 -0.063 17927 15995 1 20 . 1 1 49 49 LEU C C 49 176.832 176.832 176.118 0.714 17927 15996 1 20 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.538 -1.193 17927 15997 1 20 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.258 -0.762 17927 15998 1 20 . 1 1 49 49 LEU H H 49 7.385 7.385 7.853 -0.468 17927 15999 1 20 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.160 0.093 17927 16000 1 20 . 1 1 50 50 PRO C C 50 179.744 179.744 178.111 1.633 17927 16001 1 20 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.046 0.513 17927 16002 1 20 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.891 -0.129 17927 16003 1 20 . 1 1 51 51 ALA N N 51 120.418 120.418 119.327 1.091 17927 16004 1 20 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.148 -0.003 17927 16005 1 20 . 1 1 51 51 ALA C C 51 180.329 180.329 179.627 0.702 17927 16006 1 20 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.674 -0.240 17927 16007 1 20 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.310 0.060 17927 16008 1 20 . 1 1 51 51 ALA H H 51 7.731 7.731 7.871 -0.140 17927 16009 1 20 . 1 1 52 52 LEU N N 52 121.506 121.506 119.990 1.516 17927 16010 1 20 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.872 0.116 17927 16011 1 20 . 1 1 52 52 LEU C C 52 177.944 177.944 178.272 -0.328 17927 16012 1 20 . 1 1 52 52 LEU CA C 52 58.327 58.327 58.149 0.178 17927 16013 1 20 . 1 1 52 52 LEU CB C 52 42.382 42.382 42.107 0.275 17927 16014 1 20 . 1 1 52 52 LEU H H 52 8.355 8.355 8.354 0.000 17927 16015 1 20 . 1 1 53 53 LYS N N 53 119.732 119.732 118.051 1.681 17927 16016 1 20 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.892 0.011 17927 16017 1 20 . 1 1 53 53 LYS C C 53 179.030 179.030 178.776 0.254 17927 16018 1 20 . 1 1 53 53 LYS CA C 53 59.846 59.846 59.634 0.212 17927 16019 1 20 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.692 0.519 17927 16020 1 20 . 1 1 53 53 LYS H H 53 8.148 8.148 7.867 0.281 17927 16021 1 20 . 1 1 54 54 GLU N N 54 117.779 117.779 120.446 -2.667 17927 16022 1 20 . 1 1 54 54 GLU HA H 54 4.059 4.059 4.216 -0.157 17927 16023 1 20 . 1 1 54 54 GLU C C 54 179.646 179.646 179.259 0.387 17927 16024 1 20 . 1 1 54 54 GLU CA C 54 59.625 59.625 58.842 0.783 17927 16025 1 20 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.361 0.206 17927 16026 1 20 . 1 1 54 54 GLU H H 54 7.585 7.585 7.718 -0.133 17927 16027 1 20 . 1 1 55 55 LEU N N 55 120.581 120.581 119.984 0.597 17927 16028 1 20 . 1 1 55 55 LEU HA H 55 4.193 4.193 3.805 0.388 17927 16029 1 20 . 1 1 55 55 LEU C C 55 178.557 178.557 178.524 0.033 17927 16030 1 20 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.720 0.515 17927 16031 1 20 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.282 1.729 17927 16032 1 20 . 1 1 55 55 LEU H H 55 8.096 8.096 8.008 0.088 17927 16033 1 20 . 1 1 56 56 GLU N N 56 118.023 118.023 119.171 -1.148 17927 16034 1 20 . 1 1 56 56 GLU HA H 56 3.177 3.177 4.149 -0.972 17927 16035 1 20 . 1 1 56 56 GLU C C 56 179.650 179.650 179.004 0.646 17927 16036 1 20 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.326 -0.455 17927 16037 1 20 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.325 -2.340 17927 16038 1 20 . 1 1 56 56 GLU H H 56 8.181 8.181 7.586 0.595 17927 16039 1 20 . 1 1 57 57 GLU N N 57 117.828 117.828 118.160 -0.332 17927 16040 1 20 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.109 -0.005 17927 16041 1 20 . 1 1 57 57 GLU C C 57 179.700 179.700 178.393 1.307 17927 16042 1 20 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.375 0.652 17927 16043 1 20 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.566 0.099 17927 16044 1 20 . 1 1 57 57 GLU H H 57 7.762 7.762 8.212 -0.450 17927 16045 1 20 . 1 1 58 58 LYS N N 58 120.896 120.896 119.233 1.663 17927 16046 1 20 . 1 1 58 58 LYS HA H 58 3.979 3.979 4.074 -0.095 17927 16047 1 20 . 1 1 58 58 LYS C C 58 178.715 178.715 177.990 0.725 17927 16048 1 20 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.200 0.878 17927 16049 1 20 . 1 1 58 58 LYS CB C 58 32.980 32.980 32.910 0.070 17927 16050 1 20 . 1 1 58 58 LYS H H 58 8.410 8.410 7.629 0.781 17927 16051 1 20 . 1 1 59 59 TYR N N 59 113.713 113.713 116.914 -3.201 17927 16052 1 20 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.534 -0.222 17927 16053 1 20 . 1 1 59 59 TYR C C 59 175.025 175.025 174.876 0.149 17927 16054 1 20 . 1 1 59 59 TYR CA C 59 58.973 58.973 58.445 0.528 17927 16055 1 20 . 1 1 59 59 TYR CB C 59 37.434 37.434 39.229 -1.795 17927 16056 1 20 . 1 1 59 59 TYR H H 59 8.102 8.102 8.113 -0.011 17927 16057 1 20 . 1 1 60 60 ALA N N 60 126.637 126.637 122.710 3.927 17927 16058 1 20 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.261 0.157 17927 16059 1 20 . 1 1 60 60 ALA C C 60 179.208 179.208 177.503 1.705 17927 16060 1 20 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.937 0.597 17927 16061 1 20 . 1 1 60 60 ALA CB C 60 18.589 18.589 18.101 0.488 17927 16062 1 20 . 1 1 60 60 ALA H H 60 7.201 7.201 7.485 -0.284 17927 16063 1 20 . 1 1 61 61 GLY N N 61 111.816 111.816 112.240 -0.424 17927 16064 1 20 . 1 1 61 61 GLY C C 61 174.698 174.698 174.387 0.311 17927 16065 1 20 . 1 1 61 61 GLY CA C 61 45.904 45.904 44.872 1.032 17927 16066 1 20 . 1 1 61 61 GLY H H 61 9.184 9.184 8.377 0.807 17927 16067 1 20 . 1 1 62 62 LYS N N 62 118.497 118.497 120.996 -2.499 17927 16068 1 20 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.713 0.166 17927 16069 1 20 . 1 1 62 62 LYS C C 62 179.019 179.019 175.557 3.462 17927 16070 1 20 . 1 1 62 62 LYS CA C 62 53.988 53.988 54.388 -0.400 17927 16071 1 20 . 1 1 62 62 LYS CB C 62 33.840 33.840 33.576 0.264 17927 16072 1 20 . 1 1 62 62 LYS H H 62 8.019 8.019 7.764 0.255 17927 16073 1 20 . 1 1 63 63 ASP N N 63 122.982 122.982 121.342 1.640 17927 16074 1 20 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.777 -0.250 17927 16075 1 20 . 1 1 63 63 ASP C C 63 174.065 174.065 174.775 -0.710 17927 16076 1 20 . 1 1 63 63 ASP CA C 63 55.055 55.055 54.320 0.735 17927 16077 1 20 . 1 1 63 63 ASP CB C 63 38.582 38.582 39.718 -1.136 17927 16078 1 20 . 1 1 63 63 ASP H H 63 8.709 8.709 8.557 0.152 17927 16079 1 20 . 1 1 64 64 ILE N N 64 122.219 122.219 121.068 1.151 17927 16080 1 20 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.725 -0.118 17927 16081 1 20 . 1 1 64 64 ILE C C 64 174.627 174.627 172.965 1.662 17927 16082 1 20 . 1 1 64 64 ILE CA C 64 59.712 59.712 60.013 -0.300 17927 16083 1 20 . 1 1 64 64 ILE CB C 64 42.133 42.133 42.155 -0.022 17927 16084 1 20 . 1 1 64 64 ILE H H 64 8.678 8.678 7.537 1.141 17927 16085 1 20 . 1 1 65 65 HIS N N 65 125.584 125.584 119.755 5.829 17927 16086 1 20 . 1 1 65 65 HIS HA H 65 5.043 5.043 5.323 -0.280 17927 16087 1 20 . 1 1 65 65 HIS C C 65 174.153 174.153 173.625 0.528 17927 16088 1 20 . 1 1 65 65 HIS CA C 65 54.959 54.959 53.886 1.073 17927 16089 1 20 . 1 1 65 65 HIS CB C 65 34.156 34.156 33.543 0.613 17927 16090 1 20 . 1 1 65 65 HIS H H 65 9.204 9.204 8.855 0.349 17927 16091 1 20 . 1 1 66 66 PHE N N 66 123.244 123.244 122.126 1.118 17927 16092 1 20 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.977 0.233 17927 16093 1 20 . 1 1 66 66 PHE C C 66 175.463 175.463 174.367 1.096 17927 16094 1 20 . 1 1 66 66 PHE CA C 66 58.088 58.088 57.588 0.500 17927 16095 1 20 . 1 1 66 66 PHE CB C 66 39.637 39.637 39.679 -0.042 17927 16096 1 20 . 1 1 66 66 PHE H H 66 9.262 9.262 10.117 -0.855 17927 16097 1 20 . 1 1 67 67 VAL N N 67 126.201 126.201 124.447 1.754 17927 16098 1 20 . 1 1 67 67 VAL HA H 67 4.834 4.834 5.171 -0.337 17927 16099 1 20 . 1 1 67 67 VAL C C 67 174.364 174.364 175.274 -0.910 17927 16100 1 20 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.330 0.394 17927 16101 1 20 . 1 1 67 67 VAL CB C 67 34.893 34.893 34.048 0.845 17927 16102 1 20 . 1 1 67 67 VAL H H 67 8.843 8.843 9.349 -0.506 17927 16103 1 20 . 1 1 68 68 SER N N 68 124.528 124.528 122.533 1.995 17927 16104 1 20 . 1 1 68 68 SER HA H 68 5.585 5.585 5.592 -0.007 17927 16105 1 20 . 1 1 68 68 SER C C 68 172.858 172.858 172.475 0.383 17927 16106 1 20 . 1 1 68 68 SER CA C 68 57.282 57.282 57.382 -0.100 17927 16107 1 20 . 1 1 68 68 SER CB C 68 65.032 65.032 65.248 -0.216 17927 16108 1 20 . 1 1 68 68 SER H H 68 9.243 9.243 8.814 0.429 17927 16109 1 20 . 1 1 69 69 LEU N N 69 126.695 126.695 126.071 0.624 17927 16110 1 20 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.605 -1.088 17927 16111 1 20 . 1 1 69 69 LEU C C 69 174.652 174.652 175.005 -0.353 17927 16112 1 20 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.280 -0.453 17927 16113 1 20 . 1 1 69 69 LEU CB C 69 43.895 43.895 46.227 -2.332 17927 16114 1 20 . 1 1 69 69 LEU H H 69 9.360 9.360 9.194 0.166 17927 16115 1 20 . 1 1 70 70 SER N N 70 116.379 116.379 120.300 -3.921 17927 16116 1 20 . 1 1 70 70 SER HA H 70 4.905 4.905 5.113 -0.208 17927 16117 1 20 . 1 1 70 70 SER C C 70 176.307 176.307 174.885 1.422 17927 16118 1 20 . 1 1 70 70 SER CA C 70 55.213 55.213 55.985 -0.772 17927 16119 1 20 . 1 1 70 70 SER CB C 70 63.519 63.519 63.909 -0.390 17927 16120 1 20 . 1 1 70 70 SER H H 70 7.981 7.981 8.965 -0.984 17927 16121 1 20 . 1 1 71 71 CYS N N 71 124.670 124.670 128.459 -3.789 17927 16122 1 20 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.466 0.492 17927 16123 1 20 . 1 1 71 71 CYS C C 71 173.996 173.996 174.352 -0.356 17927 16124 1 20 . 1 1 71 71 CYS CA C 71 55.483 55.483 58.565 -3.082 17927 16125 1 20 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.064 1.048 17927 16126 1 20 . 1 1 71 71 CYS H H 71 8.609 8.609 8.978 -0.369 17927 16127 1 20 . 1 1 72 72 ASP N N 72 122.398 122.398 121.711 0.687 17927 16128 1 20 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.830 -0.538 17927 16129 1 20 . 1 1 72 72 ASP C C 72 176.653 176.653 176.631 0.022 17927 16130 1 20 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.321 1.461 17927 16131 1 20 . 1 1 72 72 ASP CB C 72 41.526 41.526 41.806 -0.280 17927 16132 1 20 . 1 1 72 72 ASP H H 72 8.557 8.557 7.390 1.167 17927 16133 1 20 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.280 -0.215 17927 16134 1 20 . 1 1 73 73 LYS C C 73 176.545 176.545 176.162 0.383 17927 16135 1 20 . 1 1 73 73 LYS CA C 73 58.458 58.458 57.825 0.633 17927 16136 1 20 . 1 1 73 73 LYS CB C 73 32.641 32.641 33.189 -0.548 17927 16137 1 20 . 1 1 74 74 ASN N N 74 117.616 117.616 119.514 -1.898 17927 16138 1 20 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.767 0.138 17927 16139 1 20 . 1 1 74 74 ASN C C 74 174.894 174.894 175.854 -0.960 17927 16140 1 20 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.399 -0.878 17927 16141 1 20 . 1 1 74 74 ASN CB C 74 38.109 38.109 36.847 1.262 17927 16142 1 20 . 1 1 74 74 ASN H H 74 8.625 8.625 8.174 0.451 17927 16143 1 20 . 1 1 75 75 LYS N N 75 126.797 126.797 124.630 2.167 17927 16144 1 20 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.692 -0.269 17927 16145 1 20 . 1 1 75 75 LYS C C 75 178.058 178.058 177.792 0.266 17927 16146 1 20 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.158 0.015 17927 16147 1 20 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.491 0.800 17927 16148 1 20 . 1 1 75 75 LYS H H 75 8.588 8.588 8.212 0.376 17927 16149 1 20 . 1 1 76 76 LYS N N 76 117.875 117.875 120.030 -2.155 17927 16150 1 20 . 1 1 76 76 LYS HA H 76 4.200 4.200 4.408 -0.208 17927 16151 1 20 . 1 1 76 76 LYS C C 76 178.791 178.791 178.820 -0.029 17927 16152 1 20 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.574 -0.966 17927 16153 1 20 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.874 -0.384 17927 16154 1 20 . 1 1 76 76 LYS H H 76 8.041 8.041 8.541 -0.500 17927 16155 1 20 . 1 1 77 77 ALA N N 77 121.567 121.567 121.609 -0.042 17927 16156 1 20 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.205 -0.082 17927 16157 1 20 . 1 1 77 77 ALA C C 77 181.191 181.191 179.742 1.449 17927 16158 1 20 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.661 0.296 17927 16159 1 20 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.032 -0.273 17927 16160 1 20 . 1 1 77 77 ALA H H 77 7.366 7.366 8.255 -0.889 17927 16161 1 20 . 1 1 78 78 TRP N N 78 119.497 119.497 120.919 -1.422 17927 16162 1 20 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.180 -0.103 17927 16163 1 20 . 1 1 78 78 TRP C C 78 175.942 175.942 177.041 -1.099 17927 16164 1 20 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.284 2.477 17927 16165 1 20 . 1 1 78 78 TRP CB C 78 27.272 27.272 30.047 -2.775 17927 16166 1 20 . 1 1 78 78 TRP H H 78 7.187 7.187 8.425 -1.238 17927 16167 1 20 . 1 1 79 79 GLU N N 79 118.771 118.771 119.031 -0.260 17927 16168 1 20 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.456 -0.442 17927 16169 1 20 . 1 1 79 79 GLU C C 79 179.863 179.863 178.165 1.698 17927 16170 1 20 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.665 -0.555 17927 16171 1 20 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.965 1.255 17927 16172 1 20 . 1 1 79 79 GLU H H 79 8.813 8.813 8.853 -0.040 17927 16173 1 20 . 1 1 80 80 ASN N N 80 115.964 115.964 117.758 -1.794 17927 16174 1 20 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.496 -0.157 17927 16175 1 20 . 1 1 80 80 ASN C C 80 176.749 176.749 177.484 -0.735 17927 16176 1 20 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.445 0.590 17927 16177 1 20 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.358 0.130 17927 16178 1 20 . 1 1 80 80 ASN H H 80 8.491 8.491 7.863 0.628 17927 16179 1 20 . 1 1 81 81 MET N N 81 119.670 119.670 120.307 -0.637 17927 16180 1 20 . 1 1 81 81 MET HA H 81 4.149 4.149 4.157 -0.008 17927 16181 1 20 . 1 1 81 81 MET C C 81 177.933 177.933 177.742 0.191 17927 16182 1 20 . 1 1 81 81 MET CA C 81 60.276 60.276 58.978 1.298 17927 16183 1 20 . 1 1 81 81 MET CB C 81 32.518 32.518 32.824 -0.306 17927 16184 1 20 . 1 1 81 81 MET H H 81 7.667 7.667 7.658 0.009 17927 16185 1 20 . 1 1 82 82 VAL N N 82 117.634 117.634 118.714 -1.080 17927 16186 1 20 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.556 -0.253 17927 16187 1 20 . 1 1 82 82 VAL C C 82 179.005 179.005 177.466 1.539 17927 16188 1 20 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.467 0.570 17927 16189 1 20 . 1 1 82 82 VAL CB C 82 31.765 31.765 30.989 0.776 17927 16190 1 20 . 1 1 82 82 VAL H H 82 8.338 8.338 8.120 0.218 17927 16191 1 20 . 1 1 83 83 THR N N 83 110.519 110.519 116.007 -5.488 17927 16192 1 20 . 1 1 83 83 THR HA H 83 3.983 3.983 3.974 0.009 17927 16193 1 20 . 1 1 83 83 THR C C 83 177.591 177.591 176.697 0.894 17927 16194 1 20 . 1 1 83 83 THR CA C 83 65.431 65.431 66.753 -1.322 17927 16195 1 20 . 1 1 83 83 THR CB C 83 69.156 69.156 68.439 0.717 17927 16196 1 20 . 1 1 83 83 THR H H 83 7.659 7.659 7.534 0.125 17927 16197 1 20 . 1 1 84 84 LYS N N 84 123.927 123.927 120.315 3.612 17927 16198 1 20 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.141 -0.072 17927 16199 1 20 . 1 1 84 84 LYS C C 84 178.582 178.582 178.153 0.429 17927 16200 1 20 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.220 1.657 17927 16201 1 20 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.183 0.140 17927 16202 1 20 . 1 1 84 84 LYS H H 84 8.665 8.665 7.709 0.956 17927 16203 1 20 . 1 1 85 85 ASP N N 85 116.280 116.280 116.864 -0.584 17927 16204 1 20 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.651 0.099 17927 16205 1 20 . 1 1 85 85 ASP C C 85 175.086 175.086 175.869 -0.783 17927 16206 1 20 . 1 1 85 85 ASP CA C 85 54.693 54.693 55.098 -0.405 17927 16207 1 20 . 1 1 85 85 ASP CB C 85 39.685 39.685 41.168 -1.483 17927 16208 1 20 . 1 1 85 85 ASP H H 85 8.179 8.179 8.195 -0.016 17927 16209 1 20 . 1 1 86 86 GLN N N 86 116.258 116.258 113.442 2.816 17927 16210 1 20 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.861 0.047 17927 16211 1 20 . 1 1 86 86 GLN C C 86 175.659 175.659 175.578 0.081 17927 16212 1 20 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.397 -0.226 17927 16213 1 20 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.201 0.089 17927 16214 1 20 . 1 1 86 86 GLN H H 86 7.431 7.431 7.744 -0.313 17927 16215 1 20 . 1 1 87 87 LEU N N 87 117.031 117.031 119.958 -2.927 17927 16216 1 20 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.168 -0.078 17927 16217 1 20 . 1 1 87 87 LEU C C 87 178.225 178.225 176.413 1.812 17927 16218 1 20 . 1 1 87 87 LEU CA C 87 55.932 55.932 55.724 0.208 17927 16219 1 20 . 1 1 87 87 LEU CB C 87 41.202 41.202 40.623 0.579 17927 16220 1 20 . 1 1 87 87 LEU H H 87 7.736 7.736 7.468 0.268 17927 16221 1 20 . 1 1 88 88 LYS N N 88 122.367 122.367 123.742 -1.375 17927 16222 1 20 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.428 0.208 17927 16223 1 20 . 1 1 88 88 LYS C C 88 177.538 177.538 176.683 0.855 17927 16224 1 20 . 1 1 88 88 LYS CA C 88 54.930 54.930 55.014 -0.084 17927 16225 1 20 . 1 1 88 88 LYS CB C 88 33.316 33.316 33.750 -0.434 17927 16226 1 20 . 1 1 88 88 LYS H H 88 8.496 8.496 8.152 0.344 17927 16227 1 20 . 1 1 89 89 GLY N N 89 108.452 108.452 106.825 1.627 17927 16228 1 20 . 1 1 89 89 GLY C C 89 173.781 173.781 173.483 0.298 17927 16229 1 20 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.563 0.795 17927 16230 1 20 . 1 1 89 89 GLY H H 89 8.497 8.497 8.106 0.391 17927 16231 1 20 . 1 1 90 90 ILE N N 90 123.295 123.295 123.672 -0.377 17927 16232 1 20 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.200 0.171 17927 16233 1 20 . 1 1 90 90 ILE C C 90 175.606 175.606 174.605 1.001 17927 16234 1 20 . 1 1 90 90 ILE CA C 90 62.001 62.001 59.342 2.659 17927 16235 1 20 . 1 1 90 90 ILE CB C 90 38.036 38.036 36.561 1.475 17927 16236 1 20 . 1 1 90 90 ILE H H 90 8.728 8.728 7.854 0.874 17927 16237 1 20 . 1 1 91 91 GLN N N 91 128.632 128.632 126.560 2.072 17927 16238 1 20 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.370 0.396 17927 16239 1 20 . 1 1 91 91 GLN C C 91 174.618 174.618 174.621 -0.003 17927 16240 1 20 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.620 1.230 17927 16241 1 20 . 1 1 91 91 GLN CB C 91 28.341 28.341 28.814 -0.473 17927 16242 1 20 . 1 1 91 91 GLN H H 91 8.762 8.762 8.563 0.199 17927 16243 1 20 . 1 1 92 92 LEU N N 92 120.830 120.830 124.575 -3.745 17927 16244 1 20 . 1 1 92 92 LEU HA H 92 5.580 5.580 4.798 0.782 17927 16245 1 20 . 1 1 92 92 LEU C C 92 176.828 176.828 175.570 1.258 17927 16246 1 20 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.944 -1.143 17927 16247 1 20 . 1 1 92 92 LEU CB C 92 44.210 44.210 44.348 -0.138 17927 16248 1 20 . 1 1 92 92 LEU H H 92 9.011 9.011 9.150 -0.139 17927 16249 1 20 . 1 1 93 93 HIS N N 93 121.481 121.481 123.275 -1.794 17927 16250 1 20 . 1 1 93 93 HIS HA H 93 3.931 3.931 4.998 -1.067 17927 16251 1 20 . 1 1 93 93 HIS C C 93 173.590 173.590 173.775 -0.185 17927 16252 1 20 . 1 1 93 93 HIS CA C 93 56.583 56.583 54.723 1.860 17927 16253 1 20 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.578 -1.329 17927 16254 1 20 . 1 1 93 93 HIS H H 93 8.038 8.038 9.108 -1.070 17927 16255 1 20 . 1 1 94 94 MET N N 94 121.881 121.881 126.946 -5.065 17927 16256 1 20 . 1 1 94 94 MET HA H 94 3.866 3.866 4.659 -0.793 17927 16257 1 20 . 1 1 94 94 MET C C 94 177.035 177.035 174.635 2.400 17927 16258 1 20 . 1 1 94 94 MET CA C 94 55.189 55.189 53.841 1.348 17927 16259 1 20 . 1 1 94 94 MET CB C 94 33.993 33.993 33.114 0.880 17927 16260 1 20 . 1 1 94 94 MET H H 94 8.039 8.039 8.631 -0.592 17927 16261 1 20 . 1 1 95 95 GLY N N 95 104.041 104.041 114.248 -10.207 17927 16262 1 20 . 1 1 95 95 GLY C C 95 174.251 174.251 174.264 -0.013 17927 16263 1 20 . 1 1 95 95 GLY CA C 95 46.580 46.580 45.252 1.327 17927 16264 1 20 . 1 1 95 95 GLY H H 95 5.666 5.666 8.833 -3.167 17927 16265 1 20 . 1 1 96 96 THR N N 96 114.114 114.114 113.988 0.126 17927 16266 1 20 . 1 1 96 96 THR HA H 96 4.211 4.211 3.861 0.350 17927 16267 1 20 . 1 1 96 96 THR C C 96 175.122 175.122 174.310 0.812 17927 16268 1 20 . 1 1 96 96 THR CA C 96 61.339 61.339 64.049 -2.710 17927 16269 1 20 . 1 1 96 96 THR CB C 96 68.615 68.615 67.991 0.624 17927 16270 1 20 . 1 1 96 96 THR H H 96 8.517 8.517 8.352 0.165 17927 16271 1 20 . 1 1 97 97 ASP N N 97 121.892 121.892 120.475 1.417 17927 16272 1 20 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.675 -0.090 17927 16273 1 20 . 1 1 97 97 ASP C C 97 178.241 178.241 176.606 1.635 17927 16274 1 20 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.594 1.206 17927 16275 1 20 . 1 1 97 97 ASP CB C 97 43.129 43.129 39.440 3.689 17927 16276 1 20 . 1 1 97 97 ASP H H 97 7.563 7.563 8.590 -1.027 17927 16277 1 20 . 1 1 98 98 ARG N N 98 127.508 127.508 118.658 8.850 17927 16278 1 20 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.451 -0.059 17927 16279 1 20 . 1 1 98 98 ARG C C 98 176.724 176.724 177.404 -0.680 17927 16280 1 20 . 1 1 98 98 ARG CA C 98 55.939 55.939 56.863 -0.924 17927 16281 1 20 . 1 1 98 98 ARG CB C 98 30.291 30.291 28.758 1.533 17927 16282 1 20 . 1 1 98 98 ARG H H 98 9.225 9.225 7.720 1.505 17927 16283 1 20 . 1 1 99 99 THR N N 99 116.384 116.384 115.978 0.406 17927 16284 1 20 . 1 1 99 99 THR HA H 99 3.987 3.987 4.039 -0.052 17927 16285 1 20 . 1 1 99 99 THR C C 99 176.969 176.969 176.129 0.840 17927 16286 1 20 . 1 1 99 99 THR CA C 99 67.714 67.714 66.210 1.504 17927 16287 1 20 . 1 1 99 99 THR CB C 99 68.777 68.777 68.210 0.567 17927 16288 1 20 . 1 1 99 99 THR H H 99 8.382 8.382 8.003 0.379 17927 16289 1 20 . 1 1 100 100 PHE N N 100 123.232 123.232 123.119 0.113 17927 16290 1 20 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.218 -0.045 17927 16291 1 20 . 1 1 100 100 PHE C C 100 177.010 177.010 176.588 0.422 17927 16292 1 20 . 1 1 100 100 PHE CA C 100 61.923 61.923 61.548 0.375 17927 16293 1 20 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.364 1.398 17927 16294 1 20 . 1 1 100 100 PHE H H 100 7.998 7.998 7.996 0.002 17927 16295 1 20 . 1 1 101 101 MET N N 101 115.968 115.968 120.266 -4.298 17927 16296 1 20 . 1 1 101 101 MET HA H 101 3.975 3.975 3.943 0.032 17927 16297 1 20 . 1 1 101 101 MET C C 101 178.763 178.763 177.448 1.315 17927 16298 1 20 . 1 1 101 101 MET CA C 101 58.552 58.552 59.303 -0.751 17927 16299 1 20 . 1 1 101 101 MET CB C 101 32.593 32.593 32.484 0.109 17927 16300 1 20 . 1 1 101 101 MET H H 101 7.828 7.828 8.175 -0.347 17927 16301 1 20 . 1 1 102 102 ASP N N 102 117.553 117.553 119.064 -1.511 17927 16302 1 20 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.396 0.126 17927 16303 1 20 . 1 1 102 102 ASP C C 102 179.503 179.503 178.125 1.378 17927 16304 1 20 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.064 -0.174 17927 16305 1 20 . 1 1 102 102 ASP CB C 102 39.926 39.926 41.007 -1.081 17927 16306 1 20 . 1 1 102 102 ASP H H 102 8.828 8.828 8.113 0.715 17927 16307 1 20 . 1 1 103 103 ALA N N 103 122.984 122.984 121.646 1.338 17927 16308 1 20 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.141 -0.155 17927 16309 1 20 . 1 1 103 103 ALA C C 103 178.782 178.782 179.244 -0.462 17927 16310 1 20 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.397 0.697 17927 16311 1 20 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.633 -0.070 17927 16312 1 20 . 1 1 103 103 ALA H H 103 7.567 7.567 7.610 -0.043 17927 16313 1 20 . 1 1 104 104 TYR N N 104 112.159 112.159 115.638 -3.479 17927 16314 1 20 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.316 -0.092 17927 16315 1 20 . 1 1 104 104 TYR C C 104 173.821 173.821 175.423 -1.602 17927 16316 1 20 . 1 1 104 104 TYR CA C 104 58.498 58.498 59.275 -0.777 17927 16317 1 20 . 1 1 104 104 TYR CB C 104 38.393 38.393 38.715 -0.322 17927 16318 1 20 . 1 1 104 104 TYR H H 104 7.203 7.203 7.889 -0.686 17927 16319 1 20 . 1 1 105 105 LEU N N 105 119.433 119.433 115.617 3.816 17927 16320 1 20 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.951 0.034 17927 16321 1 20 . 1 1 105 105 LEU C C 105 176.721 176.721 177.084 -0.363 17927 16322 1 20 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.406 0.379 17927 16323 1 20 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.551 -1.108 17927 16324 1 20 . 1 1 105 105 LEU H H 105 7.582 7.582 7.489 0.093 17927 16325 1 20 . 1 1 106 106 ILE N N 106 119.575 119.575 115.821 3.754 17927 16326 1 20 . 1 1 106 106 ILE HA H 106 4.002 4.002 4.127 -0.125 17927 16327 1 20 . 1 1 106 106 ILE C C 106 175.459 175.459 174.773 0.686 17927 16328 1 20 . 1 1 106 106 ILE CA C 106 62.043 62.043 60.830 1.213 17927 16329 1 20 . 1 1 106 106 ILE CB C 106 36.335 36.335 35.359 0.976 17927 16330 1 20 . 1 1 106 106 ILE H H 106 8.774 8.774 7.676 1.098 17927 16331 1 20 . 1 1 107 107 ASN N N 107 126.514 126.514 121.622 4.892 17927 16332 1 20 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.740 0.123 17927 16333 1 20 . 1 1 107 107 ASN C C 107 174.584 174.584 176.730 -2.146 17927 16334 1 20 . 1 1 107 107 ASN CA C 107 53.112 53.112 53.789 -0.677 17927 16335 1 20 . 1 1 107 107 ASN CB C 107 38.977 38.977 38.603 0.374 17927 16336 1 20 . 1 1 107 107 ASN H H 107 8.364 8.364 8.248 0.116 17927 16337 1 20 . 1 1 108 108 GLY N N 108 108.469 108.469 110.124 -1.655 17927 16338 1 20 . 1 1 108 108 GLY C C 108 171.245 171.245 173.140 -1.895 17927 16339 1 20 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.478 0.791 17927 16340 1 20 . 1 1 108 108 GLY H H 108 7.678 7.678 8.244 -0.566 17927 16341 1 20 . 1 1 109 109 ILE N N 109 112.817 112.817 118.776 -5.959 17927 16342 1 20 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.523 -0.117 17927 16343 1 20 . 1 1 109 109 ILE C C 109 173.498 173.498 173.846 -0.348 17927 16344 1 20 . 1 1 109 109 ILE CA C 109 58.384 58.384 57.549 0.835 17927 16345 1 20 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.464 1.858 17927 16346 1 20 . 1 1 109 109 ILE H H 109 7.868 7.868 7.429 0.439 17927 16347 1 20 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.385 0.357 17927 16348 1 20 . 1 1 110 110 PRO C C 110 175.715 175.715 175.747 -0.032 17927 16349 1 20 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.613 -0.336 17927 16350 1 20 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.394 3.974 17927 16351 1 20 . 1 1 111 111 ARG N N 111 122.358 122.358 120.544 1.814 17927 16352 1 20 . 1 1 111 111 ARG HA H 111 4.469 4.469 3.994 0.475 17927 16353 1 20 . 1 1 111 111 ARG C C 111 171.541 171.541 174.627 -3.086 17927 16354 1 20 . 1 1 111 111 ARG CA C 111 54.356 54.356 53.746 0.610 17927 16355 1 20 . 1 1 111 111 ARG CB C 111 33.430 33.430 33.249 0.181 17927 16356 1 20 . 1 1 111 111 ARG H H 111 7.732 7.732 8.340 -0.608 17927 16357 1 20 . 1 1 112 112 PHE N N 112 125.103 125.103 121.955 3.148 17927 16358 1 20 . 1 1 112 112 PHE HA H 112 5.773 5.773 4.938 0.835 17927 16359 1 20 . 1 1 112 112 PHE C C 112 175.097 175.097 175.428 -0.331 17927 16360 1 20 . 1 1 112 112 PHE CA C 112 55.791 55.791 56.471 -0.680 17927 16361 1 20 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.583 1.345 17927 16362 1 20 . 1 1 112 112 PHE H H 112 8.929 8.929 8.193 0.736 17927 16363 1 20 . 1 1 113 113 ILE N N 113 123.778 123.778 122.261 1.517 17927 16364 1 20 . 1 1 113 113 ILE HA H 113 4.543 4.543 5.030 -0.487 17927 16365 1 20 . 1 1 113 113 ILE C C 113 173.197 173.197 174.062 -0.865 17927 16366 1 20 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.983 0.303 17927 16367 1 20 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.921 1.325 17927 16368 1 20 . 1 1 113 113 ILE H H 113 8.873 8.873 9.041 -0.168 17927 16369 1 20 . 1 1 114 114 LEU N N 114 127.146 127.146 126.116 1.030 17927 16370 1 20 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.295 0.719 17927 16371 1 20 . 1 1 114 114 LEU C C 114 175.080 175.080 174.514 0.566 17927 16372 1 20 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.623 -0.222 17927 16373 1 20 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.558 0.812 17927 16374 1 20 . 1 1 114 114 LEU H H 114 8.974 8.974 9.170 -0.196 17927 16375 1 20 . 1 1 115 115 LEU N N 115 128.323 128.323 125.441 2.882 17927 16376 1 20 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.098 0.334 17927 16377 1 20 . 1 1 115 115 LEU C C 115 176.660 176.660 175.737 0.923 17927 16378 1 20 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.789 -0.712 17927 16379 1 20 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.344 -1.760 17927 16380 1 20 . 1 1 115 115 LEU H H 115 9.874 9.874 9.183 0.691 17927 16381 1 20 . 1 1 116 116 ASP N N 116 119.834 119.834 121.706 -1.872 17927 16382 1 20 . 1 1 116 116 ASP HA H 116 4.935 4.935 4.377 0.558 17927 16383 1 20 . 1 1 116 116 ASP C C 116 176.898 176.898 177.230 -0.332 17927 16384 1 20 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.872 -1.567 17927 16385 1 20 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.584 -1.556 17927 16386 1 20 . 1 1 116 116 ASP H H 116 9.357 9.357 8.762 0.595 17927 16387 1 20 . 1 1 117 117 ARG N N 117 113.356 113.356 121.689 -8.333 17927 16388 1 20 . 1 1 117 117 ARG HA H 117 3.717 3.717 3.892 -0.175 17927 16389 1 20 . 1 1 117 117 ARG C C 117 177.105 177.105 178.293 -1.188 17927 16390 1 20 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.325 -1.140 17927 16391 1 20 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.879 0.558 17927 16392 1 20 . 1 1 117 117 ARG H H 117 7.697 7.697 7.717 -0.020 17927 16393 1 20 . 1 1 118 118 ASP N N 118 117.226 117.226 117.096 0.130 17927 16394 1 20 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.435 0.460 17927 16395 1 20 . 1 1 118 118 ASP C C 118 176.657 176.657 176.329 0.328 17927 16396 1 20 . 1 1 118 118 ASP CA C 118 53.517 53.517 55.024 -1.507 17927 16397 1 20 . 1 1 118 118 ASP CB C 118 42.556 42.556 41.092 1.464 17927 16398 1 20 . 1 1 118 118 ASP H H 118 8.456 8.456 8.119 0.337 17927 16399 1 20 . 1 1 119 119 GLY N N 119 109.074 109.074 107.079 1.995 17927 16400 1 20 . 1 1 119 119 GLY C C 119 173.355 173.355 174.052 -0.697 17927 16401 1 20 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.382 0.874 17927 16402 1 20 . 1 1 119 119 GLY H H 119 8.183 8.183 8.062 0.121 17927 16403 1 20 . 1 1 120 120 LYS N N 120 120.744 120.744 120.410 0.334 17927 16404 1 20 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.751 -0.218 17927 16405 1 20 . 1 1 120 120 LYS C C 120 177.229 177.229 176.191 1.038 17927 16406 1 20 . 1 1 120 120 LYS CA C 120 55.287 55.287 53.480 1.807 17927 16407 1 20 . 1 1 120 120 LYS CB C 120 32.581 32.581 33.106 -0.525 17927 16408 1 20 . 1 1 120 120 LYS H H 120 8.449 8.449 7.493 0.956 17927 16409 1 20 . 1 1 121 121 ILE N N 121 121.221 121.221 128.015 -6.794 17927 16410 1 20 . 1 1 121 121 ILE HA H 121 3.886 3.886 4.003 -0.117 17927 16411 1 20 . 1 1 121 121 ILE C C 121 177.819 177.819 176.895 0.924 17927 16412 1 20 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.236 0.679 17927 16413 1 20 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.028 2.362 17927 16414 1 20 . 1 1 121 121 ILE H H 121 8.715 8.715 9.199 -0.484 17927 16415 1 20 . 1 1 122 122 ILE N N 122 127.165 127.165 129.124 -1.959 17927 16416 1 20 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.207 0.134 17927 16417 1 20 . 1 1 122 122 ILE C C 122 176.978 176.978 176.703 0.275 17927 16418 1 20 . 1 1 122 122 ILE CA C 122 63.719 63.719 62.359 1.360 17927 16419 1 20 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.215 0.437 17927 16420 1 20 . 1 1 122 122 ILE H H 122 8.974 8.974 8.578 0.396 17927 16421 1 20 . 1 1 123 123 SER N N 123 111.227 111.227 115.677 -4.450 17927 16422 1 20 . 1 1 123 123 SER HA H 123 4.738 4.738 4.807 -0.069 17927 16423 1 20 . 1 1 123 123 SER C C 123 174.184 174.184 173.600 0.584 17927 16424 1 20 . 1 1 123 123 SER CA C 123 57.383 57.383 57.019 0.364 17927 16425 1 20 . 1 1 123 123 SER CB C 123 65.326 65.326 65.270 0.055 17927 16426 1 20 . 1 1 123 123 SER H H 123 7.850 7.850 8.180 -0.330 17927 16427 1 20 . 1 1 124 124 ALA N N 124 131.373 131.373 127.435 3.938 17927 16428 1 20 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.282 0.203 17927 16429 1 20 . 1 1 124 124 ALA C C 124 175.147 175.147 175.893 -0.746 17927 16430 1 20 . 1 1 124 124 ALA CA C 124 53.035 53.035 53.896 -0.861 17927 16431 1 20 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.081 -0.419 17927 16432 1 20 . 1 1 124 124 ALA H H 124 9.384 9.384 8.896 0.488 17927 16433 1 20 . 1 1 125 125 ASN N N 125 119.476 119.476 114.399 5.077 17927 16434 1 20 . 1 1 125 125 ASN HA H 125 5.056 5.056 4.987 0.069 17927 16435 1 20 . 1 1 125 125 ASN C C 125 173.593 173.593 174.352 -0.759 17927 16436 1 20 . 1 1 125 125 ASN CA C 125 52.352 52.352 51.081 1.271 17927 16437 1 20 . 1 1 125 125 ASN CB C 125 38.304 38.304 38.363 -0.059 17927 16438 1 20 . 1 1 125 125 ASN H H 125 8.191 8.191 7.838 0.353 17927 16439 1 20 . 1 1 126 126 MET N N 126 122.705 122.705 122.201 0.504 17927 16440 1 20 . 1 1 126 126 MET HA H 126 4.585 4.585 4.905 -0.320 17927 16441 1 20 . 1 1 126 126 MET C C 126 175.215 175.215 175.513 -0.298 17927 16442 1 20 . 1 1 126 126 MET CA C 126 53.849 53.849 53.838 0.011 17927 16443 1 20 . 1 1 126 126 MET CB C 126 31.312 31.312 35.119 -3.807 17927 16444 1 20 . 1 1 126 126 MET H H 126 8.376 8.376 8.966 -0.590 17927 16445 1 20 . 1 1 127 127 THR N N 127 111.016 111.016 116.290 -5.274 17927 16446 1 20 . 1 1 127 127 THR HA H 127 4.291 4.291 4.396 -0.105 17927 16447 1 20 . 1 1 127 127 THR C C 127 174.574 174.574 173.635 0.939 17927 16448 1 20 . 1 1 127 127 THR CA C 127 62.085 62.085 60.638 1.447 17927 16449 1 20 . 1 1 127 127 THR CB C 127 69.733 69.733 70.168 -0.435 17927 16450 1 20 . 1 1 127 127 THR H H 127 7.714 7.714 8.226 -0.512 17927 16451 1 20 . 1 1 128 128 ARG N N 128 118.722 118.722 125.703 -6.981 17927 16452 1 20 . 1 1 128 128 ARG HA H 128 3.308 3.308 3.267 0.041 17927 16453 1 20 . 1 1 128 128 ARG C C 128 176.978 176.978 175.980 0.998 17927 16454 1 20 . 1 1 128 128 ARG CA C 128 54.727 54.727 56.479 -1.752 17927 16455 1 20 . 1 1 128 128 ARG CB C 128 29.598 29.598 29.806 -0.208 17927 16456 1 20 . 1 1 128 128 ARG H H 128 8.658 8.658 7.574 1.084 17927 16457 1 20 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.252 -0.319 17927 16458 1 20 . 1 1 129 129 PRO C C 129 175.794 175.794 176.656 -0.862 17927 16459 1 20 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.512 1.037 17927 16460 1 20 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.899 -0.222 17927 16461 1 20 . 1 1 130 130 SER N N 130 108.696 108.696 108.757 -0.061 17927 16462 1 20 . 1 1 130 130 SER HA H 130 3.988 3.988 4.465 -0.477 17927 16463 1 20 . 1 1 130 130 SER C C 130 174.445 174.445 174.042 0.403 17927 16464 1 20 . 1 1 130 130 SER CA C 130 58.911 58.911 57.943 0.968 17927 16465 1 20 . 1 1 130 130 SER CB C 130 62.680 62.680 62.492 0.188 17927 16466 1 20 . 1 1 130 130 SER H H 130 8.375 8.375 7.859 0.516 17927 16467 1 20 . 1 1 131 131 ASP N N 131 126.377 126.377 123.123 3.254 17927 16468 1 20 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.973 -0.101 17927 16469 1 20 . 1 1 131 131 ASP C C 131 176.879 176.879 175.113 1.766 17927 16470 1 20 . 1 1 131 131 ASP CA C 131 51.195 51.195 51.256 -0.061 17927 16471 1 20 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.905 -0.089 17927 16472 1 20 . 1 1 131 131 ASP H H 131 7.514 7.514 7.643 -0.129 17927 16473 1 20 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.113 0.279 17927 16474 1 20 . 1 1 132 132 PRO C C 132 178.097 178.097 178.269 -0.172 17927 16475 1 20 . 1 1 132 132 PRO CA C 132 65.079 65.079 65.067 0.012 17927 16476 1 20 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.083 0.326 17927 16477 1 20 . 1 1 133 133 LYS N N 133 116.306 116.306 116.600 -0.294 17927 16478 1 20 . 1 1 133 133 LYS HA H 133 3.958 3.958 4.170 -0.212 17927 16479 1 20 . 1 1 133 133 LYS C C 133 179.532 179.532 178.672 0.860 17927 16480 1 20 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.488 -0.967 17927 16481 1 20 . 1 1 133 133 LYS CB C 133 32.191 32.191 32.099 0.092 17927 16482 1 20 . 1 1 133 133 LYS H H 133 8.842 8.842 8.473 0.369 17927 16483 1 20 . 1 1 134 134 THR N N 134 120.833 120.833 115.879 4.954 17927 16484 1 20 . 1 1 134 134 THR HA H 134 3.147 3.147 3.692 -0.545 17927 16485 1 20 . 1 1 134 134 THR C C 134 173.356 173.356 175.355 -1.999 17927 16486 1 20 . 1 1 134 134 THR CA C 134 66.383 66.383 65.718 0.665 17927 16487 1 20 . 1 1 134 134 THR CB C 134 66.847 66.847 68.131 -1.284 17927 16488 1 20 . 1 1 134 134 THR H H 134 8.292 8.292 7.376 0.916 17927 16489 1 20 . 1 1 135 135 ALA N N 135 121.720 121.720 123.391 -1.671 17927 16490 1 20 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.758 -0.175 17927 16491 1 20 . 1 1 135 135 ALA C C 135 178.902 178.902 179.163 -0.261 17927 16492 1 20 . 1 1 135 135 ALA CA C 135 54.999 54.999 55.010 -0.011 17927 16493 1 20 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.250 -0.475 17927 16494 1 20 . 1 1 135 135 ALA H H 135 7.030 7.030 7.659 -0.629 17927 16495 1 20 . 1 1 136 136 GLU N N 136 114.623 114.623 116.527 -1.904 17927 16496 1 20 . 1 1 136 136 GLU HA H 136 3.922 3.922 4.089 -0.167 17927 16497 1 20 . 1 1 136 136 GLU C C 136 179.199 179.199 178.588 0.611 17927 16498 1 20 . 1 1 136 136 GLU CA C 136 59.837 59.837 58.425 1.412 17927 16499 1 20 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.161 0.625 17927 16500 1 20 . 1 1 136 136 GLU H H 136 7.216 7.216 8.192 -0.976 17927 16501 1 20 . 1 1 137 137 LYS N N 137 120.789 120.789 121.504 -0.715 17927 16502 1 20 . 1 1 137 137 LYS HA H 137 4.204 4.204 4.053 0.151 17927 16503 1 20 . 1 1 137 137 LYS C C 137 178.834 178.834 178.327 0.507 17927 16504 1 20 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.176 -0.833 17927 16505 1 20 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.670 -1.207 17927 16506 1 20 . 1 1 137 137 LYS H H 137 7.681 7.681 7.293 0.388 17927 16507 1 20 . 1 1 138 138 PHE N N 138 118.373 118.373 117.589 0.784 17927 16508 1 20 . 1 1 138 138 PHE HA H 138 4.033 4.033 3.919 0.114 17927 16509 1 20 . 1 1 138 138 PHE C C 138 178.027 178.027 177.703 0.324 17927 16510 1 20 . 1 1 138 138 PHE CA C 138 57.507 57.507 59.915 -2.408 17927 16511 1 20 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.309 -1.421 17927 16512 1 20 . 1 1 138 138 PHE H H 138 8.059 8.059 7.476 0.583 17927 16513 1 20 . 1 1 139 139 ASN N N 139 117.611 117.611 116.657 0.954 17927 16514 1 20 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.561 -0.157 17927 16515 1 20 . 1 1 139 139 ASN C C 139 178.190 178.190 177.382 0.808 17927 16516 1 20 . 1 1 139 139 ASN CA C 139 56.224 56.224 55.883 0.341 17927 16517 1 20 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.719 -0.985 17927 16518 1 20 . 1 1 139 139 ASN H H 139 8.683 8.683 8.142 0.541 17927 16519 1 20 . 1 1 140 140 GLU N N 140 121.432 121.432 122.177 -0.745 17927 16520 1 20 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.234 -0.229 17927 16521 1 20 . 1 1 140 140 GLU C C 140 179.751 179.751 178.839 0.912 17927 16522 1 20 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.029 0.281 17927 16523 1 20 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.686 0.369 17927 16524 1 20 . 1 1 140 140 GLU H H 140 7.868 7.868 7.870 -0.002 17927 16525 1 20 . 1 1 141 141 LEU N N 141 119.968 119.968 118.813 1.155 17927 16526 1 20 . 1 1 141 141 LEU HA H 141 4.016 4.016 3.919 0.097 17927 16527 1 20 . 1 1 141 141 LEU C C 141 179.293 179.293 179.220 0.073 17927 16528 1 20 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.188 0.248 17927 16529 1 20 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.792 -0.609 17927 16530 1 20 . 1 1 141 141 LEU H H 141 8.303 8.303 7.900 0.403 17927 16531 1 20 . 1 1 142 142 LEU N N 142 115.040 115.040 114.489 0.551 17927 16532 1 20 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.333 0.051 17927 16533 1 20 . 1 1 142 142 LEU C C 142 178.002 178.002 177.465 0.537 17927 16534 1 20 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.230 0.049 17927 16535 1 20 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.374 0.272 17927 16536 1 20 . 1 1 142 142 LEU H H 142 8.230 8.230 8.132 0.098 17927 16537 1 20 . 1 1 143 143 GLY N N 143 108.977 108.977 107.247 1.730 17927 16538 1 20 . 1 1 143 143 GLY C C 143 175.216 175.216 174.824 0.392 17927 16539 1 20 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.718 1.023 17927 16540 1 20 . 1 1 143 143 GLY H H 143 7.762 7.762 7.757 0.005 17927 16541 1 20 . 1 1 144 144 LEU N N 144 119.660 119.660 120.415 -0.755 17927 16542 1 20 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.666 -0.178 17927 16543 1 20 . 1 1 144 144 LEU C C 144 177.375 177.375 176.352 1.023 17927 16544 1 20 . 1 1 144 144 LEU CA C 144 54.525 54.525 54.133 0.393 17927 16545 1 20 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.600 0.173 17927 16546 1 20 . 1 1 144 144 LEU H H 144 8.241 8.241 8.277 -0.036 17927 16547 1 20 . 1 1 145 145 GLU N N 145 119.959 119.959 119.470 0.489 17927 16548 1 20 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.305 -0.064 17927 16549 1 20 . 1 1 145 145 GLU C C 145 177.075 177.075 177.182 -0.107 17927 16550 1 20 . 1 1 145 145 GLU CA C 145 56.799 56.799 56.927 -0.128 17927 16551 1 20 . 1 1 145 145 GLU CB C 145 30.168 30.168 30.348 -0.180 17927 16552 1 20 . 1 1 145 145 GLU H H 145 8.410 8.410 7.850 0.560 17927 16553 1 20 . 1 1 146 146 GLY N N 146 109.412 109.412 112.629 -3.217 17927 16554 1 20 . 1 1 146 146 GLY C C 146 174.276 174.276 173.265 1.011 17927 16555 1 20 . 1 1 146 146 GLY CA C 146 45.445 45.445 44.867 0.578 17927 16556 1 20 . 1 1 146 146 GLY H H 146 8.422 8.422 8.678 -0.256 17927 16557 1 20 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.566 0.090 17927 16558 1 20 . 1 1 151 151 HIS C C 151 173.990 173.990 173.959 0.031 17927 16559 1 20 . 1 1 151 151 HIS CA C 151 56.044 56.044 56.294 -0.251 17927 16560 1 20 . 1 1 151 151 HIS CB C 151 30.076 30.076 29.996 0.080 17927 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 135 3.163 0.360 3.154 17927 2 1 1 "Average Difference" HA 158 0.354 -0.020 0.355 17927 3 1 1 "Average Difference" C 144 1.087 -0.295 1.050 17927 4 1 1 "Average Difference" CA 146 1.183 -0.098 1.183 17927 5 1 1 "Average Difference" CB 134 1.346 -0.117 1.346 17927 6 1 1 "Average Difference" HN 135 0.598 -0.035 0.599 17927 7 1 2 "Average Difference" N 135 3.275 0.210 3.281 17927 8 1 2 "Average Difference" HA 158 0.370 -0.016 0.371 17927 9 1 2 "Average Difference" C 144 1.104 -0.292 1.068 17927 10 1 2 "Average Difference" CA 146 1.214 -0.156 1.209 17927 11 1 2 "Average Difference" CB 134 1.296 -0.152 1.291 17927 12 1 2 "Average Difference" HN 135 0.646 -0.044 0.647 17927 13 1 3 "Average Difference" N 135 3.243 -0.075 3.254 17927 14 1 3 "Average Difference" HA 158 0.353 -0.037 0.352 17927 15 1 3 "Average Difference" C 144 1.127 -0.287 1.093 17927 16 1 3 "Average Difference" CA 146 1.097 -0.176 1.087 17927 17 1 3 "Average Difference" CB 134 1.202 0.049 1.205 17927 18 1 3 "Average Difference" HN 135 0.601 -0.028 0.603 17927 19 1 4 "Average Difference" N 135 3.350 -0.003 3.362 17927 20 1 4 "Average Difference" HA 158 0.368 0.013 0.369 17927 21 1 4 "Average Difference" C 144 1.117 -0.298 1.080 17927 22 1 4 "Average Difference" CA 146 1.237 -0.288 1.207 17927 23 1 4 "Average Difference" CB 134 1.285 -0.015 1.289 17927 24 1 4 "Average Difference" HN 135 0.615 -0.095 0.610 17927 25 1 5 "Average Difference" N 135 3.012 0.068 3.022 17927 26 1 5 "Average Difference" HA 158 0.381 -0.030 0.381 17927 27 1 5 "Average Difference" C 144 1.169 -0.296 1.135 17927 28 1 5 "Average Difference" CA 146 1.127 -0.157 1.120 17927 29 1 5 "Average Difference" CB 134 1.248 -0.096 1.249 17927 30 1 5 "Average Difference" HN 135 0.650 -0.075 0.648 17927 31 1 6 "Average Difference" N 135 3.007 0.268 3.006 17927 32 1 6 "Average Difference" HA 158 0.343 -0.010 0.344 17927 33 1 6 "Average Difference" C 144 1.130 -0.316 1.089 17927 34 1 6 "Average Difference" CA 146 1.136 -0.213 1.119 17927 35 1 6 "Average Difference" CB 134 1.254 -0.014 1.259 17927 36 1 6 "Average Difference" HN 135 0.598 -0.043 0.599 17927 37 1 7 "Average Difference" N 135 3.325 0.191 3.332 17927 38 1 7 "Average Difference" HA 158 0.339 -0.018 0.340 17927 39 1 7 "Average Difference" C 144 1.077 -0.273 1.045 17927 40 1 7 "Average Difference" CA 146 1.207 -0.221 1.191 17927 41 1 7 "Average Difference" CB 134 1.296 -0.085 1.298 17927 42 1 7 "Average Difference" HN 135 0.571 -0.019 0.573 17927 43 1 8 "Average Difference" N 135 3.396 0.360 3.389 17927 44 1 8 "Average Difference" HA 158 0.381 -0.016 0.382 17927 45 1 8 "Average Difference" C 144 1.099 -0.258 1.072 17927 46 1 8 "Average Difference" CA 146 1.106 -0.148 1.100 17927 47 1 8 "Average Difference" CB 134 1.393 -0.123 1.393 17927 48 1 8 "Average Difference" HN 135 0.628 -0.040 0.629 17927 49 1 9 "Average Difference" N 135 3.421 -0.052 3.433 17927 50 1 9 "Average Difference" HA 158 0.365 -0.009 0.366 17927 51 1 9 "Average Difference" C 144 1.113 -0.358 1.058 17927 52 1 9 "Average Difference" CA 146 1.161 -0.223 1.144 17927 53 1 9 "Average Difference" CB 134 1.265 -0.059 1.268 17927 54 1 9 "Average Difference" HN 135 0.606 -0.080 0.603 17927 55 1 10 "Average Difference" N 135 3.310 0.278 3.311 17927 56 1 10 "Average Difference" HA 158 0.367 -0.040 0.366 17927 57 1 10 "Average Difference" C 144 1.084 -0.388 1.016 17927 58 1 10 "Average Difference" CA 146 1.177 -0.167 1.169 17927 59 1 10 "Average Difference" CB 134 1.211 -0.105 1.211 17927 60 1 10 "Average Difference" HN 135 0.601 -0.028 0.603 17927 61 1 11 "Average Difference" N 135 3.303 0.306 3.301 17927 62 1 11 "Average Difference" HA 158 0.359 -0.014 0.359 17927 63 1 11 "Average Difference" C 144 1.074 -0.253 1.047 17927 64 1 11 "Average Difference" CA 146 1.205 -0.103 1.205 17927 65 1 11 "Average Difference" CB 134 1.339 -0.113 1.339 17927 66 1 11 "Average Difference" HN 135 0.594 -0.034 0.595 17927 67 1 12 "Average Difference" N 135 3.469 0.064 3.481 17927 68 1 12 "Average Difference" HA 158 0.359 -0.044 0.357 17927 69 1 12 "Average Difference" C 144 1.056 -0.279 1.022 17927 70 1 12 "Average Difference" CA 146 1.302 -0.100 1.303 17927 71 1 12 "Average Difference" CB 134 1.290 -0.218 1.276 17927 72 1 12 "Average Difference" HN 135 0.612 -0.070 0.611 17927 73 1 13 "Average Difference" N 135 3.420 0.406 3.408 17927 74 1 13 "Average Difference" HA 158 0.348 -0.023 0.349 17927 75 1 13 "Average Difference" C 144 1.100 -0.292 1.064 17927 76 1 13 "Average Difference" CA 146 1.241 -0.144 1.237 17927 77 1 13 "Average Difference" CB 134 1.241 -0.089 1.242 17927 78 1 13 "Average Difference" HN 135 0.602 -0.068 0.601 17927 79 1 14 "Average Difference" N 135 3.153 0.169 3.161 17927 80 1 14 "Average Difference" HA 158 0.338 -0.013 0.339 17927 81 1 14 "Average Difference" C 144 1.138 -0.291 1.104 17927 82 1 14 "Average Difference" CA 146 1.230 -0.144 1.226 17927 83 1 14 "Average Difference" CB 134 1.283 -0.071 1.286 17927 84 1 14 "Average Difference" HN 135 0.644 -0.047 0.645 17927 85 1 15 "Average Difference" N 135 3.215 -0.086 3.226 17927 86 1 15 "Average Difference" HA 158 0.336 -0.018 0.336 17927 87 1 15 "Average Difference" C 144 1.045 -0.259 1.016 17927 88 1 15 "Average Difference" CA 146 1.135 -0.164 1.127 17927 89 1 15 "Average Difference" CB 134 1.208 -0.074 1.210 17927 90 1 15 "Average Difference" HN 135 0.588 -0.026 0.590 17927 91 1 16 "Average Difference" N 135 3.091 0.193 3.097 17927 92 1 16 "Average Difference" HA 158 0.368 -0.024 0.369 17927 93 1 16 "Average Difference" C 144 1.125 -0.322 1.082 17927 94 1 16 "Average Difference" CA 146 1.117 -0.123 1.114 17927 95 1 16 "Average Difference" CB 134 1.348 -0.060 1.352 17927 96 1 16 "Average Difference" HN 135 0.627 -0.054 0.627 17927 97 1 17 "Average Difference" N 135 3.340 0.184 3.347 17927 98 1 17 "Average Difference" HA 158 0.345 0.002 0.346 17927 99 1 17 "Average Difference" C 144 1.078 -0.296 1.040 17927 100 1 17 "Average Difference" CA 146 1.126 -0.217 1.109 17927 101 1 17 "Average Difference" CB 134 1.285 -0.070 1.288 17927 102 1 17 "Average Difference" HN 135 0.633 -0.057 0.633 17927 103 1 18 "Average Difference" N 135 3.077 0.042 3.088 17927 104 1 18 "Average Difference" HA 158 0.324 -0.012 0.324 17927 105 1 18 "Average Difference" C 144 1.079 -0.219 1.060 17927 106 1 18 "Average Difference" CA 146 1.251 -0.189 1.240 17927 107 1 18 "Average Difference" CB 134 1.223 -0.156 1.217 17927 108 1 18 "Average Difference" HN 135 0.593 -0.084 0.590 17927 109 1 19 "Average Difference" N 135 3.252 0.010 3.264 17927 110 1 19 "Average Difference" HA 158 0.337 0.002 0.338 17927 111 1 19 "Average Difference" C 144 1.114 -0.288 1.079 17927 112 1 19 "Average Difference" CA 146 1.095 -0.250 1.070 17927 113 1 19 "Average Difference" CB 134 1.241 -0.016 1.246 17927 114 1 19 "Average Difference" HN 135 0.584 -0.068 0.582 17927 115 1 20 "Average Difference" N 135 3.353 0.528 3.323 17927 116 1 20 "Average Difference" HA 158 0.354 -0.003 0.355 17927 117 1 20 "Average Difference" C 144 1.065 -0.292 1.028 17927 118 1 20 "Average Difference" CA 146 1.076 -0.189 1.062 17927 119 1 20 "Average Difference" CB 134 1.233 -0.137 1.230 17927 120 1 20 "Average Difference" HN 135 0.608 -0.029 0.610 17927 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 17927 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 SER HA H 2 4.121 4.121 4.601 -0.480 17927 2 1 . 1 1 2 2 SER CA C 2 57.293 57.293 58.583 -1.290 17927 3 1 . 1 1 2 2 SER CB C 2 63.545 63.545 63.531 0.014 17927 4 1 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.464 -0.032 17927 5 1 . 1 1 3 3 LEU C C 3 177.383 177.383 176.555 0.828 17927 6 1 . 1 1 3 3 LEU CA C 3 55.575 55.575 55.388 0.187 17927 7 1 . 1 1 3 3 LEU CB C 3 42.584 42.584 41.818 0.766 17927 8 1 . 1 1 4 4 ARG N N 4 122.080 122.080 120.936 1.144 17927 9 1 . 1 1 4 4 ARG HA H 4 4.384 4.384 4.305 0.079 17927 10 1 . 1 1 4 4 ARG C C 4 176.410 176.410 175.907 0.503 17927 11 1 . 1 1 4 4 ARG CA C 4 56.269 56.269 56.615 -0.346 17927 12 1 . 1 1 4 4 ARG CB C 4 30.842 30.842 30.509 0.333 17927 13 1 . 1 1 4 4 ARG H H 4 8.410 8.410 8.336 0.074 17927 14 1 . 1 1 5 5 SER N N 5 117.023 117.023 115.319 1.704 17927 15 1 . 1 1 5 5 SER HA H 5 4.423 4.423 4.529 -0.106 17927 16 1 . 1 1 5 5 SER C C 5 175.039 175.039 174.748 0.291 17927 17 1 . 1 1 5 5 SER CA C 5 58.605 58.605 58.551 0.054 17927 18 1 . 1 1 5 5 SER CB C 5 64.044 64.044 63.754 0.290 17927 19 1 . 1 1 5 5 SER H H 5 8.292 8.292 8.120 0.172 17927 20 1 . 1 1 6 6 GLY N N 6 110.718 110.718 111.495 -0.777 17927 21 1 . 1 1 6 6 GLY C C 6 173.654 173.654 173.230 0.424 17927 22 1 . 1 1 6 6 GLY CA C 6 45.273 45.273 45.170 0.103 17927 23 1 . 1 1 6 6 GLY H H 6 8.446 8.446 8.388 0.058 17927 24 1 . 1 1 7 7 ASN N N 7 119.287 119.287 119.415 -0.128 17927 25 1 . 1 1 7 7 ASN HA H 7 5.024 5.024 4.969 0.055 17927 26 1 . 1 1 7 7 ASN C C 7 173.672 173.672 173.376 0.295 17927 27 1 . 1 1 7 7 ASN CA C 7 51.357 51.357 51.670 -0.313 17927 28 1 . 1 1 7 7 ASN CB C 7 38.927 38.927 39.315 -0.388 17927 29 1 . 1 1 7 7 ASN H H 7 8.273 8.273 8.129 0.144 17927 30 1 . 1 1 8 8 PRO HA H 8 4.447 4.447 4.538 -0.091 17927 31 1 . 1 1 8 8 PRO C C 8 176.899 176.899 176.710 0.189 17927 32 1 . 1 1 8 8 PRO CA C 8 63.429 63.429 63.485 -0.056 17927 33 1 . 1 1 8 8 PRO CB C 8 32.216 32.216 32.008 0.208 17927 34 1 . 1 1 9 9 SER N N 9 115.642 115.642 116.590 -0.948 17927 35 1 . 1 1 9 9 SER HA H 9 4.415 4.415 4.498 -0.083 17927 36 1 . 1 1 9 9 SER C C 9 174.714 174.714 175.026 -0.312 17927 37 1 . 1 1 9 9 SER CA C 9 58.488 58.488 58.469 0.019 17927 38 1 . 1 1 9 9 SER CB C 9 64.048 64.048 63.564 0.484 17927 39 1 . 1 1 9 9 SER H H 9 8.336 8.336 8.269 0.067 17927 40 1 . 1 1 10 10 ALA N N 10 126.808 126.808 125.549 1.259 17927 41 1 . 1 1 10 10 ALA HA H 10 4.262 4.262 4.559 -0.297 17927 42 1 . 1 1 10 10 ALA C C 10 177.233 177.233 177.059 0.174 17927 43 1 . 1 1 10 10 ALA CA C 10 53.230 53.230 53.662 -0.432 17927 44 1 . 1 1 10 10 ALA CB C 10 19.187 19.187 17.840 1.347 17927 45 1 . 1 1 10 10 ALA H H 10 8.137 8.137 8.747 -0.611 17927 46 1 . 1 1 11 11 ALA N N 11 120.449 120.449 122.004 -1.555 17927 47 1 . 1 1 11 11 ALA HA H 11 4.261 4.261 4.467 -0.206 17927 48 1 . 1 1 11 11 ALA C C 11 177.469 177.469 176.615 0.854 17927 49 1 . 1 1 11 11 ALA CA C 11 52.475 52.475 52.183 0.292 17927 50 1 . 1 1 11 11 ALA CB C 11 19.485 19.485 19.418 0.067 17927 51 1 . 1 1 11 11 ALA H H 11 7.851 7.851 7.997 -0.146 17927 52 1 . 1 1 12 12 SER N N 12 114.186 114.186 114.269 -0.083 17927 53 1 . 1 1 12 12 SER HA H 12 4.312 4.312 4.253 0.059 17927 54 1 . 1 1 12 12 SER C C 12 173.593 173.593 173.398 0.195 17927 55 1 . 1 1 12 12 SER CA C 12 58.099 58.099 58.430 -0.331 17927 56 1 . 1 1 12 12 SER CB C 12 63.320 63.320 63.051 0.269 17927 57 1 . 1 1 12 12 SER H H 12 7.990 7.990 8.152 -0.162 17927 58 1 . 1 1 13 13 PHE N N 13 118.092 118.092 119.821 -1.729 17927 59 1 . 1 1 13 13 PHE HA H 13 4.780 4.780 4.654 0.126 17927 60 1 . 1 1 13 13 PHE C C 13 174.220 174.220 173.819 0.401 17927 61 1 . 1 1 13 13 PHE CA C 13 56.717 56.717 56.333 0.384 17927 62 1 . 1 1 13 13 PHE CB C 13 41.151 41.151 40.582 0.569 17927 63 1 . 1 1 13 13 PHE H H 13 7.147 7.147 7.491 -0.344 17927 64 1 . 1 1 14 14 SER N N 14 116.456 116.456 115.129 1.327 17927 65 1 . 1 1 14 14 SER HA H 14 5.162 5.162 5.031 0.132 17927 66 1 . 1 1 14 14 SER C C 14 172.626 172.626 172.818 -0.192 17927 67 1 . 1 1 14 14 SER CA C 14 57.390 57.390 57.462 -0.072 17927 68 1 . 1 1 14 14 SER CB C 14 64.518 64.518 64.975 -0.457 17927 69 1 . 1 1 14 14 SER H H 14 7.616 7.616 8.085 -0.469 17927 70 1 . 1 1 15 15 TYR N N 15 122.384 122.384 123.405 -1.021 17927 71 1 . 1 1 15 15 TYR HA H 15 5.206 5.206 4.930 0.276 17927 72 1 . 1 1 15 15 TYR C C 15 172.543 172.543 173.223 -0.680 17927 73 1 . 1 1 15 15 TYR CA C 15 55.946 55.946 56.270 -0.324 17927 74 1 . 1 1 15 15 TYR CB C 15 43.227 43.227 42.197 1.030 17927 75 1 . 1 1 15 15 TYR H H 15 8.558 8.558 9.197 -0.639 17927 76 1 . 1 1 16 16 PRO HA H 16 5.109 5.109 4.953 0.156 17927 77 1 . 1 1 16 16 PRO C C 16 176.475 176.475 176.461 0.014 17927 78 1 . 1 1 16 16 PRO CA C 16 61.981 61.981 62.224 -0.243 17927 79 1 . 1 1 16 16 PRO CB C 16 32.662 32.662 32.114 0.548 17927 80 1 . 1 1 17 17 ASP N N 17 119.834 119.834 125.051 -5.217 17927 81 1 . 1 1 17 17 ASP HA H 17 5.739 5.739 4.960 0.779 17927 82 1 . 1 1 17 17 ASP C C 17 180.740 180.740 178.327 2.413 17927 83 1 . 1 1 17 17 ASP CA C 17 51.717 51.717 53.705 -1.988 17927 84 1 . 1 1 17 17 ASP CB C 17 42.561 42.561 43.320 -0.759 17927 85 1 . 1 1 17 17 ASP H H 17 8.643 8.643 8.874 -0.231 17927 86 1 . 1 1 18 18 ILE N N 18 118.340 118.340 122.083 -3.743 17927 87 1 . 1 1 18 18 ILE HA H 18 4.451 4.451 3.850 0.601 17927 88 1 . 1 1 18 18 ILE C C 18 175.742 175.742 176.655 -0.913 17927 89 1 . 1 1 18 18 ILE CA C 18 61.894 61.894 64.045 -2.151 17927 90 1 . 1 1 18 18 ILE CB C 18 39.240 39.240 38.048 1.193 17927 91 1 . 1 1 18 18 ILE H H 18 8.450 8.450 8.442 0.008 17927 92 1 . 1 1 19 19 ASN N N 19 119.377 119.377 116.942 2.435 17927 93 1 . 1 1 19 19 ASN HA H 19 5.015 5.015 4.616 0.399 17927 94 1 . 1 1 19 19 ASN C C 19 175.892 175.892 175.931 -0.039 17927 95 1 . 1 1 19 19 ASN CA C 19 53.307 53.307 54.211 -0.904 17927 96 1 . 1 1 19 19 ASN CB C 19 39.825 39.825 39.074 0.751 17927 97 1 . 1 1 19 19 ASN H H 19 8.376 8.376 8.686 -0.310 17927 98 1 . 1 1 20 20 GLY N N 20 109.535 109.535 108.304 1.231 17927 99 1 . 1 1 20 20 GLY C C 20 174.285 174.285 173.294 0.991 17927 100 1 . 1 1 20 20 GLY CA C 20 45.793 45.793 45.139 0.654 17927 101 1 . 1 1 20 20 GLY H H 20 8.539 8.539 8.445 0.094 17927 102 1 . 1 1 21 21 LYS N N 21 124.675 124.675 121.018 3.657 17927 103 1 . 1 1 21 21 LYS HA H 21 4.443 4.443 4.591 -0.148 17927 104 1 . 1 1 21 21 LYS C C 21 176.537 176.537 175.858 0.678 17927 105 1 . 1 1 21 21 LYS CA C 21 55.444 55.444 54.461 0.984 17927 106 1 . 1 1 21 21 LYS CB C 21 32.754 32.754 33.712 -0.958 17927 107 1 . 1 1 21 21 LYS H H 21 8.608 8.608 7.532 1.076 17927 108 1 . 1 1 22 22 THR N N 22 120.666 120.666 123.857 -3.191 17927 109 1 . 1 1 22 22 THR HA H 22 4.087 4.087 4.300 -0.213 17927 110 1 . 1 1 22 22 THR C C 22 174.431 174.431 173.951 0.480 17927 111 1 . 1 1 22 22 THR CA C 22 64.292 64.292 63.635 0.657 17927 112 1 . 1 1 22 22 THR CB C 22 69.069 69.069 68.496 0.573 17927 113 1 . 1 1 22 22 THR H H 22 8.595 8.595 8.737 -0.142 17927 114 1 . 1 1 23 23 VAL N N 23 131.207 131.207 129.587 1.620 17927 115 1 . 1 1 23 23 VAL HA H 23 4.192 4.192 4.360 -0.168 17927 116 1 . 1 1 23 23 VAL C C 23 174.244 174.244 174.650 -0.406 17927 117 1 . 1 1 23 23 VAL CA C 23 62.456 62.456 60.849 1.607 17927 118 1 . 1 1 23 23 VAL CB C 23 33.791 33.791 33.761 0.030 17927 119 1 . 1 1 23 23 VAL H H 23 8.937 8.937 8.878 0.059 17927 120 1 . 1 1 24 24 SER N N 24 120.787 120.787 121.415 -0.628 17927 121 1 . 1 1 24 24 SER HA H 24 5.407 5.407 5.130 0.277 17927 122 1 . 1 1 24 24 SER C C 24 176.169 176.169 174.592 1.577 17927 123 1 . 1 1 24 24 SER CA C 24 55.135 55.135 56.235 -1.100 17927 124 1 . 1 1 24 24 SER CB C 24 65.646 65.646 65.812 -0.166 17927 125 1 . 1 1 24 24 SER H H 24 8.554 8.554 8.772 -0.218 17927 126 1 . 1 1 25 25 LEU N N 25 124.332 124.332 121.606 2.726 17927 127 1 . 1 1 25 25 LEU HA H 25 3.687 3.687 3.944 -0.257 17927 128 1 . 1 1 25 25 LEU C C 25 179.364 179.364 176.819 2.545 17927 129 1 . 1 1 25 25 LEU CA C 25 58.217 58.217 55.492 2.725 17927 130 1 . 1 1 25 25 LEU CB C 25 40.538 40.538 41.410 -0.872 17927 131 1 . 1 1 25 25 LEU H H 25 7.811 7.811 8.333 -0.522 17927 132 1 . 1 1 26 26 ALA N N 26 119.799 119.799 119.092 0.707 17927 133 1 . 1 1 26 26 ALA HA H 26 3.993 3.993 4.100 -0.107 17927 134 1 . 1 1 26 26 ALA C C 26 179.719 179.719 178.108 1.611 17927 135 1 . 1 1 26 26 ALA CA C 26 54.663 54.663 53.611 1.052 17927 136 1 . 1 1 26 26 ALA CB C 26 18.323 18.323 18.928 -0.605 17927 137 1 . 1 1 26 26 ALA H H 26 8.099 8.099 7.698 0.401 17927 138 1 . 1 1 27 27 ASP N N 27 116.553 116.553 118.584 -2.031 17927 139 1 . 1 1 27 27 ASP HA H 27 4.473 4.473 4.453 0.020 17927 140 1 . 1 1 27 27 ASP C C 27 176.915 176.915 177.236 -0.321 17927 141 1 . 1 1 27 27 ASP CA C 27 56.251 56.251 55.989 0.262 17927 142 1 . 1 1 27 27 ASP CB C 27 40.788 40.788 41.076 -0.288 17927 143 1 . 1 1 27 27 ASP H H 27 7.572 7.572 7.720 -0.148 17927 144 1 . 1 1 28 28 LEU N N 28 118.950 118.950 117.534 1.416 17927 145 1 . 1 1 28 28 LEU HA H 28 4.233 4.233 3.995 0.238 17927 146 1 . 1 1 28 28 LEU C C 28 175.542 175.542 176.232 -0.690 17927 147 1 . 1 1 28 28 LEU CA C 28 53.706 53.706 54.134 -0.428 17927 148 1 . 1 1 28 28 LEU CB C 28 41.049 41.049 41.977 -0.928 17927 149 1 . 1 1 28 28 LEU H H 28 7.363 7.363 7.298 0.065 17927 150 1 . 1 1 29 29 LYS N N 29 118.429 118.429 119.873 -1.444 17927 151 1 . 1 1 29 29 LYS HA H 29 4.352 4.352 4.213 0.139 17927 152 1 . 1 1 29 29 LYS C C 29 178.063 178.063 177.623 0.440 17927 153 1 . 1 1 29 29 LYS CA C 29 57.777 57.777 57.331 0.446 17927 154 1 . 1 1 29 29 LYS CB C 29 33.440 33.440 32.793 0.647 17927 155 1 . 1 1 29 29 LYS H H 29 6.780 6.780 7.228 -0.448 17927 156 1 . 1 1 30 30 GLY N N 30 112.426 112.426 112.244 0.182 17927 157 1 . 1 1 30 30 GLY C C 30 173.801 173.801 173.442 0.359 17927 158 1 . 1 1 30 30 GLY CA C 30 44.611 44.611 45.148 -0.537 17927 159 1 . 1 1 30 30 GLY H H 30 9.398 9.398 8.877 0.521 17927 160 1 . 1 1 31 31 LYS N N 31 119.295 119.295 120.113 -0.818 17927 161 1 . 1 1 31 31 LYS HA H 31 4.152 4.152 4.598 -0.446 17927 162 1 . 1 1 31 31 LYS C C 31 173.862 173.862 176.049 -2.187 17927 163 1 . 1 1 31 31 LYS CA C 31 55.188 55.188 54.532 0.656 17927 164 1 . 1 1 31 31 LYS CB C 31 36.968 36.968 35.310 1.658 17927 165 1 . 1 1 31 31 LYS H H 31 7.496 7.496 7.428 0.068 17927 166 1 . 1 1 32 32 TYR N N 32 116.984 116.984 121.530 -4.546 17927 167 1 . 1 1 32 32 TYR HA H 32 4.157 4.157 4.491 -0.334 17927 168 1 . 1 1 32 32 TYR C C 32 175.226 175.226 175.747 -0.521 17927 169 1 . 1 1 32 32 TYR CA C 32 60.590 60.590 60.358 0.232 17927 170 1 . 1 1 32 32 TYR CB C 32 39.121 39.121 39.001 0.120 17927 171 1 . 1 1 32 32 TYR H H 32 7.521 7.521 8.456 -0.935 17927 172 1 . 1 1 33 33 ILE N N 33 118.052 118.052 120.799 -2.747 17927 173 1 . 1 1 33 33 ILE HA H 33 4.907 4.907 4.535 0.372 17927 174 1 . 1 1 33 33 ILE C C 33 174.308 174.308 174.388 -0.080 17927 175 1 . 1 1 33 33 ILE CA C 33 60.702 60.702 59.930 0.772 17927 176 1 . 1 1 33 33 ILE CB C 33 41.616 41.616 40.333 1.283 17927 177 1 . 1 1 33 33 ILE H H 33 8.467 8.467 8.828 -0.361 17927 178 1 . 1 1 34 34 TYR N N 34 130.242 130.242 128.906 1.336 17927 179 1 . 1 1 34 34 TYR HA H 34 5.526 5.526 5.217 0.309 17927 180 1 . 1 1 34 34 TYR C C 34 174.245 174.245 173.570 0.675 17927 181 1 . 1 1 34 34 TYR CA C 34 56.158 56.158 55.916 0.242 17927 182 1 . 1 1 34 34 TYR CB C 34 40.133 40.133 40.967 -0.834 17927 183 1 . 1 1 34 34 TYR H H 34 8.905 8.905 9.242 -0.337 17927 184 1 . 1 1 35 35 ILE N N 35 128.697 128.697 129.411 -0.714 17927 185 1 . 1 1 35 35 ILE HA H 35 5.342 5.342 5.120 0.222 17927 186 1 . 1 1 35 35 ILE C C 35 174.520 174.520 174.258 0.262 17927 187 1 . 1 1 35 35 ILE CA C 35 59.749 59.749 59.682 0.067 17927 188 1 . 1 1 35 35 ILE CB C 35 40.899 40.899 39.437 1.462 17927 189 1 . 1 1 35 35 ILE H H 35 9.445 9.445 8.493 0.952 17927 190 1 . 1 1 36 36 ASP N N 36 123.675 123.675 126.468 -2.793 17927 191 1 . 1 1 36 36 ASP HA H 36 4.848 4.848 5.631 -0.783 17927 192 1 . 1 1 36 36 ASP C C 36 174.385 174.385 175.407 -1.022 17927 193 1 . 1 1 36 36 ASP CA C 36 51.294 51.294 51.674 -0.380 17927 194 1 . 1 1 36 36 ASP CB C 36 41.778 41.778 44.836 -3.058 17927 195 1 . 1 1 36 36 ASP H H 36 8.875 8.875 8.627 0.248 17927 196 1 . 1 1 37 37 VAL N N 37 127.159 127.159 121.299 5.860 17927 197 1 . 1 1 37 37 VAL HA H 37 4.959 4.959 4.875 0.084 17927 198 1 . 1 1 37 37 VAL C C 37 175.046 175.046 175.673 -0.627 17927 199 1 . 1 1 37 37 VAL CA C 37 62.245 62.245 61.249 0.996 17927 200 1 . 1 1 37 37 VAL CB C 37 31.807 31.807 32.412 -0.605 17927 201 1 . 1 1 37 37 VAL H H 37 8.603 8.603 7.997 0.606 17927 202 1 . 1 1 38 38 TRP N N 38 124.161 124.161 126.509 -2.348 17927 203 1 . 1 1 38 38 TRP HA H 38 5.237 5.237 5.158 0.079 17927 204 1 . 1 1 38 38 TRP C C 38 171.995 171.995 173.573 -1.578 17927 205 1 . 1 1 38 38 TRP CA C 38 55.207 55.207 53.625 1.582 17927 206 1 . 1 1 38 38 TRP CB C 38 33.187 33.187 30.714 2.473 17927 207 1 . 1 1 38 38 TRP H H 38 8.562 8.562 8.502 0.060 17927 208 1 . 1 1 39 39 ALA N N 39 116.252 116.252 125.145 -8.893 17927 209 1 . 1 1 39 39 ALA HA H 39 3.678 3.678 3.946 -0.268 17927 210 1 . 1 1 39 39 ALA C C 39 178.664 178.664 175.850 2.814 17927 211 1 . 1 1 39 39 ALA CA C 39 51.466 51.466 50.314 1.152 17927 212 1 . 1 1 39 39 ALA CB C 39 22.341 22.341 21.238 1.103 17927 213 1 . 1 1 39 39 ALA H H 39 6.757 6.757 7.886 -1.129 17927 214 1 . 1 1 40 40 THR N N 40 114.321 114.321 115.086 -0.765 17927 215 1 . 1 1 40 40 THR HA H 40 3.907 3.907 4.406 -0.499 17927 216 1 . 1 1 40 40 THR C C 40 175.885 175.885 175.350 0.535 17927 217 1 . 1 1 40 40 THR CA C 40 65.447 65.447 63.502 1.945 17927 218 1 . 1 1 40 40 THR CB C 40 70.106 70.106 69.389 0.717 17927 219 1 . 1 1 40 40 THR H H 40 9.639 9.639 8.625 1.014 17927 220 1 . 1 1 41 41 TRP N N 41 114.483 114.483 120.567 -6.084 17927 221 1 . 1 1 41 41 TRP HA H 41 4.563 4.563 4.763 -0.200 17927 222 1 . 1 1 41 41 TRP C C 41 176.189 176.189 175.712 0.477 17927 223 1 . 1 1 41 41 TRP CA C 41 54.698 54.698 55.775 -1.077 17927 224 1 . 1 1 41 41 TRP CB C 41 29.977 29.977 28.251 1.726 17927 225 1 . 1 1 41 41 TRP H H 41 6.401 6.401 7.335 -0.934 17927 226 1 . 1 1 42 42 CYS N N 42 123.536 123.536 118.110 5.426 17927 227 1 . 1 1 42 42 CYS HA H 42 4.568 4.568 4.321 0.247 17927 228 1 . 1 1 42 42 CYS C C 42 175.726 175.726 175.729 -0.003 17927 229 1 . 1 1 42 42 CYS CA C 42 58.700 58.700 58.249 0.451 17927 230 1 . 1 1 42 42 CYS CB C 42 27.121 27.121 28.625 -1.503 17927 231 1 . 1 1 42 42 CYS H H 42 6.883 6.883 7.142 -0.259 17927 232 1 . 1 1 43 43 GLY N N 43 120.977 120.977 110.447 10.530 17927 233 1 . 1 1 43 43 GLY CA C 43 49.204 49.204 46.230 2.974 17927 234 1 . 1 1 43 43 GLY H H 43 9.653 9.653 8.254 1.399 17927 235 1 . 1 1 44 44 PRO HA H 44 4.487 4.487 4.316 0.171 17927 236 1 . 1 1 44 44 PRO C C 44 179.956 179.956 178.488 1.468 17927 237 1 . 1 1 44 44 PRO CA C 44 65.642 65.642 65.119 0.523 17927 238 1 . 1 1 44 44 PRO CB C 44 32.578 32.578 31.413 1.165 17927 239 1 . 1 1 45 45 CYS N N 45 113.925 113.925 115.815 -1.890 17927 240 1 . 1 1 45 45 CYS HA H 45 4.313 4.313 4.252 0.061 17927 241 1 . 1 1 45 45 CYS C C 45 178.325 178.325 176.511 1.814 17927 242 1 . 1 1 45 45 CYS CA C 45 63.392 63.392 61.216 2.176 17927 243 1 . 1 1 45 45 CYS CB C 45 28.505 28.505 27.390 1.115 17927 244 1 . 1 1 45 45 CYS H H 45 7.676 7.676 7.961 -0.285 17927 245 1 . 1 1 46 46 ARG N N 46 120.336 120.336 119.406 0.930 17927 246 1 . 1 1 46 46 ARG HA H 46 4.069 4.069 4.238 -0.169 17927 247 1 . 1 1 46 46 ARG C C 46 180.446 180.446 178.090 2.356 17927 248 1 . 1 1 46 46 ARG CA C 46 59.785 59.785 58.045 1.740 17927 249 1 . 1 1 46 46 ARG CB C 46 29.868 29.868 29.828 0.040 17927 250 1 . 1 1 46 46 ARG H H 46 8.109 8.109 8.001 0.108 17927 251 1 . 1 1 47 47 GLY N N 47 105.408 105.408 106.914 -1.506 17927 252 1 . 1 1 47 47 GLY C C 47 175.258 175.258 175.060 0.198 17927 253 1 . 1 1 47 47 GLY CA C 47 46.594 46.594 45.978 0.616 17927 254 1 . 1 1 47 47 GLY H H 47 8.466 8.466 8.006 0.460 17927 255 1 . 1 1 48 48 GLU N N 48 116.343 116.343 119.902 -3.559 17927 256 1 . 1 1 48 48 GLU HA H 48 4.525 4.525 4.493 0.032 17927 257 1 . 1 1 48 48 GLU C C 48 176.535 176.535 177.976 -1.441 17927 258 1 . 1 1 48 48 GLU CA C 48 55.792 55.792 56.176 -0.384 17927 259 1 . 1 1 48 48 GLU CB C 48 30.982 30.982 29.756 1.226 17927 260 1 . 1 1 48 48 GLU H H 48 7.050 7.050 7.778 -0.728 17927 261 1 . 1 1 49 49 LEU N N 49 118.652 118.652 121.990 -3.338 17927 262 1 . 1 1 49 49 LEU HA H 49 4.152 4.152 4.169 -0.017 17927 263 1 . 1 1 49 49 LEU C C 49 176.832 176.832 176.349 0.483 17927 264 1 . 1 1 49 49 LEU CA C 49 59.345 59.345 60.388 -1.043 17927 265 1 . 1 1 49 49 LEU CB C 49 38.496 38.496 39.280 -0.784 17927 266 1 . 1 1 49 49 LEU H H 49 7.385 7.385 7.653 -0.268 17927 267 1 . 1 1 50 50 PRO HA H 50 4.253 4.253 4.149 0.104 17927 268 1 . 1 1 50 50 PRO C C 50 179.744 179.744 178.167 1.577 17927 269 1 . 1 1 50 50 PRO CA C 50 66.559 66.559 66.078 0.481 17927 270 1 . 1 1 50 50 PRO CB C 50 30.762 30.762 30.885 -0.123 17927 271 1 . 1 1 51 51 ALA N N 51 120.418 120.418 119.009 1.409 17927 272 1 . 1 1 51 51 ALA HA H 51 4.145 4.145 4.200 -0.055 17927 273 1 . 1 1 51 51 ALA C C 51 180.329 180.329 179.641 0.688 17927 274 1 . 1 1 51 51 ALA CA C 51 54.434 54.434 54.468 -0.034 17927 275 1 . 1 1 51 51 ALA CB C 51 18.370 18.370 18.306 0.064 17927 276 1 . 1 1 51 51 ALA H H 51 7.731 7.731 7.794 -0.063 17927 277 1 . 1 1 52 52 LEU N N 52 121.506 121.506 119.992 1.514 17927 278 1 . 1 1 52 52 LEU HA H 52 3.988 3.988 3.908 0.080 17927 279 1 . 1 1 52 52 LEU C C 52 177.944 177.944 178.326 -0.382 17927 280 1 . 1 1 52 52 LEU CA C 52 58.327 58.327 57.923 0.404 17927 281 1 . 1 1 52 52 LEU CB C 52 42.382 42.382 41.985 0.397 17927 282 1 . 1 1 52 52 LEU H H 52 8.355 8.355 8.182 0.173 17927 283 1 . 1 1 53 53 LYS N N 53 119.732 119.732 119.042 0.690 17927 284 1 . 1 1 53 53 LYS HA H 53 3.903 3.903 3.893 0.010 17927 285 1 . 1 1 53 53 LYS C C 53 179.030 179.030 178.868 0.162 17927 286 1 . 1 1 53 53 LYS CA C 53 59.846 59.846 59.570 0.276 17927 287 1 . 1 1 53 53 LYS CB C 53 32.211 32.211 31.852 0.359 17927 288 1 . 1 1 53 53 LYS H H 53 8.148 8.148 7.859 0.289 17927 289 1 . 1 1 54 54 GLU N N 54 117.779 117.779 119.747 -1.968 17927 290 1 . 1 1 54 54 GLU HA H 54 4.059 4.059 4.040 0.019 17927 291 1 . 1 1 54 54 GLU C C 54 179.646 179.646 179.146 0.500 17927 292 1 . 1 1 54 54 GLU CA C 54 59.625 59.625 59.207 0.418 17927 293 1 . 1 1 54 54 GLU CB C 54 29.567 29.567 29.299 0.268 17927 294 1 . 1 1 54 54 GLU H H 54 7.585 7.585 7.835 -0.250 17927 295 1 . 1 1 55 55 LEU N N 55 120.581 120.581 120.082 0.499 17927 296 1 . 1 1 55 55 LEU HA H 55 4.193 4.193 4.050 0.143 17927 297 1 . 1 1 55 55 LEU C C 55 178.557 178.557 178.613 -0.056 17927 298 1 . 1 1 55 55 LEU CA C 55 58.235 58.235 57.852 0.384 17927 299 1 . 1 1 55 55 LEU CB C 55 43.011 43.011 41.650 1.361 17927 300 1 . 1 1 55 55 LEU H H 55 8.096 8.096 7.925 0.171 17927 301 1 . 1 1 56 56 GLU N N 56 118.023 118.023 119.253 -1.230 17927 302 1 . 1 1 56 56 GLU HA H 56 3.177 3.177 3.520 -0.343 17927 303 1 . 1 1 56 56 GLU C C 56 179.650 179.650 178.909 0.741 17927 304 1 . 1 1 56 56 GLU CA C 56 58.871 58.871 59.314 -0.443 17927 305 1 . 1 1 56 56 GLU CB C 56 26.985 26.985 29.240 -2.255 17927 306 1 . 1 1 56 56 GLU H H 56 8.181 8.181 7.930 0.251 17927 307 1 . 1 1 57 57 GLU N N 57 117.828 117.828 117.643 0.185 17927 308 1 . 1 1 57 57 GLU HA H 57 4.104 4.104 4.076 0.028 17927 309 1 . 1 1 57 57 GLU C C 57 179.700 179.700 178.617 1.083 17927 310 1 . 1 1 57 57 GLU CA C 57 59.027 59.027 58.326 0.701 17927 311 1 . 1 1 57 57 GLU CB C 57 29.665 29.665 29.457 0.208 17927 312 1 . 1 1 57 57 GLU H H 57 7.762 7.762 8.182 -0.420 17927 313 1 . 1 1 58 58 LYS N N 58 120.896 120.896 118.917 1.979 17927 314 1 . 1 1 58 58 LYS HA H 58 3.979 3.979 4.004 -0.025 17927 315 1 . 1 1 58 58 LYS C C 58 178.715 178.715 178.082 0.633 17927 316 1 . 1 1 58 58 LYS CA C 58 59.078 59.078 58.637 0.441 17927 317 1 . 1 1 58 58 LYS CB C 58 32.980 32.980 32.864 0.116 17927 318 1 . 1 1 58 58 LYS H H 58 8.410 8.410 7.722 0.688 17927 319 1 . 1 1 59 59 TYR N N 59 113.713 113.713 116.161 -2.448 17927 320 1 . 1 1 59 59 TYR HA H 59 4.312 4.312 4.590 -0.278 17927 321 1 . 1 1 59 59 TYR C C 59 175.025 175.025 174.799 0.226 17927 322 1 . 1 1 59 59 TYR CA C 59 58.973 58.973 56.825 2.148 17927 323 1 . 1 1 59 59 TYR CB C 59 37.434 37.434 38.448 -1.014 17927 324 1 . 1 1 59 59 TYR H H 59 8.102 8.102 7.989 0.113 17927 325 1 . 1 1 60 60 ALA N N 60 126.637 126.637 122.762 3.875 17927 326 1 . 1 1 60 60 ALA HA H 60 4.418 4.418 4.364 0.054 17927 327 1 . 1 1 60 60 ALA C C 60 179.208 179.208 177.912 1.296 17927 328 1 . 1 1 60 60 ALA CA C 60 54.534 54.534 53.506 1.028 17927 329 1 . 1 1 60 60 ALA CB C 60 18.589 18.589 18.702 -0.113 17927 330 1 . 1 1 60 60 ALA H H 60 7.201 7.201 7.571 -0.370 17927 331 1 . 1 1 61 61 GLY N N 61 111.816 111.816 110.597 1.219 17927 332 1 . 1 1 61 61 GLY C C 61 174.698 174.698 174.687 0.011 17927 333 1 . 1 1 61 61 GLY CA C 61 45.904 45.904 45.518 0.386 17927 334 1 . 1 1 61 61 GLY H H 61 9.184 9.184 8.806 0.378 17927 335 1 . 1 1 62 62 LYS N N 62 118.497 118.497 120.624 -2.127 17927 336 1 . 1 1 62 62 LYS HA H 62 4.879 4.879 4.484 0.395 17927 337 1 . 1 1 62 62 LYS C C 62 179.019 179.019 176.042 2.978 17927 338 1 . 1 1 62 62 LYS CA C 62 53.988 53.988 55.133 -1.145 17927 339 1 . 1 1 62 62 LYS CB C 62 33.840 33.840 33.374 0.466 17927 340 1 . 1 1 62 62 LYS H H 62 8.019 8.019 7.702 0.317 17927 341 1 . 1 1 63 63 ASP N N 63 122.982 122.982 119.848 3.134 17927 342 1 . 1 1 63 63 ASP HA H 63 4.527 4.527 4.752 -0.225 17927 343 1 . 1 1 63 63 ASP C C 63 174.065 174.065 174.585 -0.520 17927 344 1 . 1 1 63 63 ASP CA C 63 55.055 55.055 53.896 1.159 17927 345 1 . 1 1 63 63 ASP CB C 63 38.582 38.582 40.472 -1.890 17927 346 1 . 1 1 63 63 ASP H H 63 8.709 8.709 8.560 0.149 17927 347 1 . 1 1 64 64 ILE N N 64 122.219 122.219 117.254 4.965 17927 348 1 . 1 1 64 64 ILE HA H 64 4.607 4.607 4.631 -0.024 17927 349 1 . 1 1 64 64 ILE C C 64 174.627 174.627 173.592 1.035 17927 350 1 . 1 1 64 64 ILE CA C 64 59.712 59.712 59.463 0.249 17927 351 1 . 1 1 64 64 ILE CB C 64 42.133 42.133 41.565 0.568 17927 352 1 . 1 1 64 64 ILE H H 64 8.678 8.678 7.315 1.363 17927 353 1 . 1 1 65 65 HIS N N 65 125.584 125.584 122.625 2.959 17927 354 1 . 1 1 65 65 HIS HA H 65 5.043 5.043 4.946 0.097 17927 355 1 . 1 1 65 65 HIS C C 65 174.153 174.153 173.827 0.326 17927 356 1 . 1 1 65 65 HIS CA C 65 54.959 54.959 54.301 0.658 17927 357 1 . 1 1 65 65 HIS CB C 65 34.156 34.156 32.042 2.114 17927 358 1 . 1 1 65 65 HIS H H 65 9.204 9.204 8.696 0.508 17927 359 1 . 1 1 66 66 PHE N N 66 123.244 123.244 124.264 -1.020 17927 360 1 . 1 1 66 66 PHE HA H 66 5.210 5.210 4.926 0.284 17927 361 1 . 1 1 66 66 PHE C C 66 175.463 175.463 174.798 0.665 17927 362 1 . 1 1 66 66 PHE CA C 66 58.088 58.088 58.061 0.027 17927 363 1 . 1 1 66 66 PHE CB C 66 39.637 39.637 39.045 0.592 17927 364 1 . 1 1 66 66 PHE H H 66 9.262 9.262 9.257 0.005 17927 365 1 . 1 1 67 67 VAL N N 67 126.201 126.201 125.624 0.577 17927 366 1 . 1 1 67 67 VAL HA H 67 4.834 4.834 5.024 -0.190 17927 367 1 . 1 1 67 67 VAL C C 67 174.364 174.364 175.504 -1.140 17927 368 1 . 1 1 67 67 VAL CA C 67 60.724 60.724 60.705 0.019 17927 369 1 . 1 1 67 67 VAL CB C 67 34.893 34.893 33.404 1.489 17927 370 1 . 1 1 67 67 VAL H H 67 8.843 8.843 9.287 -0.444 17927 371 1 . 1 1 68 68 SER N N 68 124.528 124.528 123.559 0.969 17927 372 1 . 1 1 68 68 SER HA H 68 5.585 5.585 5.389 0.196 17927 373 1 . 1 1 68 68 SER C C 68 172.858 172.858 173.060 -0.202 17927 374 1 . 1 1 68 68 SER CA C 68 57.282 57.282 57.586 -0.304 17927 375 1 . 1 1 68 68 SER CB C 68 65.032 65.032 64.079 0.953 17927 376 1 . 1 1 68 68 SER H H 68 9.243 9.243 8.800 0.443 17927 377 1 . 1 1 69 69 LEU N N 69 126.695 126.695 126.291 0.404 17927 378 1 . 1 1 69 69 LEU HA H 69 4.517 4.517 5.558 -1.041 17927 379 1 . 1 1 69 69 LEU C C 69 174.652 174.652 175.800 -1.148 17927 380 1 . 1 1 69 69 LEU CA C 69 52.827 52.827 53.727 -0.900 17927 381 1 . 1 1 69 69 LEU CB C 69 43.895 43.895 45.633 -1.738 17927 382 1 . 1 1 69 69 LEU H H 69 9.360 9.360 9.131 0.229 17927 383 1 . 1 1 70 70 SER N N 70 116.379 116.379 119.543 -3.164 17927 384 1 . 1 1 70 70 SER HA H 70 4.905 4.905 5.117 -0.212 17927 385 1 . 1 1 70 70 SER C C 70 176.307 176.307 174.860 1.447 17927 386 1 . 1 1 70 70 SER CA C 70 55.213 55.213 56.079 -0.866 17927 387 1 . 1 1 70 70 SER CB C 70 63.519 63.519 64.114 -0.595 17927 388 1 . 1 1 70 70 SER H H 70 7.981 7.981 8.807 -0.826 17927 389 1 . 1 1 71 71 CYS N N 71 124.670 124.670 126.921 -2.251 17927 390 1 . 1 1 71 71 CYS HA H 71 4.958 4.958 4.512 0.446 17927 391 1 . 1 1 71 71 CYS C C 71 173.996 173.996 174.334 -0.338 17927 392 1 . 1 1 71 71 CYS CA C 71 55.483 55.483 57.720 -2.237 17927 393 1 . 1 1 71 71 CYS CB C 71 28.112 28.112 27.142 0.970 17927 394 1 . 1 1 71 71 CYS H H 71 8.609 8.609 9.024 -0.415 17927 395 1 . 1 1 72 72 ASP N N 72 122.398 122.398 122.922 -0.524 17927 396 1 . 1 1 72 72 ASP HA H 72 4.292 4.292 4.741 -0.449 17927 397 1 . 1 1 72 72 ASP C C 72 176.653 176.653 176.459 0.194 17927 398 1 . 1 1 72 72 ASP CA C 72 56.782 56.782 55.407 1.375 17927 399 1 . 1 1 72 72 ASP CB C 72 41.526 41.526 41.400 0.126 17927 400 1 . 1 1 72 72 ASP H H 72 8.557 8.557 7.543 1.014 17927 401 1 . 1 1 73 73 LYS HA H 73 4.065 4.065 4.211 -0.146 17927 402 1 . 1 1 73 73 LYS C C 73 176.545 176.545 176.197 0.348 17927 403 1 . 1 1 73 73 LYS CA C 73 58.458 58.458 58.043 0.415 17927 404 1 . 1 1 73 73 LYS CB C 73 32.641 32.641 32.747 -0.106 17927 405 1 . 1 1 74 74 ASN N N 74 117.616 117.616 118.967 -1.351 17927 406 1 . 1 1 74 74 ASN HA H 74 4.905 4.905 4.797 0.108 17927 407 1 . 1 1 74 74 ASN C C 74 174.894 174.894 175.335 -0.441 17927 408 1 . 1 1 74 74 ASN CA C 74 51.521 51.521 52.568 -1.047 17927 409 1 . 1 1 74 74 ASN CB C 74 38.109 38.109 37.564 0.545 17927 410 1 . 1 1 74 74 ASN H H 74 8.625 8.625 8.260 0.365 17927 411 1 . 1 1 75 75 LYS N N 75 126.797 126.797 124.577 2.220 17927 412 1 . 1 1 75 75 LYS HA H 75 3.423 3.423 3.769 -0.346 17927 413 1 . 1 1 75 75 LYS C C 75 178.058 178.058 177.857 0.201 17927 414 1 . 1 1 75 75 LYS CA C 75 60.173 60.173 60.252 -0.079 17927 415 1 . 1 1 75 75 LYS CB C 75 33.291 33.291 32.446 0.845 17927 416 1 . 1 1 75 75 LYS H H 75 8.588 8.588 8.015 0.573 17927 417 1 . 1 1 76 76 LYS N N 76 117.875 117.875 119.636 -1.761 17927 418 1 . 1 1 76 76 LYS HA H 76 4.200 4.200 4.175 0.025 17927 419 1 . 1 1 76 76 LYS C C 76 178.791 178.791 178.627 0.164 17927 420 1 . 1 1 76 76 LYS CA C 76 58.608 58.608 59.529 -0.921 17927 421 1 . 1 1 76 76 LYS CB C 76 31.490 31.490 31.639 -0.149 17927 422 1 . 1 1 76 76 LYS H H 76 8.041 8.041 8.511 -0.470 17927 423 1 . 1 1 77 77 ALA N N 77 121.567 121.567 121.213 0.354 17927 424 1 . 1 1 77 77 ALA HA H 77 4.123 4.123 4.191 -0.068 17927 425 1 . 1 1 77 77 ALA C C 77 181.191 181.191 179.602 1.589 17927 426 1 . 1 1 77 77 ALA CA C 77 54.957 54.957 54.700 0.257 17927 427 1 . 1 1 77 77 ALA CB C 77 17.759 17.759 18.035 -0.276 17927 428 1 . 1 1 77 77 ALA H H 77 7.366 7.366 8.233 -0.867 17927 429 1 . 1 1 78 78 TRP N N 78 119.497 119.497 120.399 -0.902 17927 430 1 . 1 1 78 78 TRP HA H 78 4.077 4.077 4.194 -0.117 17927 431 1 . 1 1 78 78 TRP C C 78 175.942 175.942 177.286 -1.344 17927 432 1 . 1 1 78 78 TRP CA C 78 61.761 61.761 59.168 2.593 17927 433 1 . 1 1 78 78 TRP CB C 78 27.272 27.272 29.975 -2.703 17927 434 1 . 1 1 78 78 TRP H H 78 7.187 7.187 8.083 -0.896 17927 435 1 . 1 1 79 79 GLU N N 79 118.771 118.771 118.701 0.070 17927 436 1 . 1 1 79 79 GLU HA H 79 3.014 3.014 3.518 -0.504 17927 437 1 . 1 1 79 79 GLU C C 79 179.863 179.863 178.781 1.082 17927 438 1 . 1 1 79 79 GLU CA C 79 59.110 59.110 59.608 -0.498 17927 439 1 . 1 1 79 79 GLU CB C 79 30.220 30.220 28.763 1.457 17927 440 1 . 1 1 79 79 GLU H H 79 8.813 8.813 8.685 0.128 17927 441 1 . 1 1 80 80 ASN N N 80 115.964 115.964 117.684 -1.720 17927 442 1 . 1 1 80 80 ASN HA H 80 4.339 4.339 4.439 -0.100 17927 443 1 . 1 1 80 80 ASN C C 80 176.749 176.749 177.573 -0.824 17927 444 1 . 1 1 80 80 ASN CA C 80 56.035 56.035 55.603 0.432 17927 445 1 . 1 1 80 80 ASN CB C 80 38.489 38.489 38.199 0.290 17927 446 1 . 1 1 80 80 ASN H H 80 8.491 8.491 7.925 0.567 17927 447 1 . 1 1 81 81 MET N N 81 119.670 119.670 121.006 -1.336 17927 448 1 . 1 1 81 81 MET HA H 81 4.149 4.149 4.195 -0.046 17927 449 1 . 1 1 81 81 MET C C 81 177.933 177.933 177.760 0.173 17927 450 1 . 1 1 81 81 MET CA C 81 60.276 60.276 58.551 1.725 17927 451 1 . 1 1 81 81 MET CB C 81 32.518 32.518 32.609 -0.091 17927 452 1 . 1 1 81 81 MET H H 81 7.667 7.667 7.632 0.035 17927 453 1 . 1 1 82 82 VAL N N 82 117.634 117.634 118.664 -1.030 17927 454 1 . 1 1 82 82 VAL HA H 82 3.303 3.303 3.506 -0.203 17927 455 1 . 1 1 82 82 VAL C C 82 179.005 179.005 177.356 1.649 17927 456 1 . 1 1 82 82 VAL CA C 82 67.037 67.037 66.154 0.883 17927 457 1 . 1 1 82 82 VAL CB C 82 31.765 31.765 31.163 0.602 17927 458 1 . 1 1 82 82 VAL H H 82 8.338 8.338 7.990 0.348 17927 459 1 . 1 1 83 83 THR N N 83 110.519 110.519 115.084 -4.565 17927 460 1 . 1 1 83 83 THR HA H 83 3.983 3.983 4.003 -0.020 17927 461 1 . 1 1 83 83 THR C C 83 177.591 177.591 176.200 1.391 17927 462 1 . 1 1 83 83 THR CA C 83 65.431 65.431 66.244 -0.813 17927 463 1 . 1 1 83 83 THR CB C 83 69.156 69.156 68.572 0.584 17927 464 1 . 1 1 83 83 THR H H 83 7.659 7.659 7.620 0.039 17927 465 1 . 1 1 84 84 LYS N N 84 123.927 123.927 120.746 3.181 17927 466 1 . 1 1 84 84 LYS HA H 84 4.069 4.069 4.179 -0.110 17927 467 1 . 1 1 84 84 LYS C C 84 178.582 178.582 177.867 0.715 17927 468 1 . 1 1 84 84 LYS CA C 84 59.877 59.877 58.261 1.616 17927 469 1 . 1 1 84 84 LYS CB C 84 32.323 32.323 32.568 -0.245 17927 470 1 . 1 1 84 84 LYS H H 84 8.665 8.665 7.666 0.999 17927 471 1 . 1 1 85 85 ASP N N 85 116.280 116.280 117.291 -1.011 17927 472 1 . 1 1 85 85 ASP HA H 85 4.750 4.750 4.643 0.107 17927 473 1 . 1 1 85 85 ASP C C 85 175.086 175.086 175.425 -0.339 17927 474 1 . 1 1 85 85 ASP CA C 85 54.693 54.693 55.130 -0.437 17927 475 1 . 1 1 85 85 ASP CB C 85 39.685 39.685 41.262 -1.577 17927 476 1 . 1 1 85 85 ASP H H 85 8.179 8.179 8.261 -0.082 17927 477 1 . 1 1 86 86 GLN N N 86 116.258 116.258 114.115 2.143 17927 478 1 . 1 1 86 86 GLN HA H 86 3.908 3.908 3.883 0.025 17927 479 1 . 1 1 86 86 GLN C C 86 175.659 175.659 175.045 0.614 17927 480 1 . 1 1 86 86 GLN CA C 86 56.171 56.171 56.425 -0.254 17927 481 1 . 1 1 86 86 GLN CB C 86 26.290 26.290 26.085 0.205 17927 482 1 . 1 1 86 86 GLN H H 86 7.431 7.431 7.721 -0.290 17927 483 1 . 1 1 87 87 LEU N N 87 117.031 117.031 120.271 -3.240 17927 484 1 . 1 1 87 87 LEU HA H 87 4.090 4.090 4.268 -0.178 17927 485 1 . 1 1 87 87 LEU C C 87 178.225 178.225 176.278 1.947 17927 486 1 . 1 1 87 87 LEU CA C 87 55.932 55.932 55.226 0.706 17927 487 1 . 1 1 87 87 LEU CB C 87 41.202 41.202 41.561 -0.359 17927 488 1 . 1 1 87 87 LEU H H 87 7.736 7.736 7.612 0.124 17927 489 1 . 1 1 88 88 LYS N N 88 122.367 122.367 122.260 0.107 17927 490 1 . 1 1 88 88 LYS HA H 88 4.636 4.636 4.676 -0.040 17927 491 1 . 1 1 88 88 LYS C C 88 177.538 177.538 176.371 1.167 17927 492 1 . 1 1 88 88 LYS CA C 88 54.930 54.930 54.390 0.540 17927 493 1 . 1 1 88 88 LYS CB C 88 33.316 33.316 34.571 -1.255 17927 494 1 . 1 1 88 88 LYS H H 88 8.496 8.496 8.079 0.417 17927 495 1 . 1 1 89 89 GLY N N 89 108.452 108.452 106.604 1.848 17927 496 1 . 1 1 89 89 GLY C C 89 173.781 173.781 173.463 0.318 17927 497 1 . 1 1 89 89 GLY CA C 89 45.358 45.358 44.549 0.809 17927 498 1 . 1 1 89 89 GLY H H 89 8.497 8.497 8.175 0.322 17927 499 1 . 1 1 90 90 ILE N N 90 123.295 123.295 123.413 -0.118 17927 500 1 . 1 1 90 90 ILE HA H 90 4.371 4.371 4.228 0.143 17927 501 1 . 1 1 90 90 ILE C C 90 175.606 175.606 174.457 1.149 17927 502 1 . 1 1 90 90 ILE CA C 90 62.001 62.001 60.669 1.332 17927 503 1 . 1 1 90 90 ILE CB C 90 38.036 38.036 37.558 0.478 17927 504 1 . 1 1 90 90 ILE H H 90 8.728 8.728 8.046 0.682 17927 505 1 . 1 1 91 91 GLN N N 91 128.632 128.632 126.132 2.500 17927 506 1 . 1 1 91 91 GLN HA H 91 4.766 4.766 4.731 0.035 17927 507 1 . 1 1 91 91 GLN C C 91 174.618 174.618 174.368 0.250 17927 508 1 . 1 1 91 91 GLN CA C 91 54.850 54.850 53.788 1.062 17927 509 1 . 1 1 91 91 GLN CB C 91 28.341 28.341 30.090 -1.749 17927 510 1 . 1 1 91 91 GLN H H 91 8.762 8.762 8.813 -0.051 17927 511 1 . 1 1 92 92 LEU N N 92 120.830 120.830 123.529 -2.699 17927 512 1 . 1 1 92 92 LEU HA H 92 5.580 5.580 5.020 0.560 17927 513 1 . 1 1 92 92 LEU C C 92 176.828 176.828 175.639 1.189 17927 514 1 . 1 1 92 92 LEU CA C 92 52.801 52.801 53.881 -1.080 17927 515 1 . 1 1 92 92 LEU CB C 92 44.210 44.210 44.925 -0.715 17927 516 1 . 1 1 92 92 LEU H H 92 9.011 9.011 9.210 -0.199 17927 517 1 . 1 1 93 93 HIS N N 93 121.481 121.481 122.177 -0.696 17927 518 1 . 1 1 93 93 HIS HA H 93 3.931 3.931 5.000 -1.069 17927 519 1 . 1 1 93 93 HIS C C 93 173.590 173.590 173.509 0.081 17927 520 1 . 1 1 93 93 HIS CA C 93 56.583 56.583 55.365 1.218 17927 521 1 . 1 1 93 93 HIS CB C 93 32.250 32.250 33.234 -0.984 17927 522 1 . 1 1 93 93 HIS H H 93 8.038 8.038 8.847 -0.809 17927 523 1 . 1 1 94 94 MET N N 94 121.881 121.881 125.542 -3.661 17927 524 1 . 1 1 94 94 MET HA H 94 3.866 3.866 4.044 -0.178 17927 525 1 . 1 1 94 94 MET C C 94 177.035 177.035 175.955 1.080 17927 526 1 . 1 1 94 94 MET CA C 94 55.189 55.189 56.854 -1.665 17927 527 1 . 1 1 94 94 MET CB C 94 33.993 33.993 33.644 0.349 17927 528 1 . 1 1 94 94 MET H H 94 8.039 8.039 8.549 -0.510 17927 529 1 . 1 1 95 95 GLY N N 95 104.041 104.041 106.683 -2.641 17927 530 1 . 1 1 95 95 GLY C C 95 174.251 174.251 174.375 -0.124 17927 531 1 . 1 1 95 95 GLY CA C 95 46.580 46.580 45.860 0.720 17927 532 1 . 1 1 95 95 GLY H H 95 5.666 5.666 7.806 -2.140 17927 533 1 . 1 1 96 96 THR N N 96 114.114 114.114 115.636 -1.522 17927 534 1 . 1 1 96 96 THR HA H 96 4.211 4.211 4.301 -0.090 17927 535 1 . 1 1 96 96 THR C C 96 175.122 175.122 174.285 0.837 17927 536 1 . 1 1 96 96 THR CA C 96 61.339 61.339 62.611 -1.272 17927 537 1 . 1 1 96 96 THR CB C 96 68.615 68.615 69.196 -0.581 17927 538 1 . 1 1 96 96 THR H H 96 8.517 8.517 8.081 0.436 17927 539 1 . 1 1 97 97 ASP N N 97 121.892 121.892 122.516 -0.624 17927 540 1 . 1 1 97 97 ASP HA H 97 4.585 4.585 4.774 -0.189 17927 541 1 . 1 1 97 97 ASP C C 97 178.241 178.241 176.097 2.144 17927 542 1 . 1 1 97 97 ASP CA C 97 55.800 55.800 54.269 1.531 17927 543 1 . 1 1 97 97 ASP CB C 97 43.129 43.129 40.219 2.910 17927 544 1 . 1 1 97 97 ASP H H 97 7.563 7.563 8.233 -0.670 17927 545 1 . 1 1 98 98 ARG N N 98 127.508 127.508 120.342 7.166 17927 546 1 . 1 1 98 98 ARG HA H 98 4.392 4.392 4.393 -0.001 17927 547 1 . 1 1 98 98 ARG C C 98 176.724 176.724 177.059 -0.335 17927 548 1 . 1 1 98 98 ARG CA C 98 55.939 55.939 56.980 -1.041 17927 549 1 . 1 1 98 98 ARG CB C 98 30.291 30.291 29.245 1.046 17927 550 1 . 1 1 98 98 ARG H H 98 9.225 9.225 7.950 1.275 17927 551 1 . 1 1 99 99 THR N N 99 116.384 116.384 117.241 -0.857 17927 552 1 . 1 1 99 99 THR HA H 99 3.987 3.987 4.120 -0.133 17927 553 1 . 1 1 99 99 THR C C 99 176.969 176.969 175.703 1.266 17927 554 1 . 1 1 99 99 THR CA C 99 67.714 67.714 66.439 1.275 17927 555 1 . 1 1 99 99 THR CB C 99 68.777 68.777 68.533 0.244 17927 556 1 . 1 1 99 99 THR H H 99 8.382 8.382 8.108 0.274 17927 557 1 . 1 1 100 100 PHE N N 100 123.232 123.232 122.021 1.211 17927 558 1 . 1 1 100 100 PHE HA H 100 4.173 4.173 4.372 -0.199 17927 559 1 . 1 1 100 100 PHE C C 100 177.010 177.010 176.529 0.481 17927 560 1 . 1 1 100 100 PHE CA C 100 61.923 61.923 60.856 1.067 17927 561 1 . 1 1 100 100 PHE CB C 100 40.762 40.762 39.280 1.482 17927 562 1 . 1 1 100 100 PHE H H 100 7.998 7.998 8.152 -0.154 17927 563 1 . 1 1 101 101 MET N N 101 115.968 115.968 118.576 -2.608 17927 564 1 . 1 1 101 101 MET HA H 101 3.975 3.975 4.063 -0.088 17927 565 1 . 1 1 101 101 MET C C 101 178.763 178.763 177.815 0.948 17927 566 1 . 1 1 101 101 MET CA C 101 58.552 58.552 58.476 0.076 17927 567 1 . 1 1 101 101 MET CB C 101 32.593 32.593 31.969 0.624 17927 568 1 . 1 1 101 101 MET H H 101 7.828 7.828 7.896 -0.068 17927 569 1 . 1 1 102 102 ASP N N 102 117.553 117.553 119.696 -2.143 17927 570 1 . 1 1 102 102 ASP HA H 102 4.522 4.522 4.420 0.102 17927 571 1 . 1 1 102 102 ASP C C 102 179.503 179.503 178.535 0.968 17927 572 1 . 1 1 102 102 ASP CA C 102 56.890 56.890 57.401 -0.511 17927 573 1 . 1 1 102 102 ASP CB C 102 39.926 39.926 40.705 -0.779 17927 574 1 . 1 1 102 102 ASP H H 102 8.828 8.828 8.064 0.763 17927 575 1 . 1 1 103 103 ALA N N 103 122.984 122.984 121.889 1.095 17927 576 1 . 1 1 103 103 ALA HA H 103 3.986 3.986 4.055 -0.069 17927 577 1 . 1 1 103 103 ALA C C 103 178.782 178.782 178.331 0.451 17927 578 1 . 1 1 103 103 ALA CA C 103 55.094 55.094 54.258 0.836 17927 579 1 . 1 1 103 103 ALA CB C 103 18.563 18.563 18.356 0.207 17927 580 1 . 1 1 103 103 ALA H H 103 7.567 7.567 7.598 -0.031 17927 581 1 . 1 1 104 104 TYR N N 104 112.159 112.159 114.516 -2.357 17927 582 1 . 1 1 104 104 TYR HA H 104 4.224 4.224 4.521 -0.297 17927 583 1 . 1 1 104 104 TYR C C 104 173.821 173.821 174.947 -1.126 17927 584 1 . 1 1 104 104 TYR CA C 104 58.498 58.498 57.648 0.850 17927 585 1 . 1 1 104 104 TYR CB C 104 38.393 38.393 39.016 -0.623 17927 586 1 . 1 1 104 104 TYR H H 104 7.203 7.203 7.410 -0.207 17927 587 1 . 1 1 105 105 LEU N N 105 119.433 119.433 116.526 2.907 17927 588 1 . 1 1 105 105 LEU HA H 105 3.985 3.985 3.959 0.026 17927 589 1 . 1 1 105 105 LEU C C 105 176.721 176.721 176.274 0.447 17927 590 1 . 1 1 105 105 LEU CA C 105 55.785 55.785 55.812 -0.027 17927 591 1 . 1 1 105 105 LEU CB C 105 38.443 38.443 39.645 -1.202 17927 592 1 . 1 1 105 105 LEU H H 105 7.582 7.582 7.630 -0.048 17927 593 1 . 1 1 106 106 ILE N N 106 119.575 119.575 117.829 1.745 17927 594 1 . 1 1 106 106 ILE HA H 106 4.002 4.002 3.997 0.005 17927 595 1 . 1 1 106 106 ILE C C 106 175.459 175.459 175.212 0.247 17927 596 1 . 1 1 106 106 ILE CA C 106 62.043 62.043 61.574 0.469 17927 597 1 . 1 1 106 106 ILE CB C 106 36.335 36.335 36.592 -0.257 17927 598 1 . 1 1 106 106 ILE H H 106 8.774 8.774 7.780 0.994 17927 599 1 . 1 1 107 107 ASN N N 107 126.514 126.514 123.018 3.496 17927 600 1 . 1 1 107 107 ASN HA H 107 4.863 4.863 4.695 0.168 17927 601 1 . 1 1 107 107 ASN C C 107 174.584 174.584 175.707 -1.123 17927 602 1 . 1 1 107 107 ASN CA C 107 53.112 53.112 53.817 -0.705 17927 603 1 . 1 1 107 107 ASN CB C 107 38.977 38.977 39.392 -0.415 17927 604 1 . 1 1 107 107 ASN H H 107 8.364 8.364 8.172 0.192 17927 605 1 . 1 1 108 108 GLY N N 108 108.469 108.469 109.490 -1.021 17927 606 1 . 1 1 108 108 GLY C C 108 171.245 171.245 173.360 -2.115 17927 607 1 . 1 1 108 108 GLY CA C 108 45.269 45.269 44.558 0.711 17927 608 1 . 1 1 108 108 GLY H H 108 7.678 7.678 8.127 -0.449 17927 609 1 . 1 1 109 109 ILE N N 109 112.817 112.817 120.969 -8.152 17927 610 1 . 1 1 109 109 ILE HA H 109 4.406 4.406 4.423 -0.017 17927 611 1 . 1 1 109 109 ILE C C 109 173.498 173.498 174.227 -0.729 17927 612 1 . 1 1 109 109 ILE CA C 109 58.384 58.384 57.777 0.607 17927 613 1 . 1 1 109 109 ILE CB C 109 40.322 40.322 38.416 1.906 17927 614 1 . 1 1 109 109 ILE H H 109 7.868 7.868 7.737 0.131 17927 615 1 . 1 1 110 110 PRO HA H 110 4.742 4.742 4.507 0.235 17927 616 1 . 1 1 110 110 PRO C C 110 175.715 175.715 175.556 0.159 17927 617 1 . 1 1 110 110 PRO CA C 110 62.277 62.277 62.296 -0.019 17927 618 1 . 1 1 110 110 PRO CB C 110 36.368 36.368 32.508 3.860 17927 619 1 . 1 1 111 111 ARG N N 111 122.358 122.358 120.930 1.428 17927 620 1 . 1 1 111 111 ARG HA H 111 4.469 4.469 4.004 0.465 17927 621 1 . 1 1 111 111 ARG C C 111 171.541 171.541 174.692 -3.151 17927 622 1 . 1 1 111 111 ARG CA C 111 54.356 54.356 54.181 0.175 17927 623 1 . 1 1 111 111 ARG CB C 111 33.430 33.430 32.718 0.712 17927 624 1 . 1 1 111 111 ARG H H 111 7.732 7.732 8.355 -0.623 17927 625 1 . 1 1 112 112 PHE N N 112 125.103 125.103 120.743 4.360 17927 626 1 . 1 1 112 112 PHE HA H 112 5.773 5.773 5.035 0.738 17927 627 1 . 1 1 112 112 PHE C C 112 175.097 175.097 174.885 0.212 17927 628 1 . 1 1 112 112 PHE CA C 112 55.791 55.791 56.060 -0.269 17927 629 1 . 1 1 112 112 PHE CB C 112 40.928 40.928 39.707 1.221 17927 630 1 . 1 1 112 112 PHE H H 112 8.929 8.929 7.812 1.117 17927 631 1 . 1 1 113 113 ILE N N 113 123.778 123.778 122.471 1.307 17927 632 1 . 1 1 113 113 ILE HA H 113 4.543 4.543 4.935 -0.392 17927 633 1 . 1 1 113 113 ILE C C 113 173.197 173.197 174.060 -0.862 17927 634 1 . 1 1 113 113 ILE CA C 113 60.286 60.286 59.706 0.580 17927 635 1 . 1 1 113 113 ILE CB C 113 44.246 44.246 42.449 1.798 17927 636 1 . 1 1 113 113 ILE H H 113 8.873 8.873 8.822 0.050 17927 637 1 . 1 1 114 114 LEU N N 114 127.146 127.146 126.301 0.845 17927 638 1 . 1 1 114 114 LEU HA H 114 6.014 6.014 5.367 0.647 17927 639 1 . 1 1 114 114 LEU C C 114 175.080 175.080 174.501 0.579 17927 640 1 . 1 1 114 114 LEU CA C 114 53.401 53.401 53.606 -0.206 17927 641 1 . 1 1 114 114 LEU CB C 114 47.370 47.370 46.359 1.010 17927 642 1 . 1 1 114 114 LEU H H 114 8.974 8.974 8.802 0.173 17927 643 1 . 1 1 115 115 LEU N N 115 128.323 128.323 124.295 4.028 17927 644 1 . 1 1 115 115 LEU HA H 115 5.432 5.432 5.194 0.238 17927 645 1 . 1 1 115 115 LEU C C 115 176.660 176.660 175.658 1.002 17927 646 1 . 1 1 115 115 LEU CA C 115 53.077 53.077 53.689 -0.612 17927 647 1 . 1 1 115 115 LEU CB C 115 44.584 44.584 46.194 -1.610 17927 648 1 . 1 1 115 115 LEU H H 115 9.874 9.874 9.313 0.561 17927 649 1 . 1 1 116 116 ASP N N 116 119.834 119.834 121.812 -1.978 17927 650 1 . 1 1 116 116 ASP HA H 116 4.935 4.935 4.928 0.007 17927 651 1 . 1 1 116 116 ASP C C 116 176.898 176.898 177.457 -0.559 17927 652 1 . 1 1 116 116 ASP CA C 116 52.305 52.305 53.575 -1.270 17927 653 1 . 1 1 116 116 ASP CB C 116 41.028 41.028 42.713 -1.685 17927 654 1 . 1 1 116 116 ASP H H 116 9.357 9.357 8.879 0.478 17927 655 1 . 1 1 117 117 ARG N N 117 113.356 113.356 120.973 -7.617 17927 656 1 . 1 1 117 117 ARG HA H 117 3.717 3.717 4.014 -0.297 17927 657 1 . 1 1 117 117 ARG C C 117 177.105 177.105 177.917 -0.812 17927 658 1 . 1 1 117 117 ARG CA C 117 58.185 58.185 59.492 -1.307 17927 659 1 . 1 1 117 117 ARG CB C 117 30.437 30.437 29.903 0.534 17927 660 1 . 1 1 117 117 ARG H H 117 7.697 7.697 8.254 -0.557 17927 661 1 . 1 1 118 118 ASP N N 118 117.226 117.226 116.740 0.486 17927 662 1 . 1 1 118 118 ASP HA H 118 4.895 4.895 4.516 0.379 17927 663 1 . 1 1 118 118 ASP C C 118 176.657 176.657 176.580 0.077 17927 664 1 . 1 1 118 118 ASP CA C 118 53.517 53.517 54.681 -1.164 17927 665 1 . 1 1 118 118 ASP CB C 118 42.556 42.556 41.045 1.511 17927 666 1 . 1 1 118 118 ASP H H 118 8.456 8.456 8.164 0.292 17927 667 1 . 1 1 119 119 GLY N N 119 109.074 109.074 107.176 1.898 17927 668 1 . 1 1 119 119 GLY C C 119 173.355 173.355 173.976 -0.621 17927 669 1 . 1 1 119 119 GLY CA C 119 46.256 46.256 45.290 0.966 17927 670 1 . 1 1 119 119 GLY H H 119 8.183 8.183 8.300 -0.117 17927 671 1 . 1 1 120 120 LYS N N 120 120.744 120.744 120.949 -0.205 17927 672 1 . 1 1 120 120 LYS HA H 120 4.533 4.533 4.637 -0.104 17927 673 1 . 1 1 120 120 LYS C C 120 177.229 177.229 176.251 0.978 17927 674 1 . 1 1 120 120 LYS CA C 120 55.287 55.287 54.379 0.908 17927 675 1 . 1 1 120 120 LYS CB C 120 32.581 32.581 32.887 -0.306 17927 676 1 . 1 1 120 120 LYS H H 120 8.449 8.449 7.561 0.888 17927 677 1 . 1 1 121 121 ILE N N 121 121.221 121.221 127.671 -6.450 17927 678 1 . 1 1 121 121 ILE HA H 121 3.886 3.886 3.921 -0.035 17927 679 1 . 1 1 121 121 ILE C C 121 177.819 177.819 176.567 1.252 17927 680 1 . 1 1 121 121 ILE CA C 121 63.915 63.915 63.430 0.485 17927 681 1 . 1 1 121 121 ILE CB C 121 39.390 39.390 37.193 2.197 17927 682 1 . 1 1 121 121 ILE H H 121 8.715 8.715 8.921 -0.206 17927 683 1 . 1 1 122 122 ILE N N 122 127.165 127.165 128.565 -1.400 17927 684 1 . 1 1 122 122 ILE HA H 122 4.341 4.341 4.202 0.139 17927 685 1 . 1 1 122 122 ILE C C 122 176.978 176.978 176.645 0.333 17927 686 1 . 1 1 122 122 ILE CA C 122 63.719 63.719 62.443 1.276 17927 687 1 . 1 1 122 122 ILE CB C 122 38.652 38.652 38.585 0.067 17927 688 1 . 1 1 122 122 ILE H H 122 8.974 8.974 8.695 0.279 17927 689 1 . 1 1 123 123 SER N N 123 111.227 111.227 115.080 -3.853 17927 690 1 . 1 1 123 123 SER HA H 123 4.738 4.738 4.751 -0.013 17927 691 1 . 1 1 123 123 SER C C 123 174.184 174.184 173.738 0.446 17927 692 1 . 1 1 123 123 SER CA C 123 57.383 57.383 57.102 0.281 17927 693 1 . 1 1 123 123 SER CB C 123 65.326 65.326 65.068 0.258 17927 694 1 . 1 1 123 123 SER H H 123 7.850 7.850 8.210 -0.360 17927 695 1 . 1 1 124 124 ALA N N 124 131.373 131.373 127.325 4.048 17927 696 1 . 1 1 124 124 ALA HA H 124 4.485 4.485 4.250 0.235 17927 697 1 . 1 1 124 124 ALA C C 124 175.147 175.147 176.260 -1.113 17927 698 1 . 1 1 124 124 ALA CA C 124 53.035 53.035 53.873 -0.837 17927 699 1 . 1 1 124 124 ALA CB C 124 18.662 18.662 19.208 -0.546 17927 700 1 . 1 1 124 124 ALA H H 124 9.384 9.384 8.796 0.588 17927 701 1 . 1 1 125 125 ASN N N 125 119.476 119.476 114.016 5.460 17927 702 1 . 1 1 125 125 ASN HA H 125 5.056 5.056 5.210 -0.154 17927 703 1 . 1 1 125 125 ASN C C 125 173.593 173.593 174.291 -0.698 17927 704 1 . 1 1 125 125 ASN CA C 125 52.352 52.352 52.337 0.015 17927 705 1 . 1 1 125 125 ASN CB C 125 38.304 38.304 39.677 -1.373 17927 706 1 . 1 1 125 125 ASN H H 125 8.191 8.191 7.805 0.386 17927 707 1 . 1 1 126 126 MET N N 126 122.705 122.705 124.023 -1.318 17927 708 1 . 1 1 126 126 MET HA H 126 4.585 4.585 4.826 -0.241 17927 709 1 . 1 1 126 126 MET C C 126 175.215 175.215 175.361 -0.146 17927 710 1 . 1 1 126 126 MET CA C 126 53.849 53.849 55.233 -1.384 17927 711 1 . 1 1 126 126 MET CB C 126 31.312 31.312 34.697 -3.385 17927 712 1 . 1 1 126 126 MET H H 126 8.376 8.376 9.115 -0.739 17927 713 1 . 1 1 127 127 THR N N 127 111.016 111.016 111.543 -0.527 17927 714 1 . 1 1 127 127 THR HA H 127 4.291 4.291 4.194 0.097 17927 715 1 . 1 1 127 127 THR C C 127 174.574 174.574 173.185 1.389 17927 716 1 . 1 1 127 127 THR CA C 127 62.085 62.085 60.868 1.217 17927 717 1 . 1 1 127 127 THR CB C 127 69.733 69.733 70.716 -0.983 17927 718 1 . 1 1 127 127 THR H H 127 7.714 7.714 8.117 -0.403 17927 719 1 . 1 1 128 128 ARG N N 128 118.722 118.722 122.668 -3.946 17927 720 1 . 1 1 128 128 ARG HA H 128 3.308 3.308 4.199 -0.891 17927 721 1 . 1 1 128 128 ARG C C 128 176.978 176.978 175.301 1.677 17927 722 1 . 1 1 128 128 ARG CA C 128 54.727 54.727 55.353 -0.626 17927 723 1 . 1 1 128 128 ARG CB C 128 29.598 29.598 30.311 -0.713 17927 724 1 . 1 1 128 128 ARG H H 128 8.658 8.658 7.708 0.950 17927 725 1 . 1 1 129 129 PRO HA H 129 3.933 3.933 4.357 -0.424 17927 726 1 . 1 1 129 129 PRO C C 129 175.794 175.794 177.076 -1.282 17927 727 1 . 1 1 129 129 PRO CA C 129 66.549 66.549 65.301 1.248 17927 728 1 . 1 1 129 129 PRO CB C 129 31.677 31.677 31.725 -0.048 17927 729 1 . 1 1 130 130 SER N N 130 108.696 108.696 110.815 -2.119 17927 730 1 . 1 1 130 130 SER HA H 130 3.988 3.988 4.354 -0.366 17927 731 1 . 1 1 130 130 SER C C 130 174.445 174.445 174.141 0.304 17927 732 1 . 1 1 130 130 SER CA C 130 58.911 58.911 58.739 0.172 17927 733 1 . 1 1 130 130 SER CB C 130 62.680 62.680 63.086 -0.406 17927 734 1 . 1 1 130 130 SER H H 130 8.375 8.375 8.157 0.218 17927 735 1 . 1 1 131 131 ASP N N 131 126.377 126.377 122.769 3.608 17927 736 1 . 1 1 131 131 ASP HA H 131 4.872 4.872 4.905 -0.033 17927 737 1 . 1 1 131 131 ASP C C 131 176.879 176.879 175.353 1.526 17927 738 1 . 1 1 131 131 ASP CA C 131 51.195 51.195 51.518 -0.323 17927 739 1 . 1 1 131 131 ASP CB C 131 42.816 42.816 42.401 0.415 17927 740 1 . 1 1 131 131 ASP H H 131 7.514 7.514 7.754 -0.240 17927 741 1 . 1 1 132 132 PRO HA H 132 4.392 4.392 4.173 0.219 17927 742 1 . 1 1 132 132 PRO C C 132 178.097 178.097 178.148 -0.051 17927 743 1 . 1 1 132 132 PRO CA C 132 65.079 65.079 64.767 0.312 17927 744 1 . 1 1 132 132 PRO CB C 132 32.409 32.409 32.110 0.299 17927 745 1 . 1 1 133 133 LYS N N 133 116.306 116.306 117.350 -1.044 17927 746 1 . 1 1 133 133 LYS HA H 133 3.958 3.958 4.060 -0.102 17927 747 1 . 1 1 133 133 LYS C C 133 179.532 179.532 178.917 0.615 17927 748 1 . 1 1 133 133 LYS CA C 133 58.521 58.521 59.186 -0.665 17927 749 1 . 1 1 133 133 LYS CB C 133 32.191 32.191 31.719 0.472 17927 750 1 . 1 1 133 133 LYS H H 133 8.842 8.842 8.360 0.482 17927 751 1 . 1 1 134 134 THR N N 134 120.833 120.833 115.486 5.348 17927 752 1 . 1 1 134 134 THR HA H 134 3.147 3.147 3.652 -0.505 17927 753 1 . 1 1 134 134 THR C C 134 173.356 173.356 175.176 -1.820 17927 754 1 . 1 1 134 134 THR CA C 134 66.383 66.383 65.790 0.593 17927 755 1 . 1 1 134 134 THR CB C 134 66.847 66.847 68.185 -1.338 17927 756 1 . 1 1 134 134 THR H H 134 8.292 8.292 7.702 0.590 17927 757 1 . 1 1 135 135 ALA N N 135 121.720 121.720 123.342 -1.622 17927 758 1 . 1 1 135 135 ALA HA H 135 3.583 3.583 3.592 -0.009 17927 759 1 . 1 1 135 135 ALA C C 135 178.902 178.902 179.388 -0.486 17927 760 1 . 1 1 135 135 ALA CA C 135 54.999 54.999 54.842 0.157 17927 761 1 . 1 1 135 135 ALA CB C 135 17.775 17.775 18.136 -0.361 17927 762 1 . 1 1 135 135 ALA H H 135 7.030 7.030 7.368 -0.338 17927 763 1 . 1 1 136 136 GLU N N 136 114.623 114.623 117.686 -3.063 17927 764 1 . 1 1 136 136 GLU HA H 136 3.922 3.922 4.013 -0.091 17927 765 1 . 1 1 136 136 GLU C C 136 179.199 179.199 178.865 0.334 17927 766 1 . 1 1 136 136 GLU CA C 136 59.837 59.837 58.746 1.091 17927 767 1 . 1 1 136 136 GLU CB C 136 29.786 29.786 29.135 0.651 17927 768 1 . 1 1 136 136 GLU H H 136 7.216 7.216 8.283 -1.067 17927 769 1 . 1 1 137 137 LYS N N 137 120.789 120.789 120.238 0.551 17927 770 1 . 1 1 137 137 LYS HA H 137 4.204 4.204 4.023 0.181 17927 771 1 . 1 1 137 137 LYS C C 137 178.834 178.834 178.784 0.050 17927 772 1 . 1 1 137 137 LYS CA C 137 57.343 57.343 58.758 -1.415 17927 773 1 . 1 1 137 137 LYS CB C 137 30.463 30.463 31.873 -1.410 17927 774 1 . 1 1 137 137 LYS H H 137 7.681 7.681 7.476 0.205 17927 775 1 . 1 1 138 138 PHE N N 138 118.373 118.373 117.881 0.492 17927 776 1 . 1 1 138 138 PHE HA H 138 4.033 4.033 4.011 0.022 17927 777 1 . 1 1 138 138 PHE C C 138 178.027 178.027 177.870 0.157 17927 778 1 . 1 1 138 138 PHE CA C 138 57.507 57.507 59.888 -2.381 17927 779 1 . 1 1 138 138 PHE CB C 138 35.889 35.889 37.444 -1.555 17927 780 1 . 1 1 138 138 PHE H H 138 8.059 8.059 7.458 0.601 17927 781 1 . 1 1 139 139 ASN N N 139 117.611 117.611 117.090 0.521 17927 782 1 . 1 1 139 139 ASN HA H 139 4.404 4.404 4.471 -0.067 17927 783 1 . 1 1 139 139 ASN C C 139 178.190 178.190 177.629 0.561 17927 784 1 . 1 1 139 139 ASN CA C 139 56.224 56.224 56.124 0.100 17927 785 1 . 1 1 139 139 ASN CB C 139 36.734 36.734 37.933 -1.199 17927 786 1 . 1 1 139 139 ASN H H 139 8.683 8.683 8.148 0.535 17927 787 1 . 1 1 140 140 GLU N N 140 121.432 121.432 121.651 -0.219 17927 788 1 . 1 1 140 140 GLU HA H 140 4.005 4.005 4.073 -0.068 17927 789 1 . 1 1 140 140 GLU C C 140 179.751 179.751 179.276 0.475 17927 790 1 . 1 1 140 140 GLU CA C 140 59.310 59.310 59.366 -0.056 17927 791 1 . 1 1 140 140 GLU CB C 140 30.055 30.055 29.685 0.370 17927 792 1 . 1 1 140 140 GLU H H 140 7.868 7.868 8.053 -0.185 17927 793 1 . 1 1 141 141 LEU N N 141 119.968 119.968 118.409 1.559 17927 794 1 . 1 1 141 141 LEU HA H 141 4.016 4.016 4.063 -0.047 17927 795 1 . 1 1 141 141 LEU C C 141 179.293 179.293 178.802 0.491 17927 796 1 . 1 1 141 141 LEU CA C 141 57.436 57.436 57.315 0.121 17927 797 1 . 1 1 141 141 LEU CB C 141 41.183 41.183 41.737 -0.554 17927 798 1 . 1 1 141 141 LEU H H 141 8.303 8.303 8.027 0.276 17927 799 1 . 1 1 142 142 LEU N N 142 115.040 115.040 116.520 -1.480 17927 800 1 . 1 1 142 142 LEU HA H 142 4.384 4.384 4.341 0.043 17927 801 1 . 1 1 142 142 LEU C C 142 178.002 178.002 177.606 0.396 17927 802 1 . 1 1 142 142 LEU CA C 142 55.279 55.279 55.316 -0.037 17927 803 1 . 1 1 142 142 LEU CB C 142 42.646 42.646 42.379 0.267 17927 804 1 . 1 1 142 142 LEU H H 142 8.230 8.230 7.817 0.413 17927 805 1 . 1 1 143 143 GLY N N 143 108.977 108.977 106.714 2.263 17927 806 1 . 1 1 143 143 GLY C C 143 175.216 175.216 174.691 0.525 17927 807 1 . 1 1 143 143 GLY CA C 143 46.741 46.741 45.639 1.102 17927 808 1 . 1 1 143 143 GLY H H 143 7.762 7.762 7.748 0.014 17927 809 1 . 1 1 144 144 LEU N N 144 119.660 119.660 119.956 -0.296 17927 810 1 . 1 1 144 144 LEU HA H 144 4.488 4.488 4.476 0.012 17927 811 1 . 1 1 144 144 LEU C C 144 177.375 177.375 176.602 0.773 17927 812 1 . 1 1 144 144 LEU CA C 144 54.525 54.525 55.295 -0.770 17927 813 1 . 1 1 144 144 LEU CB C 144 42.773 42.773 42.487 0.286 17927 814 1 . 1 1 144 144 LEU H H 144 8.241 8.241 8.246 -0.005 17927 815 1 . 1 1 145 145 GLU N N 145 119.959 119.959 118.756 1.203 17927 816 1 . 1 1 145 145 GLU HA H 145 4.241 4.241 4.182 0.059 17927 817 1 . 1 1 145 145 GLU C C 145 177.075 177.075 177.004 0.071 17927 818 1 . 1 1 145 145 GLU CA C 145 56.799 56.799 56.878 -0.079 17927 819 1 . 1 1 145 145 GLU CB C 145 30.168 30.168 29.795 0.373 17927 820 1 . 1 1 145 145 GLU H H 145 8.410 8.410 7.774 0.636 17927 821 1 . 1 1 146 146 GLY N N 146 109.412 109.412 109.446 -0.034 17927 822 1 . 1 1 146 146 GLY C C 146 174.276 174.276 174.247 0.029 17927 823 1 . 1 1 146 146 GLY CA C 146 45.445 45.445 45.002 0.443 17927 824 1 . 1 1 146 146 GLY H H 146 8.422 8.422 8.444 -0.022 17927 825 1 . 1 1 151 151 HIS HA H 151 4.656 4.656 4.580 0.076 17927 826 1 . 1 1 151 151 HIS C C 151 173.990 173.990 174.161 -0.171 17927 827 1 . 1 1 151 151 HIS CA C 151 56.044 56.044 56.283 -0.239 17927 828 1 . 1 1 151 151 HIS CB C 151 30.076 30.076 30.426 -0.350 17927 stop_ save_