data_19043 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19043 _Entry.PDB_ID 2M5A 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 19043 _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 ASP N N 2 125.357 125.357 128.312 -2.955 19043 2 1 1 . 1 1 2 2 ASP C C 2 175.535 175.535 176.049 -0.514 19043 3 1 1 . 1 1 2 2 ASP CA C 2 54.307 54.307 54.113 0.194 19043 4 1 1 . 1 1 2 2 ASP CB C 2 41.470 41.470 40.239 1.230 19043 5 1 1 . 1 1 2 2 ASP H H 2 8.762 8.762 8.783 -0.021 19043 6 1 1 . 1 1 3 3 ASN N N 3 120.441 120.441 118.651 1.790 19043 7 1 1 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.202 0.498 19043 8 1 1 . 1 1 3 3 ASN C C 3 175.246 175.246 175.380 -0.134 19043 9 1 1 . 1 1 3 3 ASN CA C 3 53.289 53.289 54.117 -0.828 19043 10 1 1 . 1 1 3 3 ASN CB C 3 39.086 39.086 38.445 0.641 19043 11 1 1 . 1 1 3 3 ASN H H 3 8.548 8.548 8.328 0.220 19043 12 1 1 . 1 1 4 4 LYS N N 4 121.461 121.461 118.683 2.778 19043 13 1 1 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.070 0.145 19043 14 1 1 . 1 1 4 4 LYS C C 4 176.404 176.404 176.089 0.315 19043 15 1 1 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.449 0.404 19043 16 1 1 . 1 1 4 4 LYS CB C 4 32.780 32.780 31.679 1.101 19043 17 1 1 . 1 1 4 4 LYS H H 4 8.337 8.337 7.813 0.524 19043 18 1 1 . 1 1 5 5 PHE N N 5 119.538 119.538 115.431 4.107 19043 19 1 1 . 1 1 5 5 PHE C C 5 175.433 175.433 175.198 0.235 19043 20 1 1 . 1 1 5 5 PHE CA C 5 57.792 57.792 58.195 -0.403 19043 21 1 1 . 1 1 5 5 PHE CB C 5 40.067 40.067 35.625 4.442 19043 22 1 1 . 1 1 5 5 PHE H H 5 8.277 8.277 7.210 1.067 19043 23 1 1 . 1 1 6 6 ASN N N 6 121.168 121.168 119.980 1.188 19043 24 1 1 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.641 0.176 19043 25 1 1 . 1 1 6 6 ASN C C 6 175.884 175.884 176.429 -0.545 19043 26 1 1 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.825 -1.040 19043 27 1 1 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.324 0.047 19043 28 1 1 . 1 1 6 6 ASN H H 6 8.443 8.443 8.179 0.264 19043 29 1 1 . 1 1 7 7 LYS N N 7 121.688 121.688 121.403 0.285 19043 30 1 1 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.158 -0.213 19043 31 1 1 . 1 1 7 7 LYS C C 7 178.196 178.196 178.494 -0.298 19043 32 1 1 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.280 -0.379 19043 33 1 1 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.355 -0.230 19043 34 1 1 . 1 1 7 7 LYS H H 7 8.460 8.460 8.628 -0.168 19043 35 1 1 . 1 1 8 8 GLU N N 8 119.926 119.926 118.690 1.236 19043 36 1 1 . 1 1 8 8 GLU HA H 8 4.081 4.081 4.072 0.009 19043 37 1 1 . 1 1 8 8 GLU C C 8 179.894 179.894 179.071 0.823 19043 38 1 1 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.715 0.124 19043 39 1 1 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.168 -0.227 19043 40 1 1 . 1 1 8 8 GLU H H 8 8.386 8.386 8.776 -0.390 19043 41 1 1 . 1 1 9 9 GLN N N 9 121.401 121.401 118.124 3.277 19043 42 1 1 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.108 -0.011 19043 43 1 1 . 1 1 9 9 GLN C C 9 177.324 177.324 178.298 -0.974 19043 44 1 1 . 1 1 9 9 GLN CA C 9 59.383 59.383 59.061 0.322 19043 45 1 1 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.520 0.349 19043 46 1 1 . 1 1 9 9 GLN H H 9 8.307 8.307 8.710 -0.403 19043 47 1 1 . 1 1 10 10 GLN N N 10 120.060 120.060 119.648 0.412 19043 48 1 1 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.069 -0.847 19043 49 1 1 . 1 1 10 10 GLN C C 10 176.888 176.888 178.339 -1.451 19043 50 1 1 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.918 0.031 19043 51 1 1 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.676 0.165 19043 52 1 1 . 1 1 10 10 GLN H H 10 8.040 8.040 7.856 0.184 19043 53 1 1 . 1 1 11 11 ASN N N 11 116.214 116.214 118.908 -2.694 19043 54 1 1 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.605 -0.255 19043 55 1 1 . 1 1 11 11 ASN C C 11 177.828 177.828 177.488 0.340 19043 56 1 1 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.029 0.228 19043 57 1 1 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.066 0.144 19043 58 1 1 . 1 1 11 11 ASN H H 11 8.366 8.366 8.393 -0.027 19043 59 1 1 . 1 1 12 12 ALA N N 12 121.429 121.429 122.900 -1.471 19043 60 1 1 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.014 -0.005 19043 61 1 1 . 1 1 12 12 ALA C C 12 177.850 177.850 179.077 -1.227 19043 62 1 1 . 1 1 12 12 ALA CA C 12 55.293 55.293 55.140 0.153 19043 63 1 1 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.454 -0.133 19043 64 1 1 . 1 1 12 12 ALA H H 12 7.915 7.915 8.207 -0.292 19043 65 1 1 . 1 1 13 13 PHE N N 13 118.052 118.052 120.218 -2.166 19043 66 1 1 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.971 -0.398 19043 67 1 1 . 1 1 13 13 PHE C C 13 175.832 175.832 177.217 -1.385 19043 68 1 1 . 1 1 13 13 PHE CA C 13 61.855 61.855 62.091 -0.236 19043 69 1 1 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.939 -0.022 19043 70 1 1 . 1 1 13 13 PHE H H 13 8.097 8.097 7.459 0.638 19043 71 1 1 . 1 1 14 14 TYR N N 14 116.000 116.000 117.242 -1.242 19043 72 1 1 . 1 1 14 14 TYR HA H 14 3.985 3.985 4.026 -0.041 19043 73 1 1 . 1 1 14 14 TYR C C 14 178.860 178.860 178.382 0.478 19043 74 1 1 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.453 -1.658 19043 75 1 1 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.800 -0.820 19043 76 1 1 . 1 1 14 14 TYR H H 14 8.040 8.040 7.666 0.374 19043 77 1 1 . 1 1 15 15 GLU N N 15 118.737 118.737 118.203 0.534 19043 78 1 1 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.850 0.121 19043 79 1 1 . 1 1 15 15 GLU C C 15 180.184 180.184 179.331 0.853 19043 80 1 1 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.158 1.449 19043 81 1 1 . 1 1 15 15 GLU CB C 15 29.722 29.722 28.916 0.806 19043 82 1 1 . 1 1 15 15 GLU H H 15 8.244 8.244 8.308 -0.064 19043 83 1 1 . 1 1 16 16 ILE N N 16 119.695 119.695 118.347 1.348 19043 84 1 1 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.709 -0.356 19043 85 1 1 . 1 1 16 16 ILE C C 16 177.760 177.760 177.694 0.066 19043 86 1 1 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.360 1.294 19043 87 1 1 . 1 1 16 16 ILE CB C 16 37.403 37.403 37.799 -0.396 19043 88 1 1 . 1 1 16 16 ILE H H 16 8.336 8.336 7.556 0.780 19043 89 1 1 . 1 1 17 17 LEU N N 17 117.709 117.709 119.499 -1.790 19043 90 1 1 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.933 -0.380 19043 91 1 1 . 1 1 17 17 LEU C C 17 176.565 176.565 178.375 -1.810 19043 92 1 1 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.144 0.415 19043 93 1 1 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.562 0.276 19043 94 1 1 . 1 1 17 17 LEU H H 17 7.738 7.738 7.543 0.195 19043 95 1 1 . 1 1 18 18 HIS N N 18 110.934 110.934 116.869 -5.935 19043 96 1 1 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.307 0.190 19043 97 1 1 . 1 1 18 18 HIS C C 18 175.243 175.243 175.949 -0.706 19043 98 1 1 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.848 -1.792 19043 99 1 1 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.150 0.498 19043 100 1 1 . 1 1 18 18 HIS H H 18 7.150 7.150 8.002 -0.852 19043 101 1 1 . 1 1 19 19 LEU N N 19 123.586 123.586 121.781 1.805 19043 102 1 1 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.284 0.134 19043 103 1 1 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.943 -0.467 19043 104 1 1 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.271 -0.949 19043 105 1 1 . 1 1 19 19 LEU H H 19 7.249 7.249 7.598 -0.349 19043 106 1 1 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.425 0.006 19043 107 1 1 . 1 1 20 20 PRO C C 20 178.092 178.092 177.702 0.390 19043 108 1 1 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.916 -0.019 19043 109 1 1 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.228 0.344 19043 110 1 1 . 1 1 21 21 ASN N N 21 113.952 113.952 116.507 -2.555 19043 111 1 1 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.509 0.500 19043 112 1 1 . 1 1 21 21 ASN C C 21 176.397 176.397 175.747 0.650 19043 113 1 1 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.043 -1.414 19043 114 1 1 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.472 0.338 19043 115 1 1 . 1 1 21 21 ASN H H 21 8.871 8.871 8.179 0.692 19043 116 1 1 . 1 1 22 22 LEU N N 22 117.526 117.526 121.817 -4.291 19043 117 1 1 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.318 0.083 19043 118 1 1 . 1 1 22 22 LEU C C 22 176.879 176.879 175.041 1.838 19043 119 1 1 . 1 1 22 22 LEU CA C 22 54.457 54.457 55.086 -0.629 19043 120 1 1 . 1 1 22 22 LEU CB C 22 42.520 42.520 43.293 -0.773 19043 121 1 1 . 1 1 22 22 LEU H H 22 6.563 6.563 8.152 -1.589 19043 122 1 1 . 1 1 23 23 ASN N N 23 120.219 120.219 121.595 -1.376 19043 123 1 1 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.728 0.140 19043 124 1 1 . 1 1 23 23 ASN C C 23 175.507 175.507 176.266 -0.759 19043 125 1 1 . 1 1 23 23 ASN CA C 23 51.416 51.416 52.118 -0.702 19043 126 1 1 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.676 -0.964 19043 127 1 1 . 1 1 23 23 ASN H H 23 8.612 8.612 8.119 0.493 19043 128 1 1 . 1 1 24 24 GLU N N 24 118.801 118.801 120.085 -1.284 19043 129 1 1 . 1 1 24 24 GLU HA H 24 3.874 3.874 3.915 -0.041 19043 130 1 1 . 1 1 24 24 GLU C C 24 177.799 177.799 178.585 -0.786 19043 131 1 1 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.360 -0.169 19043 132 1 1 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.299 0.066 19043 133 1 1 . 1 1 24 24 GLU H H 24 8.735 8.735 8.918 -0.183 19043 134 1 1 . 1 1 25 25 GLU N N 25 119.198 119.198 118.850 0.348 19043 135 1 1 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.010 -0.032 19043 136 1 1 . 1 1 25 25 GLU C C 25 180.078 180.078 179.247 0.831 19043 137 1 1 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.431 0.460 19043 138 1 1 . 1 1 25 25 GLU CB C 25 29.131 29.131 29.164 -0.033 19043 139 1 1 . 1 1 25 25 GLU H H 25 8.229 8.229 8.736 -0.507 19043 140 1 1 . 1 1 26 26 GLN N N 26 119.646 119.646 118.250 1.396 19043 141 1 1 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.089 -0.149 19043 142 1 1 . 1 1 26 26 GLN C C 26 178.154 178.154 178.370 -0.216 19043 143 1 1 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.443 -0.550 19043 144 1 1 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.941 -0.039 19043 145 1 1 . 1 1 26 26 GLN H H 26 8.425 8.425 8.170 0.255 19043 146 1 1 . 1 1 27 27 ARG N N 27 119.454 119.454 120.318 -0.864 19043 147 1 1 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.146 -0.360 19043 148 1 1 . 1 1 27 27 ARG C C 27 177.863 177.863 178.367 -0.504 19043 149 1 1 . 1 1 27 27 ARG CA C 27 60.630 60.630 60.069 0.561 19043 150 1 1 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.147 -0.503 19043 151 1 1 . 1 1 27 27 ARG H H 27 8.548 8.548 8.397 0.151 19043 152 1 1 . 1 1 28 28 ASN N N 28 116.833 116.833 117.713 -0.880 19043 153 1 1 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.495 -0.163 19043 154 1 1 . 1 1 28 28 ASN C C 28 177.234 177.234 177.255 -0.021 19043 155 1 1 . 1 1 28 28 ASN CA C 28 56.038 56.038 56.052 -0.014 19043 156 1 1 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.303 -0.618 19043 157 1 1 . 1 1 28 28 ASN H H 28 8.569 8.569 8.631 -0.062 19043 158 1 1 . 1 1 29 29 ALA N N 29 122.687 122.687 123.393 -0.706 19043 159 1 1 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.054 -0.000 19043 160 1 1 . 1 1 29 29 ALA C C 29 181.045 181.045 179.618 1.427 19043 161 1 1 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.627 0.623 19043 162 1 1 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.268 -0.448 19043 163 1 1 . 1 1 29 29 ALA H H 29 7.793 7.793 7.363 0.430 19043 164 1 1 . 1 1 30 30 PHE N N 30 116.979 116.979 117.639 -0.660 19043 165 1 1 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.201 0.177 19043 166 1 1 . 1 1 30 30 PHE C C 30 177.887 177.887 178.050 -0.163 19043 167 1 1 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.865 0.754 19043 168 1 1 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.722 0.737 19043 169 1 1 . 1 1 30 30 PHE H H 30 8.017 8.017 7.515 0.502 19043 170 1 1 . 1 1 31 31 ILE N N 31 119.553 119.553 119.170 0.383 19043 171 1 1 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.627 0.151 19043 172 1 1 . 1 1 31 31 ILE C C 31 177.084 177.084 178.129 -1.045 19043 173 1 1 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.277 0.368 19043 174 1 1 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.504 -0.389 19043 175 1 1 . 1 1 31 31 ILE H H 31 8.372 8.372 8.306 0.066 19043 176 1 1 . 1 1 32 32 GLN N N 32 119.108 119.108 119.418 -0.310 19043 177 1 1 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.996 -0.190 19043 178 1 1 . 1 1 32 32 GLN C C 32 177.836 177.836 178.475 -0.639 19043 179 1 1 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.408 -0.640 19043 180 1 1 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.658 -0.680 19043 181 1 1 . 1 1 32 32 GLN H H 32 8.389 8.389 8.163 0.226 19043 182 1 1 . 1 1 33 33 SER N N 33 114.437 114.437 115.162 -0.725 19043 183 1 1 . 1 1 33 33 SER HA H 33 4.212 4.212 4.269 -0.057 19043 184 1 1 . 1 1 33 33 SER C C 33 175.469 175.469 176.833 -1.364 19043 185 1 1 . 1 1 33 33 SER CA C 33 62.403 62.403 61.148 1.254 19043 186 1 1 . 1 1 33 33 SER CB C 33 63.794 63.794 62.967 0.827 19043 187 1 1 . 1 1 33 33 SER H H 33 8.078 8.078 7.793 0.285 19043 188 1 1 . 1 1 34 34 LEU N N 34 122.967 122.967 123.784 -0.817 19043 189 1 1 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.191 -0.281 19043 190 1 1 . 1 1 34 34 LEU C C 34 177.506 177.506 178.398 -0.892 19043 191 1 1 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.751 -0.323 19043 192 1 1 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.037 0.775 19043 193 1 1 . 1 1 34 34 LEU H H 34 8.495 8.495 8.307 0.188 19043 194 1 1 . 1 1 35 35 LYS N N 35 115.859 115.859 118.258 -2.399 19043 195 1 1 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.109 -0.296 19043 196 1 1 . 1 1 35 35 LYS C C 35 177.628 177.628 178.108 -0.480 19043 197 1 1 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.662 -1.785 19043 198 1 1 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.314 -0.295 19043 199 1 1 . 1 1 35 35 LYS H H 35 7.815 7.815 7.678 0.137 19043 200 1 1 . 1 1 36 36 ASP N N 36 116.741 116.741 117.169 -0.428 19043 201 1 1 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.623 -0.109 19043 202 1 1 . 1 1 36 36 ASP C C 36 177.324 177.324 176.369 0.955 19043 203 1 1 . 1 1 36 36 ASP CA C 36 56.686 56.686 55.561 1.125 19043 204 1 1 . 1 1 36 36 ASP CB C 36 40.671 40.671 42.129 -1.458 19043 205 1 1 . 1 1 36 36 ASP H H 36 7.943 7.943 7.753 0.190 19043 206 1 1 . 1 1 37 37 ASP N N 37 116.686 116.686 116.897 -0.211 19043 207 1 1 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.028 0.013 19043 208 1 1 . 1 1 37 37 ASP CA C 37 51.946 51.946 52.457 -0.511 19043 209 1 1 . 1 1 37 37 ASP CB C 37 40.523 40.523 42.517 -1.994 19043 210 1 1 . 1 1 37 37 ASP H H 37 8.125 8.125 7.771 0.354 19043 211 1 1 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.523 0.060 19043 212 1 1 . 1 1 38 38 PRO C C 38 179.200 179.200 178.228 0.972 19043 213 1 1 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.460 0.077 19043 214 1 1 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.088 -0.202 19043 215 1 1 . 1 1 39 39 SER N N 39 114.963 114.963 113.883 1.080 19043 216 1 1 . 1 1 39 39 SER HA H 39 4.178 4.178 4.284 -0.106 19043 217 1 1 . 1 1 39 39 SER C C 39 176.151 176.151 176.107 0.044 19043 218 1 1 . 1 1 39 39 SER CA C 39 61.197 61.197 60.978 0.219 19043 219 1 1 . 1 1 39 39 SER CB C 39 62.729 62.729 62.399 0.330 19043 220 1 1 . 1 1 39 39 SER H H 39 8.315 8.315 8.504 -0.189 19043 221 1 1 . 1 1 40 40 GLN N N 40 120.058 120.058 119.769 0.289 19043 222 1 1 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.481 0.179 19043 223 1 1 . 1 1 40 40 GLN C C 40 176.192 176.192 177.166 -0.974 19043 224 1 1 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.444 -0.463 19043 225 1 1 . 1 1 40 40 GLN CB C 40 28.168 28.168 27.930 0.238 19043 226 1 1 . 1 1 40 40 GLN H H 40 7.820 7.820 7.798 0.022 19043 227 1 1 . 1 1 41 41 SER N N 41 115.553 115.553 116.060 -0.507 19043 228 1 1 . 1 1 41 41 SER HA H 41 3.845 3.845 4.110 -0.265 19043 229 1 1 . 1 1 41 41 SER C C 41 174.181 174.181 175.383 -1.202 19043 230 1 1 . 1 1 41 41 SER CA C 41 63.957 63.957 61.027 2.930 19043 231 1 1 . 1 1 41 41 SER CB C 41 63.191 63.191 62.736 0.455 19043 232 1 1 . 1 1 41 41 SER H H 41 7.666 7.666 7.772 -0.106 19043 233 1 1 . 1 1 42 42 ALA N N 42 122.360 122.360 122.549 -0.189 19043 234 1 1 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.235 -0.112 19043 235 1 1 . 1 1 42 42 ALA C C 42 180.996 180.996 178.955 2.041 19043 236 1 1 . 1 1 42 42 ALA CA C 42 55.563 55.563 53.940 1.623 19043 237 1 1 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.267 -1.212 19043 238 1 1 . 1 1 42 42 ALA H H 42 8.556 8.556 7.885 0.671 19043 239 1 1 . 1 1 43 43 ASN N N 43 118.974 118.974 118.795 0.179 19043 240 1 1 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.532 -0.013 19043 241 1 1 . 1 1 43 43 ASN C C 43 177.972 177.972 177.815 0.157 19043 242 1 1 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.492 -0.638 19043 243 1 1 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.270 -0.121 19043 244 1 1 . 1 1 43 43 ASN H H 43 7.950 7.950 7.486 0.464 19043 245 1 1 . 1 1 44 44 LEU N N 44 122.070 122.070 120.661 1.409 19043 246 1 1 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.397 -0.208 19043 247 1 1 . 1 1 44 44 LEU C C 44 178.332 178.332 179.409 -1.077 19043 248 1 1 . 1 1 44 44 LEU CA C 44 57.834 57.834 57.978 -0.144 19043 249 1 1 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.868 0.483 19043 250 1 1 . 1 1 44 44 LEU H H 44 8.789 8.789 8.578 0.211 19043 251 1 1 . 1 1 45 45 LEU N N 45 118.621 118.621 119.312 -0.691 19043 252 1 1 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.719 0.086 19043 253 1 1 . 1 1 45 45 LEU C C 45 177.832 177.832 178.538 -0.706 19043 254 1 1 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.761 0.124 19043 255 1 1 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.558 0.248 19043 256 1 1 . 1 1 45 45 LEU H H 45 8.283 8.283 7.558 0.725 19043 257 1 1 . 1 1 46 46 ALA N N 46 119.525 119.525 120.541 -1.016 19043 258 1 1 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.878 0.132 19043 259 1 1 . 1 1 46 46 ALA C C 46 181.250 181.250 179.961 1.289 19043 260 1 1 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.127 0.169 19043 261 1 1 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.015 -0.064 19043 262 1 1 . 1 1 46 46 ALA H H 46 7.640 7.640 7.764 -0.124 19043 263 1 1 . 1 1 47 47 GLU N N 47 119.572 119.572 118.326 1.246 19043 264 1 1 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.098 -0.068 19043 265 1 1 . 1 1 47 47 GLU C C 47 178.895 178.895 178.909 -0.014 19043 266 1 1 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.958 0.208 19043 267 1 1 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.849 -0.312 19043 268 1 1 . 1 1 47 47 GLU H H 47 8.139 8.139 8.277 -0.138 19043 269 1 1 . 1 1 48 48 ALA N N 48 123.953 123.953 122.452 1.501 19043 270 1 1 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.687 -0.160 19043 271 1 1 . 1 1 48 48 ALA C C 48 179.636 179.636 179.169 0.467 19043 272 1 1 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.438 1.079 19043 273 1 1 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.684 -0.439 19043 274 1 1 . 1 1 48 48 ALA H H 48 8.468 8.468 7.770 0.698 19043 275 1 1 . 1 1 49 49 LYS N N 49 117.926 117.926 118.179 -0.253 19043 276 1 1 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.910 -0.171 19043 277 1 1 . 1 1 49 49 LYS C C 49 178.761 178.761 178.707 0.054 19043 278 1 1 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.611 0.781 19043 279 1 1 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.333 -0.244 19043 280 1 1 . 1 1 49 49 LYS H H 49 8.459 8.459 8.418 0.041 19043 281 1 1 . 1 1 50 50 LYS N N 50 120.194 120.194 119.390 0.804 19043 282 1 1 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.075 0.013 19043 283 1 1 . 1 1 50 50 LYS C C 50 179.859 179.859 178.470 1.389 19043 284 1 1 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.007 0.728 19043 285 1 1 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.520 -0.057 19043 286 1 1 . 1 1 50 50 LYS H H 50 7.702 7.702 7.764 -0.062 19043 287 1 1 . 1 1 51 51 LEU N N 51 122.126 122.126 119.147 2.979 19043 288 1 1 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.253 -0.126 19043 289 1 1 . 1 1 51 51 LEU C C 51 178.123 178.123 178.048 0.075 19043 290 1 1 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.576 1.021 19043 291 1 1 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.193 0.159 19043 292 1 1 . 1 1 51 51 LEU H H 51 8.023 8.023 7.462 0.561 19043 293 1 1 . 1 1 52 52 ASN N N 52 116.675 116.675 117.311 -0.636 19043 294 1 1 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.431 -0.496 19043 295 1 1 . 1 1 52 52 ASN C C 52 177.668 177.668 176.661 1.007 19043 296 1 1 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.073 1.844 19043 297 1 1 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.581 3.355 19043 298 1 1 . 1 1 52 52 ASN H H 52 8.537 8.537 8.184 0.353 19043 299 1 1 . 1 1 53 53 ASP N N 53 118.725 118.725 118.672 0.053 19043 300 1 1 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.576 -0.132 19043 301 1 1 . 1 1 53 53 ASP C C 53 178.936 178.936 176.430 2.506 19043 302 1 1 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.531 1.402 19043 303 1 1 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.390 -1.295 19043 304 1 1 . 1 1 53 53 ASP H H 53 8.220 8.220 7.835 0.385 19043 305 1 1 . 1 1 54 54 ALA N N 54 122.872 122.872 121.245 1.627 19043 306 1 1 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.158 0.074 19043 307 1 1 . 1 1 54 54 ALA C C 54 179.354 179.354 178.710 0.644 19043 308 1 1 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.055 0.286 19043 309 1 1 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.168 -0.563 19043 310 1 1 . 1 1 54 54 ALA H H 54 8.037 8.037 7.090 0.947 19043 311 1 1 . 1 1 55 55 GLN N N 55 115.052 115.052 116.268 -1.216 19043 312 1 1 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.350 0.028 19043 313 1 1 . 1 1 55 55 GLN C C 55 174.116 174.116 175.261 -1.145 19043 314 1 1 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.199 -0.245 19043 315 1 1 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.464 -1.240 19043 316 1 1 . 1 1 55 55 GLN H H 55 7.512 7.512 7.559 -0.047 19043 317 1 1 . 1 1 56 56 ALA N N 56 124.556 124.556 125.117 -0.561 19043 318 1 1 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.419 -0.071 19043 319 1 1 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.041 -0.005 19043 320 1 1 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.588 -0.609 19043 321 1 1 . 1 1 56 56 ALA H H 56 7.100 7.100 7.469 -0.369 19043 322 1 1 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.501 -0.089 19043 323 1 1 . 1 1 57 57 PRO C C 57 176.151 176.151 176.434 -0.283 19043 324 1 1 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.418 0.865 19043 325 1 1 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.126 -0.133 19043 326 1 2 . 1 1 2 2 ASP N N 2 125.357 125.357 122.734 2.623 19043 327 1 2 . 1 1 2 2 ASP C C 2 175.535 175.535 176.046 -0.511 19043 328 1 2 . 1 1 2 2 ASP CA C 2 54.307 54.307 55.000 -0.693 19043 329 1 2 . 1 1 2 2 ASP CB C 2 41.470 41.470 40.820 0.650 19043 330 1 2 . 1 1 2 2 ASP H H 2 8.762 8.762 8.420 0.342 19043 331 1 2 . 1 1 3 3 ASN N N 3 120.441 120.441 114.348 6.093 19043 332 1 2 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.484 0.216 19043 333 1 2 . 1 1 3 3 ASN C C 3 175.246 175.246 174.604 0.642 19043 334 1 2 . 1 1 3 3 ASN CA C 3 53.289 53.289 53.425 -0.136 19043 335 1 2 . 1 1 3 3 ASN CB C 3 39.086 39.086 38.394 0.692 19043 336 1 2 . 1 1 3 3 ASN H H 3 8.548 8.548 8.156 0.392 19043 337 1 2 . 1 1 4 4 LYS N N 4 121.461 121.461 115.449 6.012 19043 338 1 2 . 1 1 4 4 LYS HA H 4 4.215 4.215 3.973 0.242 19043 339 1 2 . 1 1 4 4 LYS C C 4 176.404 176.404 177.054 -0.650 19043 340 1 2 . 1 1 4 4 LYS CA C 4 56.853 56.853 57.037 -0.184 19043 341 1 2 . 1 1 4 4 LYS CB C 4 32.780 32.780 31.785 0.995 19043 342 1 2 . 1 1 4 4 LYS H H 4 8.337 8.337 7.893 0.444 19043 343 1 2 . 1 1 5 5 PHE N N 5 119.538 119.538 118.455 1.083 19043 344 1 2 . 1 1 5 5 PHE C C 5 175.433 175.433 175.345 0.088 19043 345 1 2 . 1 1 5 5 PHE CA C 5 57.792 57.792 57.222 0.570 19043 346 1 2 . 1 1 5 5 PHE CB C 5 40.067 40.067 36.246 3.821 19043 347 1 2 . 1 1 5 5 PHE H H 5 8.277 8.277 7.570 0.707 19043 348 1 2 . 1 1 6 6 ASN N N 6 121.168 121.168 120.954 0.214 19043 349 1 2 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.575 0.242 19043 350 1 2 . 1 1 6 6 ASN C C 6 175.884 175.884 176.748 -0.864 19043 351 1 2 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.806 -1.021 19043 352 1 2 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.536 -0.165 19043 353 1 2 . 1 1 6 6 ASN H H 6 8.443 8.443 7.963 0.480 19043 354 1 2 . 1 1 7 7 LYS N N 7 121.688 121.688 121.273 0.415 19043 355 1 2 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.145 -0.200 19043 356 1 2 . 1 1 7 7 LYS C C 7 178.196 178.196 178.516 -0.320 19043 357 1 2 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.346 -0.445 19043 358 1 2 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.395 -0.270 19043 359 1 2 . 1 1 7 7 LYS H H 7 8.460 8.460 8.564 -0.104 19043 360 1 2 . 1 1 8 8 GLU N N 8 119.926 119.926 118.131 1.795 19043 361 1 2 . 1 1 8 8 GLU HA H 8 4.081 4.081 3.941 0.140 19043 362 1 2 . 1 1 8 8 GLU C C 8 179.894 179.894 178.807 1.087 19043 363 1 2 . 1 1 8 8 GLU CA C 8 59.839 59.839 60.136 -0.297 19043 364 1 2 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.078 -0.137 19043 365 1 2 . 1 1 8 8 GLU H H 8 8.386 8.386 8.644 -0.258 19043 366 1 2 . 1 1 9 9 GLN N N 9 121.401 121.401 117.536 3.865 19043 367 1 2 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.085 0.012 19043 368 1 2 . 1 1 9 9 GLN C C 9 177.324 177.324 178.168 -0.844 19043 369 1 2 . 1 1 9 9 GLN CA C 9 59.383 59.383 59.284 0.099 19043 370 1 2 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.348 0.521 19043 371 1 2 . 1 1 9 9 GLN H H 9 8.307 8.307 8.520 -0.213 19043 372 1 2 . 1 1 10 10 GLN N N 10 120.060 120.060 119.831 0.229 19043 373 1 2 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.005 -0.783 19043 374 1 2 . 1 1 10 10 GLN C C 10 176.888 176.888 178.301 -1.413 19043 375 1 2 . 1 1 10 10 GLN CA C 10 58.949 58.949 59.061 -0.112 19043 376 1 2 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.595 0.246 19043 377 1 2 . 1 1 10 10 GLN H H 10 8.040 8.040 7.900 0.140 19043 378 1 2 . 1 1 11 11 ASN N N 11 116.214 116.214 118.963 -2.749 19043 379 1 2 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.578 -0.228 19043 380 1 2 . 1 1 11 11 ASN C C 11 177.828 177.828 177.614 0.214 19043 381 1 2 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.130 0.127 19043 382 1 2 . 1 1 11 11 ASN CB C 11 38.210 38.210 37.995 0.215 19043 383 1 2 . 1 1 11 11 ASN H H 11 8.366 8.366 8.439 -0.073 19043 384 1 2 . 1 1 12 12 ALA N N 12 121.429 121.429 123.649 -2.220 19043 385 1 2 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.076 -0.067 19043 386 1 2 . 1 1 12 12 ALA C C 12 177.850 177.850 179.106 -1.256 19043 387 1 2 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.972 0.321 19043 388 1 2 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.488 -0.168 19043 389 1 2 . 1 1 12 12 ALA H H 12 7.915 7.915 8.244 -0.329 19043 390 1 2 . 1 1 13 13 PHE N N 13 118.052 118.052 120.004 -1.952 19043 391 1 2 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.999 -0.426 19043 392 1 2 . 1 1 13 13 PHE C C 13 175.832 175.832 177.154 -1.322 19043 393 1 2 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.928 -0.073 19043 394 1 2 . 1 1 13 13 PHE CB C 13 38.917 38.917 39.017 -0.100 19043 395 1 2 . 1 1 13 13 PHE H H 13 8.097 8.097 7.628 0.469 19043 396 1 2 . 1 1 14 14 TYR N N 14 116.000 116.000 118.044 -2.044 19043 397 1 2 . 1 1 14 14 TYR HA H 14 3.985 3.985 3.966 0.019 19043 398 1 2 . 1 1 14 14 TYR C C 14 178.860 178.860 178.304 0.556 19043 399 1 2 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.365 -1.570 19043 400 1 2 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.719 -0.739 19043 401 1 2 . 1 1 14 14 TYR H H 14 8.040 8.040 7.916 0.124 19043 402 1 2 . 1 1 15 15 GLU N N 15 118.737 118.737 119.490 -0.753 19043 403 1 2 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.697 0.274 19043 404 1 2 . 1 1 15 15 GLU C C 15 180.184 180.184 179.218 0.966 19043 405 1 2 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.332 1.275 19043 406 1 2 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.395 0.327 19043 407 1 2 . 1 1 15 15 GLU H H 15 8.244 8.244 8.121 0.123 19043 408 1 2 . 1 1 16 16 ILE N N 16 119.695 119.695 117.754 1.941 19043 409 1 2 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.736 -0.383 19043 410 1 2 . 1 1 16 16 ILE C C 16 177.760 177.760 177.117 0.643 19043 411 1 2 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.103 1.551 19043 412 1 2 . 1 1 16 16 ILE CB C 16 37.403 37.403 37.952 -0.549 19043 413 1 2 . 1 1 16 16 ILE H H 16 8.336 8.336 7.816 0.520 19043 414 1 2 . 1 1 17 17 LEU N N 17 117.709 117.709 117.551 0.158 19043 415 1 2 . 1 1 17 17 LEU HA H 17 3.553 3.553 4.033 -0.480 19043 416 1 2 . 1 1 17 17 LEU C C 17 176.565 176.565 177.733 -1.168 19043 417 1 2 . 1 1 17 17 LEU CA C 17 57.559 57.559 56.682 0.877 19043 418 1 2 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.939 -0.101 19043 419 1 2 . 1 1 17 17 LEU H H 17 7.738 7.738 7.455 0.283 19043 420 1 2 . 1 1 18 18 HIS N N 18 110.934 110.934 115.964 -5.030 19043 421 1 2 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.343 0.154 19043 422 1 2 . 1 1 18 18 HIS C C 18 175.243 175.243 175.917 -0.674 19043 423 1 2 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.152 -1.096 19043 424 1 2 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.161 0.487 19043 425 1 2 . 1 1 18 18 HIS H H 18 7.150 7.150 7.729 -0.579 19043 426 1 2 . 1 1 19 19 LEU N N 19 123.586 123.586 121.757 1.829 19043 427 1 2 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.250 0.168 19043 428 1 2 . 1 1 19 19 LEU CA C 19 53.476 53.476 54.051 -0.575 19043 429 1 2 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.301 -0.979 19043 430 1 2 . 1 1 19 19 LEU H H 19 7.249 7.249 7.492 -0.243 19043 431 1 2 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.446 -0.015 19043 432 1 2 . 1 1 20 20 PRO C C 20 178.092 178.092 177.409 0.683 19043 433 1 2 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.386 0.511 19043 434 1 2 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.401 0.171 19043 435 1 2 . 1 1 21 21 ASN N N 21 113.952 113.952 116.527 -2.575 19043 436 1 2 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.502 0.507 19043 437 1 2 . 1 1 21 21 ASN C C 21 176.397 176.397 175.848 0.549 19043 438 1 2 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.059 -1.430 19043 439 1 2 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.425 0.385 19043 440 1 2 . 1 1 21 21 ASN H H 21 8.871 8.871 8.148 0.723 19043 441 1 2 . 1 1 22 22 LEU N N 22 117.526 117.526 121.854 -4.328 19043 442 1 2 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.228 0.173 19043 443 1 2 . 1 1 22 22 LEU C C 22 176.879 176.879 175.986 0.893 19043 444 1 2 . 1 1 22 22 LEU CA C 22 54.457 54.457 55.376 -0.919 19043 445 1 2 . 1 1 22 22 LEU CB C 22 42.520 42.520 42.675 -0.155 19043 446 1 2 . 1 1 22 22 LEU H H 22 6.563 6.563 8.178 -1.615 19043 447 1 2 . 1 1 23 23 ASN N N 23 120.219 120.219 124.241 -4.022 19043 448 1 2 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.744 0.124 19043 449 1 2 . 1 1 23 23 ASN C C 23 175.507 175.507 176.154 -0.647 19043 450 1 2 . 1 1 23 23 ASN CA C 23 51.416 51.416 52.282 -0.866 19043 451 1 2 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.565 -0.853 19043 452 1 2 . 1 1 23 23 ASN H H 23 8.612 8.612 8.064 0.548 19043 453 1 2 . 1 1 24 24 GLU N N 24 118.801 118.801 119.316 -0.515 19043 454 1 2 . 1 1 24 24 GLU HA H 24 3.874 3.874 4.041 -0.167 19043 455 1 2 . 1 1 24 24 GLU C C 24 177.799 177.799 178.361 -0.562 19043 456 1 2 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.009 0.182 19043 457 1 2 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.398 -0.034 19043 458 1 2 . 1 1 24 24 GLU H H 24 8.735 8.735 8.958 -0.223 19043 459 1 2 . 1 1 25 25 GLU N N 25 119.198 119.198 120.179 -0.981 19043 460 1 2 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.116 -0.138 19043 461 1 2 . 1 1 25 25 GLU C C 25 180.078 180.078 179.181 0.897 19043 462 1 2 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.554 0.337 19043 463 1 2 . 1 1 25 25 GLU CB C 25 29.131 29.131 28.750 0.381 19043 464 1 2 . 1 1 25 25 GLU H H 25 8.229 8.229 8.814 -0.585 19043 465 1 2 . 1 1 26 26 GLN N N 26 119.646 119.646 118.380 1.266 19043 466 1 2 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.036 -0.096 19043 467 1 2 . 1 1 26 26 GLN C C 26 178.154 178.154 178.442 -0.288 19043 468 1 2 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.908 -1.015 19043 469 1 2 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.464 0.438 19043 470 1 2 . 1 1 26 26 GLN H H 26 8.425 8.425 8.431 -0.006 19043 471 1 2 . 1 1 27 27 ARG N N 27 119.454 119.454 120.255 -0.801 19043 472 1 2 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.114 -0.328 19043 473 1 2 . 1 1 27 27 ARG C C 27 177.863 177.863 178.325 -0.462 19043 474 1 2 . 1 1 27 27 ARG CA C 27 60.630 60.630 60.073 0.557 19043 475 1 2 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.158 -0.514 19043 476 1 2 . 1 1 27 27 ARG H H 27 8.548 8.548 7.975 0.573 19043 477 1 2 . 1 1 28 28 ASN N N 28 116.833 116.833 118.020 -1.187 19043 478 1 2 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.431 -0.099 19043 479 1 2 . 1 1 28 28 ASN C C 28 177.234 177.234 177.576 -0.342 19043 480 1 2 . 1 1 28 28 ASN CA C 28 56.038 56.038 56.030 0.008 19043 481 1 2 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.347 -0.662 19043 482 1 2 . 1 1 28 28 ASN H H 28 8.569 8.569 8.516 0.053 19043 483 1 2 . 1 1 29 29 ALA N N 29 122.687 122.687 122.002 0.685 19043 484 1 2 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.101 -0.047 19043 485 1 2 . 1 1 29 29 ALA C C 29 181.045 181.045 179.038 2.007 19043 486 1 2 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.672 0.578 19043 487 1 2 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.335 -0.515 19043 488 1 2 . 1 1 29 29 ALA H H 29 7.793 7.793 7.668 0.125 19043 489 1 2 . 1 1 30 30 PHE N N 30 116.979 116.979 118.384 -1.405 19043 490 1 2 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.298 0.080 19043 491 1 2 . 1 1 30 30 PHE C C 30 177.887 177.887 177.827 0.060 19043 492 1 2 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.134 1.485 19043 493 1 2 . 1 1 30 30 PHE CB C 30 39.459 39.459 39.038 0.421 19043 494 1 2 . 1 1 30 30 PHE H H 30 8.017 8.017 7.512 0.505 19043 495 1 2 . 1 1 31 31 ILE N N 31 119.553 119.553 119.610 -0.057 19043 496 1 2 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.690 0.088 19043 497 1 2 . 1 1 31 31 ILE C C 31 177.084 177.084 177.920 -0.836 19043 498 1 2 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.250 0.395 19043 499 1 2 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.717 -0.602 19043 500 1 2 . 1 1 31 31 ILE H H 31 8.372 8.372 8.597 -0.225 19043 501 1 2 . 1 1 32 32 GLN N N 32 119.108 119.108 119.904 -0.796 19043 502 1 2 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.981 -0.175 19043 503 1 2 . 1 1 32 32 GLN C C 32 177.836 177.836 178.451 -0.615 19043 504 1 2 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.639 -0.871 19043 505 1 2 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.645 -0.667 19043 506 1 2 . 1 1 32 32 GLN H H 32 8.389 8.389 8.270 0.119 19043 507 1 2 . 1 1 33 33 SER N N 33 114.437 114.437 114.501 -0.064 19043 508 1 2 . 1 1 33 33 SER HA H 33 4.212 4.212 4.274 -0.062 19043 509 1 2 . 1 1 33 33 SER C C 33 175.469 175.469 176.895 -1.426 19043 510 1 2 . 1 1 33 33 SER CA C 33 62.403 62.403 60.644 1.759 19043 511 1 2 . 1 1 33 33 SER CB C 33 63.794 63.794 62.755 1.039 19043 512 1 2 . 1 1 33 33 SER H H 33 8.078 8.078 7.764 0.314 19043 513 1 2 . 1 1 34 34 LEU N N 34 122.967 122.967 123.392 -0.425 19043 514 1 2 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.213 -0.303 19043 515 1 2 . 1 1 34 34 LEU C C 34 177.506 177.506 178.340 -0.834 19043 516 1 2 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.262 0.166 19043 517 1 2 . 1 1 34 34 LEU CB C 34 42.812 42.812 41.861 0.951 19043 518 1 2 . 1 1 34 34 LEU H H 34 8.495 8.495 7.698 0.797 19043 519 1 2 . 1 1 35 35 LYS N N 35 115.859 115.859 118.633 -2.774 19043 520 1 2 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.195 -0.382 19043 521 1 2 . 1 1 35 35 LYS C C 35 177.628 177.628 178.187 -0.559 19043 522 1 2 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.758 -1.881 19043 523 1 2 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.141 -0.122 19043 524 1 2 . 1 1 35 35 LYS H H 35 7.815 7.815 7.699 0.116 19043 525 1 2 . 1 1 36 36 ASP N N 36 116.741 116.741 117.171 -0.430 19043 526 1 2 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.619 -0.105 19043 527 1 2 . 1 1 36 36 ASP C C 36 177.324 177.324 175.983 1.341 19043 528 1 2 . 1 1 36 36 ASP CA C 36 56.686 56.686 55.358 1.328 19043 529 1 2 . 1 1 36 36 ASP CB C 36 40.671 40.671 41.960 -1.289 19043 530 1 2 . 1 1 36 36 ASP H H 36 7.943 7.943 7.861 0.082 19043 531 1 2 . 1 1 37 37 ASP N N 37 116.686 116.686 118.439 -1.753 19043 532 1 2 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.128 -0.087 19043 533 1 2 . 1 1 37 37 ASP CA C 37 51.946 51.946 51.672 0.274 19043 534 1 2 . 1 1 37 37 ASP CB C 37 40.523 40.523 41.831 -1.308 19043 535 1 2 . 1 1 37 37 ASP H H 37 8.125 8.125 7.950 0.175 19043 536 1 2 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.459 0.124 19043 537 1 2 . 1 1 38 38 PRO C C 38 179.200 179.200 178.125 1.075 19043 538 1 2 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.271 0.266 19043 539 1 2 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.051 -0.165 19043 540 1 2 . 1 1 39 39 SER N N 39 114.963 114.963 115.436 -0.473 19043 541 1 2 . 1 1 39 39 SER HA H 39 4.178 4.178 4.334 -0.156 19043 542 1 2 . 1 1 39 39 SER C C 39 176.151 176.151 175.851 0.300 19043 543 1 2 . 1 1 39 39 SER CA C 39 61.197 61.197 61.513 -0.316 19043 544 1 2 . 1 1 39 39 SER CB C 39 62.729 62.729 62.617 0.112 19043 545 1 2 . 1 1 39 39 SER H H 39 8.315 8.315 8.555 -0.240 19043 546 1 2 . 1 1 40 40 GLN N N 40 120.058 120.058 119.652 0.406 19043 547 1 2 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.512 0.148 19043 548 1 2 . 1 1 40 40 GLN C C 40 176.192 176.192 177.002 -0.810 19043 549 1 2 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.039 -0.058 19043 550 1 2 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.054 0.114 19043 551 1 2 . 1 1 40 40 GLN H H 40 7.820 7.820 7.772 0.048 19043 552 1 2 . 1 1 41 41 SER N N 41 115.553 115.553 116.864 -1.311 19043 553 1 2 . 1 1 41 41 SER HA H 41 3.845 3.845 4.042 -0.197 19043 554 1 2 . 1 1 41 41 SER C C 41 174.181 174.181 175.641 -1.460 19043 555 1 2 . 1 1 41 41 SER CA C 41 63.957 63.957 61.975 1.982 19043 556 1 2 . 1 1 41 41 SER CB C 41 63.191 63.191 63.038 0.153 19043 557 1 2 . 1 1 41 41 SER H H 41 7.666 7.666 7.671 -0.005 19043 558 1 2 . 1 1 42 42 ALA N N 42 122.360 122.360 121.817 0.543 19043 559 1 2 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.204 -0.081 19043 560 1 2 . 1 1 42 42 ALA C C 42 180.996 180.996 178.758 2.238 19043 561 1 2 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.092 1.471 19043 562 1 2 . 1 1 42 42 ALA CB C 42 18.056 18.056 18.804 -0.748 19043 563 1 2 . 1 1 42 42 ALA H H 42 8.556 8.556 8.203 0.353 19043 564 1 2 . 1 1 43 43 ASN N N 43 118.974 118.974 118.894 0.080 19043 565 1 2 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.524 -0.005 19043 566 1 2 . 1 1 43 43 ASN C C 43 177.972 177.972 177.739 0.233 19043 567 1 2 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.126 -0.272 19043 568 1 2 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.523 -0.374 19043 569 1 2 . 1 1 43 43 ASN H H 43 7.950 7.950 7.791 0.159 19043 570 1 2 . 1 1 44 44 LEU N N 44 122.070 122.070 120.437 1.633 19043 571 1 2 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.343 -0.154 19043 572 1 2 . 1 1 44 44 LEU C C 44 178.332 178.332 179.175 -0.843 19043 573 1 2 . 1 1 44 44 LEU CA C 44 57.834 57.834 58.082 -0.248 19043 574 1 2 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.793 0.558 19043 575 1 2 . 1 1 44 44 LEU H H 44 8.789 8.789 8.626 0.163 19043 576 1 2 . 1 1 45 45 LEU N N 45 118.621 118.621 119.346 -0.725 19043 577 1 2 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.732 0.073 19043 578 1 2 . 1 1 45 45 LEU C C 45 177.832 177.832 178.434 -0.602 19043 579 1 2 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.670 0.214 19043 580 1 2 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.573 0.233 19043 581 1 2 . 1 1 45 45 LEU H H 45 8.283 8.283 7.508 0.775 19043 582 1 2 . 1 1 46 46 ALA N N 46 119.525 119.525 120.286 -0.761 19043 583 1 2 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.911 0.099 19043 584 1 2 . 1 1 46 46 ALA C C 46 181.250 181.250 180.010 1.240 19043 585 1 2 . 1 1 46 46 ALA CA C 46 55.296 55.296 54.997 0.299 19043 586 1 2 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.077 -0.126 19043 587 1 2 . 1 1 46 46 ALA H H 46 7.640 7.640 7.747 -0.107 19043 588 1 2 . 1 1 47 47 GLU N N 47 119.572 119.572 118.122 1.450 19043 589 1 2 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.149 -0.119 19043 590 1 2 . 1 1 47 47 GLU C C 47 178.895 178.895 178.645 0.250 19043 591 1 2 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.678 0.488 19043 592 1 2 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.881 -0.343 19043 593 1 2 . 1 1 47 47 GLU H H 47 8.139 8.139 8.348 -0.209 19043 594 1 2 . 1 1 48 48 ALA N N 48 123.953 123.953 122.671 1.282 19043 595 1 2 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.629 -0.102 19043 596 1 2 . 1 1 48 48 ALA C C 48 179.636 179.636 179.028 0.608 19043 597 1 2 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.333 1.183 19043 598 1 2 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.757 -0.512 19043 599 1 2 . 1 1 48 48 ALA H H 48 8.468 8.468 7.702 0.766 19043 600 1 2 . 1 1 49 49 LYS N N 49 117.926 117.926 118.158 -0.232 19043 601 1 2 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.906 -0.167 19043 602 1 2 . 1 1 49 49 LYS C C 49 178.761 178.761 178.670 0.091 19043 603 1 2 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.678 0.714 19043 604 1 2 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.303 -0.214 19043 605 1 2 . 1 1 49 49 LYS H H 49 8.459 8.459 8.364 0.095 19043 606 1 2 . 1 1 50 50 LYS N N 50 120.194 120.194 119.182 1.012 19043 607 1 2 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.076 0.012 19043 608 1 2 . 1 1 50 50 LYS C C 50 179.859 179.859 178.359 1.500 19043 609 1 2 . 1 1 50 50 LYS CA C 50 59.735 59.735 58.936 0.799 19043 610 1 2 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.495 -0.033 19043 611 1 2 . 1 1 50 50 LYS H H 50 7.702 7.702 7.577 0.126 19043 612 1 2 . 1 1 51 51 LEU N N 51 122.126 122.126 119.470 2.656 19043 613 1 2 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.227 -0.100 19043 614 1 2 . 1 1 51 51 LEU C C 51 178.123 178.123 178.175 -0.052 19043 615 1 2 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.796 0.801 19043 616 1 2 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.217 0.135 19043 617 1 2 . 1 1 51 51 LEU H H 51 8.023 8.023 7.402 0.621 19043 618 1 2 . 1 1 52 52 ASN N N 52 116.675 116.675 117.056 -0.381 19043 619 1 2 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.420 -0.485 19043 620 1 2 . 1 1 52 52 ASN C C 52 177.668 177.668 175.802 1.866 19043 621 1 2 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.198 1.719 19043 622 1 2 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.688 3.248 19043 623 1 2 . 1 1 52 52 ASN H H 52 8.537 8.537 8.309 0.228 19043 624 1 2 . 1 1 53 53 ASP N N 53 118.725 118.725 117.542 1.183 19043 625 1 2 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.530 -0.087 19043 626 1 2 . 1 1 53 53 ASP C C 53 178.936 178.936 177.038 1.898 19043 627 1 2 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.510 1.423 19043 628 1 2 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.285 -1.190 19043 629 1 2 . 1 1 53 53 ASP H H 53 8.220 8.220 7.789 0.431 19043 630 1 2 . 1 1 54 54 ALA N N 54 122.872 122.872 121.268 1.604 19043 631 1 2 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.149 0.083 19043 632 1 2 . 1 1 54 54 ALA C C 54 179.354 179.354 178.901 0.453 19043 633 1 2 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.069 0.272 19043 634 1 2 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.266 -0.661 19043 635 1 2 . 1 1 54 54 ALA H H 54 8.037 8.037 7.120 0.917 19043 636 1 2 . 1 1 55 55 GLN N N 55 115.052 115.052 116.459 -1.407 19043 637 1 2 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.371 0.007 19043 638 1 2 . 1 1 55 55 GLN C C 55 174.116 174.116 175.175 -1.059 19043 639 1 2 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.111 -0.157 19043 640 1 2 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.469 -1.245 19043 641 1 2 . 1 1 55 55 GLN H H 55 7.512 7.512 7.549 -0.037 19043 642 1 2 . 1 1 56 56 ALA N N 56 124.556 124.556 124.603 -0.047 19043 643 1 2 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.519 -0.171 19043 644 1 2 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.202 -0.165 19043 645 1 2 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.559 -0.580 19043 646 1 2 . 1 1 56 56 ALA H H 56 7.100 7.100 7.774 -0.674 19043 647 1 2 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.711 -0.299 19043 648 1 2 . 1 1 57 57 PRO C C 57 176.151 176.151 176.375 -0.224 19043 649 1 2 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.310 0.973 19043 650 1 2 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.364 -0.371 19043 651 1 3 . 1 1 2 2 ASP N N 2 125.357 125.357 125.966 -0.609 19043 652 1 3 . 1 1 2 2 ASP C C 2 175.535 175.535 173.902 1.633 19043 653 1 3 . 1 1 2 2 ASP CA C 2 54.307 54.307 53.644 0.663 19043 654 1 3 . 1 1 2 2 ASP CB C 2 41.470 41.470 43.213 -1.743 19043 655 1 3 . 1 1 2 2 ASP H H 2 8.762 8.762 8.224 0.538 19043 656 1 3 . 1 1 3 3 ASN N N 3 120.441 120.441 121.555 -1.114 19043 657 1 3 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.575 0.125 19043 658 1 3 . 1 1 3 3 ASN C C 3 175.246 175.246 174.154 1.092 19043 659 1 3 . 1 1 3 3 ASN CA C 3 53.289 53.289 52.693 0.596 19043 660 1 3 . 1 1 3 3 ASN CB C 3 39.086 39.086 39.353 -0.267 19043 661 1 3 . 1 1 3 3 ASN H H 3 8.548 8.548 8.139 0.409 19043 662 1 3 . 1 1 4 4 LYS N N 4 121.461 121.461 121.266 0.195 19043 663 1 3 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.025 0.190 19043 664 1 3 . 1 1 4 4 LYS C C 4 176.404 176.404 176.142 0.262 19043 665 1 3 . 1 1 4 4 LYS CA C 4 56.853 56.853 57.213 -0.360 19043 666 1 3 . 1 1 4 4 LYS CB C 4 32.780 32.780 32.351 0.429 19043 667 1 3 . 1 1 4 4 LYS H H 4 8.337 8.337 8.620 -0.283 19043 668 1 3 . 1 1 5 5 PHE N N 5 119.538 119.538 114.639 4.899 19043 669 1 3 . 1 1 5 5 PHE C C 5 175.433 175.433 175.029 0.404 19043 670 1 3 . 1 1 5 5 PHE CA C 5 57.792 57.792 58.094 -0.302 19043 671 1 3 . 1 1 5 5 PHE CB C 5 40.067 40.067 36.092 3.975 19043 672 1 3 . 1 1 5 5 PHE H H 5 8.277 8.277 7.689 0.588 19043 673 1 3 . 1 1 6 6 ASN N N 6 121.168 121.168 120.988 0.180 19043 674 1 3 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.680 0.137 19043 675 1 3 . 1 1 6 6 ASN C C 6 175.884 175.884 176.283 -0.399 19043 676 1 3 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.267 -0.481 19043 677 1 3 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.335 0.036 19043 678 1 3 . 1 1 6 6 ASN H H 6 8.443 8.443 8.389 0.054 19043 679 1 3 . 1 1 7 7 LYS N N 7 121.688 121.688 121.049 0.639 19043 680 1 3 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.103 -0.158 19043 681 1 3 . 1 1 7 7 LYS C C 7 178.196 178.196 178.248 -0.052 19043 682 1 3 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.352 -0.451 19043 683 1 3 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.242 -0.117 19043 684 1 3 . 1 1 7 7 LYS H H 7 8.460 8.460 8.647 -0.187 19043 685 1 3 . 1 1 8 8 GLU N N 8 119.926 119.926 118.388 1.538 19043 686 1 3 . 1 1 8 8 GLU HA H 8 4.081 4.081 4.039 0.042 19043 687 1 3 . 1 1 8 8 GLU C C 8 179.894 179.894 179.011 0.883 19043 688 1 3 . 1 1 8 8 GLU CA C 8 59.839 59.839 60.222 -0.383 19043 689 1 3 . 1 1 8 8 GLU CB C 8 28.941 28.941 28.736 0.205 19043 690 1 3 . 1 1 8 8 GLU H H 8 8.386 8.386 8.918 -0.532 19043 691 1 3 . 1 1 9 9 GLN N N 9 121.401 121.401 117.178 4.223 19043 692 1 3 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.123 -0.026 19043 693 1 3 . 1 1 9 9 GLN C C 9 177.324 177.324 178.137 -0.813 19043 694 1 3 . 1 1 9 9 GLN CA C 9 59.383 59.383 58.800 0.583 19043 695 1 3 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.473 0.396 19043 696 1 3 . 1 1 9 9 GLN H H 9 8.307 8.307 8.658 -0.351 19043 697 1 3 . 1 1 10 10 GLN N N 10 120.060 120.060 120.471 -0.411 19043 698 1 3 . 1 1 10 10 GLN HA H 10 3.222 3.222 3.973 -0.751 19043 699 1 3 . 1 1 10 10 GLN C C 10 176.888 176.888 178.154 -1.266 19043 700 1 3 . 1 1 10 10 GLN CA C 10 58.949 58.949 59.051 -0.102 19043 701 1 3 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.738 0.103 19043 702 1 3 . 1 1 10 10 GLN H H 10 8.040 8.040 7.886 0.154 19043 703 1 3 . 1 1 11 11 ASN N N 11 116.214 116.214 118.825 -2.611 19043 704 1 3 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.568 -0.218 19043 705 1 3 . 1 1 11 11 ASN C C 11 177.828 177.828 177.554 0.274 19043 706 1 3 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.291 -0.034 19043 707 1 3 . 1 1 11 11 ASN CB C 11 38.210 38.210 37.994 0.216 19043 708 1 3 . 1 1 11 11 ASN H H 11 8.366 8.366 8.385 -0.019 19043 709 1 3 . 1 1 12 12 ALA N N 12 121.429 121.429 122.973 -1.544 19043 710 1 3 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.037 -0.028 19043 711 1 3 . 1 1 12 12 ALA C C 12 177.850 177.850 179.242 -1.392 19043 712 1 3 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.912 0.381 19043 713 1 3 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.404 -0.083 19043 714 1 3 . 1 1 12 12 ALA H H 12 7.915 7.915 7.905 0.010 19043 715 1 3 . 1 1 13 13 PHE N N 13 118.052 118.052 119.832 -1.780 19043 716 1 3 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.947 -0.374 19043 717 1 3 . 1 1 13 13 PHE C C 13 175.832 175.832 177.227 -1.395 19043 718 1 3 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.963 -0.108 19043 719 1 3 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.864 0.053 19043 720 1 3 . 1 1 13 13 PHE H H 13 8.097 8.097 7.501 0.596 19043 721 1 3 . 1 1 14 14 TYR N N 14 116.000 116.000 117.524 -1.524 19043 722 1 3 . 1 1 14 14 TYR HA H 14 3.985 3.985 4.061 -0.076 19043 723 1 3 . 1 1 14 14 TYR C C 14 178.860 178.860 178.345 0.515 19043 724 1 3 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.501 -1.706 19043 725 1 3 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.704 -0.724 19043 726 1 3 . 1 1 14 14 TYR H H 14 8.040 8.040 7.749 0.291 19043 727 1 3 . 1 1 15 15 GLU N N 15 118.737 118.737 119.396 -0.659 19043 728 1 3 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.826 0.145 19043 729 1 3 . 1 1 15 15 GLU C C 15 180.184 180.184 179.212 0.972 19043 730 1 3 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.330 1.278 19043 731 1 3 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.255 0.467 19043 732 1 3 . 1 1 15 15 GLU H H 15 8.244 8.244 8.404 -0.160 19043 733 1 3 . 1 1 16 16 ILE N N 16 119.695 119.695 118.587 1.108 19043 734 1 3 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.748 -0.395 19043 735 1 3 . 1 1 16 16 ILE C C 16 177.760 177.760 177.599 0.161 19043 736 1 3 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.319 1.335 19043 737 1 3 . 1 1 16 16 ILE CB C 16 37.403 37.403 38.005 -0.602 19043 738 1 3 . 1 1 16 16 ILE H H 16 8.336 8.336 7.740 0.596 19043 739 1 3 . 1 1 17 17 LEU N N 17 117.709 117.709 120.544 -2.835 19043 740 1 3 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.882 -0.329 19043 741 1 3 . 1 1 17 17 LEU C C 17 176.565 176.565 178.666 -2.101 19043 742 1 3 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.636 -0.077 19043 743 1 3 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.621 0.217 19043 744 1 3 . 1 1 17 17 LEU H H 17 7.738 7.738 7.658 0.080 19043 745 1 3 . 1 1 18 18 HIS N N 18 110.934 110.934 116.756 -5.822 19043 746 1 3 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.287 0.210 19043 747 1 3 . 1 1 18 18 HIS C C 18 175.243 175.243 175.891 -0.648 19043 748 1 3 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.879 -1.823 19043 749 1 3 . 1 1 18 18 HIS CB C 18 30.648 30.648 29.985 0.663 19043 750 1 3 . 1 1 18 18 HIS H H 18 7.150 7.150 8.178 -1.028 19043 751 1 3 . 1 1 19 19 LEU N N 19 123.586 123.586 121.831 1.755 19043 752 1 3 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.263 0.155 19043 753 1 3 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.974 -0.498 19043 754 1 3 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.375 -1.053 19043 755 1 3 . 1 1 19 19 LEU H H 19 7.249 7.249 7.633 -0.384 19043 756 1 3 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.437 -0.006 19043 757 1 3 . 1 1 20 20 PRO C C 20 178.092 178.092 177.613 0.479 19043 758 1 3 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.794 0.103 19043 759 1 3 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.254 0.318 19043 760 1 3 . 1 1 21 21 ASN N N 21 113.952 113.952 116.472 -2.520 19043 761 1 3 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.513 0.496 19043 762 1 3 . 1 1 21 21 ASN C C 21 176.397 176.397 175.838 0.559 19043 763 1 3 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.130 -1.500 19043 764 1 3 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.423 0.387 19043 765 1 3 . 1 1 21 21 ASN H H 21 8.871 8.871 8.149 0.722 19043 766 1 3 . 1 1 22 22 LEU N N 22 117.526 117.526 121.155 -3.629 19043 767 1 3 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.354 0.047 19043 768 1 3 . 1 1 22 22 LEU C C 22 176.879 176.879 175.207 1.672 19043 769 1 3 . 1 1 22 22 LEU CA C 22 54.457 54.457 54.668 -0.211 19043 770 1 3 . 1 1 22 22 LEU CB C 22 42.520 42.520 43.602 -1.082 19043 771 1 3 . 1 1 22 22 LEU H H 22 6.563 6.563 8.108 -1.545 19043 772 1 3 . 1 1 23 23 ASN N N 23 120.219 120.219 120.283 -0.064 19043 773 1 3 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.835 0.033 19043 774 1 3 . 1 1 23 23 ASN C C 23 175.507 175.507 176.023 -0.516 19043 775 1 3 . 1 1 23 23 ASN CA C 23 51.416 51.416 51.573 -0.157 19043 776 1 3 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.793 -1.081 19043 777 1 3 . 1 1 23 23 ASN H H 23 8.612 8.612 8.013 0.599 19043 778 1 3 . 1 1 24 24 GLU N N 24 118.801 118.801 119.158 -0.357 19043 779 1 3 . 1 1 24 24 GLU HA H 24 3.874 3.874 4.011 -0.137 19043 780 1 3 . 1 1 24 24 GLU C C 24 177.799 177.799 178.261 -0.462 19043 781 1 3 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.314 -0.123 19043 782 1 3 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.093 0.272 19043 783 1 3 . 1 1 24 24 GLU H H 24 8.735 8.735 8.899 -0.164 19043 784 1 3 . 1 1 25 25 GLU N N 25 119.198 119.198 119.192 0.006 19043 785 1 3 . 1 1 25 25 GLU HA H 25 3.978 3.978 3.997 -0.019 19043 786 1 3 . 1 1 25 25 GLU C C 25 180.078 180.078 179.299 0.779 19043 787 1 3 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.367 0.524 19043 788 1 3 . 1 1 25 25 GLU CB C 25 29.131 29.131 29.234 -0.103 19043 789 1 3 . 1 1 25 25 GLU H H 25 8.229 8.229 8.711 -0.482 19043 790 1 3 . 1 1 26 26 GLN N N 26 119.646 119.646 117.624 2.022 19043 791 1 3 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.053 -0.113 19043 792 1 3 . 1 1 26 26 GLN C C 26 178.154 178.154 178.495 -0.341 19043 793 1 3 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.221 -0.328 19043 794 1 3 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.617 0.284 19043 795 1 3 . 1 1 26 26 GLN H H 26 8.425 8.425 7.813 0.612 19043 796 1 3 . 1 1 27 27 ARG N N 27 119.454 119.454 120.629 -1.175 19043 797 1 3 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.146 -0.360 19043 798 1 3 . 1 1 27 27 ARG C C 27 177.863 177.863 178.529 -0.666 19043 799 1 3 . 1 1 27 27 ARG CA C 27 60.630 60.630 59.600 1.030 19043 800 1 3 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.099 -0.455 19043 801 1 3 . 1 1 27 27 ARG H H 27 8.548 8.548 8.435 0.113 19043 802 1 3 . 1 1 28 28 ASN N N 28 116.833 116.833 117.632 -0.799 19043 803 1 3 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.495 -0.163 19043 804 1 3 . 1 1 28 28 ASN C C 28 177.234 177.234 177.288 -0.054 19043 805 1 3 . 1 1 28 28 ASN CA C 28 56.038 56.038 56.049 -0.011 19043 806 1 3 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.345 -0.660 19043 807 1 3 . 1 1 28 28 ASN H H 28 8.569 8.569 8.601 -0.032 19043 808 1 3 . 1 1 29 29 ALA N N 29 122.687 122.687 123.252 -0.565 19043 809 1 3 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.024 0.030 19043 810 1 3 . 1 1 29 29 ALA C C 29 181.045 181.045 179.349 1.696 19043 811 1 3 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.731 0.519 19043 812 1 3 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.163 -0.343 19043 813 1 3 . 1 1 29 29 ALA H H 29 7.793 7.793 7.355 0.438 19043 814 1 3 . 1 1 30 30 PHE N N 30 116.979 116.979 117.785 -0.806 19043 815 1 3 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.218 0.160 19043 816 1 3 . 1 1 30 30 PHE C C 30 177.887 177.887 178.059 -0.172 19043 817 1 3 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.817 0.802 19043 818 1 3 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.809 0.650 19043 819 1 3 . 1 1 30 30 PHE H H 30 8.017 8.017 7.674 0.343 19043 820 1 3 . 1 1 31 31 ILE N N 31 119.553 119.553 119.252 0.301 19043 821 1 3 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.625 0.153 19043 822 1 3 . 1 1 31 31 ILE C C 31 177.084 177.084 178.099 -1.015 19043 823 1 3 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.266 0.379 19043 824 1 3 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.606 -0.491 19043 825 1 3 . 1 1 31 31 ILE H H 31 8.372 8.372 8.511 -0.139 19043 826 1 3 . 1 1 32 32 GLN N N 32 119.108 119.108 119.712 -0.604 19043 827 1 3 . 1 1 32 32 GLN HA H 32 3.806 3.806 4.006 -0.200 19043 828 1 3 . 1 1 32 32 GLN C C 32 177.836 177.836 178.542 -0.706 19043 829 1 3 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.551 -0.783 19043 830 1 3 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.718 -0.740 19043 831 1 3 . 1 1 32 32 GLN H H 32 8.389 8.389 8.202 0.187 19043 832 1 3 . 1 1 33 33 SER N N 33 114.437 114.437 115.426 -0.989 19043 833 1 3 . 1 1 33 33 SER HA H 33 4.212 4.212 4.297 -0.085 19043 834 1 3 . 1 1 33 33 SER C C 33 175.469 175.469 176.610 -1.141 19043 835 1 3 . 1 1 33 33 SER CA C 33 62.403 62.403 61.656 0.747 19043 836 1 3 . 1 1 33 33 SER CB C 33 63.794 63.794 63.205 0.590 19043 837 1 3 . 1 1 33 33 SER H H 33 8.078 8.078 7.835 0.243 19043 838 1 3 . 1 1 34 34 LEU N N 34 122.967 122.967 123.466 -0.499 19043 839 1 3 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.203 -0.293 19043 840 1 3 . 1 1 34 34 LEU C C 34 177.506 177.506 177.922 -0.416 19043 841 1 3 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.214 0.214 19043 842 1 3 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.048 0.764 19043 843 1 3 . 1 1 34 34 LEU H H 34 8.495 8.495 8.172 0.323 19043 844 1 3 . 1 1 35 35 LYS N N 35 115.859 115.859 119.224 -3.365 19043 845 1 3 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.202 -0.389 19043 846 1 3 . 1 1 35 35 LYS C C 35 177.628 177.628 178.025 -0.397 19043 847 1 3 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.694 -1.817 19043 848 1 3 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.167 -0.148 19043 849 1 3 . 1 1 35 35 LYS H H 35 7.815 7.815 7.609 0.206 19043 850 1 3 . 1 1 36 36 ASP N N 36 116.741 116.741 117.517 -0.776 19043 851 1 3 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.564 -0.050 19043 852 1 3 . 1 1 36 36 ASP C C 36 177.324 177.324 176.185 1.139 19043 853 1 3 . 1 1 36 36 ASP CA C 36 56.686 56.686 56.139 0.547 19043 854 1 3 . 1 1 36 36 ASP CB C 36 40.671 40.671 42.107 -1.436 19043 855 1 3 . 1 1 36 36 ASP H H 36 7.943 7.943 7.829 0.114 19043 856 1 3 . 1 1 37 37 ASP N N 37 116.686 116.686 118.664 -1.978 19043 857 1 3 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.128 -0.087 19043 858 1 3 . 1 1 37 37 ASP CA C 37 51.946 51.946 52.096 -0.150 19043 859 1 3 . 1 1 37 37 ASP CB C 37 40.523 40.523 41.990 -1.467 19043 860 1 3 . 1 1 37 37 ASP H H 37 8.125 8.125 7.946 0.179 19043 861 1 3 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.507 0.076 19043 862 1 3 . 1 1 38 38 PRO C C 38 179.200 179.200 178.022 1.178 19043 863 1 3 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.558 -0.021 19043 864 1 3 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.014 -0.128 19043 865 1 3 . 1 1 39 39 SER N N 39 114.963 114.963 112.557 2.406 19043 866 1 3 . 1 1 39 39 SER HA H 39 4.178 4.178 4.224 -0.046 19043 867 1 3 . 1 1 39 39 SER C C 39 176.151 176.151 176.342 -0.191 19043 868 1 3 . 1 1 39 39 SER CA C 39 61.197 61.197 60.805 0.392 19043 869 1 3 . 1 1 39 39 SER CB C 39 62.729 62.729 62.446 0.283 19043 870 1 3 . 1 1 39 39 SER H H 39 8.315 8.315 8.442 -0.127 19043 871 1 3 . 1 1 40 40 GLN N N 40 120.058 120.058 119.879 0.179 19043 872 1 3 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.451 0.209 19043 873 1 3 . 1 1 40 40 GLN C C 40 176.192 176.192 177.373 -1.181 19043 874 1 3 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.613 -0.632 19043 875 1 3 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.144 0.024 19043 876 1 3 . 1 1 40 40 GLN H H 40 7.820 7.820 7.789 0.031 19043 877 1 3 . 1 1 41 41 SER N N 41 115.553 115.553 116.634 -1.081 19043 878 1 3 . 1 1 41 41 SER HA H 41 3.845 3.845 4.110 -0.265 19043 879 1 3 . 1 1 41 41 SER C C 41 174.181 174.181 175.477 -1.296 19043 880 1 3 . 1 1 41 41 SER CA C 41 63.957 63.957 61.823 2.134 19043 881 1 3 . 1 1 41 41 SER CB C 41 63.191 63.191 62.446 0.745 19043 882 1 3 . 1 1 41 41 SER H H 41 7.666 7.666 7.801 -0.135 19043 883 1 3 . 1 1 42 42 ALA N N 42 122.360 122.360 122.948 -0.588 19043 884 1 3 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.213 -0.090 19043 885 1 3 . 1 1 42 42 ALA C C 42 180.996 180.996 178.912 2.084 19043 886 1 3 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.238 1.325 19043 887 1 3 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.263 -1.207 19043 888 1 3 . 1 1 42 42 ALA H H 42 8.556 8.556 7.862 0.694 19043 889 1 3 . 1 1 43 43 ASN N N 43 118.974 118.974 118.729 0.245 19043 890 1 3 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.508 0.011 19043 891 1 3 . 1 1 43 43 ASN C C 43 177.972 177.972 177.841 0.131 19043 892 1 3 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.546 -0.692 19043 893 1 3 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.202 -0.053 19043 894 1 3 . 1 1 43 43 ASN H H 43 7.950 7.950 7.437 0.513 19043 895 1 3 . 1 1 44 44 LEU N N 44 122.070 122.070 120.499 1.571 19043 896 1 3 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.397 -0.208 19043 897 1 3 . 1 1 44 44 LEU C C 44 178.332 178.332 179.446 -1.114 19043 898 1 3 . 1 1 44 44 LEU CA C 44 57.834 57.834 57.941 -0.107 19043 899 1 3 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.800 0.551 19043 900 1 3 . 1 1 44 44 LEU H H 44 8.789 8.789 8.525 0.264 19043 901 1 3 . 1 1 45 45 LEU N N 45 118.621 118.621 119.299 -0.678 19043 902 1 3 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.737 0.068 19043 903 1 3 . 1 1 45 45 LEU C C 45 177.832 177.832 178.452 -0.620 19043 904 1 3 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.703 0.182 19043 905 1 3 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.576 0.230 19043 906 1 3 . 1 1 45 45 LEU H H 45 8.283 8.283 7.558 0.725 19043 907 1 3 . 1 1 46 46 ALA N N 46 119.525 119.525 120.548 -1.023 19043 908 1 3 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.905 0.105 19043 909 1 3 . 1 1 46 46 ALA C C 46 181.250 181.250 179.930 1.320 19043 910 1 3 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.083 0.214 19043 911 1 3 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.055 -0.104 19043 912 1 3 . 1 1 46 46 ALA H H 46 7.640 7.640 7.838 -0.198 19043 913 1 3 . 1 1 47 47 GLU N N 47 119.572 119.572 118.447 1.125 19043 914 1 3 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.109 -0.079 19043 915 1 3 . 1 1 47 47 GLU C C 47 178.895 178.895 178.881 0.014 19043 916 1 3 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.994 0.172 19043 917 1 3 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.824 -0.286 19043 918 1 3 . 1 1 47 47 GLU H H 47 8.139 8.139 8.463 -0.324 19043 919 1 3 . 1 1 48 48 ALA N N 48 123.953 123.953 122.604 1.349 19043 920 1 3 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.679 -0.152 19043 921 1 3 . 1 1 48 48 ALA C C 48 179.636 179.636 179.176 0.460 19043 922 1 3 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.433 1.083 19043 923 1 3 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.683 -0.438 19043 924 1 3 . 1 1 48 48 ALA H H 48 8.468 8.468 7.768 0.700 19043 925 1 3 . 1 1 49 49 LYS N N 49 117.926 117.926 118.220 -0.294 19043 926 1 3 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.913 -0.174 19043 927 1 3 . 1 1 49 49 LYS C C 49 178.761 178.761 178.724 0.037 19043 928 1 3 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.618 0.774 19043 929 1 3 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.316 -0.227 19043 930 1 3 . 1 1 49 49 LYS H H 49 8.459 8.459 8.320 0.139 19043 931 1 3 . 1 1 50 50 LYS N N 50 120.194 120.194 119.752 0.442 19043 932 1 3 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.076 0.012 19043 933 1 3 . 1 1 50 50 LYS C C 50 179.859 179.859 178.918 0.941 19043 934 1 3 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.141 0.594 19043 935 1 3 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.546 -0.084 19043 936 1 3 . 1 1 50 50 LYS H H 50 7.702 7.702 7.786 -0.084 19043 937 1 3 . 1 1 51 51 LEU N N 51 122.126 122.126 119.742 2.384 19043 938 1 3 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.169 -0.042 19043 939 1 3 . 1 1 51 51 LEU C C 51 178.123 178.123 178.021 0.102 19043 940 1 3 . 1 1 51 51 LEU CA C 51 57.597 57.597 57.105 0.492 19043 941 1 3 . 1 1 51 51 LEU CB C 51 42.352 42.352 41.959 0.394 19043 942 1 3 . 1 1 51 51 LEU H H 51 8.023 8.023 7.697 0.326 19043 943 1 3 . 1 1 52 52 ASN N N 52 116.675 116.675 116.826 -0.151 19043 944 1 3 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.358 -0.423 19043 945 1 3 . 1 1 52 52 ASN C C 52 177.668 177.668 176.411 1.257 19043 946 1 3 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.294 1.623 19043 947 1 3 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.626 3.310 19043 948 1 3 . 1 1 52 52 ASN H H 52 8.537 8.537 8.240 0.297 19043 949 1 3 . 1 1 53 53 ASP N N 53 118.725 118.725 117.253 1.472 19043 950 1 3 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.552 -0.108 19043 951 1 3 . 1 1 53 53 ASP C C 53 178.936 178.936 177.229 1.707 19043 952 1 3 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.320 1.613 19043 953 1 3 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.304 -1.209 19043 954 1 3 . 1 1 53 53 ASP H H 53 8.220 8.220 7.624 0.596 19043 955 1 3 . 1 1 54 54 ALA N N 54 122.872 122.872 121.618 1.254 19043 956 1 3 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.125 0.107 19043 957 1 3 . 1 1 54 54 ALA C C 54 179.354 179.354 179.105 0.249 19043 958 1 3 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.355 -0.014 19043 959 1 3 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.284 -0.679 19043 960 1 3 . 1 1 54 54 ALA H H 54 8.037 8.037 7.316 0.721 19043 961 1 3 . 1 1 55 55 GLN N N 55 115.052 115.052 116.554 -1.502 19043 962 1 3 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.340 0.038 19043 963 1 3 . 1 1 55 55 GLN C C 55 174.116 174.116 175.268 -1.152 19043 964 1 3 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.346 -0.392 19043 965 1 3 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.260 -1.036 19043 966 1 3 . 1 1 55 55 GLN H H 55 7.512 7.512 7.633 -0.121 19043 967 1 3 . 1 1 56 56 ALA N N 56 124.556 124.556 123.848 0.708 19043 968 1 3 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.377 -0.029 19043 969 1 3 . 1 1 56 56 ALA CA C 56 51.037 51.037 50.890 0.147 19043 970 1 3 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.676 -0.697 19043 971 1 3 . 1 1 56 56 ALA H H 56 7.100 7.100 7.660 -0.560 19043 972 1 3 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.532 -0.120 19043 973 1 3 . 1 1 57 57 PRO C C 57 176.151 176.151 176.612 -0.461 19043 974 1 3 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.324 0.959 19043 975 1 3 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.194 -0.201 19043 976 1 4 . 1 1 2 2 ASP N N 2 125.357 125.357 122.907 2.450 19043 977 1 4 . 1 1 2 2 ASP C C 2 175.535 175.535 175.072 0.463 19043 978 1 4 . 1 1 2 2 ASP CA C 2 54.307 54.307 54.212 0.095 19043 979 1 4 . 1 1 2 2 ASP CB C 2 41.470 41.470 41.170 0.300 19043 980 1 4 . 1 1 2 2 ASP H H 2 8.762 8.762 8.222 0.540 19043 981 1 4 . 1 1 3 3 ASN N N 3 120.441 120.441 120.816 -0.375 19043 982 1 4 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.205 0.495 19043 983 1 4 . 1 1 3 3 ASN C C 3 175.246 175.246 175.656 -0.410 19043 984 1 4 . 1 1 3 3 ASN CA C 3 53.289 53.289 53.578 -0.289 19043 985 1 4 . 1 1 3 3 ASN CB C 3 39.086 39.086 38.767 0.319 19043 986 1 4 . 1 1 3 3 ASN H H 3 8.548 8.548 8.603 -0.055 19043 987 1 4 . 1 1 4 4 LYS N N 4 121.461 121.461 117.938 3.523 19043 988 1 4 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.054 0.161 19043 989 1 4 . 1 1 4 4 LYS C C 4 176.404 176.404 176.494 -0.090 19043 990 1 4 . 1 1 4 4 LYS CA C 4 56.853 56.853 57.097 -0.244 19043 991 1 4 . 1 1 4 4 LYS CB C 4 32.780 32.780 32.094 0.686 19043 992 1 4 . 1 1 4 4 LYS H H 4 8.337 8.337 7.725 0.612 19043 993 1 4 . 1 1 5 5 PHE N N 5 119.538 119.538 115.091 4.447 19043 994 1 4 . 1 1 5 5 PHE C C 5 175.433 175.433 175.127 0.306 19043 995 1 4 . 1 1 5 5 PHE CA C 5 57.792 57.792 58.152 -0.360 19043 996 1 4 . 1 1 5 5 PHE CB C 5 40.067 40.067 35.576 4.491 19043 997 1 4 . 1 1 5 5 PHE H H 5 8.277 8.277 7.421 0.856 19043 998 1 4 . 1 1 6 6 ASN N N 6 121.168 121.168 120.502 0.666 19043 999 1 4 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.757 0.060 19043 1000 1 4 . 1 1 6 6 ASN C C 6 175.884 175.884 176.345 -0.461 19043 1001 1 4 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.304 -0.519 19043 1002 1 4 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.371 0.000 19043 1003 1 4 . 1 1 6 6 ASN H H 6 8.443 8.443 8.198 0.245 19043 1004 1 4 . 1 1 7 7 LYS N N 7 121.688 121.688 121.450 0.238 19043 1005 1 4 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.172 -0.227 19043 1006 1 4 . 1 1 7 7 LYS C C 7 178.196 178.196 178.523 -0.327 19043 1007 1 4 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.246 -0.345 19043 1008 1 4 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.376 -0.251 19043 1009 1 4 . 1 1 7 7 LYS H H 7 8.460 8.460 8.613 -0.153 19043 1010 1 4 . 1 1 8 8 GLU N N 8 119.926 119.926 118.544 1.382 19043 1011 1 4 . 1 1 8 8 GLU HA H 8 4.081 4.081 3.973 0.108 19043 1012 1 4 . 1 1 8 8 GLU C C 8 179.894 179.894 178.777 1.117 19043 1013 1 4 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.761 0.078 19043 1014 1 4 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.028 -0.087 19043 1015 1 4 . 1 1 8 8 GLU H H 8 8.386 8.386 8.856 -0.470 19043 1016 1 4 . 1 1 9 9 GLN N N 9 121.401 121.401 118.004 3.397 19043 1017 1 4 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.087 0.010 19043 1018 1 4 . 1 1 9 9 GLN C C 9 177.324 177.324 178.295 -0.971 19043 1019 1 4 . 1 1 9 9 GLN CA C 9 59.383 59.383 59.071 0.312 19043 1020 1 4 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.473 0.396 19043 1021 1 4 . 1 1 9 9 GLN H H 9 8.307 8.307 8.727 -0.420 19043 1022 1 4 . 1 1 10 10 GLN N N 10 120.060 120.060 119.664 0.396 19043 1023 1 4 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.082 -0.860 19043 1024 1 4 . 1 1 10 10 GLN C C 10 176.888 176.888 178.337 -1.449 19043 1025 1 4 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.962 -0.012 19043 1026 1 4 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.695 0.146 19043 1027 1 4 . 1 1 10 10 GLN H H 10 8.040 8.040 7.840 0.200 19043 1028 1 4 . 1 1 11 11 ASN N N 11 116.214 116.214 119.125 -2.911 19043 1029 1 4 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.603 -0.253 19043 1030 1 4 . 1 1 11 11 ASN C C 11 177.828 177.828 177.624 0.204 19043 1031 1 4 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.132 0.125 19043 1032 1 4 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.022 0.188 19043 1033 1 4 . 1 1 11 11 ASN H H 11 8.366 8.366 8.449 -0.083 19043 1034 1 4 . 1 1 12 12 ALA N N 12 121.429 121.429 123.175 -1.746 19043 1035 1 4 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.072 -0.063 19043 1036 1 4 . 1 1 12 12 ALA C C 12 177.850 177.850 179.217 -1.367 19043 1037 1 4 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.952 0.341 19043 1038 1 4 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.435 -0.114 19043 1039 1 4 . 1 1 12 12 ALA H H 12 7.915 7.915 8.225 -0.310 19043 1040 1 4 . 1 1 13 13 PHE N N 13 118.052 118.052 120.073 -2.021 19043 1041 1 4 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.980 -0.407 19043 1042 1 4 . 1 1 13 13 PHE C C 13 175.832 175.832 177.214 -1.382 19043 1043 1 4 . 1 1 13 13 PHE CA C 13 61.855 61.855 62.057 -0.202 19043 1044 1 4 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.930 -0.013 19043 1045 1 4 . 1 1 13 13 PHE H H 13 8.097 8.097 7.487 0.610 19043 1046 1 4 . 1 1 14 14 TYR N N 14 116.000 116.000 117.356 -1.356 19043 1047 1 4 . 1 1 14 14 TYR HA H 14 3.985 3.985 4.005 -0.020 19043 1048 1 4 . 1 1 14 14 TYR C C 14 178.860 178.860 178.257 0.603 19043 1049 1 4 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.673 -1.878 19043 1050 1 4 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.829 -0.849 19043 1051 1 4 . 1 1 14 14 TYR H H 14 8.040 8.040 7.719 0.321 19043 1052 1 4 . 1 1 15 15 GLU N N 15 118.737 118.737 119.007 -0.270 19043 1053 1 4 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.826 0.145 19043 1054 1 4 . 1 1 15 15 GLU C C 15 180.184 180.184 179.218 0.966 19043 1055 1 4 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.414 1.192 19043 1056 1 4 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.326 0.396 19043 1057 1 4 . 1 1 15 15 GLU H H 15 8.244 8.244 8.284 -0.040 19043 1058 1 4 . 1 1 16 16 ILE N N 16 119.695 119.695 118.189 1.506 19043 1059 1 4 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.771 -0.418 19043 1060 1 4 . 1 1 16 16 ILE C C 16 177.760 177.760 177.542 0.218 19043 1061 1 4 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.164 1.490 19043 1062 1 4 . 1 1 16 16 ILE CB C 16 37.403 37.403 37.967 -0.563 19043 1063 1 4 . 1 1 16 16 ILE H H 16 8.336 8.336 7.536 0.800 19043 1064 1 4 . 1 1 17 17 LEU N N 17 117.709 117.709 119.015 -1.306 19043 1065 1 4 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.945 -0.392 19043 1066 1 4 . 1 1 17 17 LEU C C 17 176.565 176.565 177.864 -1.299 19043 1067 1 4 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.061 0.498 19043 1068 1 4 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.815 0.023 19043 1069 1 4 . 1 1 17 17 LEU H H 17 7.738 7.738 7.529 0.209 19043 1070 1 4 . 1 1 18 18 HIS N N 18 110.934 110.934 116.270 -5.336 19043 1071 1 4 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.341 0.156 19043 1072 1 4 . 1 1 18 18 HIS C C 18 175.243 175.243 175.726 -0.483 19043 1073 1 4 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.399 -1.343 19043 1074 1 4 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.057 0.591 19043 1075 1 4 . 1 1 18 18 HIS H H 18 7.150 7.150 7.974 -0.824 19043 1076 1 4 . 1 1 19 19 LEU N N 19 123.586 123.586 121.900 1.686 19043 1077 1 4 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.220 0.198 19043 1078 1 4 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.998 -0.522 19043 1079 1 4 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.962 -1.640 19043 1080 1 4 . 1 1 19 19 LEU H H 19 7.249 7.249 7.559 -0.310 19043 1081 1 4 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.454 -0.023 19043 1082 1 4 . 1 1 20 20 PRO C C 20 178.092 178.092 177.437 0.655 19043 1083 1 4 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.105 0.792 19043 1084 1 4 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.544 0.028 19043 1085 1 4 . 1 1 21 21 ASN N N 21 113.952 113.952 116.572 -2.620 19043 1086 1 4 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.508 0.501 19043 1087 1 4 . 1 1 21 21 ASN C C 21 176.397 176.397 175.930 0.467 19043 1088 1 4 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.100 -1.471 19043 1089 1 4 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.469 0.341 19043 1090 1 4 . 1 1 21 21 ASN H H 21 8.871 8.871 8.159 0.712 19043 1091 1 4 . 1 1 22 22 LEU N N 22 117.526 117.526 121.551 -4.025 19043 1092 1 4 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.283 0.118 19043 1093 1 4 . 1 1 22 22 LEU C C 22 176.879 176.879 175.265 1.614 19043 1094 1 4 . 1 1 22 22 LEU CA C 22 54.457 54.457 55.269 -0.812 19043 1095 1 4 . 1 1 22 22 LEU CB C 22 42.520 42.520 43.248 -0.729 19043 1096 1 4 . 1 1 22 22 LEU H H 22 6.563 6.563 8.228 -1.665 19043 1097 1 4 . 1 1 23 23 ASN N N 23 120.219 120.219 120.295 -0.076 19043 1098 1 4 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.781 0.087 19043 1099 1 4 . 1 1 23 23 ASN C C 23 175.507 175.507 176.066 -0.559 19043 1100 1 4 . 1 1 23 23 ASN CA C 23 51.416 51.416 51.622 -0.206 19043 1101 1 4 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.411 -0.699 19043 1102 1 4 . 1 1 23 23 ASN H H 23 8.612 8.612 7.973 0.639 19043 1103 1 4 . 1 1 24 24 GLU N N 24 118.801 118.801 118.605 0.196 19043 1104 1 4 . 1 1 24 24 GLU HA H 24 3.874 3.874 4.088 -0.214 19043 1105 1 4 . 1 1 24 24 GLU C C 24 177.799 177.799 178.262 -0.463 19043 1106 1 4 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.180 0.011 19043 1107 1 4 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.073 0.292 19043 1108 1 4 . 1 1 24 24 GLU H H 24 8.735 8.735 8.880 -0.145 19043 1109 1 4 . 1 1 25 25 GLU N N 25 119.198 119.198 119.515 -0.317 19043 1110 1 4 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.053 -0.075 19043 1111 1 4 . 1 1 25 25 GLU C C 25 180.078 180.078 179.333 0.745 19043 1112 1 4 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.336 0.555 19043 1113 1 4 . 1 1 25 25 GLU CB C 25 29.131 29.131 28.826 0.305 19043 1114 1 4 . 1 1 25 25 GLU H H 25 8.229 8.229 8.718 -0.489 19043 1115 1 4 . 1 1 26 26 GLN N N 26 119.646 119.646 118.415 1.231 19043 1116 1 4 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.102 -0.162 19043 1117 1 4 . 1 1 26 26 GLN C C 26 178.154 178.154 178.391 -0.237 19043 1118 1 4 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.288 -0.396 19043 1119 1 4 . 1 1 26 26 GLN CB C 26 28.902 28.902 29.045 -0.143 19043 1120 1 4 . 1 1 26 26 GLN H H 26 8.425 8.425 8.658 -0.233 19043 1121 1 4 . 1 1 27 27 ARG N N 27 119.454 119.454 120.163 -0.709 19043 1122 1 4 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.216 -0.430 19043 1123 1 4 . 1 1 27 27 ARG C C 27 177.863 177.863 178.102 -0.239 19043 1124 1 4 . 1 1 27 27 ARG CA C 27 60.630 60.630 60.053 0.577 19043 1125 1 4 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.167 -0.523 19043 1126 1 4 . 1 1 27 27 ARG H H 27 8.548 8.548 8.175 0.373 19043 1127 1 4 . 1 1 28 28 ASN N N 28 116.833 116.833 117.626 -0.793 19043 1128 1 4 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.466 -0.134 19043 1129 1 4 . 1 1 28 28 ASN C C 28 177.234 177.234 177.243 -0.009 19043 1130 1 4 . 1 1 28 28 ASN CA C 28 56.038 56.038 56.131 -0.093 19043 1131 1 4 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.248 -0.563 19043 1132 1 4 . 1 1 28 28 ASN H H 28 8.569 8.569 8.532 0.037 19043 1133 1 4 . 1 1 29 29 ALA N N 29 122.687 122.687 122.153 0.534 19043 1134 1 4 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.025 0.029 19043 1135 1 4 . 1 1 29 29 ALA C C 29 181.045 181.045 179.437 1.608 19043 1136 1 4 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.790 0.460 19043 1137 1 4 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.115 -0.295 19043 1138 1 4 . 1 1 29 29 ALA H H 29 7.793 7.793 7.486 0.307 19043 1139 1 4 . 1 1 30 30 PHE N N 30 116.979 116.979 118.103 -1.124 19043 1140 1 4 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.239 0.139 19043 1141 1 4 . 1 1 30 30 PHE C C 30 177.887 177.887 177.827 0.060 19043 1142 1 4 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.025 1.594 19043 1143 1 4 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.844 0.615 19043 1144 1 4 . 1 1 30 30 PHE H H 30 8.017 8.017 7.119 0.898 19043 1145 1 4 . 1 1 31 31 ILE N N 31 119.553 119.553 119.252 0.301 19043 1146 1 4 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.626 0.152 19043 1147 1 4 . 1 1 31 31 ILE C C 31 177.084 177.084 178.200 -1.116 19043 1148 1 4 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.400 0.245 19043 1149 1 4 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.558 -0.443 19043 1150 1 4 . 1 1 31 31 ILE H H 31 8.372 8.372 8.240 0.132 19043 1151 1 4 . 1 1 32 32 GLN N N 32 119.108 119.108 119.427 -0.319 19043 1152 1 4 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.919 -0.113 19043 1153 1 4 . 1 1 32 32 GLN C C 32 177.836 177.836 178.279 -0.443 19043 1154 1 4 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.630 -0.862 19043 1155 1 4 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.697 -0.719 19043 1156 1 4 . 1 1 32 32 GLN H H 32 8.389 8.389 8.437 -0.047 19043 1157 1 4 . 1 1 33 33 SER N N 33 114.437 114.437 114.390 0.047 19043 1158 1 4 . 1 1 33 33 SER HA H 33 4.212 4.212 4.318 -0.106 19043 1159 1 4 . 1 1 33 33 SER C C 33 175.469 175.469 176.717 -1.248 19043 1160 1 4 . 1 1 33 33 SER CA C 33 62.403 62.403 60.397 2.006 19043 1161 1 4 . 1 1 33 33 SER CB C 33 63.794 63.794 62.980 0.814 19043 1162 1 4 . 1 1 33 33 SER H H 33 8.078 8.078 7.709 0.369 19043 1163 1 4 . 1 1 34 34 LEU N N 34 122.967 122.967 123.761 -0.794 19043 1164 1 4 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.282 -0.372 19043 1165 1 4 . 1 1 34 34 LEU C C 34 177.506 177.506 178.221 -0.715 19043 1166 1 4 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.092 0.336 19043 1167 1 4 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.086 0.726 19043 1168 1 4 . 1 1 34 34 LEU H H 34 8.495 8.495 8.172 0.323 19043 1169 1 4 . 1 1 35 35 LYS N N 35 115.859 115.859 119.124 -3.265 19043 1170 1 4 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.141 -0.328 19043 1171 1 4 . 1 1 35 35 LYS C C 35 177.628 177.628 177.985 -0.357 19043 1172 1 4 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.717 -1.840 19043 1173 1 4 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.147 -0.127 19043 1174 1 4 . 1 1 35 35 LYS H H 35 7.815 7.815 7.889 -0.074 19043 1175 1 4 . 1 1 36 36 ASP N N 36 116.741 116.741 116.742 -0.001 19043 1176 1 4 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.657 -0.143 19043 1177 1 4 . 1 1 36 36 ASP C C 36 177.324 177.324 176.250 1.074 19043 1178 1 4 . 1 1 36 36 ASP CA C 36 56.686 56.686 56.177 0.509 19043 1179 1 4 . 1 1 36 36 ASP CB C 36 40.671 40.671 41.935 -1.264 19043 1180 1 4 . 1 1 36 36 ASP H H 36 7.943 7.943 7.638 0.305 19043 1181 1 4 . 1 1 37 37 ASP N N 37 116.686 116.686 119.131 -2.445 19043 1182 1 4 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.078 -0.037 19043 1183 1 4 . 1 1 37 37 ASP CA C 37 51.946 51.946 51.817 0.129 19043 1184 1 4 . 1 1 37 37 ASP CB C 37 40.523 40.523 41.943 -1.420 19043 1185 1 4 . 1 1 37 37 ASP H H 37 8.125 8.125 7.884 0.241 19043 1186 1 4 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.509 0.074 19043 1187 1 4 . 1 1 38 38 PRO C C 38 179.200 179.200 178.516 0.684 19043 1188 1 4 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.612 -0.075 19043 1189 1 4 . 1 1 38 38 PRO CB C 38 31.886 31.886 31.947 -0.061 19043 1190 1 4 . 1 1 39 39 SER N N 39 114.963 114.963 113.548 1.415 19043 1191 1 4 . 1 1 39 39 SER HA H 39 4.178 4.178 4.248 -0.070 19043 1192 1 4 . 1 1 39 39 SER C C 39 176.151 176.151 175.943 0.208 19043 1193 1 4 . 1 1 39 39 SER CA C 39 61.197 61.197 60.178 1.019 19043 1194 1 4 . 1 1 39 39 SER CB C 39 62.729 62.729 62.300 0.429 19043 1195 1 4 . 1 1 39 39 SER H H 39 8.315 8.315 8.511 -0.196 19043 1196 1 4 . 1 1 40 40 GLN N N 40 120.058 120.058 119.625 0.433 19043 1197 1 4 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.521 0.139 19043 1198 1 4 . 1 1 40 40 GLN C C 40 176.192 176.192 177.220 -1.028 19043 1199 1 4 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.370 -0.389 19043 1200 1 4 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.113 0.056 19043 1201 1 4 . 1 1 40 40 GLN H H 40 7.820 7.820 7.849 -0.029 19043 1202 1 4 . 1 1 41 41 SER N N 41 115.553 115.553 116.991 -1.438 19043 1203 1 4 . 1 1 41 41 SER HA H 41 3.845 3.845 4.108 -0.263 19043 1204 1 4 . 1 1 41 41 SER C C 41 174.181 174.181 175.395 -1.214 19043 1205 1 4 . 1 1 41 41 SER CA C 41 63.957 63.957 61.567 2.390 19043 1206 1 4 . 1 1 41 41 SER CB C 41 63.191 63.191 62.318 0.873 19043 1207 1 4 . 1 1 41 41 SER H H 41 7.666 7.666 7.877 -0.211 19043 1208 1 4 . 1 1 42 42 ALA N N 42 122.360 122.360 122.431 -0.071 19043 1209 1 4 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.187 -0.064 19043 1210 1 4 . 1 1 42 42 ALA C C 42 180.996 180.996 178.835 2.161 19043 1211 1 4 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.069 1.494 19043 1212 1 4 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.077 -1.021 19043 1213 1 4 . 1 1 42 42 ALA H H 42 8.556 8.556 8.022 0.534 19043 1214 1 4 . 1 1 43 43 ASN N N 43 118.974 118.974 118.877 0.097 19043 1215 1 4 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.526 -0.007 19043 1216 1 4 . 1 1 43 43 ASN C C 43 177.972 177.972 177.723 0.249 19043 1217 1 4 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.213 -0.359 19043 1218 1 4 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.453 -0.304 19043 1219 1 4 . 1 1 43 43 ASN H H 43 7.950 7.950 7.606 0.344 19043 1220 1 4 . 1 1 44 44 LEU N N 44 122.070 122.070 120.404 1.666 19043 1221 1 4 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.156 0.033 19043 1222 1 4 . 1 1 44 44 LEU C C 44 178.332 178.332 178.858 -0.526 19043 1223 1 4 . 1 1 44 44 LEU CA C 44 57.834 57.834 58.053 -0.219 19043 1224 1 4 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.794 0.558 19043 1225 1 4 . 1 1 44 44 LEU H H 44 8.789 8.789 8.584 0.205 19043 1226 1 4 . 1 1 45 45 LEU N N 45 118.621 118.621 119.433 -0.812 19043 1227 1 4 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.727 0.078 19043 1228 1 4 . 1 1 45 45 LEU C C 45 177.832 177.832 178.468 -0.636 19043 1229 1 4 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.699 0.186 19043 1230 1 4 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.567 0.239 19043 1231 1 4 . 1 1 45 45 LEU H H 45 8.283 8.283 7.501 0.782 19043 1232 1 4 . 1 1 46 46 ALA N N 46 119.525 119.525 120.855 -1.330 19043 1233 1 4 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.873 0.137 19043 1234 1 4 . 1 1 46 46 ALA C C 46 181.250 181.250 180.026 1.224 19043 1235 1 4 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.325 -0.029 19043 1236 1 4 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.003 -0.052 19043 1237 1 4 . 1 1 46 46 ALA H H 46 7.640 7.640 7.750 -0.110 19043 1238 1 4 . 1 1 47 47 GLU N N 47 119.572 119.572 117.870 1.702 19043 1239 1 4 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.117 -0.087 19043 1240 1 4 . 1 1 47 47 GLU C C 47 178.895 178.895 178.954 -0.059 19043 1241 1 4 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.967 0.199 19043 1242 1 4 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.614 -0.076 19043 1243 1 4 . 1 1 47 47 GLU H H 47 8.139 8.139 8.356 -0.217 19043 1244 1 4 . 1 1 48 48 ALA N N 48 123.953 123.953 122.383 1.570 19043 1245 1 4 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.618 -0.091 19043 1246 1 4 . 1 1 48 48 ALA C C 48 179.636 179.636 179.468 0.168 19043 1247 1 4 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.661 0.855 19043 1248 1 4 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.624 -0.379 19043 1249 1 4 . 1 1 48 48 ALA H H 48 8.468 8.468 7.794 0.674 19043 1250 1 4 . 1 1 49 49 LYS N N 49 117.926 117.926 117.820 0.106 19043 1251 1 4 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.935 -0.196 19043 1252 1 4 . 1 1 49 49 LYS C C 49 178.761 178.761 178.703 0.058 19043 1253 1 4 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.416 0.976 19043 1254 1 4 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.346 -0.258 19043 1255 1 4 . 1 1 49 49 LYS H H 49 8.459 8.459 8.256 0.203 19043 1256 1 4 . 1 1 50 50 LYS N N 50 120.194 120.194 119.759 0.435 19043 1257 1 4 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.069 0.019 19043 1258 1 4 . 1 1 50 50 LYS C C 50 179.859 179.859 178.238 1.621 19043 1259 1 4 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.045 0.690 19043 1260 1 4 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.538 -0.076 19043 1261 1 4 . 1 1 50 50 LYS H H 50 7.702 7.702 7.663 0.039 19043 1262 1 4 . 1 1 51 51 LEU N N 51 122.126 122.126 118.906 3.220 19043 1263 1 4 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.284 -0.157 19043 1264 1 4 . 1 1 51 51 LEU C C 51 178.123 178.123 177.927 0.196 19043 1265 1 4 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.539 1.058 19043 1266 1 4 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.428 -0.076 19043 1267 1 4 . 1 1 51 51 LEU H H 51 8.023 8.023 7.683 0.340 19043 1268 1 4 . 1 1 52 52 ASN N N 52 116.675 116.675 117.053 -0.378 19043 1269 1 4 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.395 -0.460 19043 1270 1 4 . 1 1 52 52 ASN C C 52 177.668 177.668 176.257 1.411 19043 1271 1 4 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.085 1.832 19043 1272 1 4 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.660 3.276 19043 1273 1 4 . 1 1 52 52 ASN H H 52 8.537 8.537 8.143 0.394 19043 1274 1 4 . 1 1 53 53 ASP N N 53 118.725 118.725 116.777 1.948 19043 1275 1 4 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.556 -0.112 19043 1276 1 4 . 1 1 53 53 ASP C C 53 178.936 178.936 176.741 2.195 19043 1277 1 4 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.016 1.917 19043 1278 1 4 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.450 -1.355 19043 1279 1 4 . 1 1 53 53 ASP H H 53 8.220 8.220 7.782 0.438 19043 1280 1 4 . 1 1 54 54 ALA N N 54 122.872 122.872 121.997 0.875 19043 1281 1 4 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.168 0.064 19043 1282 1 4 . 1 1 54 54 ALA C C 54 179.354 179.354 179.006 0.348 19043 1283 1 4 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.053 0.288 19043 1284 1 4 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.531 -0.926 19043 1285 1 4 . 1 1 54 54 ALA H H 54 8.037 8.037 7.331 0.706 19043 1286 1 4 . 1 1 55 55 GLN N N 55 115.052 115.052 116.475 -1.423 19043 1287 1 4 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.368 0.010 19043 1288 1 4 . 1 1 55 55 GLN C C 55 174.116 174.116 175.234 -1.118 19043 1289 1 4 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.195 -0.241 19043 1290 1 4 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.465 -1.241 19043 1291 1 4 . 1 1 55 55 GLN H H 55 7.512 7.512 7.535 -0.023 19043 1292 1 4 . 1 1 56 56 ALA N N 56 124.556 124.556 124.592 -0.036 19043 1293 1 4 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.379 -0.031 19043 1294 1 4 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.129 -0.092 19043 1295 1 4 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.506 -0.527 19043 1296 1 4 . 1 1 56 56 ALA H H 56 7.100 7.100 7.793 -0.693 19043 1297 1 4 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.697 -0.285 19043 1298 1 4 . 1 1 57 57 PRO C C 57 176.151 176.151 176.542 -0.391 19043 1299 1 4 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.187 1.096 19043 1300 1 4 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.320 -0.327 19043 1301 1 5 . 1 1 2 2 ASP N N 2 125.357 125.357 122.739 2.618 19043 1302 1 5 . 1 1 2 2 ASP C C 2 175.535 175.535 175.809 -0.274 19043 1303 1 5 . 1 1 2 2 ASP CA C 2 54.307 54.307 55.550 -1.243 19043 1304 1 5 . 1 1 2 2 ASP CB C 2 41.470 41.470 40.191 1.279 19043 1305 1 5 . 1 1 2 2 ASP H H 2 8.762 8.762 8.029 0.733 19043 1306 1 5 . 1 1 3 3 ASN N N 3 120.441 120.441 116.621 3.820 19043 1307 1 5 . 1 1 3 3 ASN HA H 3 4.700 4.700 3.911 0.789 19043 1308 1 5 . 1 1 3 3 ASN C C 3 175.246 175.246 174.897 0.349 19043 1309 1 5 . 1 1 3 3 ASN CA C 3 53.289 53.289 54.172 -0.883 19043 1310 1 5 . 1 1 3 3 ASN CB C 3 39.086 39.086 37.865 1.221 19043 1311 1 5 . 1 1 3 3 ASN H H 3 8.548 8.548 8.521 0.027 19043 1312 1 5 . 1 1 4 4 LYS N N 4 121.461 121.461 116.220 5.241 19043 1313 1 5 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.092 0.123 19043 1314 1 5 . 1 1 4 4 LYS C C 4 176.404 176.404 176.298 0.106 19043 1315 1 5 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.215 0.638 19043 1316 1 5 . 1 1 4 4 LYS CB C 4 32.780 32.780 31.907 0.873 19043 1317 1 5 . 1 1 4 4 LYS H H 4 8.337 8.337 8.186 0.151 19043 1318 1 5 . 1 1 5 5 PHE N N 5 119.538 119.538 115.877 3.661 19043 1319 1 5 . 1 1 5 5 PHE C C 5 175.433 175.433 174.776 0.657 19043 1320 1 5 . 1 1 5 5 PHE CA C 5 57.792 57.792 58.457 -0.665 19043 1321 1 5 . 1 1 5 5 PHE CB C 5 40.067 40.067 35.557 4.510 19043 1322 1 5 . 1 1 5 5 PHE H H 5 8.277 8.277 7.469 0.808 19043 1323 1 5 . 1 1 6 6 ASN N N 6 121.168 121.168 119.192 1.976 19043 1324 1 5 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.588 0.229 19043 1325 1 5 . 1 1 6 6 ASN C C 6 175.884 175.884 176.330 -0.446 19043 1326 1 5 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.306 -0.521 19043 1327 1 5 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.230 0.141 19043 1328 1 5 . 1 1 6 6 ASN H H 6 8.443 8.443 7.917 0.526 19043 1329 1 5 . 1 1 7 7 LYS N N 7 121.688 121.688 120.855 0.833 19043 1330 1 5 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.077 -0.132 19043 1331 1 5 . 1 1 7 7 LYS C C 7 178.196 178.196 178.358 -0.162 19043 1332 1 5 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.371 -0.470 19043 1333 1 5 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.053 0.071 19043 1334 1 5 . 1 1 7 7 LYS H H 7 8.460 8.460 8.575 -0.115 19043 1335 1 5 . 1 1 8 8 GLU N N 8 119.926 119.926 118.638 1.288 19043 1336 1 5 . 1 1 8 8 GLU HA H 8 4.081 4.081 4.099 -0.018 19043 1337 1 5 . 1 1 8 8 GLU C C 8 179.894 179.894 179.056 0.838 19043 1338 1 5 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.695 0.144 19043 1339 1 5 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.195 -0.254 19043 1340 1 5 . 1 1 8 8 GLU H H 8 8.386 8.386 8.775 -0.389 19043 1341 1 5 . 1 1 9 9 GLN N N 9 121.401 121.401 119.258 2.143 19043 1342 1 5 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.124 -0.027 19043 1343 1 5 . 1 1 9 9 GLN C C 9 177.324 177.324 178.515 -1.191 19043 1344 1 5 . 1 1 9 9 GLN CA C 9 59.383 59.383 59.016 0.367 19043 1345 1 5 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.503 0.366 19043 1346 1 5 . 1 1 9 9 GLN H H 9 8.307 8.307 8.402 -0.095 19043 1347 1 5 . 1 1 10 10 GLN N N 10 120.060 120.060 119.611 0.449 19043 1348 1 5 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.069 -0.847 19043 1349 1 5 . 1 1 10 10 GLN C C 10 176.888 176.888 178.359 -1.471 19043 1350 1 5 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.996 -0.047 19043 1351 1 5 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.701 0.140 19043 1352 1 5 . 1 1 10 10 GLN H H 10 8.040 8.040 7.715 0.325 19043 1353 1 5 . 1 1 11 11 ASN N N 11 116.214 116.214 118.902 -2.688 19043 1354 1 5 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.612 -0.262 19043 1355 1 5 . 1 1 11 11 ASN C C 11 177.828 177.828 177.500 0.328 19043 1356 1 5 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.079 0.178 19043 1357 1 5 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.068 0.142 19043 1358 1 5 . 1 1 11 11 ASN H H 11 8.366 8.366 8.515 -0.149 19043 1359 1 5 . 1 1 12 12 ALA N N 12 121.429 121.429 122.660 -1.231 19043 1360 1 5 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.045 -0.036 19043 1361 1 5 . 1 1 12 12 ALA C C 12 177.850 177.850 179.144 -1.294 19043 1362 1 5 . 1 1 12 12 ALA CA C 12 55.293 55.293 55.028 0.265 19043 1363 1 5 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.457 -0.136 19043 1364 1 5 . 1 1 12 12 ALA H H 12 7.915 7.915 8.215 -0.300 19043 1365 1 5 . 1 1 13 13 PHE N N 13 118.052 118.052 119.779 -1.727 19043 1366 1 5 . 1 1 13 13 PHE HA H 13 3.573 3.573 4.014 -0.441 19043 1367 1 5 . 1 1 13 13 PHE C C 13 175.832 175.832 177.133 -1.301 19043 1368 1 5 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.848 0.007 19043 1369 1 5 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.979 -0.062 19043 1370 1 5 . 1 1 13 13 PHE H H 13 8.097 8.097 7.448 0.649 19043 1371 1 5 . 1 1 14 14 TYR N N 14 116.000 116.000 117.601 -1.601 19043 1372 1 5 . 1 1 14 14 TYR HA H 14 3.985 3.985 4.006 -0.021 19043 1373 1 5 . 1 1 14 14 TYR C C 14 178.860 178.860 178.519 0.341 19043 1374 1 5 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.724 -1.929 19043 1375 1 5 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.679 -0.699 19043 1376 1 5 . 1 1 14 14 TYR H H 14 8.040 8.040 7.778 0.262 19043 1377 1 5 . 1 1 15 15 GLU N N 15 118.737 118.737 116.973 1.764 19043 1378 1 5 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.886 0.085 19043 1379 1 5 . 1 1 15 15 GLU C C 15 180.184 180.184 178.755 1.429 19043 1380 1 5 . 1 1 15 15 GLU CA C 15 60.607 60.607 58.945 1.662 19043 1381 1 5 . 1 1 15 15 GLU CB C 15 29.722 29.722 28.936 0.785 19043 1382 1 5 . 1 1 15 15 GLU H H 15 8.244 8.244 8.276 -0.032 19043 1383 1 5 . 1 1 16 16 ILE N N 16 119.695 119.695 117.878 1.817 19043 1384 1 5 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.772 -0.419 19043 1385 1 5 . 1 1 16 16 ILE C C 16 177.760 177.760 178.086 -0.326 19043 1386 1 5 . 1 1 16 16 ILE CA C 16 65.654 65.654 63.989 1.665 19043 1387 1 5 . 1 1 16 16 ILE CB C 16 37.403 37.403 38.001 -0.598 19043 1388 1 5 . 1 1 16 16 ILE H H 16 8.336 8.336 7.305 1.031 19043 1389 1 5 . 1 1 17 17 LEU N N 17 117.709 117.709 119.508 -1.799 19043 1390 1 5 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.984 -0.431 19043 1391 1 5 . 1 1 17 17 LEU C C 17 176.565 176.565 177.872 -1.307 19043 1392 1 5 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.002 0.557 19043 1393 1 5 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.528 0.310 19043 1394 1 5 . 1 1 17 17 LEU H H 17 7.738 7.738 7.431 0.307 19043 1395 1 5 . 1 1 18 18 HIS N N 18 110.934 110.934 114.511 -3.577 19043 1396 1 5 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.423 0.074 19043 1397 1 5 . 1 1 18 18 HIS C C 18 175.243 175.243 175.764 -0.521 19043 1398 1 5 . 1 1 18 18 HIS CA C 18 56.056 56.056 56.763 -0.707 19043 1399 1 5 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.130 0.518 19043 1400 1 5 . 1 1 18 18 HIS H H 18 7.150 7.150 7.741 -0.591 19043 1401 1 5 . 1 1 19 19 LEU N N 19 123.586 123.586 122.424 1.162 19043 1402 1 5 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.300 0.118 19043 1403 1 5 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.583 -0.107 19043 1404 1 5 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.973 -1.651 19043 1405 1 5 . 1 1 19 19 LEU H H 19 7.249 7.249 7.222 0.027 19043 1406 1 5 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.437 -0.006 19043 1407 1 5 . 1 1 20 20 PRO C C 20 178.092 178.092 177.462 0.630 19043 1408 1 5 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.171 0.726 19043 1409 1 5 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.517 0.056 19043 1410 1 5 . 1 1 21 21 ASN N N 21 113.952 113.952 116.635 -2.683 19043 1411 1 5 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.519 0.490 19043 1412 1 5 . 1 1 21 21 ASN C C 21 176.397 176.397 175.454 0.943 19043 1413 1 5 . 1 1 21 21 ASN CA C 21 52.629 52.629 53.948 -1.319 19043 1414 1 5 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.354 0.456 19043 1415 1 5 . 1 1 21 21 ASN H H 21 8.871 8.871 8.113 0.758 19043 1416 1 5 . 1 1 22 22 LEU N N 22 117.526 117.526 122.036 -4.510 19043 1417 1 5 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.339 0.062 19043 1418 1 5 . 1 1 22 22 LEU C C 22 176.879 176.879 175.190 1.689 19043 1419 1 5 . 1 1 22 22 LEU CA C 22 54.457 54.457 54.941 -0.484 19043 1420 1 5 . 1 1 22 22 LEU CB C 22 42.520 42.520 42.919 -0.399 19043 1421 1 5 . 1 1 22 22 LEU H H 22 6.563 6.563 7.874 -1.311 19043 1422 1 5 . 1 1 23 23 ASN N N 23 120.219 120.219 123.323 -3.104 19043 1423 1 5 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.738 0.130 19043 1424 1 5 . 1 1 23 23 ASN C C 23 175.507 175.507 176.070 -0.563 19043 1425 1 5 . 1 1 23 23 ASN CA C 23 51.416 51.416 52.276 -0.860 19043 1426 1 5 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.420 -0.708 19043 1427 1 5 . 1 1 23 23 ASN H H 23 8.612 8.612 8.333 0.279 19043 1428 1 5 . 1 1 24 24 GLU N N 24 118.801 118.801 119.027 -0.226 19043 1429 1 5 . 1 1 24 24 GLU HA H 24 3.874 3.874 4.043 -0.169 19043 1430 1 5 . 1 1 24 24 GLU C C 24 177.799 177.799 178.413 -0.614 19043 1431 1 5 . 1 1 24 24 GLU CA C 24 60.191 60.191 59.726 0.465 19043 1432 1 5 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.080 0.285 19043 1433 1 5 . 1 1 24 24 GLU H H 24 8.735 8.735 8.921 -0.186 19043 1434 1 5 . 1 1 25 25 GLU N N 25 119.198 119.198 120.249 -1.051 19043 1435 1 5 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.084 -0.106 19043 1436 1 5 . 1 1 25 25 GLU C C 25 180.078 180.078 179.100 0.978 19043 1437 1 5 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.568 0.323 19043 1438 1 5 . 1 1 25 25 GLU CB C 25 29.131 29.131 29.016 0.115 19043 1439 1 5 . 1 1 25 25 GLU H H 25 8.229 8.229 8.854 -0.625 19043 1440 1 5 . 1 1 26 26 GLN N N 26 119.646 119.646 118.538 1.108 19043 1441 1 5 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.065 -0.125 19043 1442 1 5 . 1 1 26 26 GLN C C 26 178.154 178.154 178.273 -0.119 19043 1443 1 5 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.843 -0.950 19043 1444 1 5 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.536 0.366 19043 1445 1 5 . 1 1 26 26 GLN H H 26 8.425 8.425 8.329 0.096 19043 1446 1 5 . 1 1 27 27 ARG N N 27 119.454 119.454 120.269 -0.815 19043 1447 1 5 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.091 -0.305 19043 1448 1 5 . 1 1 27 27 ARG C C 27 177.863 177.863 178.280 -0.417 19043 1449 1 5 . 1 1 27 27 ARG CA C 27 60.630 60.630 60.122 0.508 19043 1450 1 5 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.164 -0.520 19043 1451 1 5 . 1 1 27 27 ARG H H 27 8.548 8.548 8.245 0.303 19043 1452 1 5 . 1 1 28 28 ASN N N 28 116.833 116.833 117.834 -1.001 19043 1453 1 5 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.482 -0.150 19043 1454 1 5 . 1 1 28 28 ASN C C 28 177.234 177.234 177.354 -0.120 19043 1455 1 5 . 1 1 28 28 ASN CA C 28 56.038 56.038 56.092 -0.054 19043 1456 1 5 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.235 -0.550 19043 1457 1 5 . 1 1 28 28 ASN H H 28 8.569 8.569 8.512 0.057 19043 1458 1 5 . 1 1 29 29 ALA N N 29 122.687 122.687 122.330 0.357 19043 1459 1 5 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.058 -0.004 19043 1460 1 5 . 1 1 29 29 ALA C C 29 181.045 181.045 179.425 1.620 19043 1461 1 5 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.635 0.616 19043 1462 1 5 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.230 -0.409 19043 1463 1 5 . 1 1 29 29 ALA H H 29 7.793 7.793 7.304 0.489 19043 1464 1 5 . 1 1 30 30 PHE N N 30 116.979 116.979 118.303 -1.324 19043 1465 1 5 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.299 0.079 19043 1466 1 5 . 1 1 30 30 PHE C C 30 177.887 177.887 177.894 -0.007 19043 1467 1 5 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.578 1.041 19043 1468 1 5 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.985 0.474 19043 1469 1 5 . 1 1 30 30 PHE H H 30 8.017 8.017 7.619 0.398 19043 1470 1 5 . 1 1 31 31 ILE N N 31 119.553 119.553 119.813 -0.260 19043 1471 1 5 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.619 0.159 19043 1472 1 5 . 1 1 31 31 ILE C C 31 177.084 177.084 177.876 -0.792 19043 1473 1 5 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.564 0.081 19043 1474 1 5 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.666 -0.551 19043 1475 1 5 . 1 1 31 31 ILE H H 31 8.372 8.372 8.655 -0.283 19043 1476 1 5 . 1 1 32 32 GLN N N 32 119.108 119.108 119.551 -0.443 19043 1477 1 5 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.958 -0.152 19043 1478 1 5 . 1 1 32 32 GLN C C 32 177.836 177.836 178.628 -0.792 19043 1479 1 5 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.588 -0.820 19043 1480 1 5 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.683 -0.705 19043 1481 1 5 . 1 1 32 32 GLN H H 32 8.389 8.389 8.371 0.018 19043 1482 1 5 . 1 1 33 33 SER N N 33 114.437 114.437 115.402 -0.965 19043 1483 1 5 . 1 1 33 33 SER HA H 33 4.212 4.212 4.207 0.005 19043 1484 1 5 . 1 1 33 33 SER C C 33 175.469 175.469 176.805 -1.336 19043 1485 1 5 . 1 1 33 33 SER CA C 33 62.403 62.403 61.890 0.513 19043 1486 1 5 . 1 1 33 33 SER CB C 33 63.794 63.794 63.102 0.691 19043 1487 1 5 . 1 1 33 33 SER H H 33 8.078 8.078 7.748 0.330 19043 1488 1 5 . 1 1 34 34 LEU N N 34 122.967 122.967 123.723 -0.756 19043 1489 1 5 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.125 -0.215 19043 1490 1 5 . 1 1 34 34 LEU C C 34 177.506 177.506 178.316 -0.810 19043 1491 1 5 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.962 -0.534 19043 1492 1 5 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.126 0.686 19043 1493 1 5 . 1 1 34 34 LEU H H 34 8.495 8.495 8.143 0.352 19043 1494 1 5 . 1 1 35 35 LYS N N 35 115.859 115.859 118.129 -2.270 19043 1495 1 5 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.086 -0.273 19043 1496 1 5 . 1 1 35 35 LYS C C 35 177.628 177.628 178.197 -0.569 19043 1497 1 5 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.830 -1.953 19043 1498 1 5 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.103 -0.084 19043 1499 1 5 . 1 1 35 35 LYS H H 35 7.815 7.815 7.807 0.008 19043 1500 1 5 . 1 1 36 36 ASP N N 36 116.741 116.741 117.321 -0.580 19043 1501 1 5 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.564 -0.050 19043 1502 1 5 . 1 1 36 36 ASP C C 36 177.324 177.324 176.737 0.587 19043 1503 1 5 . 1 1 36 36 ASP CA C 36 56.686 56.686 56.387 0.299 19043 1504 1 5 . 1 1 36 36 ASP CB C 36 40.671 40.671 41.657 -0.986 19043 1505 1 5 . 1 1 36 36 ASP H H 36 7.943 7.943 7.845 0.098 19043 1506 1 5 . 1 1 37 37 ASP N N 37 116.686 116.686 117.935 -1.249 19043 1507 1 5 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.102 -0.061 19043 1508 1 5 . 1 1 37 37 ASP CA C 37 51.946 51.946 52.218 -0.272 19043 1509 1 5 . 1 1 37 37 ASP CB C 37 40.523 40.523 42.340 -1.817 19043 1510 1 5 . 1 1 37 37 ASP H H 37 8.125 8.125 7.834 0.291 19043 1511 1 5 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.551 0.032 19043 1512 1 5 . 1 1 38 38 PRO C C 38 179.200 179.200 178.314 0.886 19043 1513 1 5 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.522 0.015 19043 1514 1 5 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.044 -0.157 19043 1515 1 5 . 1 1 39 39 SER N N 39 114.963 114.963 114.054 0.909 19043 1516 1 5 . 1 1 39 39 SER HA H 39 4.178 4.178 4.284 -0.106 19043 1517 1 5 . 1 1 39 39 SER C C 39 176.151 176.151 176.028 0.123 19043 1518 1 5 . 1 1 39 39 SER CA C 39 61.197 61.197 61.391 -0.194 19043 1519 1 5 . 1 1 39 39 SER CB C 39 62.729 62.729 62.468 0.261 19043 1520 1 5 . 1 1 39 39 SER H H 39 8.315 8.315 8.508 -0.193 19043 1521 1 5 . 1 1 40 40 GLN N N 40 120.058 120.058 120.025 0.033 19043 1522 1 5 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.444 0.216 19043 1523 1 5 . 1 1 40 40 GLN C C 40 176.192 176.192 177.220 -1.028 19043 1524 1 5 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.525 -0.544 19043 1525 1 5 . 1 1 40 40 GLN CB C 40 28.168 28.168 27.963 0.205 19043 1526 1 5 . 1 1 40 40 GLN H H 40 7.820 7.820 7.939 -0.119 19043 1527 1 5 . 1 1 41 41 SER N N 41 115.553 115.553 116.606 -1.053 19043 1528 1 5 . 1 1 41 41 SER HA H 41 3.845 3.845 4.084 -0.239 19043 1529 1 5 . 1 1 41 41 SER C C 41 174.181 174.181 175.237 -1.056 19043 1530 1 5 . 1 1 41 41 SER CA C 41 63.957 63.957 61.224 2.733 19043 1531 1 5 . 1 1 41 41 SER CB C 41 63.191 63.191 63.050 0.141 19043 1532 1 5 . 1 1 41 41 SER H H 41 7.666 7.666 7.659 0.007 19043 1533 1 5 . 1 1 42 42 ALA N N 42 122.360 122.360 121.694 0.666 19043 1534 1 5 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.224 -0.101 19043 1535 1 5 . 1 1 42 42 ALA C C 42 180.996 180.996 178.753 2.243 19043 1536 1 5 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.273 1.290 19043 1537 1 5 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.051 -0.995 19043 1538 1 5 . 1 1 42 42 ALA H H 42 8.556 8.556 8.079 0.477 19043 1539 1 5 . 1 1 43 43 ASN N N 43 118.974 118.974 118.838 0.136 19043 1540 1 5 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.533 -0.014 19043 1541 1 5 . 1 1 43 43 ASN C C 43 177.972 177.972 177.790 0.182 19043 1542 1 5 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.487 -0.633 19043 1543 1 5 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.290 -0.141 19043 1544 1 5 . 1 1 43 43 ASN H H 43 7.950 7.950 7.503 0.447 19043 1545 1 5 . 1 1 44 44 LEU N N 44 122.070 122.070 120.546 1.524 19043 1546 1 5 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.372 -0.182 19043 1547 1 5 . 1 1 44 44 LEU C C 44 178.332 178.332 179.413 -1.081 19043 1548 1 5 . 1 1 44 44 LEU CA C 44 57.834 57.834 57.924 -0.090 19043 1549 1 5 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.800 0.551 19043 1550 1 5 . 1 1 44 44 LEU H H 44 8.789 8.789 8.502 0.287 19043 1551 1 5 . 1 1 45 45 LEU N N 45 118.621 118.621 119.341 -0.720 19043 1552 1 5 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.751 0.054 19043 1553 1 5 . 1 1 45 45 LEU C C 45 177.832 177.832 178.482 -0.650 19043 1554 1 5 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.708 0.177 19043 1555 1 5 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.598 0.208 19043 1556 1 5 . 1 1 45 45 LEU H H 45 8.283 8.283 7.550 0.733 19043 1557 1 5 . 1 1 46 46 ALA N N 46 119.525 119.525 120.561 -1.036 19043 1558 1 5 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.896 0.114 19043 1559 1 5 . 1 1 46 46 ALA C C 46 181.250 181.250 179.960 1.290 19043 1560 1 5 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.082 0.214 19043 1561 1 5 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.060 -0.109 19043 1562 1 5 . 1 1 46 46 ALA H H 46 7.640 7.640 7.786 -0.146 19043 1563 1 5 . 1 1 47 47 GLU N N 47 119.572 119.572 118.162 1.410 19043 1564 1 5 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.117 -0.087 19043 1565 1 5 . 1 1 47 47 GLU C C 47 178.895 178.895 178.767 0.128 19043 1566 1 5 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.841 0.325 19043 1567 1 5 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.839 -0.301 19043 1568 1 5 . 1 1 47 47 GLU H H 47 8.139 8.139 8.392 -0.253 19043 1569 1 5 . 1 1 48 48 ALA N N 48 123.953 123.953 122.426 1.527 19043 1570 1 5 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.606 -0.079 19043 1571 1 5 . 1 1 48 48 ALA C C 48 179.636 179.636 179.070 0.566 19043 1572 1 5 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.298 1.218 19043 1573 1 5 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.714 -0.469 19043 1574 1 5 . 1 1 48 48 ALA H H 48 8.468 8.468 7.632 0.836 19043 1575 1 5 . 1 1 49 49 LYS N N 49 117.926 117.926 118.266 -0.340 19043 1576 1 5 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.923 -0.184 19043 1577 1 5 . 1 1 49 49 LYS C C 49 178.761 178.761 178.678 0.083 19043 1578 1 5 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.609 0.783 19043 1579 1 5 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.345 -0.256 19043 1580 1 5 . 1 1 49 49 LYS H H 49 8.459 8.459 8.353 0.106 19043 1581 1 5 . 1 1 50 50 LYS N N 50 120.194 120.194 119.348 0.846 19043 1582 1 5 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.075 0.013 19043 1583 1 5 . 1 1 50 50 LYS C C 50 179.859 179.859 178.343 1.516 19043 1584 1 5 . 1 1 50 50 LYS CA C 50 59.735 59.735 58.980 0.755 19043 1585 1 5 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.525 -0.063 19043 1586 1 5 . 1 1 50 50 LYS H H 50 7.702 7.702 7.705 -0.003 19043 1587 1 5 . 1 1 51 51 LEU N N 51 122.126 122.126 119.263 2.863 19043 1588 1 5 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.264 -0.137 19043 1589 1 5 . 1 1 51 51 LEU C C 51 178.123 178.123 177.955 0.168 19043 1590 1 5 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.696 0.901 19043 1591 1 5 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.329 0.023 19043 1592 1 5 . 1 1 51 51 LEU H H 51 8.023 8.023 7.430 0.593 19043 1593 1 5 . 1 1 52 52 ASN N N 52 116.675 116.675 116.873 -0.198 19043 1594 1 5 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.361 -0.426 19043 1595 1 5 . 1 1 52 52 ASN C C 52 177.668 177.668 176.380 1.288 19043 1596 1 5 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.181 1.736 19043 1597 1 5 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.728 3.208 19043 1598 1 5 . 1 1 52 52 ASN H H 52 8.537 8.537 8.310 0.227 19043 1599 1 5 . 1 1 53 53 ASP N N 53 118.725 118.725 117.622 1.103 19043 1600 1 5 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.611 -0.167 19043 1601 1 5 . 1 1 53 53 ASP C C 53 178.936 178.936 176.417 2.519 19043 1602 1 5 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.327 1.606 19043 1603 1 5 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.316 -1.221 19043 1604 1 5 . 1 1 53 53 ASP H H 53 8.220 8.220 7.706 0.514 19043 1605 1 5 . 1 1 54 54 ALA N N 54 122.872 122.872 120.263 2.609 19043 1606 1 5 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.202 0.030 19043 1607 1 5 . 1 1 54 54 ALA C C 54 179.354 179.354 178.848 0.506 19043 1608 1 5 . 1 1 54 54 ALA CA C 54 54.341 54.341 53.904 0.437 19043 1609 1 5 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.071 -0.466 19043 1610 1 5 . 1 1 54 54 ALA H H 54 8.037 8.037 7.083 0.954 19043 1611 1 5 . 1 1 55 55 GLN N N 55 115.052 115.052 116.298 -1.246 19043 1612 1 5 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.389 -0.011 19043 1613 1 5 . 1 1 55 55 GLN C C 55 174.116 174.116 175.185 -1.069 19043 1614 1 5 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.049 -0.095 19043 1615 1 5 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.613 -1.389 19043 1616 1 5 . 1 1 55 55 GLN H H 55 7.512 7.512 7.522 -0.010 19043 1617 1 5 . 1 1 56 56 ALA N N 56 124.556 124.556 125.282 -0.726 19043 1618 1 5 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.402 -0.054 19043 1619 1 5 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.189 -0.152 19043 1620 1 5 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.768 -0.789 19043 1621 1 5 . 1 1 56 56 ALA H H 56 7.100 7.100 7.753 -0.653 19043 1622 1 5 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.718 -0.306 19043 1623 1 5 . 1 1 57 57 PRO C C 57 176.151 176.151 176.549 -0.398 19043 1624 1 5 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.048 1.235 19043 1625 1 5 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.322 -0.329 19043 1626 1 6 . 1 1 2 2 ASP N N 2 125.357 125.357 123.213 2.144 19043 1627 1 6 . 1 1 2 2 ASP C C 2 175.535 175.535 175.703 -0.168 19043 1628 1 6 . 1 1 2 2 ASP CA C 2 54.307 54.307 53.824 0.483 19043 1629 1 6 . 1 1 2 2 ASP CB C 2 41.470 41.470 39.031 2.439 19043 1630 1 6 . 1 1 2 2 ASP H H 2 8.762 8.762 8.594 0.168 19043 1631 1 6 . 1 1 3 3 ASN N N 3 120.441 120.441 118.905 1.536 19043 1632 1 6 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.163 0.537 19043 1633 1 6 . 1 1 3 3 ASN C C 3 175.246 175.246 175.197 0.049 19043 1634 1 6 . 1 1 3 3 ASN CA C 3 53.289 53.289 53.656 -0.367 19043 1635 1 6 . 1 1 3 3 ASN CB C 3 39.086 39.086 38.270 0.816 19043 1636 1 6 . 1 1 3 3 ASN H H 3 8.548 8.548 7.512 1.036 19043 1637 1 6 . 1 1 4 4 LYS N N 4 121.461 121.461 116.824 4.637 19043 1638 1 6 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.013 0.202 19043 1639 1 6 . 1 1 4 4 LYS C C 4 176.404 176.404 176.313 0.091 19043 1640 1 6 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.596 0.257 19043 1641 1 6 . 1 1 4 4 LYS CB C 4 32.780 32.780 32.061 0.719 19043 1642 1 6 . 1 1 4 4 LYS H H 4 8.337 8.337 7.739 0.598 19043 1643 1 6 . 1 1 5 5 PHE N N 5 119.538 119.538 115.449 4.089 19043 1644 1 6 . 1 1 5 5 PHE C C 5 175.433 175.433 175.098 0.335 19043 1645 1 6 . 1 1 5 5 PHE CA C 5 57.792 57.792 58.216 -0.424 19043 1646 1 6 . 1 1 5 5 PHE CB C 5 40.067 40.067 35.570 4.497 19043 1647 1 6 . 1 1 5 5 PHE H H 5 8.277 8.277 7.256 1.021 19043 1648 1 6 . 1 1 6 6 ASN N N 6 121.168 121.168 120.562 0.606 19043 1649 1 6 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.653 0.164 19043 1650 1 6 . 1 1 6 6 ASN C C 6 175.884 175.884 176.284 -0.400 19043 1651 1 6 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.728 -0.943 19043 1652 1 6 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.226 0.145 19043 1653 1 6 . 1 1 6 6 ASN H H 6 8.443 8.443 8.058 0.385 19043 1654 1 6 . 1 1 7 7 LYS N N 7 121.688 121.688 120.796 0.892 19043 1655 1 6 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.102 -0.157 19043 1656 1 6 . 1 1 7 7 LYS C C 7 178.196 178.196 178.499 -0.303 19043 1657 1 6 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.363 -0.462 19043 1658 1 6 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.310 -0.186 19043 1659 1 6 . 1 1 7 7 LYS H H 7 8.460 8.460 8.568 -0.108 19043 1660 1 6 . 1 1 8 8 GLU N N 8 119.926 119.926 118.590 1.336 19043 1661 1 6 . 1 1 8 8 GLU HA H 8 4.081 4.081 4.047 0.034 19043 1662 1 6 . 1 1 8 8 GLU C C 8 179.894 179.894 178.957 0.937 19043 1663 1 6 . 1 1 8 8 GLU CA C 8 59.839 59.839 60.212 -0.373 19043 1664 1 6 . 1 1 8 8 GLU CB C 8 28.941 28.941 28.708 0.233 19043 1665 1 6 . 1 1 8 8 GLU H H 8 8.386 8.386 8.911 -0.525 19043 1666 1 6 . 1 1 9 9 GLN N N 9 121.401 121.401 117.771 3.630 19043 1667 1 6 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.096 0.001 19043 1668 1 6 . 1 1 9 9 GLN C C 9 177.324 177.324 178.165 -0.841 19043 1669 1 6 . 1 1 9 9 GLN CA C 9 59.383 59.383 59.072 0.311 19043 1670 1 6 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.478 0.391 19043 1671 1 6 . 1 1 9 9 GLN H H 9 8.307 8.307 8.679 -0.372 19043 1672 1 6 . 1 1 10 10 GLN N N 10 120.060 120.060 119.702 0.358 19043 1673 1 6 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.044 -0.822 19043 1674 1 6 . 1 1 10 10 GLN C C 10 176.888 176.888 178.288 -1.400 19043 1675 1 6 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.925 0.024 19043 1676 1 6 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.667 0.174 19043 1677 1 6 . 1 1 10 10 GLN H H 10 8.040 8.040 7.799 0.241 19043 1678 1 6 . 1 1 11 11 ASN N N 11 116.214 116.214 119.023 -2.809 19043 1679 1 6 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.615 -0.265 19043 1680 1 6 . 1 1 11 11 ASN C C 11 177.828 177.828 177.615 0.213 19043 1681 1 6 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.113 0.144 19043 1682 1 6 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.087 0.123 19043 1683 1 6 . 1 1 11 11 ASN H H 11 8.366 8.366 8.496 -0.130 19043 1684 1 6 . 1 1 12 12 ALA N N 12 121.429 121.429 122.750 -1.321 19043 1685 1 6 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.095 -0.086 19043 1686 1 6 . 1 1 12 12 ALA C C 12 177.850 177.850 179.172 -1.322 19043 1687 1 6 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.785 0.508 19043 1688 1 6 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.430 -0.109 19043 1689 1 6 . 1 1 12 12 ALA H H 12 7.915 7.915 8.226 -0.311 19043 1690 1 6 . 1 1 13 13 PHE N N 13 118.052 118.052 119.878 -1.826 19043 1691 1 6 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.965 -0.392 19043 1692 1 6 . 1 1 13 13 PHE C C 13 175.832 175.832 177.024 -1.192 19043 1693 1 6 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.793 0.062 19043 1694 1 6 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.923 -0.006 19043 1695 1 6 . 1 1 13 13 PHE H H 13 8.097 8.097 7.422 0.675 19043 1696 1 6 . 1 1 14 14 TYR N N 14 116.000 116.000 117.873 -1.873 19043 1697 1 6 . 1 1 14 14 TYR HA H 14 3.985 3.985 3.786 0.199 19043 1698 1 6 . 1 1 14 14 TYR C C 14 178.860 178.860 177.954 0.906 19043 1699 1 6 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.292 -1.497 19043 1700 1 6 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.329 -0.349 19043 1701 1 6 . 1 1 14 14 TYR H H 14 8.040 8.040 7.751 0.289 19043 1702 1 6 . 1 1 15 15 GLU N N 15 118.737 118.737 118.410 0.327 19043 1703 1 6 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.807 0.164 19043 1704 1 6 . 1 1 15 15 GLU C C 15 180.184 180.184 178.987 1.197 19043 1705 1 6 . 1 1 15 15 GLU CA C 15 60.607 60.607 58.817 1.790 19043 1706 1 6 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.279 0.444 19043 1707 1 6 . 1 1 15 15 GLU H H 15 8.244 8.244 8.095 0.149 19043 1708 1 6 . 1 1 16 16 ILE N N 16 119.695 119.695 118.154 1.541 19043 1709 1 6 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.718 -0.365 19043 1710 1 6 . 1 1 16 16 ILE C C 16 177.760 177.760 177.474 0.286 19043 1711 1 6 . 1 1 16 16 ILE CA C 16 65.654 65.654 63.952 1.702 19043 1712 1 6 . 1 1 16 16 ILE CB C 16 37.403 37.403 37.926 -0.523 19043 1713 1 6 . 1 1 16 16 ILE H H 16 8.336 8.336 7.263 1.073 19043 1714 1 6 . 1 1 17 17 LEU N N 17 117.709 117.709 118.887 -1.178 19043 1715 1 6 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.972 -0.419 19043 1716 1 6 . 1 1 17 17 LEU C C 17 176.565 176.565 177.930 -1.365 19043 1717 1 6 . 1 1 17 17 LEU CA C 17 57.559 57.559 56.949 0.610 19043 1718 1 6 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.718 0.120 19043 1719 1 6 . 1 1 17 17 LEU H H 17 7.738 7.738 7.290 0.448 19043 1720 1 6 . 1 1 18 18 HIS N N 18 110.934 110.934 116.038 -5.104 19043 1721 1 6 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.345 0.152 19043 1722 1 6 . 1 1 18 18 HIS C C 18 175.243 175.243 175.674 -0.431 19043 1723 1 6 . 1 1 18 18 HIS CA C 18 56.056 56.056 56.385 -0.329 19043 1724 1 6 . 1 1 18 18 HIS CB C 18 30.648 30.648 29.815 0.833 19043 1725 1 6 . 1 1 18 18 HIS H H 18 7.150 7.150 7.705 -0.555 19043 1726 1 6 . 1 1 19 19 LEU N N 19 123.586 123.586 121.222 2.364 19043 1727 1 6 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.256 0.162 19043 1728 1 6 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.963 -0.487 19043 1729 1 6 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.405 -1.083 19043 1730 1 6 . 1 1 19 19 LEU H H 19 7.249 7.249 7.328 -0.079 19043 1731 1 6 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.503 -0.072 19043 1732 1 6 . 1 1 20 20 PRO C C 20 178.092 178.092 177.214 0.878 19043 1733 1 6 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.417 0.480 19043 1734 1 6 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.253 0.319 19043 1735 1 6 . 1 1 21 21 ASN N N 21 113.952 113.952 116.746 -2.794 19043 1736 1 6 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.561 0.448 19043 1737 1 6 . 1 1 21 21 ASN C C 21 176.397 176.397 176.101 0.296 19043 1738 1 6 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.232 -1.603 19043 1739 1 6 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.133 0.677 19043 1740 1 6 . 1 1 21 21 ASN H H 21 8.871 8.871 8.254 0.617 19043 1741 1 6 . 1 1 22 22 LEU N N 22 117.526 117.526 122.236 -4.710 19043 1742 1 6 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.253 0.148 19043 1743 1 6 . 1 1 22 22 LEU C C 22 176.879 176.879 175.659 1.220 19043 1744 1 6 . 1 1 22 22 LEU CA C 22 54.457 54.457 55.183 -0.726 19043 1745 1 6 . 1 1 22 22 LEU CB C 22 42.520 42.520 43.127 -0.606 19043 1746 1 6 . 1 1 22 22 LEU H H 22 6.563 6.563 7.777 -1.214 19043 1747 1 6 . 1 1 23 23 ASN N N 23 120.219 120.219 121.945 -1.726 19043 1748 1 6 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.819 0.049 19043 1749 1 6 . 1 1 23 23 ASN C C 23 175.507 175.507 176.139 -0.632 19043 1750 1 6 . 1 1 23 23 ASN CA C 23 51.416 51.416 52.016 -0.600 19043 1751 1 6 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.715 -1.003 19043 1752 1 6 . 1 1 23 23 ASN H H 23 8.612 8.612 8.053 0.559 19043 1753 1 6 . 1 1 24 24 GLU N N 24 118.801 118.801 119.840 -1.039 19043 1754 1 6 . 1 1 24 24 GLU HA H 24 3.874 3.874 3.975 -0.101 19043 1755 1 6 . 1 1 24 24 GLU C C 24 177.799 177.799 178.363 -0.564 19043 1756 1 6 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.274 -0.083 19043 1757 1 6 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.329 0.036 19043 1758 1 6 . 1 1 24 24 GLU H H 24 8.735 8.735 9.022 -0.287 19043 1759 1 6 . 1 1 25 25 GLU N N 25 119.198 119.198 119.697 -0.499 19043 1760 1 6 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.116 -0.138 19043 1761 1 6 . 1 1 25 25 GLU C C 25 180.078 180.078 179.076 1.002 19043 1762 1 6 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.440 0.451 19043 1763 1 6 . 1 1 25 25 GLU CB C 25 29.131 29.131 28.737 0.394 19043 1764 1 6 . 1 1 25 25 GLU H H 25 8.229 8.229 8.797 -0.568 19043 1765 1 6 . 1 1 26 26 GLN N N 26 119.646 119.646 118.389 1.257 19043 1766 1 6 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.088 -0.148 19043 1767 1 6 . 1 1 26 26 GLN C C 26 178.154 178.154 178.419 -0.265 19043 1768 1 6 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.382 -0.489 19043 1769 1 6 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.158 0.744 19043 1770 1 6 . 1 1 26 26 GLN H H 26 8.425 8.425 8.260 0.165 19043 1771 1 6 . 1 1 27 27 ARG N N 27 119.454 119.454 120.669 -1.215 19043 1772 1 6 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.089 -0.303 19043 1773 1 6 . 1 1 27 27 ARG C C 27 177.863 177.863 178.461 -0.598 19043 1774 1 6 . 1 1 27 27 ARG CA C 27 60.630 60.630 60.090 0.540 19043 1775 1 6 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.145 -0.501 19043 1776 1 6 . 1 1 27 27 ARG H H 27 8.548 8.548 8.543 0.005 19043 1777 1 6 . 1 1 28 28 ASN N N 28 116.833 116.833 117.564 -0.731 19043 1778 1 6 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.464 -0.132 19043 1779 1 6 . 1 1 28 28 ASN C C 28 177.234 177.234 177.338 -0.104 19043 1780 1 6 . 1 1 28 28 ASN CA C 28 56.038 56.038 55.973 0.065 19043 1781 1 6 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.307 -0.622 19043 1782 1 6 . 1 1 28 28 ASN H H 28 8.569 8.569 8.497 0.072 19043 1783 1 6 . 1 1 29 29 ALA N N 29 122.687 122.687 123.070 -0.383 19043 1784 1 6 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.066 -0.013 19043 1785 1 6 . 1 1 29 29 ALA C C 29 181.045 181.045 179.575 1.470 19043 1786 1 6 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.680 0.570 19043 1787 1 6 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.089 -0.269 19043 1788 1 6 . 1 1 29 29 ALA H H 29 7.793 7.793 7.447 0.346 19043 1789 1 6 . 1 1 30 30 PHE N N 30 116.979 116.979 117.906 -0.927 19043 1790 1 6 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.284 0.094 19043 1791 1 6 . 1 1 30 30 PHE C C 30 177.887 177.887 177.943 -0.056 19043 1792 1 6 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.671 0.948 19043 1793 1 6 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.952 0.507 19043 1794 1 6 . 1 1 30 30 PHE H H 30 8.017 8.017 7.746 0.271 19043 1795 1 6 . 1 1 31 31 ILE N N 31 119.553 119.553 119.793 -0.240 19043 1796 1 6 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.664 0.114 19043 1797 1 6 . 1 1 31 31 ILE C C 31 177.084 177.084 177.790 -0.706 19043 1798 1 6 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.227 0.418 19043 1799 1 6 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.706 -0.591 19043 1800 1 6 . 1 1 31 31 ILE H H 31 8.372 8.372 8.543 -0.171 19043 1801 1 6 . 1 1 32 32 GLN N N 32 119.108 119.108 119.679 -0.571 19043 1802 1 6 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.913 -0.107 19043 1803 1 6 . 1 1 32 32 GLN C C 32 177.836 177.836 178.260 -0.424 19043 1804 1 6 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.698 -0.930 19043 1805 1 6 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.654 -0.676 19043 1806 1 6 . 1 1 32 32 GLN H H 32 8.389 8.389 8.353 0.036 19043 1807 1 6 . 1 1 33 33 SER N N 33 114.437 114.437 114.350 0.087 19043 1808 1 6 . 1 1 33 33 SER HA H 33 4.212 4.212 4.301 -0.089 19043 1809 1 6 . 1 1 33 33 SER C C 33 175.469 175.469 176.580 -1.111 19043 1810 1 6 . 1 1 33 33 SER CA C 33 62.403 62.403 60.799 1.604 19043 1811 1 6 . 1 1 33 33 SER CB C 33 63.794 63.794 62.992 0.802 19043 1812 1 6 . 1 1 33 33 SER H H 33 8.078 8.078 7.675 0.403 19043 1813 1 6 . 1 1 34 34 LEU N N 34 122.967 122.967 123.845 -0.878 19043 1814 1 6 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.170 -0.260 19043 1815 1 6 . 1 1 34 34 LEU C C 34 177.506 177.506 178.443 -0.937 19043 1816 1 6 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.417 0.011 19043 1817 1 6 . 1 1 34 34 LEU CB C 34 42.812 42.812 41.911 0.901 19043 1818 1 6 . 1 1 34 34 LEU H H 34 8.495 8.495 7.753 0.742 19043 1819 1 6 . 1 1 35 35 LYS N N 35 115.859 115.859 119.161 -3.302 19043 1820 1 6 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.104 -0.291 19043 1821 1 6 . 1 1 35 35 LYS C C 35 177.628 177.628 178.125 -0.497 19043 1822 1 6 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.854 -1.977 19043 1823 1 6 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.090 -0.071 19043 1824 1 6 . 1 1 35 35 LYS H H 35 7.815 7.815 7.817 -0.002 19043 1825 1 6 . 1 1 36 36 ASP N N 36 116.741 116.741 116.298 0.443 19043 1826 1 6 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.556 -0.042 19043 1827 1 6 . 1 1 36 36 ASP C C 36 177.324 177.324 176.850 0.474 19043 1828 1 6 . 1 1 36 36 ASP CA C 36 56.686 56.686 56.491 0.195 19043 1829 1 6 . 1 1 36 36 ASP CB C 36 40.671 40.671 41.566 -0.895 19043 1830 1 6 . 1 1 36 36 ASP H H 36 7.943 7.943 7.778 0.165 19043 1831 1 6 . 1 1 37 37 ASP N N 37 116.686 116.686 119.073 -2.387 19043 1832 1 6 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.103 -0.062 19043 1833 1 6 . 1 1 37 37 ASP CA C 37 51.946 51.946 52.230 -0.284 19043 1834 1 6 . 1 1 37 37 ASP CB C 37 40.523 40.523 42.395 -1.872 19043 1835 1 6 . 1 1 37 37 ASP H H 37 8.125 8.125 7.926 0.199 19043 1836 1 6 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.490 0.093 19043 1837 1 6 . 1 1 38 38 PRO C C 38 179.200 179.200 178.523 0.677 19043 1838 1 6 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.645 -0.108 19043 1839 1 6 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.041 -0.155 19043 1840 1 6 . 1 1 39 39 SER N N 39 114.963 114.963 112.310 2.653 19043 1841 1 6 . 1 1 39 39 SER HA H 39 4.178 4.178 4.249 -0.071 19043 1842 1 6 . 1 1 39 39 SER C C 39 176.151 176.151 175.754 0.397 19043 1843 1 6 . 1 1 39 39 SER CA C 39 61.197 61.197 60.471 0.726 19043 1844 1 6 . 1 1 39 39 SER CB C 39 62.729 62.729 62.185 0.544 19043 1845 1 6 . 1 1 39 39 SER H H 39 8.315 8.315 8.416 -0.101 19043 1846 1 6 . 1 1 40 40 GLN N N 40 120.058 120.058 120.474 -0.416 19043 1847 1 6 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.466 0.194 19043 1848 1 6 . 1 1 40 40 GLN C C 40 176.192 176.192 177.214 -1.022 19043 1849 1 6 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.512 -0.531 19043 1850 1 6 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.200 -0.032 19043 1851 1 6 . 1 1 40 40 GLN H H 40 7.820 7.820 7.917 -0.097 19043 1852 1 6 . 1 1 41 41 SER N N 41 115.553 115.553 116.165 -0.612 19043 1853 1 6 . 1 1 41 41 SER HA H 41 3.845 3.845 4.103 -0.258 19043 1854 1 6 . 1 1 41 41 SER C C 41 174.181 174.181 175.468 -1.287 19043 1855 1 6 . 1 1 41 41 SER CA C 41 63.957 63.957 61.101 2.856 19043 1856 1 6 . 1 1 41 41 SER CB C 41 63.191 63.191 62.752 0.440 19043 1857 1 6 . 1 1 41 41 SER H H 41 7.666 7.666 8.024 -0.358 19043 1858 1 6 . 1 1 42 42 ALA N N 42 122.360 122.360 122.132 0.228 19043 1859 1 6 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.245 -0.122 19043 1860 1 6 . 1 1 42 42 ALA C C 42 180.996 180.996 178.913 2.083 19043 1861 1 6 . 1 1 42 42 ALA CA C 42 55.563 55.563 53.726 1.837 19043 1862 1 6 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.251 -1.195 19043 1863 1 6 . 1 1 42 42 ALA H H 42 8.556 8.556 7.978 0.578 19043 1864 1 6 . 1 1 43 43 ASN N N 43 118.974 118.974 118.877 0.097 19043 1865 1 6 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.564 -0.045 19043 1866 1 6 . 1 1 43 43 ASN C C 43 177.972 177.972 177.741 0.231 19043 1867 1 6 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.389 -0.535 19043 1868 1 6 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.403 -0.254 19043 1869 1 6 . 1 1 43 43 ASN H H 43 7.950 7.950 7.613 0.337 19043 1870 1 6 . 1 1 44 44 LEU N N 44 122.070 122.070 120.529 1.541 19043 1871 1 6 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.335 -0.146 19043 1872 1 6 . 1 1 44 44 LEU C C 44 178.332 178.332 179.315 -0.983 19043 1873 1 6 . 1 1 44 44 LEU CA C 44 57.834 57.834 58.017 -0.183 19043 1874 1 6 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.810 0.541 19043 1875 1 6 . 1 1 44 44 LEU H H 44 8.789 8.789 8.486 0.303 19043 1876 1 6 . 1 1 45 45 LEU N N 45 118.621 118.621 119.186 -0.565 19043 1877 1 6 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.738 0.067 19043 1878 1 6 . 1 1 45 45 LEU C C 45 177.832 177.832 178.529 -0.697 19043 1879 1 6 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.704 0.181 19043 1880 1 6 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.591 0.215 19043 1881 1 6 . 1 1 45 45 LEU H H 45 8.283 8.283 7.539 0.744 19043 1882 1 6 . 1 1 46 46 ALA N N 46 119.525 119.525 120.381 -0.856 19043 1883 1 6 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.897 0.113 19043 1884 1 6 . 1 1 46 46 ALA C C 46 181.250 181.250 180.041 1.209 19043 1885 1 6 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.032 0.264 19043 1886 1 6 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.063 -0.112 19043 1887 1 6 . 1 1 46 46 ALA H H 46 7.640 7.640 7.730 -0.090 19043 1888 1 6 . 1 1 47 47 GLU N N 47 119.572 119.572 118.083 1.489 19043 1889 1 6 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.157 -0.127 19043 1890 1 6 . 1 1 47 47 GLU C C 47 178.895 178.895 178.747 0.148 19043 1891 1 6 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.768 0.398 19043 1892 1 6 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.862 -0.324 19043 1893 1 6 . 1 1 47 47 GLU H H 47 8.139 8.139 8.475 -0.336 19043 1894 1 6 . 1 1 48 48 ALA N N 48 123.953 123.953 122.580 1.373 19043 1895 1 6 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.515 0.012 19043 1896 1 6 . 1 1 48 48 ALA C C 48 179.636 179.636 179.168 0.468 19043 1897 1 6 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.218 1.298 19043 1898 1 6 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.732 -0.487 19043 1899 1 6 . 1 1 48 48 ALA H H 48 8.468 8.468 7.691 0.777 19043 1900 1 6 . 1 1 49 49 LYS N N 49 117.926 117.926 118.067 -0.141 19043 1901 1 6 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.934 -0.195 19043 1902 1 6 . 1 1 49 49 LYS C C 49 178.761 178.761 178.383 0.378 19043 1903 1 6 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.418 0.974 19043 1904 1 6 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.354 -0.265 19043 1905 1 6 . 1 1 49 49 LYS H H 49 8.459 8.459 8.346 0.113 19043 1906 1 6 . 1 1 50 50 LYS N N 50 120.194 120.194 120.091 0.103 19043 1907 1 6 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.062 0.026 19043 1908 1 6 . 1 1 50 50 LYS C C 50 179.859 179.859 178.975 0.884 19043 1909 1 6 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.282 0.453 19043 1910 1 6 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.481 -0.019 19043 1911 1 6 . 1 1 50 50 LYS H H 50 7.702 7.702 7.751 -0.049 19043 1912 1 6 . 1 1 51 51 LEU N N 51 122.126 122.126 119.252 2.874 19043 1913 1 6 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.216 -0.089 19043 1914 1 6 . 1 1 51 51 LEU C C 51 178.123 178.123 177.593 0.530 19043 1915 1 6 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.531 1.067 19043 1916 1 6 . 1 1 51 51 LEU CB C 51 42.352 42.352 41.996 0.356 19043 1917 1 6 . 1 1 51 51 LEU H H 51 8.023 8.023 7.556 0.467 19043 1918 1 6 . 1 1 52 52 ASN N N 52 116.675 116.675 117.794 -1.119 19043 1919 1 6 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.357 -0.422 19043 1920 1 6 . 1 1 52 52 ASN C C 52 177.668 177.668 176.351 1.317 19043 1921 1 6 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.366 1.551 19043 1922 1 6 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.509 3.427 19043 1923 1 6 . 1 1 52 52 ASN H H 52 8.537 8.537 8.003 0.534 19043 1924 1 6 . 1 1 53 53 ASP N N 53 118.725 118.725 118.395 0.330 19043 1925 1 6 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.578 -0.134 19043 1926 1 6 . 1 1 53 53 ASP C C 53 178.936 178.936 177.417 1.519 19043 1927 1 6 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.497 1.436 19043 1928 1 6 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.360 -1.265 19043 1929 1 6 . 1 1 53 53 ASP H H 53 8.220 8.220 7.972 0.248 19043 1930 1 6 . 1 1 54 54 ALA N N 54 122.872 122.872 123.152 -0.280 19043 1931 1 6 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.163 0.069 19043 1932 1 6 . 1 1 54 54 ALA C C 54 179.354 179.354 179.149 0.205 19043 1933 1 6 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.354 -0.013 19043 1934 1 6 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.223 -0.618 19043 1935 1 6 . 1 1 54 54 ALA H H 54 8.037 8.037 7.427 0.610 19043 1936 1 6 . 1 1 55 55 GLN N N 55 115.052 115.052 116.305 -1.253 19043 1937 1 6 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.391 -0.013 19043 1938 1 6 . 1 1 55 55 GLN C C 55 174.116 174.116 174.925 -0.809 19043 1939 1 6 . 1 1 55 55 GLN CA C 55 54.954 54.954 54.842 0.112 19043 1940 1 6 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.269 -1.045 19043 1941 1 6 . 1 1 55 55 GLN H H 55 7.512 7.512 7.877 -0.365 19043 1942 1 6 . 1 1 56 56 ALA N N 56 124.556 124.556 124.085 0.471 19043 1943 1 6 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.487 -0.139 19043 1944 1 6 . 1 1 56 56 ALA CA C 56 51.037 51.037 50.982 0.055 19043 1945 1 6 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.721 -0.742 19043 1946 1 6 . 1 1 56 56 ALA H H 56 7.100 7.100 7.125 -0.025 19043 1947 1 6 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.559 -0.147 19043 1948 1 6 . 1 1 57 57 PRO C C 57 176.151 176.151 176.638 -0.487 19043 1949 1 6 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.258 1.024 19043 1950 1 6 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.193 -0.200 19043 1951 1 7 . 1 1 2 2 ASP N N 2 125.357 125.357 125.495 -0.138 19043 1952 1 7 . 1 1 2 2 ASP C C 2 175.535 175.535 174.586 0.949 19043 1953 1 7 . 1 1 2 2 ASP CA C 2 54.307 54.307 53.739 0.568 19043 1954 1 7 . 1 1 2 2 ASP CB C 2 41.470 41.470 42.779 -1.309 19043 1955 1 7 . 1 1 2 2 ASP H H 2 8.762 8.762 8.556 0.206 19043 1956 1 7 . 1 1 3 3 ASN N N 3 120.441 120.441 118.688 1.753 19043 1957 1 7 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.768 -0.068 19043 1958 1 7 . 1 1 3 3 ASN C C 3 175.246 175.246 175.091 0.155 19043 1959 1 7 . 1 1 3 3 ASN CA C 3 53.289 53.289 53.441 -0.152 19043 1960 1 7 . 1 1 3 3 ASN CB C 3 39.086 39.086 39.851 -0.765 19043 1961 1 7 . 1 1 3 3 ASN H H 3 8.548 8.548 8.690 -0.142 19043 1962 1 7 . 1 1 4 4 LYS N N 4 121.461 121.461 119.629 1.832 19043 1963 1 7 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.293 -0.078 19043 1964 1 7 . 1 1 4 4 LYS C C 4 176.404 176.404 176.767 -0.363 19043 1965 1 7 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.235 0.618 19043 1966 1 7 . 1 1 4 4 LYS CB C 4 32.780 32.780 32.822 -0.042 19043 1967 1 7 . 1 1 4 4 LYS H H 4 8.337 8.337 7.937 0.400 19043 1968 1 7 . 1 1 5 5 PHE N N 5 119.538 119.538 119.238 0.300 19043 1969 1 7 . 1 1 5 5 PHE C C 5 175.433 175.433 175.145 0.288 19043 1970 1 7 . 1 1 5 5 PHE CA C 5 57.792 57.792 56.196 1.596 19043 1971 1 7 . 1 1 5 5 PHE CB C 5 40.067 40.067 36.479 3.588 19043 1972 1 7 . 1 1 5 5 PHE H H 5 8.277 8.277 7.816 0.462 19043 1973 1 7 . 1 1 6 6 ASN N N 6 121.168 121.168 120.577 0.591 19043 1974 1 7 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.590 0.227 19043 1975 1 7 . 1 1 6 6 ASN C C 6 175.884 175.884 176.546 -0.662 19043 1976 1 7 . 1 1 6 6 ASN CA C 6 52.785 52.785 54.227 -1.442 19043 1977 1 7 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.405 -0.034 19043 1978 1 7 . 1 1 6 6 ASN H H 6 8.443 8.443 7.524 0.919 19043 1979 1 7 . 1 1 7 7 LYS N N 7 121.688 121.688 121.471 0.217 19043 1980 1 7 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.115 -0.170 19043 1981 1 7 . 1 1 7 7 LYS C C 7 178.196 178.196 178.505 -0.309 19043 1982 1 7 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.484 -0.583 19043 1983 1 7 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.290 -0.165 19043 1984 1 7 . 1 1 7 7 LYS H H 7 8.460 8.460 8.623 -0.163 19043 1985 1 7 . 1 1 8 8 GLU N N 8 119.926 119.926 118.169 1.757 19043 1986 1 7 . 1 1 8 8 GLU HA H 8 4.081 4.081 3.961 0.120 19043 1987 1 7 . 1 1 8 8 GLU C C 8 179.894 179.894 178.811 1.083 19043 1988 1 7 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.717 0.122 19043 1989 1 7 . 1 1 8 8 GLU CB C 8 28.941 28.941 28.957 -0.016 19043 1990 1 7 . 1 1 8 8 GLU H H 8 8.386 8.386 8.837 -0.451 19043 1991 1 7 . 1 1 9 9 GLN N N 9 121.401 121.401 117.666 3.735 19043 1992 1 7 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.122 -0.025 19043 1993 1 7 . 1 1 9 9 GLN C C 9 177.324 177.324 178.281 -0.957 19043 1994 1 7 . 1 1 9 9 GLN CA C 9 59.383 59.383 59.293 0.090 19043 1995 1 7 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.517 0.352 19043 1996 1 7 . 1 1 9 9 GLN H H 9 8.307 8.307 8.595 -0.288 19043 1997 1 7 . 1 1 10 10 GLN N N 10 120.060 120.060 120.356 -0.296 19043 1998 1 7 . 1 1 10 10 GLN HA H 10 3.222 3.222 3.997 -0.775 19043 1999 1 7 . 1 1 10 10 GLN C C 10 176.888 176.888 178.317 -1.429 19043 2000 1 7 . 1 1 10 10 GLN CA C 10 58.949 58.949 59.261 -0.312 19043 2001 1 7 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.631 0.209 19043 2002 1 7 . 1 1 10 10 GLN H H 10 8.040 8.040 7.875 0.165 19043 2003 1 7 . 1 1 11 11 ASN N N 11 116.214 116.214 118.586 -2.372 19043 2004 1 7 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.573 -0.223 19043 2005 1 7 . 1 1 11 11 ASN C C 11 177.828 177.828 177.569 0.259 19043 2006 1 7 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.226 0.031 19043 2007 1 7 . 1 1 11 11 ASN CB C 11 38.210 38.210 37.937 0.273 19043 2008 1 7 . 1 1 11 11 ASN H H 11 8.366 8.366 8.488 -0.122 19043 2009 1 7 . 1 1 12 12 ALA N N 12 121.429 121.429 123.265 -1.836 19043 2010 1 7 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.046 -0.037 19043 2011 1 7 . 1 1 12 12 ALA C C 12 177.850 177.850 179.397 -1.547 19043 2012 1 7 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.855 0.438 19043 2013 1 7 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.428 -0.107 19043 2014 1 7 . 1 1 12 12 ALA H H 12 7.915 7.915 7.900 0.015 19043 2015 1 7 . 1 1 13 13 PHE N N 13 118.052 118.052 119.453 -1.401 19043 2016 1 7 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.965 -0.392 19043 2017 1 7 . 1 1 13 13 PHE C C 13 175.832 175.832 177.311 -1.479 19043 2018 1 7 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.846 0.009 19043 2019 1 7 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.953 -0.036 19043 2020 1 7 . 1 1 13 13 PHE H H 13 8.097 8.097 7.653 0.444 19043 2021 1 7 . 1 1 14 14 TYR N N 14 116.000 116.000 117.115 -1.115 19043 2022 1 7 . 1 1 14 14 TYR HA H 14 3.985 3.985 4.045 -0.060 19043 2023 1 7 . 1 1 14 14 TYR C C 14 178.860 178.860 178.217 0.643 19043 2024 1 7 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.376 -1.581 19043 2025 1 7 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.786 -0.806 19043 2026 1 7 . 1 1 14 14 TYR H H 14 8.040 8.040 7.724 0.316 19043 2027 1 7 . 1 1 15 15 GLU N N 15 118.737 118.737 119.157 -0.420 19043 2028 1 7 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.824 0.147 19043 2029 1 7 . 1 1 15 15 GLU C C 15 180.184 180.184 179.122 1.062 19043 2030 1 7 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.294 1.313 19043 2031 1 7 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.243 0.479 19043 2032 1 7 . 1 1 15 15 GLU H H 15 8.244 8.244 8.415 -0.171 19043 2033 1 7 . 1 1 16 16 ILE N N 16 119.695 119.695 118.453 1.242 19043 2034 1 7 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.765 -0.412 19043 2035 1 7 . 1 1 16 16 ILE C C 16 177.760 177.760 177.429 0.331 19043 2036 1 7 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.241 1.413 19043 2037 1 7 . 1 1 16 16 ILE CB C 16 37.403 37.403 38.053 -0.651 19043 2038 1 7 . 1 1 16 16 ILE H H 16 8.336 8.336 7.446 0.890 19043 2039 1 7 . 1 1 17 17 LEU N N 17 117.709 117.709 119.762 -2.053 19043 2040 1 7 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.969 -0.416 19043 2041 1 7 . 1 1 17 17 LEU C C 17 176.565 176.565 178.112 -1.547 19043 2042 1 7 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.254 0.305 19043 2043 1 7 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.694 0.144 19043 2044 1 7 . 1 1 17 17 LEU H H 17 7.738 7.738 7.654 0.084 19043 2045 1 7 . 1 1 18 18 HIS N N 18 110.934 110.934 116.058 -5.124 19043 2046 1 7 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.330 0.167 19043 2047 1 7 . 1 1 18 18 HIS C C 18 175.243 175.243 175.854 -0.611 19043 2048 1 7 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.384 -1.328 19043 2049 1 7 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.172 0.476 19043 2050 1 7 . 1 1 18 18 HIS H H 18 7.150 7.150 8.073 -0.923 19043 2051 1 7 . 1 1 19 19 LEU N N 19 123.586 123.586 122.023 1.563 19043 2052 1 7 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.307 0.111 19043 2053 1 7 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.836 -0.360 19043 2054 1 7 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.410 -1.088 19043 2055 1 7 . 1 1 19 19 LEU H H 19 7.249 7.249 7.693 -0.444 19043 2056 1 7 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.433 -0.002 19043 2057 1 7 . 1 1 20 20 PRO C C 20 178.092 178.092 177.684 0.408 19043 2058 1 7 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.889 0.008 19043 2059 1 7 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.247 0.325 19043 2060 1 7 . 1 1 21 21 ASN N N 21 113.952 113.952 116.568 -2.616 19043 2061 1 7 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.520 0.489 19043 2062 1 7 . 1 1 21 21 ASN C C 21 176.397 176.397 175.589 0.808 19043 2063 1 7 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.048 -1.419 19043 2064 1 7 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.492 0.318 19043 2065 1 7 . 1 1 21 21 ASN H H 21 8.871 8.871 8.172 0.699 19043 2066 1 7 . 1 1 22 22 LEU N N 22 117.526 117.526 121.947 -4.421 19043 2067 1 7 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.340 0.061 19043 2068 1 7 . 1 1 22 22 LEU C C 22 176.879 176.879 174.980 1.899 19043 2069 1 7 . 1 1 22 22 LEU CA C 22 54.457 54.457 54.774 -0.317 19043 2070 1 7 . 1 1 22 22 LEU CB C 22 42.520 42.520 43.325 -0.805 19043 2071 1 7 . 1 1 22 22 LEU H H 22 6.563 6.563 8.078 -1.515 19043 2072 1 7 . 1 1 23 23 ASN N N 23 120.219 120.219 122.061 -1.842 19043 2073 1 7 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.718 0.150 19043 2074 1 7 . 1 1 23 23 ASN C C 23 175.507 175.507 176.344 -0.837 19043 2075 1 7 . 1 1 23 23 ASN CA C 23 51.416 51.416 52.236 -0.820 19043 2076 1 7 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.523 -0.811 19043 2077 1 7 . 1 1 23 23 ASN H H 23 8.612 8.612 8.318 0.294 19043 2078 1 7 . 1 1 24 24 GLU N N 24 118.801 118.801 120.251 -1.450 19043 2079 1 7 . 1 1 24 24 GLU HA H 24 3.874 3.874 4.059 -0.185 19043 2080 1 7 . 1 1 24 24 GLU C C 24 177.799 177.799 178.415 -0.616 19043 2081 1 7 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.240 -0.049 19043 2082 1 7 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.039 0.326 19043 2083 1 7 . 1 1 24 24 GLU H H 24 8.735 8.735 8.948 -0.213 19043 2084 1 7 . 1 1 25 25 GLU N N 25 119.198 119.198 119.453 -0.255 19043 2085 1 7 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.040 -0.062 19043 2086 1 7 . 1 1 25 25 GLU C C 25 180.078 180.078 178.924 1.154 19043 2087 1 7 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.395 0.496 19043 2088 1 7 . 1 1 25 25 GLU CB C 25 29.131 29.131 28.819 0.312 19043 2089 1 7 . 1 1 25 25 GLU H H 25 8.229 8.229 8.805 -0.576 19043 2090 1 7 . 1 1 26 26 GLN N N 26 119.646 119.646 118.921 0.725 19043 2091 1 7 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.137 -0.197 19043 2092 1 7 . 1 1 26 26 GLN C C 26 178.154 178.154 178.359 -0.205 19043 2093 1 7 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.224 -0.331 19043 2094 1 7 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.636 0.266 19043 2095 1 7 . 1 1 26 26 GLN H H 26 8.425 8.425 8.204 0.221 19043 2096 1 7 . 1 1 27 27 ARG N N 27 119.454 119.454 120.837 -1.383 19043 2097 1 7 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.152 -0.366 19043 2098 1 7 . 1 1 27 27 ARG C C 27 177.863 177.863 178.175 -0.312 19043 2099 1 7 . 1 1 27 27 ARG CA C 27 60.630 60.630 60.163 0.467 19043 2100 1 7 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.212 -0.568 19043 2101 1 7 . 1 1 27 27 ARG H H 27 8.548 8.548 8.469 0.079 19043 2102 1 7 . 1 1 28 28 ASN N N 28 116.833 116.833 117.718 -0.885 19043 2103 1 7 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.459 -0.127 19043 2104 1 7 . 1 1 28 28 ASN C C 28 177.234 177.234 177.346 -0.112 19043 2105 1 7 . 1 1 28 28 ASN CA C 28 56.038 56.038 56.114 -0.076 19043 2106 1 7 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.373 -0.688 19043 2107 1 7 . 1 1 28 28 ASN H H 28 8.569 8.569 8.533 0.036 19043 2108 1 7 . 1 1 29 29 ALA N N 29 122.687 122.687 123.049 -0.362 19043 2109 1 7 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.065 -0.011 19043 2110 1 7 . 1 1 29 29 ALA C C 29 181.045 181.045 179.472 1.573 19043 2111 1 7 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.597 0.653 19043 2112 1 7 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.335 -0.515 19043 2113 1 7 . 1 1 29 29 ALA H H 29 7.793 7.793 7.366 0.427 19043 2114 1 7 . 1 1 30 30 PHE N N 30 116.979 116.979 118.250 -1.271 19043 2115 1 7 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.251 0.127 19043 2116 1 7 . 1 1 30 30 PHE C C 30 177.887 177.887 177.942 -0.055 19043 2117 1 7 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.515 1.104 19043 2118 1 7 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.834 0.625 19043 2119 1 7 . 1 1 30 30 PHE H H 30 8.017 8.017 7.491 0.526 19043 2120 1 7 . 1 1 31 31 ILE N N 31 119.553 119.553 119.167 0.386 19043 2121 1 7 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.629 0.149 19043 2122 1 7 . 1 1 31 31 ILE C C 31 177.084 177.084 178.166 -1.082 19043 2123 1 7 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.213 0.432 19043 2124 1 7 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.550 -0.435 19043 2125 1 7 . 1 1 31 31 ILE H H 31 8.372 8.372 8.615 -0.243 19043 2126 1 7 . 1 1 32 32 GLN N N 32 119.108 119.108 119.396 -0.288 19043 2127 1 7 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.998 -0.192 19043 2128 1 7 . 1 1 32 32 GLN C C 32 177.836 177.836 178.439 -0.603 19043 2129 1 7 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.461 -0.692 19043 2130 1 7 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.701 -0.723 19043 2131 1 7 . 1 1 32 32 GLN H H 32 8.389 8.389 8.075 0.314 19043 2132 1 7 . 1 1 33 33 SER N N 33 114.437 114.437 115.182 -0.745 19043 2133 1 7 . 1 1 33 33 SER HA H 33 4.212 4.212 4.295 -0.083 19043 2134 1 7 . 1 1 33 33 SER C C 33 175.469 175.469 176.867 -1.398 19043 2135 1 7 . 1 1 33 33 SER CA C 33 62.403 62.403 60.463 1.940 19043 2136 1 7 . 1 1 33 33 SER CB C 33 63.794 63.794 62.776 1.018 19043 2137 1 7 . 1 1 33 33 SER H H 33 8.078 8.078 7.796 0.282 19043 2138 1 7 . 1 1 34 34 LEU N N 34 122.967 122.967 122.721 0.246 19043 2139 1 7 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.197 -0.287 19043 2140 1 7 . 1 1 34 34 LEU C C 34 177.506 177.506 178.003 -0.497 19043 2141 1 7 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.344 0.084 19043 2142 1 7 . 1 1 34 34 LEU CB C 34 42.812 42.812 41.776 1.036 19043 2143 1 7 . 1 1 34 34 LEU H H 34 8.495 8.495 8.345 0.150 19043 2144 1 7 . 1 1 35 35 LYS N N 35 115.859 115.859 119.377 -3.518 19043 2145 1 7 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.202 -0.389 19043 2146 1 7 . 1 1 35 35 LYS C C 35 177.628 177.628 178.194 -0.566 19043 2147 1 7 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.563 -1.686 19043 2148 1 7 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.154 -0.135 19043 2149 1 7 . 1 1 35 35 LYS H H 35 7.815 7.815 7.459 0.356 19043 2150 1 7 . 1 1 36 36 ASP N N 36 116.741 116.741 117.926 -1.185 19043 2151 1 7 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.486 0.028 19043 2152 1 7 . 1 1 36 36 ASP C C 36 177.324 177.324 176.203 1.121 19043 2153 1 7 . 1 1 36 36 ASP CA C 36 56.686 56.686 56.031 0.655 19043 2154 1 7 . 1 1 36 36 ASP CB C 36 40.671 40.671 41.723 -1.052 19043 2155 1 7 . 1 1 36 36 ASP H H 36 7.943 7.943 7.828 0.115 19043 2156 1 7 . 1 1 37 37 ASP N N 37 116.686 116.686 118.731 -2.045 19043 2157 1 7 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.036 0.005 19043 2158 1 7 . 1 1 37 37 ASP CA C 37 51.946 51.946 52.102 -0.156 19043 2159 1 7 . 1 1 37 37 ASP CB C 37 40.523 40.523 41.965 -1.442 19043 2160 1 7 . 1 1 37 37 ASP H H 37 8.125 8.125 8.007 0.118 19043 2161 1 7 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.546 0.037 19043 2162 1 7 . 1 1 38 38 PRO C C 38 179.200 179.200 178.253 0.947 19043 2163 1 7 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.632 -0.094 19043 2164 1 7 . 1 1 38 38 PRO CB C 38 31.886 31.886 31.996 -0.110 19043 2165 1 7 . 1 1 39 39 SER N N 39 114.963 114.963 113.536 1.427 19043 2166 1 7 . 1 1 39 39 SER HA H 39 4.178 4.178 4.241 -0.063 19043 2167 1 7 . 1 1 39 39 SER C C 39 176.151 176.151 175.888 0.263 19043 2168 1 7 . 1 1 39 39 SER CA C 39 61.197 61.197 60.761 0.436 19043 2169 1 7 . 1 1 39 39 SER CB C 39 62.729 62.729 61.936 0.793 19043 2170 1 7 . 1 1 39 39 SER H H 39 8.315 8.315 8.530 -0.215 19043 2171 1 7 . 1 1 40 40 GLN N N 40 120.058 120.058 120.448 -0.390 19043 2172 1 7 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.513 0.147 19043 2173 1 7 . 1 1 40 40 GLN C C 40 176.192 176.192 177.360 -1.168 19043 2174 1 7 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.834 -0.854 19043 2175 1 7 . 1 1 40 40 GLN CB C 40 28.168 28.168 27.703 0.465 19043 2176 1 7 . 1 1 40 40 GLN H H 40 7.820 7.820 7.888 -0.068 19043 2177 1 7 . 1 1 41 41 SER N N 41 115.553 115.553 116.626 -1.073 19043 2178 1 7 . 1 1 41 41 SER HA H 41 3.845 3.845 4.117 -0.272 19043 2179 1 7 . 1 1 41 41 SER C C 41 174.181 174.181 175.351 -1.170 19043 2180 1 7 . 1 1 41 41 SER CA C 41 63.957 63.957 61.422 2.535 19043 2181 1 7 . 1 1 41 41 SER CB C 41 63.191 63.191 62.181 1.010 19043 2182 1 7 . 1 1 41 41 SER H H 41 7.666 7.666 7.696 -0.030 19043 2183 1 7 . 1 1 42 42 ALA N N 42 122.360 122.360 122.848 -0.488 19043 2184 1 7 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.194 -0.071 19043 2185 1 7 . 1 1 42 42 ALA C C 42 180.996 180.996 178.848 2.148 19043 2186 1 7 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.217 1.346 19043 2187 1 7 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.227 -1.171 19043 2188 1 7 . 1 1 42 42 ALA H H 42 8.556 8.556 7.684 0.872 19043 2189 1 7 . 1 1 43 43 ASN N N 43 118.974 118.974 118.766 0.208 19043 2190 1 7 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.513 0.006 19043 2191 1 7 . 1 1 43 43 ASN C C 43 177.972 177.972 177.813 0.159 19043 2192 1 7 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.503 -0.649 19043 2193 1 7 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.232 -0.083 19043 2194 1 7 . 1 1 43 43 ASN H H 43 7.950 7.950 7.459 0.491 19043 2195 1 7 . 1 1 44 44 LEU N N 44 122.070 122.070 120.515 1.555 19043 2196 1 7 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.353 -0.164 19043 2197 1 7 . 1 1 44 44 LEU C C 44 178.332 178.332 179.356 -1.024 19043 2198 1 7 . 1 1 44 44 LEU CA C 44 57.834 57.834 57.965 -0.131 19043 2199 1 7 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.803 0.548 19043 2200 1 7 . 1 1 44 44 LEU H H 44 8.789 8.789 8.573 0.216 19043 2201 1 7 . 1 1 45 45 LEU N N 45 118.621 118.621 119.273 -0.652 19043 2202 1 7 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.715 0.090 19043 2203 1 7 . 1 1 45 45 LEU C C 45 177.832 177.832 178.486 -0.654 19043 2204 1 7 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.720 0.165 19043 2205 1 7 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.580 0.226 19043 2206 1 7 . 1 1 45 45 LEU H H 45 8.283 8.283 7.537 0.746 19043 2207 1 7 . 1 1 46 46 ALA N N 46 119.525 119.525 120.508 -0.983 19043 2208 1 7 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.899 0.111 19043 2209 1 7 . 1 1 46 46 ALA C C 46 181.250 181.250 179.967 1.283 19043 2210 1 7 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.068 0.228 19043 2211 1 7 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.047 -0.096 19043 2212 1 7 . 1 1 46 46 ALA H H 46 7.640 7.640 7.808 -0.168 19043 2213 1 7 . 1 1 47 47 GLU N N 47 119.572 119.572 118.258 1.314 19043 2214 1 7 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.120 -0.090 19043 2215 1 7 . 1 1 47 47 GLU C C 47 178.895 178.895 178.816 0.079 19043 2216 1 7 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.896 0.270 19043 2217 1 7 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.845 -0.307 19043 2218 1 7 . 1 1 47 47 GLU H H 47 8.139 8.139 8.407 -0.268 19043 2219 1 7 . 1 1 48 48 ALA N N 48 123.953 123.953 122.568 1.385 19043 2220 1 7 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.745 -0.218 19043 2221 1 7 . 1 1 48 48 ALA C C 48 179.636 179.636 179.143 0.493 19043 2222 1 7 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.407 1.109 19043 2223 1 7 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.746 -0.501 19043 2224 1 7 . 1 1 48 48 ALA H H 48 8.468 8.468 7.707 0.761 19043 2225 1 7 . 1 1 49 49 LYS N N 49 117.926 117.926 118.265 -0.339 19043 2226 1 7 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.924 -0.185 19043 2227 1 7 . 1 1 49 49 LYS C C 49 178.761 178.761 178.694 0.067 19043 2228 1 7 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.606 0.786 19043 2229 1 7 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.334 -0.245 19043 2230 1 7 . 1 1 49 49 LYS H H 49 8.459 8.459 8.367 0.092 19043 2231 1 7 . 1 1 50 50 LYS N N 50 120.194 120.194 119.541 0.653 19043 2232 1 7 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.075 0.013 19043 2233 1 7 . 1 1 50 50 LYS C C 50 179.859 179.859 178.897 0.962 19043 2234 1 7 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.093 0.642 19043 2235 1 7 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.545 -0.083 19043 2236 1 7 . 1 1 50 50 LYS H H 50 7.702 7.702 7.741 -0.039 19043 2237 1 7 . 1 1 51 51 LEU N N 51 122.126 122.126 119.616 2.510 19043 2238 1 7 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.195 -0.068 19043 2239 1 7 . 1 1 51 51 LEU C C 51 178.123 178.123 178.124 -0.001 19043 2240 1 7 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.968 0.629 19043 2241 1 7 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.033 0.319 19043 2242 1 7 . 1 1 51 51 LEU H H 51 8.023 8.023 7.558 0.465 19043 2243 1 7 . 1 1 52 52 ASN N N 52 116.675 116.675 116.706 -0.031 19043 2244 1 7 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.369 -0.434 19043 2245 1 7 . 1 1 52 52 ASN C C 52 177.668 177.668 176.363 1.305 19043 2246 1 7 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.170 1.747 19043 2247 1 7 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.686 3.250 19043 2248 1 7 . 1 1 52 52 ASN H H 52 8.537 8.537 8.323 0.214 19043 2249 1 7 . 1 1 53 53 ASP N N 53 118.725 118.725 117.023 1.702 19043 2250 1 7 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.578 -0.134 19043 2251 1 7 . 1 1 53 53 ASP C C 53 178.936 178.936 177.078 1.858 19043 2252 1 7 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.083 1.850 19043 2253 1 7 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.393 -1.298 19043 2254 1 7 . 1 1 53 53 ASP H H 53 8.220 8.220 7.624 0.596 19043 2255 1 7 . 1 1 54 54 ALA N N 54 122.872 122.872 121.654 1.218 19043 2256 1 7 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.128 0.104 19043 2257 1 7 . 1 1 54 54 ALA C C 54 179.354 179.354 179.166 0.188 19043 2258 1 7 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.290 0.051 19043 2259 1 7 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.245 -0.640 19043 2260 1 7 . 1 1 54 54 ALA H H 54 8.037 8.037 7.534 0.503 19043 2261 1 7 . 1 1 55 55 GLN N N 55 115.052 115.052 116.338 -1.286 19043 2262 1 7 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.315 0.063 19043 2263 1 7 . 1 1 55 55 GLN C C 55 174.116 174.116 175.126 -1.010 19043 2264 1 7 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.034 -0.080 19043 2265 1 7 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.261 -1.037 19043 2266 1 7 . 1 1 55 55 GLN H H 55 7.512 7.512 7.766 -0.254 19043 2267 1 7 . 1 1 56 56 ALA N N 56 124.556 124.556 124.063 0.493 19043 2268 1 7 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.350 -0.002 19043 2269 1 7 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.017 0.020 19043 2270 1 7 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.586 -0.607 19043 2271 1 7 . 1 1 56 56 ALA H H 56 7.100 7.100 7.707 -0.607 19043 2272 1 7 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.503 -0.091 19043 2273 1 7 . 1 1 57 57 PRO C C 57 176.151 176.151 176.832 -0.681 19043 2274 1 7 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.360 0.923 19043 2275 1 7 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.218 -0.225 19043 2276 1 8 . 1 1 2 2 ASP N N 2 125.357 125.357 119.881 5.476 19043 2277 1 8 . 1 1 2 2 ASP C C 2 175.535 175.535 175.065 0.470 19043 2278 1 8 . 1 1 2 2 ASP CA C 2 54.307 54.307 53.497 0.810 19043 2279 1 8 . 1 1 2 2 ASP CB C 2 41.470 41.470 41.207 0.263 19043 2280 1 8 . 1 1 2 2 ASP H H 2 8.762 8.762 8.559 0.203 19043 2281 1 8 . 1 1 3 3 ASN N N 3 120.441 120.441 117.480 2.961 19043 2282 1 8 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.600 0.100 19043 2283 1 8 . 1 1 3 3 ASN C C 3 175.246 175.246 175.611 -0.365 19043 2284 1 8 . 1 1 3 3 ASN CA C 3 53.289 53.289 53.177 0.112 19043 2285 1 8 . 1 1 3 3 ASN CB C 3 39.086 39.086 38.297 0.789 19043 2286 1 8 . 1 1 3 3 ASN H H 3 8.548 8.548 8.291 0.257 19043 2287 1 8 . 1 1 4 4 LYS N N 4 121.461 121.461 119.856 1.605 19043 2288 1 8 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.274 -0.059 19043 2289 1 8 . 1 1 4 4 LYS C C 4 176.404 176.404 174.780 1.624 19043 2290 1 8 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.161 0.692 19043 2291 1 8 . 1 1 4 4 LYS CB C 4 32.780 32.780 32.788 -0.009 19043 2292 1 8 . 1 1 4 4 LYS H H 4 8.337 8.337 8.251 0.086 19043 2293 1 8 . 1 1 5 5 PHE N N 5 119.538 119.538 118.215 1.323 19043 2294 1 8 . 1 1 5 5 PHE C C 5 175.433 175.433 174.080 1.353 19043 2295 1 8 . 1 1 5 5 PHE CA C 5 57.792 57.792 56.172 1.619 19043 2296 1 8 . 1 1 5 5 PHE CB C 5 40.067 40.067 38.536 1.531 19043 2297 1 8 . 1 1 5 5 PHE H H 5 8.277 8.277 7.635 0.642 19043 2298 1 8 . 1 1 6 6 ASN N N 6 121.168 121.168 122.015 -0.847 19043 2299 1 8 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.850 -0.033 19043 2300 1 8 . 1 1 6 6 ASN C C 6 175.884 175.884 176.906 -1.022 19043 2301 1 8 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.272 -0.487 19043 2302 1 8 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.283 0.087 19043 2303 1 8 . 1 1 6 6 ASN H H 6 8.443 8.443 8.095 0.348 19043 2304 1 8 . 1 1 7 7 LYS N N 7 121.688 121.688 121.283 0.405 19043 2305 1 8 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.123 -0.178 19043 2306 1 8 . 1 1 7 7 LYS C C 7 178.196 178.196 178.414 -0.218 19043 2307 1 8 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.383 -0.482 19043 2308 1 8 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.351 -0.226 19043 2309 1 8 . 1 1 7 7 LYS H H 7 8.460 8.460 8.604 -0.144 19043 2310 1 8 . 1 1 8 8 GLU N N 8 119.926 119.926 118.477 1.449 19043 2311 1 8 . 1 1 8 8 GLU HA H 8 4.081 4.081 4.094 -0.013 19043 2312 1 8 . 1 1 8 8 GLU C C 8 179.894 179.894 179.148 0.746 19043 2313 1 8 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.698 0.141 19043 2314 1 8 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.072 -0.131 19043 2315 1 8 . 1 1 8 8 GLU H H 8 8.386 8.386 8.821 -0.435 19043 2316 1 8 . 1 1 9 9 GLN N N 9 121.401 121.401 117.407 3.994 19043 2317 1 8 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.148 -0.051 19043 2318 1 8 . 1 1 9 9 GLN C C 9 177.324 177.324 178.195 -0.871 19043 2319 1 8 . 1 1 9 9 GLN CA C 9 59.383 59.383 58.883 0.499 19043 2320 1 8 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.522 0.347 19043 2321 1 8 . 1 1 9 9 GLN H H 9 8.307 8.307 8.639 -0.332 19043 2322 1 8 . 1 1 10 10 GLN N N 10 120.060 120.060 120.083 -0.023 19043 2323 1 8 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.021 -0.799 19043 2324 1 8 . 1 1 10 10 GLN C C 10 176.888 176.888 178.367 -1.479 19043 2325 1 8 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.828 0.121 19043 2326 1 8 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.593 0.248 19043 2327 1 8 . 1 1 10 10 GLN H H 10 8.040 8.040 7.864 0.176 19043 2328 1 8 . 1 1 11 11 ASN N N 11 116.214 116.214 118.733 -2.519 19043 2329 1 8 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.621 -0.271 19043 2330 1 8 . 1 1 11 11 ASN C C 11 177.828 177.828 177.307 0.521 19043 2331 1 8 . 1 1 11 11 ASN CA C 11 56.257 56.257 55.896 0.361 19043 2332 1 8 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.155 0.055 19043 2333 1 8 . 1 1 11 11 ASN H H 11 8.366 8.366 8.407 -0.041 19043 2334 1 8 . 1 1 12 12 ALA N N 12 121.429 121.429 123.519 -2.090 19043 2335 1 8 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.036 -0.027 19043 2336 1 8 . 1 1 12 12 ALA C C 12 177.850 177.850 179.096 -1.246 19043 2337 1 8 . 1 1 12 12 ALA CA C 12 55.293 55.293 55.191 0.102 19043 2338 1 8 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.502 -0.181 19043 2339 1 8 . 1 1 12 12 ALA H H 12 7.915 7.915 8.051 -0.136 19043 2340 1 8 . 1 1 13 13 PHE N N 13 118.052 118.052 120.007 -1.955 19043 2341 1 8 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.993 -0.420 19043 2342 1 8 . 1 1 13 13 PHE C C 13 175.832 175.832 177.265 -1.433 19043 2343 1 8 . 1 1 13 13 PHE CA C 13 61.855 61.855 62.228 -0.373 19043 2344 1 8 . 1 1 13 13 PHE CB C 13 38.917 38.917 39.046 -0.129 19043 2345 1 8 . 1 1 13 13 PHE H H 13 8.097 8.097 7.734 0.363 19043 2346 1 8 . 1 1 14 14 TYR N N 14 116.000 116.000 117.203 -1.203 19043 2347 1 8 . 1 1 14 14 TYR HA H 14 3.985 3.985 4.134 -0.149 19043 2348 1 8 . 1 1 14 14 TYR C C 14 178.860 178.860 178.373 0.487 19043 2349 1 8 . 1 1 14 14 TYR CA C 14 59.795 59.795 60.581 -0.786 19043 2350 1 8 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.804 -0.824 19043 2351 1 8 . 1 1 14 14 TYR H H 14 8.040 8.040 7.672 0.368 19043 2352 1 8 . 1 1 15 15 GLU N N 15 118.737 118.737 118.905 -0.168 19043 2353 1 8 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.924 0.047 19043 2354 1 8 . 1 1 15 15 GLU C C 15 180.184 180.184 179.378 0.806 19043 2355 1 8 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.204 1.403 19043 2356 1 8 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.012 0.710 19043 2357 1 8 . 1 1 15 15 GLU H H 15 8.244 8.244 8.426 -0.182 19043 2358 1 8 . 1 1 16 16 ILE N N 16 119.695 119.695 119.688 0.007 19043 2359 1 8 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.680 -0.327 19043 2360 1 8 . 1 1 16 16 ILE C C 16 177.760 177.760 177.537 0.223 19043 2361 1 8 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.585 1.069 19043 2362 1 8 . 1 1 16 16 ILE CB C 16 37.403 37.403 37.811 -0.408 19043 2363 1 8 . 1 1 16 16 ILE H H 16 8.336 8.336 7.792 0.544 19043 2364 1 8 . 1 1 17 17 LEU N N 17 117.709 117.709 120.047 -2.338 19043 2365 1 8 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.858 -0.305 19043 2366 1 8 . 1 1 17 17 LEU C C 17 176.565 176.565 178.417 -1.852 19043 2367 1 8 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.461 0.098 19043 2368 1 8 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.126 0.712 19043 2369 1 8 . 1 1 17 17 LEU H H 17 7.738 7.738 7.592 0.146 19043 2370 1 8 . 1 1 18 18 HIS N N 18 110.934 110.934 114.557 -3.623 19043 2371 1 8 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.340 0.157 19043 2372 1 8 . 1 1 18 18 HIS C C 18 175.243 175.243 176.221 -0.978 19043 2373 1 8 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.075 -1.019 19043 2374 1 8 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.376 0.272 19043 2375 1 8 . 1 1 18 18 HIS H H 18 7.150 7.150 8.259 -1.109 19043 2376 1 8 . 1 1 19 19 LEU N N 19 123.586 123.586 122.165 1.421 19043 2377 1 8 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.256 0.162 19043 2378 1 8 . 1 1 19 19 LEU CA C 19 53.476 53.476 54.054 -0.578 19043 2379 1 8 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.363 -1.041 19043 2380 1 8 . 1 1 19 19 LEU H H 19 7.249 7.249 7.615 -0.366 19043 2381 1 8 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.438 -0.007 19043 2382 1 8 . 1 1 20 20 PRO C C 20 178.092 178.092 177.914 0.178 19043 2383 1 8 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.868 0.030 19043 2384 1 8 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.188 0.384 19043 2385 1 8 . 1 1 21 21 ASN N N 21 113.952 113.952 116.963 -3.011 19043 2386 1 8 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.486 0.523 19043 2387 1 8 . 1 1 21 21 ASN C C 21 176.397 176.397 175.783 0.614 19043 2388 1 8 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.083 -1.454 19043 2389 1 8 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.425 0.385 19043 2390 1 8 . 1 1 21 21 ASN H H 21 8.871 8.871 8.184 0.687 19043 2391 1 8 . 1 1 22 22 LEU N N 22 117.526 117.526 122.346 -4.820 19043 2392 1 8 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.341 0.060 19043 2393 1 8 . 1 1 22 22 LEU C C 22 176.879 176.879 174.950 1.929 19043 2394 1 8 . 1 1 22 22 LEU CA C 22 54.457 54.457 55.127 -0.670 19043 2395 1 8 . 1 1 22 22 LEU CB C 22 42.520 42.520 43.336 -0.816 19043 2396 1 8 . 1 1 22 22 LEU H H 22 6.563 6.563 8.259 -1.696 19043 2397 1 8 . 1 1 23 23 ASN N N 23 120.219 120.219 122.551 -2.332 19043 2398 1 8 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.716 0.152 19043 2399 1 8 . 1 1 23 23 ASN C C 23 175.507 175.507 176.593 -1.086 19043 2400 1 8 . 1 1 23 23 ASN CA C 23 51.416 51.416 51.948 -0.532 19043 2401 1 8 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.285 -0.573 19043 2402 1 8 . 1 1 23 23 ASN H H 23 8.612 8.612 8.245 0.367 19043 2403 1 8 . 1 1 24 24 GLU N N 24 118.801 118.801 119.820 -1.019 19043 2404 1 8 . 1 1 24 24 GLU HA H 24 3.874 3.874 3.932 -0.058 19043 2405 1 8 . 1 1 24 24 GLU C C 24 177.799 177.799 178.477 -0.678 19043 2406 1 8 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.213 -0.022 19043 2407 1 8 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.341 0.024 19043 2408 1 8 . 1 1 24 24 GLU H H 24 8.735 8.735 8.906 -0.171 19043 2409 1 8 . 1 1 25 25 GLU N N 25 119.198 119.198 119.345 -0.147 19043 2410 1 8 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.009 -0.031 19043 2411 1 8 . 1 1 25 25 GLU C C 25 180.078 180.078 179.197 0.881 19043 2412 1 8 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.471 0.420 19043 2413 1 8 . 1 1 25 25 GLU CB C 25 29.131 29.131 29.263 -0.132 19043 2414 1 8 . 1 1 25 25 GLU H H 25 8.229 8.229 8.526 -0.297 19043 2415 1 8 . 1 1 26 26 GLN N N 26 119.646 119.646 118.279 1.367 19043 2416 1 8 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.055 -0.115 19043 2417 1 8 . 1 1 26 26 GLN C C 26 178.154 178.154 178.469 -0.315 19043 2418 1 8 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.624 -0.731 19043 2419 1 8 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.884 0.018 19043 2420 1 8 . 1 1 26 26 GLN H H 26 8.425 8.425 8.707 -0.282 19043 2421 1 8 . 1 1 27 27 ARG N N 27 119.454 119.454 120.260 -0.806 19043 2422 1 8 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.145 -0.359 19043 2423 1 8 . 1 1 27 27 ARG C C 27 177.863 177.863 178.533 -0.670 19043 2424 1 8 . 1 1 27 27 ARG CA C 27 60.630 60.630 59.660 0.970 19043 2425 1 8 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.052 -0.408 19043 2426 1 8 . 1 1 27 27 ARG H H 27 8.548 8.548 8.393 0.155 19043 2427 1 8 . 1 1 28 28 ASN N N 28 116.833 116.833 117.603 -0.770 19043 2428 1 8 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.522 -0.190 19043 2429 1 8 . 1 1 28 28 ASN C C 28 177.234 177.234 177.226 0.008 19043 2430 1 8 . 1 1 28 28 ASN CA C 28 56.038 56.038 55.952 0.086 19043 2431 1 8 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.419 -0.734 19043 2432 1 8 . 1 1 28 28 ASN H H 28 8.569 8.569 8.365 0.204 19043 2433 1 8 . 1 1 29 29 ALA N N 29 122.687 122.687 123.628 -0.941 19043 2434 1 8 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.041 0.013 19043 2435 1 8 . 1 1 29 29 ALA C C 29 181.045 181.045 179.400 1.645 19043 2436 1 8 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.631 0.619 19043 2437 1 8 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.243 -0.423 19043 2438 1 8 . 1 1 29 29 ALA H H 29 7.793 7.793 7.601 0.192 19043 2439 1 8 . 1 1 30 30 PHE N N 30 116.979 116.979 117.565 -0.586 19043 2440 1 8 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.216 0.162 19043 2441 1 8 . 1 1 30 30 PHE C C 30 177.887 177.887 178.025 -0.138 19043 2442 1 8 . 1 1 30 30 PHE CA C 30 62.619 62.619 62.084 0.534 19043 2443 1 8 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.750 0.709 19043 2444 1 8 . 1 1 30 30 PHE H H 30 8.017 8.017 7.740 0.277 19043 2445 1 8 . 1 1 31 31 ILE N N 31 119.553 119.553 119.137 0.416 19043 2446 1 8 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.682 0.096 19043 2447 1 8 . 1 1 31 31 ILE C C 31 177.084 177.084 178.210 -1.126 19043 2448 1 8 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.149 0.496 19043 2449 1 8 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.565 -0.450 19043 2450 1 8 . 1 1 31 31 ILE H H 31 8.372 8.372 8.374 -0.002 19043 2451 1 8 . 1 1 32 32 GLN N N 32 119.108 119.108 120.049 -0.941 19043 2452 1 8 . 1 1 32 32 GLN HA H 32 3.806 3.806 4.035 -0.229 19043 2453 1 8 . 1 1 32 32 GLN C C 32 177.836 177.836 178.587 -0.751 19043 2454 1 8 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.545 -0.777 19043 2455 1 8 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.796 -0.818 19043 2456 1 8 . 1 1 32 32 GLN H H 32 8.389 8.389 8.125 0.264 19043 2457 1 8 . 1 1 33 33 SER N N 33 114.437 114.437 116.512 -2.075 19043 2458 1 8 . 1 1 33 33 SER HA H 33 4.212 4.212 4.199 0.013 19043 2459 1 8 . 1 1 33 33 SER C C 33 175.469 175.469 176.736 -1.267 19043 2460 1 8 . 1 1 33 33 SER CA C 33 62.403 62.403 62.102 0.301 19043 2461 1 8 . 1 1 33 33 SER CB C 33 63.794 63.794 63.036 0.758 19043 2462 1 8 . 1 1 33 33 SER H H 33 8.078 8.078 7.988 0.090 19043 2463 1 8 . 1 1 34 34 LEU N N 34 122.967 122.967 123.104 -0.137 19043 2464 1 8 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.092 -0.182 19043 2465 1 8 . 1 1 34 34 LEU C C 34 177.506 177.506 178.098 -0.592 19043 2466 1 8 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.620 -0.192 19043 2467 1 8 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.177 0.635 19043 2468 1 8 . 1 1 34 34 LEU H H 34 8.495 8.495 8.505 -0.010 19043 2469 1 8 . 1 1 35 35 LYS N N 35 115.859 115.859 117.930 -2.071 19043 2470 1 8 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.212 -0.399 19043 2471 1 8 . 1 1 35 35 LYS C C 35 177.628 177.628 178.132 -0.504 19043 2472 1 8 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.376 -1.499 19043 2473 1 8 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.105 -0.085 19043 2474 1 8 . 1 1 35 35 LYS H H 35 7.815 7.815 7.585 0.230 19043 2475 1 8 . 1 1 36 36 ASP N N 36 116.741 116.741 117.721 -0.980 19043 2476 1 8 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.583 -0.069 19043 2477 1 8 . 1 1 36 36 ASP C C 36 177.324 177.324 175.850 1.474 19043 2478 1 8 . 1 1 36 36 ASP CA C 36 56.686 56.686 55.380 1.306 19043 2479 1 8 . 1 1 36 36 ASP CB C 36 40.671 40.671 42.106 -1.435 19043 2480 1 8 . 1 1 36 36 ASP H H 36 7.943 7.943 7.669 0.274 19043 2481 1 8 . 1 1 37 37 ASP N N 37 116.686 116.686 117.531 -0.845 19043 2482 1 8 . 1 1 37 37 ASP HA H 37 5.041 5.041 4.922 0.119 19043 2483 1 8 . 1 1 37 37 ASP CA C 37 51.946 51.946 52.053 -0.107 19043 2484 1 8 . 1 1 37 37 ASP CB C 37 40.523 40.523 41.894 -1.371 19043 2485 1 8 . 1 1 37 37 ASP H H 37 8.125 8.125 7.941 0.184 19043 2486 1 8 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.563 0.020 19043 2487 1 8 . 1 1 38 38 PRO C C 38 179.200 179.200 177.934 1.266 19043 2488 1 8 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.344 0.193 19043 2489 1 8 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.243 -0.357 19043 2490 1 8 . 1 1 39 39 SER N N 39 114.963 114.963 113.825 1.138 19043 2491 1 8 . 1 1 39 39 SER HA H 39 4.178 4.178 4.263 -0.085 19043 2492 1 8 . 1 1 39 39 SER C C 39 176.151 176.151 176.511 -0.360 19043 2493 1 8 . 1 1 39 39 SER CA C 39 61.197 61.197 60.444 0.753 19043 2494 1 8 . 1 1 39 39 SER CB C 39 62.729 62.729 62.680 0.049 19043 2495 1 8 . 1 1 39 39 SER H H 39 8.315 8.315 7.892 0.423 19043 2496 1 8 . 1 1 40 40 GLN N N 40 120.058 120.058 119.796 0.262 19043 2497 1 8 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.477 0.183 19043 2498 1 8 . 1 1 40 40 GLN C C 40 176.192 176.192 177.240 -1.048 19043 2499 1 8 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.561 -0.580 19043 2500 1 8 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.122 0.046 19043 2501 1 8 . 1 1 40 40 GLN H H 40 7.820 7.820 7.873 -0.053 19043 2502 1 8 . 1 1 41 41 SER N N 41 115.553 115.553 116.744 -1.191 19043 2503 1 8 . 1 1 41 41 SER HA H 41 3.845 3.845 4.099 -0.254 19043 2504 1 8 . 1 1 41 41 SER C C 41 174.181 174.181 175.614 -1.433 19043 2505 1 8 . 1 1 41 41 SER CA C 41 63.957 63.957 61.938 2.019 19043 2506 1 8 . 1 1 41 41 SER CB C 41 63.191 63.191 62.345 0.846 19043 2507 1 8 . 1 1 41 41 SER H H 41 7.666 7.666 7.730 -0.064 19043 2508 1 8 . 1 1 42 42 ALA N N 42 122.360 122.360 122.752 -0.392 19043 2509 1 8 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.219 -0.096 19043 2510 1 8 . 1 1 42 42 ALA C C 42 180.996 180.996 178.939 2.057 19043 2511 1 8 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.060 1.503 19043 2512 1 8 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.115 -1.059 19043 2513 1 8 . 1 1 42 42 ALA H H 42 8.556 8.556 7.915 0.641 19043 2514 1 8 . 1 1 43 43 ASN N N 43 118.974 118.974 118.871 0.103 19043 2515 1 8 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.560 -0.041 19043 2516 1 8 . 1 1 43 43 ASN C C 43 177.972 177.972 177.761 0.211 19043 2517 1 8 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.393 -0.539 19043 2518 1 8 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.411 -0.262 19043 2519 1 8 . 1 1 43 43 ASN H H 43 7.950 7.950 7.643 0.307 19043 2520 1 8 . 1 1 44 44 LEU N N 44 122.070 122.070 120.649 1.421 19043 2521 1 8 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.419 -0.230 19043 2522 1 8 . 1 1 44 44 LEU C C 44 178.332 178.332 179.439 -1.107 19043 2523 1 8 . 1 1 44 44 LEU CA C 44 57.834 57.834 57.993 -0.160 19043 2524 1 8 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.819 0.533 19043 2525 1 8 . 1 1 44 44 LEU H H 44 8.789 8.789 8.658 0.131 19043 2526 1 8 . 1 1 45 45 LEU N N 45 118.621 118.621 119.396 -0.775 19043 2527 1 8 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.775 0.030 19043 2528 1 8 . 1 1 45 45 LEU C C 45 177.832 177.832 178.483 -0.651 19043 2529 1 8 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.693 0.192 19043 2530 1 8 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.578 0.229 19043 2531 1 8 . 1 1 45 45 LEU H H 45 8.283 8.283 7.547 0.736 19043 2532 1 8 . 1 1 46 46 ALA N N 46 119.525 119.525 120.736 -1.211 19043 2533 1 8 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.885 0.125 19043 2534 1 8 . 1 1 46 46 ALA C C 46 181.250 181.250 179.896 1.354 19043 2535 1 8 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.171 0.125 19043 2536 1 8 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.031 -0.080 19043 2537 1 8 . 1 1 46 46 ALA H H 46 7.640 7.640 7.714 -0.074 19043 2538 1 8 . 1 1 47 47 GLU N N 47 119.572 119.572 118.401 1.171 19043 2539 1 8 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.084 -0.054 19043 2540 1 8 . 1 1 47 47 GLU C C 47 178.895 178.895 178.977 -0.082 19043 2541 1 8 . 1 1 47 47 GLU CA C 47 59.166 59.166 59.016 0.150 19043 2542 1 8 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.843 -0.305 19043 2543 1 8 . 1 1 47 47 GLU H H 47 8.139 8.139 8.348 -0.209 19043 2544 1 8 . 1 1 48 48 ALA N N 48 123.953 123.953 122.400 1.553 19043 2545 1 8 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.555 -0.028 19043 2546 1 8 . 1 1 48 48 ALA C C 48 179.636 179.636 179.152 0.484 19043 2547 1 8 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.447 1.069 19043 2548 1 8 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.649 -0.404 19043 2549 1 8 . 1 1 48 48 ALA H H 48 8.468 8.468 7.815 0.653 19043 2550 1 8 . 1 1 49 49 LYS N N 49 117.926 117.926 118.083 -0.157 19043 2551 1 8 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.908 -0.169 19043 2552 1 8 . 1 1 49 49 LYS C C 49 178.761 178.761 179.124 -0.363 19043 2553 1 8 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.670 0.722 19043 2554 1 8 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.309 -0.220 19043 2555 1 8 . 1 1 49 49 LYS H H 49 8.459 8.459 8.280 0.179 19043 2556 1 8 . 1 1 50 50 LYS N N 50 120.194 120.194 118.609 1.585 19043 2557 1 8 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.064 0.024 19043 2558 1 8 . 1 1 50 50 LYS C C 50 179.859 179.859 178.682 1.177 19043 2559 1 8 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.003 0.732 19043 2560 1 8 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.380 0.082 19043 2561 1 8 . 1 1 50 50 LYS H H 50 7.702 7.702 7.833 -0.131 19043 2562 1 8 . 1 1 51 51 LEU N N 51 122.126 122.126 119.756 2.370 19043 2563 1 8 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.250 -0.123 19043 2564 1 8 . 1 1 51 51 LEU C C 51 178.123 178.123 177.846 0.277 19043 2565 1 8 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.472 1.125 19043 2566 1 8 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.270 0.083 19043 2567 1 8 . 1 1 51 51 LEU H H 51 8.023 8.023 7.526 0.497 19043 2568 1 8 . 1 1 52 52 ASN N N 52 116.675 116.675 117.521 -0.846 19043 2569 1 8 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.381 -0.446 19043 2570 1 8 . 1 1 52 52 ASN C C 52 177.668 177.668 176.863 0.805 19043 2571 1 8 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.348 1.569 19043 2572 1 8 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.567 3.369 19043 2573 1 8 . 1 1 52 52 ASN H H 52 8.537 8.537 8.361 0.176 19043 2574 1 8 . 1 1 53 53 ASP N N 53 118.725 118.725 118.080 0.645 19043 2575 1 8 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.570 -0.126 19043 2576 1 8 . 1 1 53 53 ASP C C 53 178.936 178.936 177.155 1.781 19043 2577 1 8 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.518 1.415 19043 2578 1 8 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.163 -1.068 19043 2579 1 8 . 1 1 53 53 ASP H H 53 8.220 8.220 7.826 0.394 19043 2580 1 8 . 1 1 54 54 ALA N N 54 122.872 122.872 121.510 1.362 19043 2581 1 8 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.244 -0.012 19043 2582 1 8 . 1 1 54 54 ALA C C 54 179.354 179.354 178.915 0.439 19043 2583 1 8 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.086 0.255 19043 2584 1 8 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.038 -0.433 19043 2585 1 8 . 1 1 54 54 ALA H H 54 8.037 8.037 7.642 0.395 19043 2586 1 8 . 1 1 55 55 GLN N N 55 115.052 115.052 115.728 -0.676 19043 2587 1 8 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.308 0.070 19043 2588 1 8 . 1 1 55 55 GLN C C 55 174.116 174.116 175.428 -1.312 19043 2589 1 8 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.126 -0.172 19043 2590 1 8 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.723 -1.498 19043 2591 1 8 . 1 1 55 55 GLN H H 55 7.512 7.512 7.793 -0.281 19043 2592 1 8 . 1 1 56 56 ALA N N 56 124.556 124.556 123.656 0.900 19043 2593 1 8 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.283 0.065 19043 2594 1 8 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.076 -0.039 19043 2595 1 8 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.516 -0.537 19043 2596 1 8 . 1 1 56 56 ALA H H 56 7.100 7.100 7.373 -0.273 19043 2597 1 8 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.264 0.148 19043 2598 1 8 . 1 1 57 57 PRO C C 57 176.151 176.151 176.613 -0.462 19043 2599 1 8 . 1 1 57 57 PRO CA C 57 63.283 63.283 63.948 -0.665 19043 2600 1 8 . 1 1 57 57 PRO CB C 57 31.993 31.993 31.901 0.092 19043 2601 1 9 . 1 1 2 2 ASP N N 2 125.357 125.357 123.025 2.332 19043 2602 1 9 . 1 1 2 2 ASP C C 2 175.535 175.535 176.188 -0.653 19043 2603 1 9 . 1 1 2 2 ASP CA C 2 54.307 54.307 54.348 -0.041 19043 2604 1 9 . 1 1 2 2 ASP CB C 2 41.470 41.470 40.172 1.298 19043 2605 1 9 . 1 1 2 2 ASP H H 2 8.762 8.762 8.633 0.129 19043 2606 1 9 . 1 1 3 3 ASN N N 3 120.441 120.441 116.909 3.532 19043 2607 1 9 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.144 0.556 19043 2608 1 9 . 1 1 3 3 ASN C C 3 175.246 175.246 175.469 -0.223 19043 2609 1 9 . 1 1 3 3 ASN CA C 3 53.289 53.289 53.751 -0.462 19043 2610 1 9 . 1 1 3 3 ASN CB C 3 39.086 39.086 37.871 1.215 19043 2611 1 9 . 1 1 3 3 ASN H H 3 8.548 8.548 8.069 0.479 19043 2612 1 9 . 1 1 4 4 LYS N N 4 121.461 121.461 118.860 2.601 19043 2613 1 9 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.081 0.134 19043 2614 1 9 . 1 1 4 4 LYS C C 4 176.404 176.404 176.850 -0.446 19043 2615 1 9 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.403 0.450 19043 2616 1 9 . 1 1 4 4 LYS CB C 4 32.780 32.780 31.928 0.852 19043 2617 1 9 . 1 1 4 4 LYS H H 4 8.337 8.337 7.761 0.576 19043 2618 1 9 . 1 1 5 5 PHE N N 5 119.538 119.538 115.680 3.858 19043 2619 1 9 . 1 1 5 5 PHE C C 5 175.433 175.433 175.013 0.420 19043 2620 1 9 . 1 1 5 5 PHE CA C 5 57.792 57.792 58.306 -0.514 19043 2621 1 9 . 1 1 5 5 PHE CB C 5 40.067 40.067 35.693 4.374 19043 2622 1 9 . 1 1 5 5 PHE H H 5 8.277 8.277 7.272 1.005 19043 2623 1 9 . 1 1 6 6 ASN N N 6 121.168 121.168 120.117 1.051 19043 2624 1 9 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.597 0.220 19043 2625 1 9 . 1 1 6 6 ASN C C 6 175.884 175.884 176.347 -0.463 19043 2626 1 9 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.366 -0.581 19043 2627 1 9 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.237 0.134 19043 2628 1 9 . 1 1 6 6 ASN H H 6 8.443 8.443 8.057 0.386 19043 2629 1 9 . 1 1 7 7 LYS N N 7 121.688 121.688 120.947 0.741 19043 2630 1 9 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.103 -0.158 19043 2631 1 9 . 1 1 7 7 LYS C C 7 178.196 178.196 178.510 -0.314 19043 2632 1 9 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.379 -0.478 19043 2633 1 9 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.319 -0.194 19043 2634 1 9 . 1 1 7 7 LYS H H 7 8.460 8.460 8.560 -0.100 19043 2635 1 9 . 1 1 8 8 GLU N N 8 119.926 119.926 118.374 1.552 19043 2636 1 9 . 1 1 8 8 GLU HA H 8 4.081 4.081 3.966 0.115 19043 2637 1 9 . 1 1 8 8 GLU C C 8 179.894 179.894 178.841 1.053 19043 2638 1 9 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.721 0.118 19043 2639 1 9 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.027 -0.086 19043 2640 1 9 . 1 1 8 8 GLU H H 8 8.386 8.386 8.859 -0.473 19043 2641 1 9 . 1 1 9 9 GLN N N 9 121.401 121.401 118.051 3.350 19043 2642 1 9 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.090 0.007 19043 2643 1 9 . 1 1 9 9 GLN C C 9 177.324 177.324 178.252 -0.928 19043 2644 1 9 . 1 1 9 9 GLN CA C 9 59.383 59.383 59.072 0.311 19043 2645 1 9 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.484 0.385 19043 2646 1 9 . 1 1 9 9 GLN H H 9 8.307 8.307 8.705 -0.398 19043 2647 1 9 . 1 1 10 10 GLN N N 10 120.060 120.060 119.761 0.299 19043 2648 1 9 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.038 -0.816 19043 2649 1 9 . 1 1 10 10 GLN C C 10 176.888 176.888 178.361 -1.473 19043 2650 1 9 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.992 -0.043 19043 2651 1 9 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.637 0.204 19043 2652 1 9 . 1 1 10 10 GLN H H 10 8.040 8.040 7.887 0.153 19043 2653 1 9 . 1 1 11 11 ASN N N 11 116.214 116.214 118.974 -2.760 19043 2654 1 9 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.590 -0.240 19043 2655 1 9 . 1 1 11 11 ASN C C 11 177.828 177.828 177.572 0.256 19043 2656 1 9 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.074 0.183 19043 2657 1 9 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.017 0.193 19043 2658 1 9 . 1 1 11 11 ASN H H 11 8.366 8.366 8.445 -0.079 19043 2659 1 9 . 1 1 12 12 ALA N N 12 121.429 121.429 123.324 -1.895 19043 2660 1 9 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.044 -0.035 19043 2661 1 9 . 1 1 12 12 ALA C C 12 177.850 177.850 179.180 -1.330 19043 2662 1 9 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.937 0.356 19043 2663 1 9 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.413 -0.092 19043 2664 1 9 . 1 1 12 12 ALA H H 12 7.915 7.915 8.137 -0.222 19043 2665 1 9 . 1 1 13 13 PHE N N 13 118.052 118.052 119.508 -1.456 19043 2666 1 9 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.948 -0.375 19043 2667 1 9 . 1 1 13 13 PHE C C 13 175.832 175.832 177.217 -1.385 19043 2668 1 9 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.836 0.019 19043 2669 1 9 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.908 0.009 19043 2670 1 9 . 1 1 13 13 PHE H H 13 8.097 8.097 7.530 0.567 19043 2671 1 9 . 1 1 14 14 TYR N N 14 116.000 116.000 117.729 -1.729 19043 2672 1 9 . 1 1 14 14 TYR HA H 14 3.985 3.985 3.881 0.104 19043 2673 1 9 . 1 1 14 14 TYR C C 14 178.860 178.860 178.192 0.668 19043 2674 1 9 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.406 -1.611 19043 2675 1 9 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.526 -0.546 19043 2676 1 9 . 1 1 14 14 TYR H H 14 8.040 8.040 7.674 0.366 19043 2677 1 9 . 1 1 15 15 GLU N N 15 118.737 118.737 118.739 -0.002 19043 2678 1 9 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.759 0.212 19043 2679 1 9 . 1 1 15 15 GLU C C 15 180.184 180.184 179.022 1.162 19043 2680 1 9 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.058 1.549 19043 2681 1 9 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.363 0.359 19043 2682 1 9 . 1 1 15 15 GLU H H 15 8.244 8.244 8.130 0.114 19043 2683 1 9 . 1 1 16 16 ILE N N 16 119.695 119.695 118.166 1.529 19043 2684 1 9 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.701 -0.348 19043 2685 1 9 . 1 1 16 16 ILE C C 16 177.760 177.760 177.089 0.671 19043 2686 1 9 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.246 1.408 19043 2687 1 9 . 1 1 16 16 ILE CB C 16 37.403 37.403 38.033 -0.630 19043 2688 1 9 . 1 1 16 16 ILE H H 16 8.336 8.336 7.547 0.789 19043 2689 1 9 . 1 1 17 17 LEU N N 17 117.709 117.709 118.908 -1.199 19043 2690 1 9 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.927 -0.374 19043 2691 1 9 . 1 1 17 17 LEU C C 17 176.565 176.565 178.409 -1.844 19043 2692 1 9 . 1 1 17 17 LEU CA C 17 57.559 57.559 56.754 0.805 19043 2693 1 9 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.500 0.338 19043 2694 1 9 . 1 1 17 17 LEU H H 17 7.738 7.738 7.424 0.314 19043 2695 1 9 . 1 1 18 18 HIS N N 18 110.934 110.934 116.762 -5.828 19043 2696 1 9 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.388 0.109 19043 2697 1 9 . 1 1 18 18 HIS C C 18 175.243 175.243 175.597 -0.354 19043 2698 1 9 . 1 1 18 18 HIS CA C 18 56.056 56.056 56.350 -0.294 19043 2699 1 9 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.356 0.292 19043 2700 1 9 . 1 1 18 18 HIS H H 18 7.150 7.150 7.590 -0.440 19043 2701 1 9 . 1 1 19 19 LEU N N 19 123.586 123.586 123.012 0.574 19043 2702 1 9 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.294 0.124 19043 2703 1 9 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.870 -0.394 19043 2704 1 9 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.603 -1.281 19043 2705 1 9 . 1 1 19 19 LEU H H 19 7.249 7.249 7.718 -0.469 19043 2706 1 9 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.458 -0.027 19043 2707 1 9 . 1 1 20 20 PRO C C 20 178.092 178.092 177.585 0.507 19043 2708 1 9 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.588 0.309 19043 2709 1 9 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.326 0.246 19043 2710 1 9 . 1 1 21 21 ASN N N 21 113.952 113.952 116.545 -2.593 19043 2711 1 9 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.512 0.497 19043 2712 1 9 . 1 1 21 21 ASN C C 21 176.397 176.397 175.749 0.648 19043 2713 1 9 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.018 -1.389 19043 2714 1 9 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.342 0.468 19043 2715 1 9 . 1 1 21 21 ASN H H 21 8.871 8.871 8.060 0.811 19043 2716 1 9 . 1 1 22 22 LEU N N 22 117.526 117.526 121.652 -4.126 19043 2717 1 9 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.298 0.103 19043 2718 1 9 . 1 1 22 22 LEU C C 22 176.879 176.879 175.793 1.086 19043 2719 1 9 . 1 1 22 22 LEU CA C 22 54.457 54.457 55.023 -0.565 19043 2720 1 9 . 1 1 22 22 LEU CB C 22 42.520 42.520 42.917 -0.397 19043 2721 1 9 . 1 1 22 22 LEU H H 22 6.563 6.563 7.980 -1.417 19043 2722 1 9 . 1 1 23 23 ASN N N 23 120.219 120.219 121.412 -1.193 19043 2723 1 9 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.791 0.077 19043 2724 1 9 . 1 1 23 23 ASN C C 23 175.507 175.507 176.419 -0.912 19043 2725 1 9 . 1 1 23 23 ASN CA C 23 51.416 51.416 51.851 -0.435 19043 2726 1 9 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.366 -0.654 19043 2727 1 9 . 1 1 23 23 ASN H H 23 8.612 8.612 8.440 0.172 19043 2728 1 9 . 1 1 24 24 GLU N N 24 118.801 118.801 121.931 -3.130 19043 2729 1 9 . 1 1 24 24 GLU HA H 24 3.874 3.874 3.973 -0.099 19043 2730 1 9 . 1 1 24 24 GLU C C 24 177.799 177.799 178.217 -0.418 19043 2731 1 9 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.344 -0.153 19043 2732 1 9 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.373 -0.008 19043 2733 1 9 . 1 1 24 24 GLU H H 24 8.735 8.735 8.995 -0.260 19043 2734 1 9 . 1 1 25 25 GLU N N 25 119.198 119.198 119.121 0.077 19043 2735 1 9 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.033 -0.055 19043 2736 1 9 . 1 1 25 25 GLU C C 25 180.078 180.078 179.173 0.905 19043 2737 1 9 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.395 0.496 19043 2738 1 9 . 1 1 25 25 GLU CB C 25 29.131 29.131 29.117 0.014 19043 2739 1 9 . 1 1 25 25 GLU H H 25 8.229 8.229 8.699 -0.470 19043 2740 1 9 . 1 1 26 26 GLN N N 26 119.646 119.646 117.915 1.731 19043 2741 1 9 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.052 -0.112 19043 2742 1 9 . 1 1 26 26 GLN C C 26 178.154 178.154 178.448 -0.294 19043 2743 1 9 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.248 -0.355 19043 2744 1 9 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.371 0.531 19043 2745 1 9 . 1 1 26 26 GLN H H 26 8.425 8.425 7.625 0.800 19043 2746 1 9 . 1 1 27 27 ARG N N 27 119.454 119.454 120.632 -1.178 19043 2747 1 9 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.254 -0.468 19043 2748 1 9 . 1 1 27 27 ARG C C 27 177.863 177.863 178.444 -0.581 19043 2749 1 9 . 1 1 27 27 ARG CA C 27 60.630 60.630 59.665 0.965 19043 2750 1 9 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.124 -0.480 19043 2751 1 9 . 1 1 27 27 ARG H H 27 8.548 8.548 8.443 0.105 19043 2752 1 9 . 1 1 28 28 ASN N N 28 116.833 116.833 117.525 -0.692 19043 2753 1 9 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.503 -0.171 19043 2754 1 9 . 1 1 28 28 ASN C C 28 177.234 177.234 177.297 -0.063 19043 2755 1 9 . 1 1 28 28 ASN CA C 28 56.038 56.038 55.915 0.123 19043 2756 1 9 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.416 -0.731 19043 2757 1 9 . 1 1 28 28 ASN H H 28 8.569 8.569 8.363 0.206 19043 2758 1 9 . 1 1 29 29 ALA N N 29 122.687 122.687 123.082 -0.395 19043 2759 1 9 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.041 0.013 19043 2760 1 9 . 1 1 29 29 ALA C C 29 181.045 181.045 179.201 1.844 19043 2761 1 9 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.587 0.663 19043 2762 1 9 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.161 -0.341 19043 2763 1 9 . 1 1 29 29 ALA H H 29 7.793 7.793 7.620 0.173 19043 2764 1 9 . 1 1 30 30 PHE N N 30 116.979 116.979 118.494 -1.515 19043 2765 1 9 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.245 0.133 19043 2766 1 9 . 1 1 30 30 PHE C C 30 177.887 177.887 177.845 0.042 19043 2767 1 9 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.587 1.032 19043 2768 1 9 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.852 0.607 19043 2769 1 9 . 1 1 30 30 PHE H H 30 8.017 8.017 7.524 0.493 19043 2770 1 9 . 1 1 31 31 ILE N N 31 119.553 119.553 118.915 0.638 19043 2771 1 9 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.628 0.150 19043 2772 1 9 . 1 1 31 31 ILE C C 31 177.084 177.084 178.141 -1.057 19043 2773 1 9 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.344 0.301 19043 2774 1 9 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.492 -0.377 19043 2775 1 9 . 1 1 31 31 ILE H H 31 8.372 8.372 8.537 -0.165 19043 2776 1 9 . 1 1 32 32 GLN N N 32 119.108 119.108 119.617 -0.509 19043 2777 1 9 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.997 -0.191 19043 2778 1 9 . 1 1 32 32 GLN C C 32 177.836 177.836 178.516 -0.680 19043 2779 1 9 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.526 -0.758 19043 2780 1 9 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.655 -0.677 19043 2781 1 9 . 1 1 32 32 GLN H H 32 8.389 8.389 7.952 0.437 19043 2782 1 9 . 1 1 33 33 SER N N 33 114.437 114.437 115.273 -0.836 19043 2783 1 9 . 1 1 33 33 SER HA H 33 4.212 4.212 4.302 -0.090 19043 2784 1 9 . 1 1 33 33 SER C C 33 175.469 175.469 176.831 -1.362 19043 2785 1 9 . 1 1 33 33 SER CA C 33 62.403 62.403 60.870 1.534 19043 2786 1 9 . 1 1 33 33 SER CB C 33 63.794 63.794 63.211 0.583 19043 2787 1 9 . 1 1 33 33 SER H H 33 8.078 8.078 7.695 0.383 19043 2788 1 9 . 1 1 34 34 LEU N N 34 122.967 122.967 123.758 -0.791 19043 2789 1 9 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.240 -0.330 19043 2790 1 9 . 1 1 34 34 LEU C C 34 177.506 177.506 178.069 -0.563 19043 2791 1 9 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.438 -0.010 19043 2792 1 9 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.237 0.575 19043 2793 1 9 . 1 1 34 34 LEU H H 34 8.495 8.495 8.305 0.190 19043 2794 1 9 . 1 1 35 35 LYS N N 35 115.859 115.859 119.319 -3.460 19043 2795 1 9 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.123 -0.310 19043 2796 1 9 . 1 1 35 35 LYS C C 35 177.628 177.628 178.145 -0.517 19043 2797 1 9 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.905 -2.028 19043 2798 1 9 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.269 -0.250 19043 2799 1 9 . 1 1 35 35 LYS H H 35 7.815 7.815 7.757 0.058 19043 2800 1 9 . 1 1 36 36 ASP N N 36 116.741 116.741 117.332 -0.591 19043 2801 1 9 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.603 -0.089 19043 2802 1 9 . 1 1 36 36 ASP C C 36 177.324 177.324 176.681 0.643 19043 2803 1 9 . 1 1 36 36 ASP CA C 36 56.686 56.686 55.903 0.783 19043 2804 1 9 . 1 1 36 36 ASP CB C 36 40.671 40.671 41.907 -1.236 19043 2805 1 9 . 1 1 36 36 ASP H H 36 7.943 7.943 7.673 0.270 19043 2806 1 9 . 1 1 37 37 ASP N N 37 116.686 116.686 117.072 -0.386 19043 2807 1 9 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.051 -0.010 19043 2808 1 9 . 1 1 37 37 ASP CA C 37 51.946 51.946 51.800 0.146 19043 2809 1 9 . 1 1 37 37 ASP CB C 37 40.523 40.523 41.609 -1.086 19043 2810 1 9 . 1 1 37 37 ASP H H 37 8.125 8.125 7.778 0.347 19043 2811 1 9 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.495 0.088 19043 2812 1 9 . 1 1 38 38 PRO C C 38 179.200 179.200 178.408 0.792 19043 2813 1 9 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.342 0.195 19043 2814 1 9 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.091 -0.205 19043 2815 1 9 . 1 1 39 39 SER N N 39 114.963 114.963 114.135 0.828 19043 2816 1 9 . 1 1 39 39 SER HA H 39 4.178 4.178 4.257 -0.079 19043 2817 1 9 . 1 1 39 39 SER C C 39 176.151 176.151 175.903 0.248 19043 2818 1 9 . 1 1 39 39 SER CA C 39 61.197 61.197 60.991 0.206 19043 2819 1 9 . 1 1 39 39 SER CB C 39 62.729 62.729 62.685 0.044 19043 2820 1 9 . 1 1 39 39 SER H H 39 8.315 8.315 8.416 -0.101 19043 2821 1 9 . 1 1 40 40 GLN N N 40 120.058 120.058 119.431 0.627 19043 2822 1 9 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.478 0.182 19043 2823 1 9 . 1 1 40 40 GLN C C 40 176.192 176.192 177.170 -0.978 19043 2824 1 9 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.470 -0.489 19043 2825 1 9 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.086 0.082 19043 2826 1 9 . 1 1 40 40 GLN H H 40 7.820 7.820 7.822 -0.002 19043 2827 1 9 . 1 1 41 41 SER N N 41 115.553 115.553 116.627 -1.074 19043 2828 1 9 . 1 1 41 41 SER HA H 41 3.845 3.845 4.130 -0.285 19043 2829 1 9 . 1 1 41 41 SER C C 41 174.181 174.181 175.309 -1.128 19043 2830 1 9 . 1 1 41 41 SER CA C 41 63.957 63.957 61.433 2.524 19043 2831 1 9 . 1 1 41 41 SER CB C 41 63.191 63.191 62.210 0.981 19043 2832 1 9 . 1 1 41 41 SER H H 41 7.666 7.666 7.831 -0.165 19043 2833 1 9 . 1 1 42 42 ALA N N 42 122.360 122.360 122.407 -0.047 19043 2834 1 9 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.217 -0.094 19043 2835 1 9 . 1 1 42 42 ALA C C 42 180.996 180.996 178.759 2.237 19043 2836 1 9 . 1 1 42 42 ALA CA C 42 55.563 55.563 53.938 1.625 19043 2837 1 9 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.263 -1.207 19043 2838 1 9 . 1 1 42 42 ALA H H 42 8.556 8.556 7.845 0.711 19043 2839 1 9 . 1 1 43 43 ASN N N 43 118.974 118.974 118.882 0.092 19043 2840 1 9 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.578 -0.059 19043 2841 1 9 . 1 1 43 43 ASN C C 43 177.972 177.972 177.700 0.272 19043 2842 1 9 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.325 -0.471 19043 2843 1 9 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.454 -0.305 19043 2844 1 9 . 1 1 43 43 ASN H H 43 7.950 7.950 7.719 0.231 19043 2845 1 9 . 1 1 44 44 LEU N N 44 122.070 122.070 120.478 1.592 19043 2846 1 9 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.184 0.005 19043 2847 1 9 . 1 1 44 44 LEU C C 44 178.332 178.332 179.047 -0.715 19043 2848 1 9 . 1 1 44 44 LEU CA C 44 57.834 57.834 58.076 -0.242 19043 2849 1 9 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.800 0.551 19043 2850 1 9 . 1 1 44 44 LEU H H 44 8.789 8.789 8.543 0.246 19043 2851 1 9 . 1 1 45 45 LEU N N 45 118.621 118.621 119.190 -0.569 19043 2852 1 9 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.747 0.058 19043 2853 1 9 . 1 1 45 45 LEU C C 45 177.832 177.832 178.448 -0.616 19043 2854 1 9 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.667 0.218 19043 2855 1 9 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.570 0.236 19043 2856 1 9 . 1 1 45 45 LEU H H 45 8.283 8.283 7.556 0.727 19043 2857 1 9 . 1 1 46 46 ALA N N 46 119.525 119.525 120.781 -1.256 19043 2858 1 9 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.899 0.111 19043 2859 1 9 . 1 1 46 46 ALA C C 46 181.250 181.250 180.107 1.143 19043 2860 1 9 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.282 0.014 19043 2861 1 9 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.046 -0.094 19043 2862 1 9 . 1 1 46 46 ALA H H 46 7.640 7.640 7.713 -0.073 19043 2863 1 9 . 1 1 47 47 GLU N N 47 119.572 119.572 117.727 1.845 19043 2864 1 9 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.175 -0.145 19043 2865 1 9 . 1 1 47 47 GLU C C 47 178.895 178.895 178.918 -0.023 19043 2866 1 9 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.832 0.334 19043 2867 1 9 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.638 -0.100 19043 2868 1 9 . 1 1 47 47 GLU H H 47 8.139 8.139 8.391 -0.252 19043 2869 1 9 . 1 1 48 48 ALA N N 48 123.953 123.953 122.671 1.282 19043 2870 1 9 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.667 -0.140 19043 2871 1 9 . 1 1 48 48 ALA C C 48 179.636 179.636 179.429 0.207 19043 2872 1 9 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.646 0.870 19043 2873 1 9 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.703 -0.458 19043 2874 1 9 . 1 1 48 48 ALA H H 48 8.468 8.468 7.825 0.643 19043 2875 1 9 . 1 1 49 49 LYS N N 49 117.926 117.926 117.824 0.102 19043 2876 1 9 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.951 -0.212 19043 2877 1 9 . 1 1 49 49 LYS C C 49 178.761 178.761 178.663 0.098 19043 2878 1 9 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.414 0.978 19043 2879 1 9 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.361 -0.272 19043 2880 1 9 . 1 1 49 49 LYS H H 49 8.459 8.459 8.336 0.123 19043 2881 1 9 . 1 1 50 50 LYS N N 50 120.194 120.194 119.878 0.316 19043 2882 1 9 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.081 0.007 19043 2883 1 9 . 1 1 50 50 LYS C C 50 179.859 179.859 178.543 1.316 19043 2884 1 9 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.054 0.681 19043 2885 1 9 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.562 -0.100 19043 2886 1 9 . 1 1 50 50 LYS H H 50 7.702 7.702 7.602 0.100 19043 2887 1 9 . 1 1 51 51 LEU N N 51 122.126 122.126 119.204 2.922 19043 2888 1 9 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.255 -0.128 19043 2889 1 9 . 1 1 51 51 LEU C C 51 178.123 178.123 177.881 0.242 19043 2890 1 9 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.700 0.897 19043 2891 1 9 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.288 0.064 19043 2892 1 9 . 1 1 51 51 LEU H H 51 8.023 8.023 7.694 0.329 19043 2893 1 9 . 1 1 52 52 ASN N N 52 116.675 116.675 117.222 -0.547 19043 2894 1 9 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.404 -0.469 19043 2895 1 9 . 1 1 52 52 ASN C C 52 177.668 177.668 176.750 0.918 19043 2896 1 9 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.198 1.719 19043 2897 1 9 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.559 3.377 19043 2898 1 9 . 1 1 52 52 ASN H H 52 8.537 8.537 8.208 0.329 19043 2899 1 9 . 1 1 53 53 ASP N N 53 118.725 118.725 117.779 0.946 19043 2900 1 9 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.603 -0.159 19043 2901 1 9 . 1 1 53 53 ASP C C 53 178.936 178.936 176.928 2.008 19043 2902 1 9 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.172 1.761 19043 2903 1 9 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.235 -1.140 19043 2904 1 9 . 1 1 53 53 ASP H H 53 8.220 8.220 7.790 0.430 19043 2905 1 9 . 1 1 54 54 ALA N N 54 122.872 122.872 121.828 1.044 19043 2906 1 9 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.250 -0.018 19043 2907 1 9 . 1 1 54 54 ALA C C 54 179.354 179.354 178.908 0.446 19043 2908 1 9 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.023 0.318 19043 2909 1 9 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.214 -0.609 19043 2910 1 9 . 1 1 54 54 ALA H H 54 8.037 8.037 7.235 0.802 19043 2911 1 9 . 1 1 55 55 GLN N N 55 115.052 115.052 116.557 -1.505 19043 2912 1 9 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.327 0.051 19043 2913 1 9 . 1 1 55 55 GLN C C 55 174.116 174.116 175.402 -1.286 19043 2914 1 9 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.157 -0.203 19043 2915 1 9 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.318 -1.094 19043 2916 1 9 . 1 1 55 55 GLN H H 55 7.512 7.512 7.911 -0.399 19043 2917 1 9 . 1 1 56 56 ALA N N 56 124.556 124.556 124.070 0.486 19043 2918 1 9 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.305 0.043 19043 2919 1 9 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.022 0.015 19043 2920 1 9 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.448 -0.469 19043 2921 1 9 . 1 1 56 56 ALA H H 56 7.100 7.100 7.368 -0.268 19043 2922 1 9 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.414 -0.002 19043 2923 1 9 . 1 1 57 57 PRO C C 57 176.151 176.151 176.784 -0.633 19043 2924 1 9 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.317 0.966 19043 2925 1 9 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.069 -0.076 19043 2926 1 10 . 1 1 2 2 ASP N N 2 125.357 125.357 120.996 4.361 19043 2927 1 10 . 1 1 2 2 ASP C C 2 175.535 175.535 175.489 0.046 19043 2928 1 10 . 1 1 2 2 ASP CA C 2 54.307 54.307 53.377 0.930 19043 2929 1 10 . 1 1 2 2 ASP CB C 2 41.470 41.470 40.113 1.357 19043 2930 1 10 . 1 1 2 2 ASP H H 2 8.762 8.762 8.133 0.629 19043 2931 1 10 . 1 1 3 3 ASN N N 3 120.441 120.441 116.620 3.821 19043 2932 1 10 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.014 0.686 19043 2933 1 10 . 1 1 3 3 ASN C C 3 175.246 175.246 174.633 0.613 19043 2934 1 10 . 1 1 3 3 ASN CA C 3 53.289 53.289 54.033 -0.744 19043 2935 1 10 . 1 1 3 3 ASN CB C 3 39.086 39.086 37.480 1.606 19043 2936 1 10 . 1 1 3 3 ASN H H 3 8.548 8.548 7.751 0.797 19043 2937 1 10 . 1 1 4 4 LYS N N 4 121.461 121.461 117.573 3.888 19043 2938 1 10 . 1 1 4 4 LYS HA H 4 4.215 4.215 3.973 0.242 19043 2939 1 10 . 1 1 4 4 LYS C C 4 176.404 176.404 176.579 -0.175 19043 2940 1 10 . 1 1 4 4 LYS CA C 4 56.853 56.853 57.409 -0.556 19043 2941 1 10 . 1 1 4 4 LYS CB C 4 32.780 32.780 32.108 0.672 19043 2942 1 10 . 1 1 4 4 LYS H H 4 8.337 8.337 7.850 0.487 19043 2943 1 10 . 1 1 5 5 PHE N N 5 119.538 119.538 114.557 4.981 19043 2944 1 10 . 1 1 5 5 PHE C C 5 175.433 175.433 174.917 0.516 19043 2945 1 10 . 1 1 5 5 PHE CA C 5 57.792 57.792 58.239 -0.447 19043 2946 1 10 . 1 1 5 5 PHE CB C 5 40.067 40.067 36.145 3.922 19043 2947 1 10 . 1 1 5 5 PHE H H 5 8.277 8.277 7.414 0.863 19043 2948 1 10 . 1 1 6 6 ASN N N 6 121.168 121.168 119.971 1.197 19043 2949 1 10 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.715 0.102 19043 2950 1 10 . 1 1 6 6 ASN C C 6 175.884 175.884 176.378 -0.494 19043 2951 1 10 . 1 1 6 6 ASN CA C 6 52.785 52.785 52.841 -0.056 19043 2952 1 10 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.233 0.138 19043 2953 1 10 . 1 1 6 6 ASN H H 6 8.443 8.443 8.142 0.301 19043 2954 1 10 . 1 1 7 7 LYS N N 7 121.688 121.688 121.538 0.150 19043 2955 1 10 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.137 -0.192 19043 2956 1 10 . 1 1 7 7 LYS C C 7 178.196 178.196 178.410 -0.214 19043 2957 1 10 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.370 -0.469 19043 2958 1 10 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.360 -0.235 19043 2959 1 10 . 1 1 7 7 LYS H H 7 8.460 8.460 8.616 -0.156 19043 2960 1 10 . 1 1 8 8 GLU N N 8 119.926 119.926 118.763 1.163 19043 2961 1 10 . 1 1 8 8 GLU HA H 8 4.081 4.081 4.062 0.019 19043 2962 1 10 . 1 1 8 8 GLU C C 8 179.894 179.894 179.019 0.875 19043 2963 1 10 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.817 0.022 19043 2964 1 10 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.152 -0.211 19043 2965 1 10 . 1 1 8 8 GLU H H 8 8.386 8.386 8.769 -0.383 19043 2966 1 10 . 1 1 9 9 GLN N N 9 121.401 121.401 117.962 3.439 19043 2967 1 10 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.076 0.021 19043 2968 1 10 . 1 1 9 9 GLN C C 9 177.324 177.324 178.344 -1.020 19043 2969 1 10 . 1 1 9 9 GLN CA C 9 59.383 59.383 59.119 0.264 19043 2970 1 10 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.447 0.422 19043 2971 1 10 . 1 1 9 9 GLN H H 9 8.307 8.307 8.743 -0.436 19043 2972 1 10 . 1 1 10 10 GLN N N 10 120.060 120.060 119.462 0.598 19043 2973 1 10 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.056 -0.834 19043 2974 1 10 . 1 1 10 10 GLN C C 10 176.888 176.888 178.368 -1.480 19043 2975 1 10 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.886 0.063 19043 2976 1 10 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.634 0.207 19043 2977 1 10 . 1 1 10 10 GLN H H 10 8.040 8.040 7.810 0.230 19043 2978 1 10 . 1 1 11 11 ASN N N 11 116.214 116.214 119.082 -2.868 19043 2979 1 10 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.600 -0.250 19043 2980 1 10 . 1 1 11 11 ASN C C 11 177.828 177.828 177.464 0.364 19043 2981 1 10 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.086 0.171 19043 2982 1 10 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.106 0.104 19043 2983 1 10 . 1 1 11 11 ASN H H 11 8.366 8.366 8.444 -0.078 19043 2984 1 10 . 1 1 12 12 ALA N N 12 121.429 121.429 122.683 -1.254 19043 2985 1 10 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.018 -0.009 19043 2986 1 10 . 1 1 12 12 ALA C C 12 177.850 177.850 179.066 -1.216 19043 2987 1 10 . 1 1 12 12 ALA CA C 12 55.293 55.293 55.038 0.255 19043 2988 1 10 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.425 -0.104 19043 2989 1 10 . 1 1 12 12 ALA H H 12 7.915 7.915 8.359 -0.444 19043 2990 1 10 . 1 1 13 13 PHE N N 13 118.052 118.052 120.390 -2.338 19043 2991 1 10 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.951 -0.378 19043 2992 1 10 . 1 1 13 13 PHE C C 13 175.832 175.832 177.057 -1.225 19043 2993 1 10 . 1 1 13 13 PHE CA C 13 61.855 61.855 62.066 -0.211 19043 2994 1 10 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.964 -0.047 19043 2995 1 10 . 1 1 13 13 PHE H H 13 8.097 8.097 7.380 0.717 19043 2996 1 10 . 1 1 14 14 TYR N N 14 116.000 116.000 117.481 -1.481 19043 2997 1 10 . 1 1 14 14 TYR HA H 14 3.985 3.985 3.874 0.111 19043 2998 1 10 . 1 1 14 14 TYR C C 14 178.860 178.860 178.187 0.673 19043 2999 1 10 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.333 -1.538 19043 3000 1 10 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.500 -0.520 19043 3001 1 10 . 1 1 14 14 TYR H H 14 8.040 8.040 7.787 0.253 19043 3002 1 10 . 1 1 15 15 GLU N N 15 118.737 118.737 118.263 0.474 19043 3003 1 10 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.784 0.187 19043 3004 1 10 . 1 1 15 15 GLU C C 15 180.184 180.184 179.198 0.986 19043 3005 1 10 . 1 1 15 15 GLU CA C 15 60.607 60.607 58.853 1.754 19043 3006 1 10 . 1 1 15 15 GLU CB C 15 29.722 29.722 28.815 0.907 19043 3007 1 10 . 1 1 15 15 GLU H H 15 8.244 8.244 8.238 0.006 19043 3008 1 10 . 1 1 16 16 ILE N N 16 119.695 119.695 118.538 1.157 19043 3009 1 10 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.691 -0.338 19043 3010 1 10 . 1 1 16 16 ILE C C 16 177.760 177.760 177.495 0.265 19043 3011 1 10 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.376 1.278 19043 3012 1 10 . 1 1 16 16 ILE CB C 16 37.403 37.403 37.881 -0.478 19043 3013 1 10 . 1 1 16 16 ILE H H 16 8.336 8.336 7.387 0.949 19043 3014 1 10 . 1 1 17 17 LEU N N 17 117.709 117.709 118.854 -1.145 19043 3015 1 10 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.863 -0.310 19043 3016 1 10 . 1 1 17 17 LEU C C 17 176.565 176.565 177.927 -1.362 19043 3017 1 10 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.147 0.412 19043 3018 1 10 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.541 0.298 19043 3019 1 10 . 1 1 17 17 LEU H H 17 7.738 7.738 7.194 0.544 19043 3020 1 10 . 1 1 18 18 HIS N N 18 110.934 110.934 115.833 -4.899 19043 3021 1 10 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.306 0.191 19043 3022 1 10 . 1 1 18 18 HIS C C 18 175.243 175.243 175.957 -0.714 19043 3023 1 10 . 1 1 18 18 HIS CA C 18 56.056 56.056 56.633 -0.577 19043 3024 1 10 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.148 0.500 19043 3025 1 10 . 1 1 18 18 HIS H H 18 7.150 7.150 7.739 -0.589 19043 3026 1 10 . 1 1 19 19 LEU N N 19 123.586 123.586 122.439 1.147 19043 3027 1 10 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.274 0.144 19043 3028 1 10 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.789 -0.313 19043 3029 1 10 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.344 -1.022 19043 3030 1 10 . 1 1 19 19 LEU H H 19 7.249 7.249 7.643 -0.394 19043 3031 1 10 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.424 0.007 19043 3032 1 10 . 1 1 20 20 PRO C C 20 178.092 178.092 177.713 0.379 19043 3033 1 10 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.925 -0.028 19043 3034 1 10 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.229 0.343 19043 3035 1 10 . 1 1 21 21 ASN N N 21 113.952 113.952 116.459 -2.507 19043 3036 1 10 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.512 0.497 19043 3037 1 10 . 1 1 21 21 ASN C C 21 176.397 176.397 175.707 0.690 19043 3038 1 10 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.037 -1.408 19043 3039 1 10 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.434 0.376 19043 3040 1 10 . 1 1 21 21 ASN H H 21 8.871 8.871 8.168 0.703 19043 3041 1 10 . 1 1 22 22 LEU N N 22 117.526 117.526 122.092 -4.566 19043 3042 1 10 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.276 0.125 19043 3043 1 10 . 1 1 22 22 LEU C C 22 176.879 176.879 175.857 1.022 19043 3044 1 10 . 1 1 22 22 LEU CA C 22 54.457 54.457 55.171 -0.714 19043 3045 1 10 . 1 1 22 22 LEU CB C 22 42.520 42.520 42.912 -0.392 19043 3046 1 10 . 1 1 22 22 LEU H H 22 6.563 6.563 8.145 -1.582 19043 3047 1 10 . 1 1 23 23 ASN N N 23 120.219 120.219 124.432 -4.213 19043 3048 1 10 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.830 0.038 19043 3049 1 10 . 1 1 23 23 ASN C C 23 175.507 175.507 176.178 -0.671 19043 3050 1 10 . 1 1 23 23 ASN CA C 23 51.416 51.416 51.359 0.057 19043 3051 1 10 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.244 -0.532 19043 3052 1 10 . 1 1 23 23 ASN H H 23 8.612 8.612 8.213 0.399 19043 3053 1 10 . 1 1 24 24 GLU N N 24 118.801 118.801 119.685 -0.884 19043 3054 1 10 . 1 1 24 24 GLU HA H 24 3.874 3.874 3.904 -0.030 19043 3055 1 10 . 1 1 24 24 GLU C C 24 177.799 177.799 178.234 -0.435 19043 3056 1 10 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.273 -0.082 19043 3057 1 10 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.290 0.075 19043 3058 1 10 . 1 1 24 24 GLU H H 24 8.735 8.735 8.945 -0.210 19043 3059 1 10 . 1 1 25 25 GLU N N 25 119.198 119.198 118.760 0.438 19043 3060 1 10 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.047 -0.069 19043 3061 1 10 . 1 1 25 25 GLU C C 25 180.078 180.078 179.295 0.783 19043 3062 1 10 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.455 0.436 19043 3063 1 10 . 1 1 25 25 GLU CB C 25 29.131 29.131 28.874 0.257 19043 3064 1 10 . 1 1 25 25 GLU H H 25 8.229 8.229 8.592 -0.363 19043 3065 1 10 . 1 1 26 26 GLN N N 26 119.646 119.646 118.680 0.966 19043 3066 1 10 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.050 -0.110 19043 3067 1 10 . 1 1 26 26 GLN C C 26 178.154 178.154 178.507 -0.353 19043 3068 1 10 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.653 -0.760 19043 3069 1 10 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.917 -0.015 19043 3070 1 10 . 1 1 26 26 GLN H H 26 8.425 8.425 8.583 -0.158 19043 3071 1 10 . 1 1 27 27 ARG N N 27 119.454 119.454 120.161 -0.707 19043 3072 1 10 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.148 -0.362 19043 3073 1 10 . 1 1 27 27 ARG C C 27 177.863 177.863 178.507 -0.644 19043 3074 1 10 . 1 1 27 27 ARG CA C 27 60.630 60.630 59.572 1.058 19043 3075 1 10 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.041 -0.397 19043 3076 1 10 . 1 1 27 27 ARG H H 27 8.548 8.548 8.392 0.156 19043 3077 1 10 . 1 1 28 28 ASN N N 28 116.833 116.833 117.528 -0.695 19043 3078 1 10 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.521 -0.189 19043 3079 1 10 . 1 1 28 28 ASN C C 28 177.234 177.234 177.239 -0.005 19043 3080 1 10 . 1 1 28 28 ASN CA C 28 56.038 56.038 55.924 0.114 19043 3081 1 10 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.446 -0.760 19043 3082 1 10 . 1 1 28 28 ASN H H 28 8.569 8.569 8.455 0.114 19043 3083 1 10 . 1 1 29 29 ALA N N 29 122.687 122.687 123.695 -1.008 19043 3084 1 10 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.013 0.041 19043 3085 1 10 . 1 1 29 29 ALA C C 29 181.045 181.045 179.245 1.800 19043 3086 1 10 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.810 0.439 19043 3087 1 10 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.152 -0.333 19043 3088 1 10 . 1 1 29 29 ALA H H 29 7.793 7.793 7.646 0.147 19043 3089 1 10 . 1 1 30 30 PHE N N 30 116.979 116.979 118.090 -1.111 19043 3090 1 10 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.199 0.179 19043 3091 1 10 . 1 1 30 30 PHE C C 30 177.887 177.887 177.990 -0.103 19043 3092 1 10 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.913 0.706 19043 3093 1 10 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.758 0.701 19043 3094 1 10 . 1 1 30 30 PHE H H 30 8.017 8.017 7.689 0.328 19043 3095 1 10 . 1 1 31 31 ILE N N 31 119.553 119.553 118.999 0.554 19043 3096 1 10 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.546 0.232 19043 3097 1 10 . 1 1 31 31 ILE C C 31 177.084 177.084 177.936 -0.852 19043 3098 1 10 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.418 0.227 19043 3099 1 10 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.562 -0.447 19043 3100 1 10 . 1 1 31 31 ILE H H 31 8.372 8.372 8.391 -0.019 19043 3101 1 10 . 1 1 32 32 GLN N N 32 119.108 119.108 119.801 -0.693 19043 3102 1 10 . 1 1 32 32 GLN HA H 32 3.806 3.806 4.006 -0.200 19043 3103 1 10 . 1 1 32 32 GLN C C 32 177.836 177.836 178.593 -0.757 19043 3104 1 10 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.516 -0.748 19043 3105 1 10 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.721 -0.743 19043 3106 1 10 . 1 1 32 32 GLN H H 32 8.389 8.389 8.040 0.349 19043 3107 1 10 . 1 1 33 33 SER N N 33 114.437 114.437 115.493 -1.056 19043 3108 1 10 . 1 1 33 33 SER HA H 33 4.212 4.212 4.265 -0.053 19043 3109 1 10 . 1 1 33 33 SER C C 33 175.469 175.469 176.644 -1.175 19043 3110 1 10 . 1 1 33 33 SER CA C 33 62.403 62.403 61.397 1.006 19043 3111 1 10 . 1 1 33 33 SER CB C 33 63.794 63.794 63.202 0.592 19043 3112 1 10 . 1 1 33 33 SER H H 33 8.078 8.078 7.993 0.085 19043 3113 1 10 . 1 1 34 34 LEU N N 34 122.967 122.967 123.455 -0.488 19043 3114 1 10 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.210 -0.300 19043 3115 1 10 . 1 1 34 34 LEU C C 34 177.506 177.506 177.900 -0.394 19043 3116 1 10 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.233 0.195 19043 3117 1 10 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.209 0.603 19043 3118 1 10 . 1 1 34 34 LEU H H 34 8.495 8.495 8.267 0.228 19043 3119 1 10 . 1 1 35 35 LYS N N 35 115.859 115.859 118.368 -2.509 19043 3120 1 10 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.229 -0.416 19043 3121 1 10 . 1 1 35 35 LYS C C 35 177.628 177.628 178.085 -0.457 19043 3122 1 10 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.574 -1.697 19043 3123 1 10 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.196 -0.177 19043 3124 1 10 . 1 1 35 35 LYS H H 35 7.815 7.815 7.655 0.160 19043 3125 1 10 . 1 1 36 36 ASP N N 36 116.741 116.741 117.693 -0.952 19043 3126 1 10 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.580 -0.066 19043 3127 1 10 . 1 1 36 36 ASP C C 36 177.324 177.324 175.903 1.421 19043 3128 1 10 . 1 1 36 36 ASP CA C 36 56.686 56.686 55.620 1.066 19043 3129 1 10 . 1 1 36 36 ASP CB C 36 40.671 40.671 42.037 -1.366 19043 3130 1 10 . 1 1 36 36 ASP H H 36 7.943 7.943 7.838 0.105 19043 3131 1 10 . 1 1 37 37 ASP N N 37 116.686 116.686 118.522 -1.836 19043 3132 1 10 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.108 -0.067 19043 3133 1 10 . 1 1 37 37 ASP CA C 37 51.946 51.946 52.234 -0.289 19043 3134 1 10 . 1 1 37 37 ASP CB C 37 40.523 40.523 42.480 -1.957 19043 3135 1 10 . 1 1 37 37 ASP H H 37 8.125 8.125 7.995 0.130 19043 3136 1 10 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.571 0.012 19043 3137 1 10 . 1 1 38 38 PRO C C 38 179.200 179.200 177.694 1.506 19043 3138 1 10 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.395 0.142 19043 3139 1 10 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.172 -0.286 19043 3140 1 10 . 1 1 39 39 SER N N 39 114.963 114.963 114.597 0.366 19043 3141 1 10 . 1 1 39 39 SER HA H 39 4.178 4.178 4.321 -0.143 19043 3142 1 10 . 1 1 39 39 SER C C 39 176.151 176.151 175.979 0.172 19043 3143 1 10 . 1 1 39 39 SER CA C 39 61.197 61.197 61.551 -0.354 19043 3144 1 10 . 1 1 39 39 SER CB C 39 62.729 62.729 62.298 0.431 19043 3145 1 10 . 1 1 39 39 SER H H 39 8.315 8.315 8.488 -0.173 19043 3146 1 10 . 1 1 40 40 GLN N N 40 120.058 120.058 119.693 0.365 19043 3147 1 10 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.515 0.145 19043 3148 1 10 . 1 1 40 40 GLN C C 40 176.192 176.192 177.124 -0.932 19043 3149 1 10 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.352 -0.371 19043 3150 1 10 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.125 0.042 19043 3151 1 10 . 1 1 40 40 GLN H H 40 7.820 7.820 7.780 0.040 19043 3152 1 10 . 1 1 41 41 SER N N 41 115.553 115.553 117.672 -2.119 19043 3153 1 10 . 1 1 41 41 SER HA H 41 3.845 3.845 3.974 -0.129 19043 3154 1 10 . 1 1 41 41 SER C C 41 174.181 174.181 175.770 -1.589 19043 3155 1 10 . 1 1 41 41 SER CA C 41 63.957 63.957 62.036 1.921 19043 3156 1 10 . 1 1 41 41 SER CB C 41 63.191 63.191 62.885 0.306 19043 3157 1 10 . 1 1 41 41 SER H H 41 7.666 7.666 7.713 -0.047 19043 3158 1 10 . 1 1 42 42 ALA N N 42 122.360 122.360 121.859 0.501 19043 3159 1 10 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.086 0.037 19043 3160 1 10 . 1 1 42 42 ALA C C 42 180.996 180.996 179.102 1.894 19043 3161 1 10 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.664 0.898 19043 3162 1 10 . 1 1 42 42 ALA CB C 42 18.056 18.056 18.426 -0.370 19043 3163 1 10 . 1 1 42 42 ALA H H 42 8.556 8.556 8.430 0.126 19043 3164 1 10 . 1 1 43 43 ASN N N 43 118.974 118.974 118.665 0.309 19043 3165 1 10 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.558 -0.039 19043 3166 1 10 . 1 1 43 43 ASN C C 43 177.972 177.972 177.758 0.214 19043 3167 1 10 . 1 1 43 43 ASN CA C 43 55.854 55.854 55.744 0.110 19043 3168 1 10 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.100 0.049 19043 3169 1 10 . 1 1 43 43 ASN H H 43 7.950 7.950 7.791 0.159 19043 3170 1 10 . 1 1 44 44 LEU N N 44 122.070 122.070 121.159 0.911 19043 3171 1 10 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.388 -0.199 19043 3172 1 10 . 1 1 44 44 LEU C C 44 178.332 178.332 179.426 -1.094 19043 3173 1 10 . 1 1 44 44 LEU CA C 44 57.834 57.834 58.042 -0.208 19043 3174 1 10 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.759 0.592 19043 3175 1 10 . 1 1 44 44 LEU H H 44 8.789 8.789 8.689 0.100 19043 3176 1 10 . 1 1 45 45 LEU N N 45 118.621 118.621 119.624 -1.003 19043 3177 1 10 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.748 0.057 19043 3178 1 10 . 1 1 45 45 LEU C C 45 177.832 177.832 178.594 -0.762 19043 3179 1 10 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.694 0.191 19043 3180 1 10 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.609 0.197 19043 3181 1 10 . 1 1 45 45 LEU H H 45 8.283 8.283 7.722 0.561 19043 3182 1 10 . 1 1 46 46 ALA N N 46 119.525 119.525 120.719 -1.194 19043 3183 1 10 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.895 0.115 19043 3184 1 10 . 1 1 46 46 ALA C C 46 181.250 181.250 179.822 1.428 19043 3185 1 10 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.164 0.132 19043 3186 1 10 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.067 -0.116 19043 3187 1 10 . 1 1 46 46 ALA H H 46 7.640 7.640 7.845 -0.205 19043 3188 1 10 . 1 1 47 47 GLU N N 47 119.572 119.572 118.480 1.092 19043 3189 1 10 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.084 -0.054 19043 3190 1 10 . 1 1 47 47 GLU C C 47 178.895 178.895 178.931 -0.036 19043 3191 1 10 . 1 1 47 47 GLU CA C 47 59.166 59.166 59.003 0.163 19043 3192 1 10 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.814 -0.276 19043 3193 1 10 . 1 1 47 47 GLU H H 47 8.139 8.139 8.405 -0.266 19043 3194 1 10 . 1 1 48 48 ALA N N 48 123.953 123.953 122.401 1.552 19043 3195 1 10 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.601 -0.074 19043 3196 1 10 . 1 1 48 48 ALA C C 48 179.636 179.636 179.118 0.518 19043 3197 1 10 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.387 1.129 19043 3198 1 10 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.607 -0.362 19043 3199 1 10 . 1 1 48 48 ALA H H 48 8.468 8.468 7.794 0.674 19043 3200 1 10 . 1 1 49 49 LYS N N 49 117.926 117.926 118.414 -0.488 19043 3201 1 10 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.895 -0.156 19043 3202 1 10 . 1 1 49 49 LYS C C 49 178.761 178.761 178.737 0.024 19043 3203 1 10 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.659 0.733 19043 3204 1 10 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.304 -0.215 19043 3205 1 10 . 1 1 49 49 LYS H H 49 8.459 8.459 8.258 0.201 19043 3206 1 10 . 1 1 50 50 LYS N N 50 120.194 120.194 119.607 0.587 19043 3207 1 10 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.069 0.019 19043 3208 1 10 . 1 1 50 50 LYS C C 50 179.859 179.859 178.961 0.898 19043 3209 1 10 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.148 0.587 19043 3210 1 10 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.525 -0.063 19043 3211 1 10 . 1 1 50 50 LYS H H 50 7.702 7.702 7.826 -0.124 19043 3212 1 10 . 1 1 51 51 LEU N N 51 122.126 122.126 119.667 2.459 19043 3213 1 10 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.193 -0.066 19043 3214 1 10 . 1 1 51 51 LEU C C 51 178.123 178.123 178.000 0.123 19043 3215 1 10 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.970 0.627 19043 3216 1 10 . 1 1 51 51 LEU CB C 51 42.352 42.352 41.953 0.399 19043 3217 1 10 . 1 1 51 51 LEU H H 51 8.023 8.023 7.572 0.451 19043 3218 1 10 . 1 1 52 52 ASN N N 52 116.675 116.675 116.812 -0.137 19043 3219 1 10 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.418 -0.483 19043 3220 1 10 . 1 1 52 52 ASN C C 52 177.668 177.668 175.860 1.808 19043 3221 1 10 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.264 1.653 19043 3222 1 10 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.690 3.246 19043 3223 1 10 . 1 1 52 52 ASN H H 52 8.537 8.537 8.186 0.351 19043 3224 1 10 . 1 1 53 53 ASP N N 53 118.725 118.725 117.182 1.543 19043 3225 1 10 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.525 -0.081 19043 3226 1 10 . 1 1 53 53 ASP C C 53 178.936 178.936 177.065 1.871 19043 3227 1 10 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.285 1.648 19043 3228 1 10 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.366 -1.271 19043 3229 1 10 . 1 1 53 53 ASP H H 53 8.220 8.220 7.739 0.481 19043 3230 1 10 . 1 1 54 54 ALA N N 54 122.872 122.872 122.189 0.683 19043 3231 1 10 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.118 0.114 19043 3232 1 10 . 1 1 54 54 ALA C C 54 179.354 179.354 179.111 0.243 19043 3233 1 10 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.201 0.140 19043 3234 1 10 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.257 -0.652 19043 3235 1 10 . 1 1 54 54 ALA H H 54 8.037 8.037 7.339 0.698 19043 3236 1 10 . 1 1 55 55 GLN N N 55 115.052 115.052 116.474 -1.422 19043 3237 1 10 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.344 0.034 19043 3238 1 10 . 1 1 55 55 GLN C C 55 174.116 174.116 175.229 -1.113 19043 3239 1 10 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.358 -0.404 19043 3240 1 10 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.359 -1.135 19043 3241 1 10 . 1 1 55 55 GLN H H 55 7.512 7.512 7.601 -0.089 19043 3242 1 10 . 1 1 56 56 ALA N N 56 124.556 124.556 123.848 0.708 19043 3243 1 10 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.382 -0.034 19043 3244 1 10 . 1 1 56 56 ALA CA C 56 51.037 51.037 50.889 0.148 19043 3245 1 10 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.636 -0.656 19043 3246 1 10 . 1 1 56 56 ALA H H 56 7.100 7.100 7.661 -0.561 19043 3247 1 10 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.534 -0.122 19043 3248 1 10 . 1 1 57 57 PRO C C 57 176.151 176.151 176.906 -0.755 19043 3249 1 10 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.239 1.044 19043 3250 1 10 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.130 -0.137 19043 3251 1 11 . 1 1 2 2 ASP N N 2 125.357 125.357 125.206 0.151 19043 3252 1 11 . 1 1 2 2 ASP C C 2 175.535 175.535 175.286 0.249 19043 3253 1 11 . 1 1 2 2 ASP CA C 2 54.307 54.307 54.529 -0.223 19043 3254 1 11 . 1 1 2 2 ASP CB C 2 41.470 41.470 40.137 1.333 19043 3255 1 11 . 1 1 2 2 ASP H H 2 8.762 8.762 8.208 0.554 19043 3256 1 11 . 1 1 3 3 ASN N N 3 120.441 120.441 118.862 1.579 19043 3257 1 11 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.567 0.133 19043 3258 1 11 . 1 1 3 3 ASN C C 3 175.246 175.246 174.574 0.672 19043 3259 1 11 . 1 1 3 3 ASN CA C 3 53.289 53.289 52.880 0.409 19043 3260 1 11 . 1 1 3 3 ASN CB C 3 39.086 39.086 38.641 0.445 19043 3261 1 11 . 1 1 3 3 ASN H H 3 8.548 8.548 7.989 0.559 19043 3262 1 11 . 1 1 4 4 LYS N N 4 121.461 121.461 120.046 1.415 19043 3263 1 11 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.159 0.056 19043 3264 1 11 . 1 1 4 4 LYS C C 4 176.404 176.404 176.545 -0.141 19043 3265 1 11 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.802 0.051 19043 3266 1 11 . 1 1 4 4 LYS CB C 4 32.780 32.780 32.157 0.623 19043 3267 1 11 . 1 1 4 4 LYS H H 4 8.337 8.337 8.377 -0.040 19043 3268 1 11 . 1 1 5 5 PHE N N 5 119.538 119.538 115.400 4.138 19043 3269 1 11 . 1 1 5 5 PHE C C 5 175.433 175.433 174.968 0.465 19043 3270 1 11 . 1 1 5 5 PHE CA C 5 57.792 57.792 58.360 -0.568 19043 3271 1 11 . 1 1 5 5 PHE CB C 5 40.067 40.067 36.279 3.788 19043 3272 1 11 . 1 1 5 5 PHE H H 5 8.277 8.277 7.432 0.845 19043 3273 1 11 . 1 1 6 6 ASN N N 6 121.168 121.168 118.877 2.291 19043 3274 1 11 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.622 0.195 19043 3275 1 11 . 1 1 6 6 ASN C C 6 175.884 175.884 176.491 -0.607 19043 3276 1 11 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.173 -0.388 19043 3277 1 11 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.179 0.192 19043 3278 1 11 . 1 1 6 6 ASN H H 6 8.443 8.443 7.976 0.467 19043 3279 1 11 . 1 1 7 7 LYS N N 7 121.688 121.688 121.744 -0.056 19043 3280 1 11 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.048 -0.103 19043 3281 1 11 . 1 1 7 7 LYS C C 7 178.196 178.196 178.316 -0.120 19043 3282 1 11 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.662 -0.761 19043 3283 1 11 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.218 -0.093 19043 3284 1 11 . 1 1 7 7 LYS H H 7 8.460 8.460 8.594 -0.134 19043 3285 1 11 . 1 1 8 8 GLU N N 8 119.926 119.926 117.953 1.973 19043 3286 1 11 . 1 1 8 8 GLU HA H 8 4.081 4.081 4.056 0.025 19043 3287 1 11 . 1 1 8 8 GLU C C 8 179.894 179.894 179.365 0.529 19043 3288 1 11 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.502 0.337 19043 3289 1 11 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.141 -0.200 19043 3290 1 11 . 1 1 8 8 GLU H H 8 8.386 8.386 8.837 -0.451 19043 3291 1 11 . 1 1 9 9 GLN N N 9 121.401 121.401 118.359 3.042 19043 3292 1 11 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.191 -0.094 19043 3293 1 11 . 1 1 9 9 GLN C C 9 177.324 177.324 178.165 -0.841 19043 3294 1 11 . 1 1 9 9 GLN CA C 9 59.383 59.383 58.880 0.503 19043 3295 1 11 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.754 0.115 19043 3296 1 11 . 1 1 9 9 GLN H H 9 8.307 8.307 8.229 0.078 19043 3297 1 11 . 1 1 10 10 GLN N N 10 120.060 120.060 120.136 -0.076 19043 3298 1 11 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.030 -0.808 19043 3299 1 11 . 1 1 10 10 GLN C C 10 176.888 176.888 178.242 -1.354 19043 3300 1 11 . 1 1 10 10 GLN CA C 10 58.949 58.949 59.138 -0.189 19043 3301 1 11 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.834 0.007 19043 3302 1 11 . 1 1 10 10 GLN H H 10 8.040 8.040 8.202 -0.162 19043 3303 1 11 . 1 1 11 11 ASN N N 11 116.214 116.214 118.372 -2.158 19043 3304 1 11 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.515 -0.165 19043 3305 1 11 . 1 1 11 11 ASN C C 11 177.828 177.828 177.054 0.774 19043 3306 1 11 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.450 -0.193 19043 3307 1 11 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.021 0.189 19043 3308 1 11 . 1 1 11 11 ASN H H 11 8.366 8.366 8.769 -0.403 19043 3309 1 11 . 1 1 12 12 ALA N N 12 121.429 121.429 122.037 -0.608 19043 3310 1 11 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.069 -0.060 19043 3311 1 11 . 1 1 12 12 ALA C C 12 177.850 177.850 179.678 -1.828 19043 3312 1 11 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.904 0.389 19043 3313 1 11 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.035 0.286 19043 3314 1 11 . 1 1 12 12 ALA H H 12 7.915 7.915 7.650 0.265 19043 3315 1 11 . 1 1 13 13 PHE N N 13 118.052 118.052 119.923 -1.871 19043 3316 1 11 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.988 -0.415 19043 3317 1 11 . 1 1 13 13 PHE C C 13 175.832 175.832 177.119 -1.287 19043 3318 1 11 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.896 -0.041 19043 3319 1 11 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.858 0.059 19043 3320 1 11 . 1 1 13 13 PHE H H 13 8.097 8.097 7.478 0.619 19043 3321 1 11 . 1 1 14 14 TYR N N 14 116.000 116.000 117.288 -1.288 19043 3322 1 11 . 1 1 14 14 TYR HA H 14 3.985 3.985 4.049 -0.064 19043 3323 1 11 . 1 1 14 14 TYR C C 14 178.860 178.860 178.431 0.429 19043 3324 1 11 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.806 -2.011 19043 3325 1 11 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.793 -0.813 19043 3326 1 11 . 1 1 14 14 TYR H H 14 8.040 8.040 8.172 -0.132 19043 3327 1 11 . 1 1 15 15 GLU N N 15 118.737 118.737 118.340 0.397 19043 3328 1 11 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.913 0.058 19043 3329 1 11 . 1 1 15 15 GLU C C 15 180.184 180.184 179.091 1.093 19043 3330 1 11 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.063 1.544 19043 3331 1 11 . 1 1 15 15 GLU CB C 15 29.722 29.722 28.938 0.784 19043 3332 1 11 . 1 1 15 15 GLU H H 15 8.244 8.244 8.260 -0.016 19043 3333 1 11 . 1 1 16 16 ILE N N 16 119.695 119.695 118.484 1.211 19043 3334 1 11 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.762 -0.409 19043 3335 1 11 . 1 1 16 16 ILE C C 16 177.760 177.760 177.726 0.034 19043 3336 1 11 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.205 1.449 19043 3337 1 11 . 1 1 16 16 ILE CB C 16 37.403 37.403 38.070 -0.667 19043 3338 1 11 . 1 1 16 16 ILE H H 16 8.336 8.336 7.649 0.687 19043 3339 1 11 . 1 1 17 17 LEU N N 17 117.709 117.709 119.686 -1.977 19043 3340 1 11 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.847 -0.294 19043 3341 1 11 . 1 1 17 17 LEU C C 17 176.565 176.565 177.934 -1.369 19043 3342 1 11 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.538 0.021 19043 3343 1 11 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.535 0.303 19043 3344 1 11 . 1 1 17 17 LEU H H 17 7.738 7.738 7.249 0.489 19043 3345 1 11 . 1 1 18 18 HIS N N 18 110.934 110.934 115.688 -4.754 19043 3346 1 11 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.305 0.192 19043 3347 1 11 . 1 1 18 18 HIS C C 18 175.243 175.243 175.828 -0.585 19043 3348 1 11 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.344 -1.288 19043 3349 1 11 . 1 1 18 18 HIS CB C 18 30.648 30.648 29.951 0.697 19043 3350 1 11 . 1 1 18 18 HIS H H 18 7.150 7.150 8.108 -0.958 19043 3351 1 11 . 1 1 19 19 LEU N N 19 123.586 123.586 121.969 1.617 19043 3352 1 11 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.301 0.117 19043 3353 1 11 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.653 -0.177 19043 3354 1 11 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.729 -1.407 19043 3355 1 11 . 1 1 19 19 LEU H H 19 7.249 7.249 7.394 -0.145 19043 3356 1 11 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.427 0.004 19043 3357 1 11 . 1 1 20 20 PRO C C 20 178.092 178.092 177.727 0.365 19043 3358 1 11 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.906 -0.009 19043 3359 1 11 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.242 0.330 19043 3360 1 11 . 1 1 21 21 ASN N N 21 113.952 113.952 116.530 -2.578 19043 3361 1 11 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.503 0.506 19043 3362 1 11 . 1 1 21 21 ASN C C 21 176.397 176.397 175.722 0.675 19043 3363 1 11 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.079 -1.450 19043 3364 1 11 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.429 0.381 19043 3365 1 11 . 1 1 21 21 ASN H H 21 8.871 8.871 8.124 0.747 19043 3366 1 11 . 1 1 22 22 LEU N N 22 117.526 117.526 121.940 -4.414 19043 3367 1 11 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.256 0.145 19043 3368 1 11 . 1 1 22 22 LEU C C 22 176.879 176.879 175.630 1.249 19043 3369 1 11 . 1 1 22 22 LEU CA C 22 54.457 54.457 55.256 -0.799 19043 3370 1 11 . 1 1 22 22 LEU CB C 22 42.520 42.520 42.812 -0.292 19043 3371 1 11 . 1 1 22 22 LEU H H 22 6.563 6.563 8.192 -1.629 19043 3372 1 11 . 1 1 23 23 ASN N N 23 120.219 120.219 124.161 -3.942 19043 3373 1 11 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.759 0.109 19043 3374 1 11 . 1 1 23 23 ASN C C 23 175.507 175.507 176.361 -0.854 19043 3375 1 11 . 1 1 23 23 ASN CA C 23 51.416 51.416 51.541 -0.125 19043 3376 1 11 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.157 -0.445 19043 3377 1 11 . 1 1 23 23 ASN H H 23 8.612 8.612 8.104 0.508 19043 3378 1 11 . 1 1 24 24 GLU N N 24 118.801 118.801 119.530 -0.729 19043 3379 1 11 . 1 1 24 24 GLU HA H 24 3.874 3.874 3.958 -0.084 19043 3380 1 11 . 1 1 24 24 GLU C C 24 177.799 177.799 178.477 -0.678 19043 3381 1 11 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.276 -0.085 19043 3382 1 11 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.343 0.022 19043 3383 1 11 . 1 1 24 24 GLU H H 24 8.735 8.735 8.848 -0.113 19043 3384 1 11 . 1 1 25 25 GLU N N 25 119.198 119.198 118.826 0.372 19043 3385 1 11 . 1 1 25 25 GLU HA H 25 3.978 3.978 3.989 -0.011 19043 3386 1 11 . 1 1 25 25 GLU C C 25 180.078 180.078 179.049 1.029 19043 3387 1 11 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.144 0.747 19043 3388 1 11 . 1 1 25 25 GLU CB C 25 29.131 29.131 28.798 0.333 19043 3389 1 11 . 1 1 25 25 GLU H H 25 8.229 8.229 8.784 -0.555 19043 3390 1 11 . 1 1 26 26 GLN N N 26 119.646 119.646 119.255 0.391 19043 3391 1 11 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.093 -0.153 19043 3392 1 11 . 1 1 26 26 GLN C C 26 178.154 178.154 178.394 -0.240 19043 3393 1 11 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.225 -0.332 19043 3394 1 11 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.965 -0.063 19043 3395 1 11 . 1 1 26 26 GLN H H 26 8.425 8.425 7.900 0.525 19043 3396 1 11 . 1 1 27 27 ARG N N 27 119.454 119.454 120.705 -1.251 19043 3397 1 11 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.187 -0.401 19043 3398 1 11 . 1 1 27 27 ARG C C 27 177.863 177.863 178.458 -0.595 19043 3399 1 11 . 1 1 27 27 ARG CA C 27 60.630 60.630 59.693 0.937 19043 3400 1 11 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.086 -0.442 19043 3401 1 11 . 1 1 27 27 ARG H H 27 8.548 8.548 8.254 0.294 19043 3402 1 11 . 1 1 28 28 ASN N N 28 116.833 116.833 117.759 -0.926 19043 3403 1 11 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.480 -0.148 19043 3404 1 11 . 1 1 28 28 ASN C C 28 177.234 177.234 177.293 -0.059 19043 3405 1 11 . 1 1 28 28 ASN CA C 28 56.038 56.038 56.126 -0.088 19043 3406 1 11 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.289 -0.604 19043 3407 1 11 . 1 1 28 28 ASN H H 28 8.569 8.569 8.552 0.017 19043 3408 1 11 . 1 1 29 29 ALA N N 29 122.687 122.687 123.429 -0.742 19043 3409 1 11 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.039 0.015 19043 3410 1 11 . 1 1 29 29 ALA C C 29 181.045 181.045 179.488 1.557 19043 3411 1 11 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.674 0.576 19043 3412 1 11 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.273 -0.453 19043 3413 1 11 . 1 1 29 29 ALA H H 29 7.793 7.793 7.333 0.460 19043 3414 1 11 . 1 1 30 30 PHE N N 30 116.979 116.979 117.896 -0.917 19043 3415 1 11 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.207 0.171 19043 3416 1 11 . 1 1 30 30 PHE C C 30 177.887 177.887 178.088 -0.201 19043 3417 1 11 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.769 0.850 19043 3418 1 11 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.694 0.765 19043 3419 1 11 . 1 1 30 30 PHE H H 30 8.017 8.017 7.687 0.330 19043 3420 1 11 . 1 1 31 31 ILE N N 31 119.553 119.553 118.900 0.653 19043 3421 1 11 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.582 0.196 19043 3422 1 11 . 1 1 31 31 ILE C C 31 177.084 177.084 177.987 -0.903 19043 3423 1 11 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.188 0.457 19043 3424 1 11 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.569 -0.454 19043 3425 1 11 . 1 1 31 31 ILE H H 31 8.372 8.372 8.444 -0.072 19043 3426 1 11 . 1 1 32 32 GLN N N 32 119.108 119.108 119.825 -0.717 19043 3427 1 11 . 1 1 32 32 GLN HA H 32 3.806 3.806 4.000 -0.194 19043 3428 1 11 . 1 1 32 32 GLN C C 32 177.836 177.836 178.385 -0.549 19043 3429 1 11 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.580 -0.812 19043 3430 1 11 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.704 -0.726 19043 3431 1 11 . 1 1 32 32 GLN H H 32 8.389 8.389 8.158 0.231 19043 3432 1 11 . 1 1 33 33 SER N N 33 114.437 114.437 114.974 -0.537 19043 3433 1 11 . 1 1 33 33 SER HA H 33 4.212 4.212 4.253 -0.041 19043 3434 1 11 . 1 1 33 33 SER C C 33 175.469 175.469 176.945 -1.476 19043 3435 1 11 . 1 1 33 33 SER CA C 33 62.403 62.403 61.136 1.267 19043 3436 1 11 . 1 1 33 33 SER CB C 33 63.794 63.794 62.909 0.885 19043 3437 1 11 . 1 1 33 33 SER H H 33 8.078 8.078 7.965 0.113 19043 3438 1 11 . 1 1 34 34 LEU N N 34 122.967 122.967 122.242 0.725 19043 3439 1 11 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.262 -0.352 19043 3440 1 11 . 1 1 34 34 LEU C C 34 177.506 177.506 178.063 -0.557 19043 3441 1 11 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.051 0.377 19043 3442 1 11 . 1 1 34 34 LEU CB C 34 42.812 42.812 41.952 0.860 19043 3443 1 11 . 1 1 34 34 LEU H H 34 8.495 8.495 7.888 0.607 19043 3444 1 11 . 1 1 35 35 LYS N N 35 115.859 115.859 119.656 -3.797 19043 3445 1 11 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.194 -0.381 19043 3446 1 11 . 1 1 35 35 LYS C C 35 177.628 177.628 178.193 -0.565 19043 3447 1 11 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.740 -1.863 19043 3448 1 11 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.109 -0.090 19043 3449 1 11 . 1 1 35 35 LYS H H 35 7.815 7.815 7.581 0.234 19043 3450 1 11 . 1 1 36 36 ASP N N 36 116.741 116.741 116.958 -0.217 19043 3451 1 11 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.562 -0.048 19043 3452 1 11 . 1 1 36 36 ASP C C 36 177.324 177.324 175.972 1.352 19043 3453 1 11 . 1 1 36 36 ASP CA C 36 56.686 56.686 56.282 0.404 19043 3454 1 11 . 1 1 36 36 ASP CB C 36 40.671 40.671 41.866 -1.195 19043 3455 1 11 . 1 1 36 36 ASP H H 36 7.943 7.943 8.020 -0.077 19043 3456 1 11 . 1 1 37 37 ASP N N 37 116.686 116.686 117.011 -0.325 19043 3457 1 11 . 1 1 37 37 ASP HA H 37 5.041 5.041 4.996 0.045 19043 3458 1 11 . 1 1 37 37 ASP CA C 37 51.946 51.946 52.365 -0.420 19043 3459 1 11 . 1 1 37 37 ASP CB C 37 40.523 40.523 41.392 -0.869 19043 3460 1 11 . 1 1 37 37 ASP H H 37 8.125 8.125 7.984 0.141 19043 3461 1 11 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.523 0.060 19043 3462 1 11 . 1 1 38 38 PRO C C 38 179.200 179.200 178.742 0.458 19043 3463 1 11 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.601 -0.064 19043 3464 1 11 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.036 -0.150 19043 3465 1 11 . 1 1 39 39 SER N N 39 114.963 114.963 113.625 1.338 19043 3466 1 11 . 1 1 39 39 SER HA H 39 4.178 4.178 4.248 -0.070 19043 3467 1 11 . 1 1 39 39 SER C C 39 176.151 176.151 175.768 0.383 19043 3468 1 11 . 1 1 39 39 SER CA C 39 61.197 61.197 60.902 0.295 19043 3469 1 11 . 1 1 39 39 SER CB C 39 62.729 62.729 62.598 0.131 19043 3470 1 11 . 1 1 39 39 SER H H 39 8.315 8.315 8.439 -0.124 19043 3471 1 11 . 1 1 40 40 GLN N N 40 120.058 120.058 119.307 0.751 19043 3472 1 11 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.504 0.156 19043 3473 1 11 . 1 1 40 40 GLN C C 40 176.192 176.192 176.912 -0.720 19043 3474 1 11 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.168 -0.187 19043 3475 1 11 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.236 -0.068 19043 3476 1 11 . 1 1 40 40 GLN H H 40 7.820 7.820 7.848 -0.028 19043 3477 1 11 . 1 1 41 41 SER N N 41 115.553 115.553 116.544 -0.991 19043 3478 1 11 . 1 1 41 41 SER HA H 41 3.845 3.845 4.068 -0.223 19043 3479 1 11 . 1 1 41 41 SER C C 41 174.181 174.181 175.719 -1.538 19043 3480 1 11 . 1 1 41 41 SER CA C 41 63.957 63.957 61.340 2.617 19043 3481 1 11 . 1 1 41 41 SER CB C 41 63.191 63.191 62.728 0.463 19043 3482 1 11 . 1 1 41 41 SER H H 41 7.666 7.666 8.007 -0.341 19043 3483 1 11 . 1 1 42 42 ALA N N 42 122.360 122.360 122.250 0.110 19043 3484 1 11 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.235 -0.112 19043 3485 1 11 . 1 1 42 42 ALA C C 42 180.996 180.996 178.964 2.032 19043 3486 1 11 . 1 1 42 42 ALA CA C 42 55.563 55.563 53.930 1.633 19043 3487 1 11 . 1 1 42 42 ALA CB C 42 18.056 18.056 18.860 -0.804 19043 3488 1 11 . 1 1 42 42 ALA H H 42 8.556 8.556 8.245 0.311 19043 3489 1 11 . 1 1 43 43 ASN N N 43 118.974 118.974 118.849 0.125 19043 3490 1 11 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.542 -0.023 19043 3491 1 11 . 1 1 43 43 ASN C C 43 177.972 177.972 177.741 0.231 19043 3492 1 11 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.246 -0.392 19043 3493 1 11 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.600 -0.451 19043 3494 1 11 . 1 1 43 43 ASN H H 43 7.950 7.950 7.879 0.071 19043 3495 1 11 . 1 1 44 44 LEU N N 44 122.070 122.070 120.461 1.609 19043 3496 1 11 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.204 -0.015 19043 3497 1 11 . 1 1 44 44 LEU C C 44 178.332 178.332 178.775 -0.443 19043 3498 1 11 . 1 1 44 44 LEU CA C 44 57.834 57.834 58.068 -0.234 19043 3499 1 11 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.889 0.462 19043 3500 1 11 . 1 1 44 44 LEU H H 44 8.789 8.789 8.712 0.077 19043 3501 1 11 . 1 1 45 45 LEU N N 45 118.621 118.621 119.907 -1.286 19043 3502 1 11 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.796 0.009 19043 3503 1 11 . 1 1 45 45 LEU C C 45 177.832 177.832 178.432 -0.600 19043 3504 1 11 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.631 0.254 19043 3505 1 11 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.610 0.196 19043 3506 1 11 . 1 1 45 45 LEU H H 45 8.283 8.283 7.520 0.763 19043 3507 1 11 . 1 1 46 46 ALA N N 46 119.525 119.525 121.046 -1.521 19043 3508 1 11 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.903 0.107 19043 3509 1 11 . 1 1 46 46 ALA C C 46 181.250 181.250 179.908 1.342 19043 3510 1 11 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.364 -0.068 19043 3511 1 11 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.042 -0.091 19043 3512 1 11 . 1 1 46 46 ALA H H 46 7.640 7.640 7.851 -0.211 19043 3513 1 11 . 1 1 47 47 GLU N N 47 119.572 119.572 117.946 1.626 19043 3514 1 11 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.103 -0.073 19043 3515 1 11 . 1 1 47 47 GLU C C 47 178.895 178.895 178.936 -0.041 19043 3516 1 11 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.980 0.186 19043 3517 1 11 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.583 -0.045 19043 3518 1 11 . 1 1 47 47 GLU H H 47 8.139 8.139 8.361 -0.222 19043 3519 1 11 . 1 1 48 48 ALA N N 48 123.953 123.953 122.198 1.755 19043 3520 1 11 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.491 0.036 19043 3521 1 11 . 1 1 48 48 ALA C C 48 179.636 179.636 179.418 0.218 19043 3522 1 11 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.553 0.963 19043 3523 1 11 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.605 -0.359 19043 3524 1 11 . 1 1 48 48 ALA H H 48 8.468 8.468 7.768 0.700 19043 3525 1 11 . 1 1 49 49 LYS N N 49 117.926 117.926 117.958 -0.032 19043 3526 1 11 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.932 -0.193 19043 3527 1 11 . 1 1 49 49 LYS C C 49 178.761 178.761 178.675 0.086 19043 3528 1 11 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.429 0.962 19043 3529 1 11 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.344 -0.255 19043 3530 1 11 . 1 1 49 49 LYS H H 49 8.459 8.459 8.134 0.325 19043 3531 1 11 . 1 1 50 50 LYS N N 50 120.194 120.194 119.812 0.382 19043 3532 1 11 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.069 0.019 19043 3533 1 11 . 1 1 50 50 LYS C C 50 179.859 179.859 178.288 1.571 19043 3534 1 11 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.090 0.645 19043 3535 1 11 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.529 -0.067 19043 3536 1 11 . 1 1 50 50 LYS H H 50 7.702 7.702 7.726 -0.024 19043 3537 1 11 . 1 1 51 51 LEU N N 51 122.126 122.126 118.966 3.160 19043 3538 1 11 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.292 -0.165 19043 3539 1 11 . 1 1 51 51 LEU C C 51 178.123 178.123 178.067 0.056 19043 3540 1 11 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.601 0.996 19043 3541 1 11 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.418 -0.066 19043 3542 1 11 . 1 1 51 51 LEU H H 51 8.023 8.023 7.608 0.415 19043 3543 1 11 . 1 1 52 52 ASN N N 52 116.675 116.675 116.961 -0.286 19043 3544 1 11 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.433 -0.498 19043 3545 1 11 . 1 1 52 52 ASN C C 52 177.668 177.668 175.993 1.675 19043 3546 1 11 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.134 1.783 19043 3547 1 11 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.690 3.246 19043 3548 1 11 . 1 1 52 52 ASN H H 52 8.537 8.537 8.218 0.319 19043 3549 1 11 . 1 1 53 53 ASP N N 53 118.725 118.725 117.547 1.178 19043 3550 1 11 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.554 -0.110 19043 3551 1 11 . 1 1 53 53 ASP C C 53 178.936 178.936 177.307 1.629 19043 3552 1 11 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.413 1.520 19043 3553 1 11 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.221 -1.126 19043 3554 1 11 . 1 1 53 53 ASP H H 53 8.220 8.220 7.857 0.363 19043 3555 1 11 . 1 1 54 54 ALA N N 54 122.872 122.872 121.452 1.420 19043 3556 1 11 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.273 -0.041 19043 3557 1 11 . 1 1 54 54 ALA C C 54 179.354 179.354 178.765 0.589 19043 3558 1 11 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.011 0.330 19043 3559 1 11 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.039 -0.434 19043 3560 1 11 . 1 1 54 54 ALA H H 54 8.037 8.037 7.754 0.283 19043 3561 1 11 . 1 1 55 55 GLN N N 55 115.052 115.052 116.467 -1.415 19043 3562 1 11 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.318 0.060 19043 3563 1 11 . 1 1 55 55 GLN C C 55 174.116 174.116 175.012 -0.896 19043 3564 1 11 . 1 1 55 55 GLN CA C 55 54.954 54.954 54.900 0.054 19043 3565 1 11 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.168 -0.943 19043 3566 1 11 . 1 1 55 55 GLN H H 55 7.512 7.512 7.748 -0.236 19043 3567 1 11 . 1 1 56 56 ALA N N 56 124.556 124.556 123.855 0.701 19043 3568 1 11 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.487 -0.139 19043 3569 1 11 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.036 0.001 19043 3570 1 11 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.626 -0.647 19043 3571 1 11 . 1 1 56 56 ALA H H 56 7.100 7.100 7.650 -0.550 19043 3572 1 11 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.462 -0.050 19043 3573 1 11 . 1 1 57 57 PRO C C 57 176.151 176.151 176.681 -0.530 19043 3574 1 11 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.366 0.917 19043 3575 1 11 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.129 -0.136 19043 3576 1 12 . 1 1 2 2 ASP N N 2 125.357 125.357 125.548 -0.191 19043 3577 1 12 . 1 1 2 2 ASP C C 2 175.535 175.535 174.324 1.211 19043 3578 1 12 . 1 1 2 2 ASP CA C 2 54.307 54.307 53.805 0.502 19043 3579 1 12 . 1 1 2 2 ASP CB C 2 41.470 41.470 42.725 -1.255 19043 3580 1 12 . 1 1 2 2 ASP H H 2 8.762 8.762 8.210 0.552 19043 3581 1 12 . 1 1 3 3 ASN N N 3 120.441 120.441 119.141 1.300 19043 3582 1 12 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.640 0.060 19043 3583 1 12 . 1 1 3 3 ASN C C 3 175.246 175.246 175.051 0.195 19043 3584 1 12 . 1 1 3 3 ASN CA C 3 53.289 53.289 53.451 -0.162 19043 3585 1 12 . 1 1 3 3 ASN CB C 3 39.086 39.086 39.185 -0.099 19043 3586 1 12 . 1 1 3 3 ASN H H 3 8.548 8.548 8.270 0.279 19043 3587 1 12 . 1 1 4 4 LYS N N 4 121.461 121.461 120.033 1.428 19043 3588 1 12 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.158 0.057 19043 3589 1 12 . 1 1 4 4 LYS C C 4 176.404 176.404 174.870 1.534 19043 3590 1 12 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.071 0.782 19043 3591 1 12 . 1 1 4 4 LYS CB C 4 32.780 32.780 32.918 -0.138 19043 3592 1 12 . 1 1 4 4 LYS H H 4 8.337 8.337 7.994 0.343 19043 3593 1 12 . 1 1 5 5 PHE N N 5 119.538 119.538 118.349 1.189 19043 3594 1 12 . 1 1 5 5 PHE C C 5 175.433 175.433 175.165 0.268 19043 3595 1 12 . 1 1 5 5 PHE CA C 5 57.792 57.792 56.298 1.494 19043 3596 1 12 . 1 1 5 5 PHE CB C 5 40.067 40.067 38.618 1.449 19043 3597 1 12 . 1 1 5 5 PHE H H 5 8.277 8.277 7.607 0.670 19043 3598 1 12 . 1 1 6 6 ASN N N 6 121.168 121.168 121.114 0.054 19043 3599 1 12 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.692 0.125 19043 3600 1 12 . 1 1 6 6 ASN C C 6 175.884 175.884 176.475 -0.591 19043 3601 1 12 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.369 -0.584 19043 3602 1 12 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.640 -0.269 19043 3603 1 12 . 1 1 6 6 ASN H H 6 8.443 8.443 8.023 0.420 19043 3604 1 12 . 1 1 7 7 LYS N N 7 121.688 121.688 121.272 0.416 19043 3605 1 12 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.071 -0.126 19043 3606 1 12 . 1 1 7 7 LYS C C 7 178.196 178.196 178.263 -0.067 19043 3607 1 12 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.360 -0.459 19043 3608 1 12 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.099 0.026 19043 3609 1 12 . 1 1 7 7 LYS H H 7 8.460 8.460 8.628 -0.168 19043 3610 1 12 . 1 1 8 8 GLU N N 8 119.926 119.926 117.998 1.928 19043 3611 1 12 . 1 1 8 8 GLU HA H 8 4.081 4.081 3.970 0.111 19043 3612 1 12 . 1 1 8 8 GLU C C 8 179.894 179.894 178.679 1.215 19043 3613 1 12 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.620 0.219 19043 3614 1 12 . 1 1 8 8 GLU CB C 8 28.941 28.941 28.890 0.051 19043 3615 1 12 . 1 1 8 8 GLU H H 8 8.386 8.386 8.800 -0.414 19043 3616 1 12 . 1 1 9 9 GLN N N 9 121.401 121.401 117.432 3.969 19043 3617 1 12 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.160 -0.063 19043 3618 1 12 . 1 1 9 9 GLN C C 9 177.324 177.324 178.264 -0.940 19043 3619 1 12 . 1 1 9 9 GLN CA C 9 59.383 59.383 59.101 0.282 19043 3620 1 12 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.331 0.538 19043 3621 1 12 . 1 1 9 9 GLN H H 9 8.307 8.307 8.609 -0.302 19043 3622 1 12 . 1 1 10 10 GLN N N 10 120.060 120.060 120.459 -0.399 19043 3623 1 12 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.002 -0.780 19043 3624 1 12 . 1 1 10 10 GLN C C 10 176.888 176.888 178.173 -1.285 19043 3625 1 12 . 1 1 10 10 GLN CA C 10 58.949 58.949 59.213 -0.264 19043 3626 1 12 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.689 0.152 19043 3627 1 12 . 1 1 10 10 GLN H H 10 8.040 8.040 7.853 0.187 19043 3628 1 12 . 1 1 11 11 ASN N N 11 116.214 116.214 118.610 -2.396 19043 3629 1 12 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.567 -0.217 19043 3630 1 12 . 1 1 11 11 ASN C C 11 177.828 177.828 177.549 0.279 19043 3631 1 12 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.193 0.064 19043 3632 1 12 . 1 1 11 11 ASN CB C 11 38.210 38.210 37.923 0.287 19043 3633 1 12 . 1 1 11 11 ASN H H 11 8.366 8.366 8.451 -0.085 19043 3634 1 12 . 1 1 12 12 ALA N N 12 121.429 121.429 123.283 -1.854 19043 3635 1 12 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.042 -0.033 19043 3636 1 12 . 1 1 12 12 ALA C C 12 177.850 177.850 179.257 -1.407 19043 3637 1 12 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.864 0.429 19043 3638 1 12 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.430 -0.109 19043 3639 1 12 . 1 1 12 12 ALA H H 12 7.915 7.915 7.866 0.049 19043 3640 1 12 . 1 1 13 13 PHE N N 13 118.052 118.052 119.326 -1.274 19043 3641 1 12 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.965 -0.392 19043 3642 1 12 . 1 1 13 13 PHE C C 13 175.832 175.832 177.256 -1.424 19043 3643 1 12 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.729 0.126 19043 3644 1 12 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.972 -0.055 19043 3645 1 12 . 1 1 13 13 PHE H H 13 8.097 8.097 7.580 0.517 19043 3646 1 12 . 1 1 14 14 TYR N N 14 116.000 116.000 117.637 -1.637 19043 3647 1 12 . 1 1 14 14 TYR HA H 14 3.985 3.985 3.976 0.009 19043 3648 1 12 . 1 1 14 14 TYR C C 14 178.860 178.860 178.154 0.706 19043 3649 1 12 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.385 -1.590 19043 3650 1 12 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.576 -0.596 19043 3651 1 12 . 1 1 14 14 TYR H H 14 8.040 8.040 7.807 0.233 19043 3652 1 12 . 1 1 15 15 GLU N N 15 118.737 118.737 119.473 -0.736 19043 3653 1 12 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.811 0.160 19043 3654 1 12 . 1 1 15 15 GLU C C 15 180.184 180.184 179.065 1.119 19043 3655 1 12 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.112 1.495 19043 3656 1 12 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.270 0.452 19043 3657 1 12 . 1 1 15 15 GLU H H 15 8.244 8.244 8.354 -0.110 19043 3658 1 12 . 1 1 16 16 ILE N N 16 119.695 119.695 118.350 1.345 19043 3659 1 12 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.761 -0.408 19043 3660 1 12 . 1 1 16 16 ILE C C 16 177.760 177.760 176.851 0.909 19043 3661 1 12 . 1 1 16 16 ILE CA C 16 65.654 65.654 63.604 2.050 19043 3662 1 12 . 1 1 16 16 ILE CB C 16 37.403 37.403 38.203 -0.800 19043 3663 1 12 . 1 1 16 16 ILE H H 16 8.336 8.336 7.317 1.019 19043 3664 1 12 . 1 1 17 17 LEU N N 17 117.709 117.709 117.782 -0.073 19043 3665 1 12 . 1 1 17 17 LEU HA H 17 3.553 3.553 4.029 -0.476 19043 3666 1 12 . 1 1 17 17 LEU C C 17 176.565 176.565 177.819 -1.254 19043 3667 1 12 . 1 1 17 17 LEU CA C 17 57.559 57.559 56.783 0.776 19043 3668 1 12 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.849 -0.011 19043 3669 1 12 . 1 1 17 17 LEU H H 17 7.738 7.738 7.132 0.606 19043 3670 1 12 . 1 1 18 18 HIS N N 18 110.934 110.934 115.952 -5.018 19043 3671 1 12 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.323 0.174 19043 3672 1 12 . 1 1 18 18 HIS C C 18 175.243 175.243 175.824 -0.581 19043 3673 1 12 . 1 1 18 18 HIS CA C 18 56.056 56.056 56.982 -0.926 19043 3674 1 12 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.003 0.645 19043 3675 1 12 . 1 1 18 18 HIS H H 18 7.150 7.150 8.176 -1.026 19043 3676 1 12 . 1 1 19 19 LEU N N 19 123.586 123.586 121.947 1.639 19043 3677 1 12 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.227 0.191 19043 3678 1 12 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.924 -0.448 19043 3679 1 12 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.593 -1.271 19043 3680 1 12 . 1 1 19 19 LEU H H 19 7.249 7.249 7.710 -0.461 19043 3681 1 12 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.439 -0.008 19043 3682 1 12 . 1 1 20 20 PRO C C 20 178.092 178.092 177.473 0.619 19043 3683 1 12 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.209 0.688 19043 3684 1 12 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.486 0.086 19043 3685 1 12 . 1 1 21 21 ASN N N 21 113.952 113.952 116.501 -2.549 19043 3686 1 12 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.511 0.498 19043 3687 1 12 . 1 1 21 21 ASN C C 21 176.397 176.397 175.719 0.678 19043 3688 1 12 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.025 -1.396 19043 3689 1 12 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.346 0.465 19043 3690 1 12 . 1 1 21 21 ASN H H 21 8.871 8.871 8.080 0.791 19043 3691 1 12 . 1 1 22 22 LEU N N 22 117.526 117.526 121.944 -4.418 19043 3692 1 12 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.267 0.134 19043 3693 1 12 . 1 1 22 22 LEU C C 22 176.879 176.879 175.819 1.060 19043 3694 1 12 . 1 1 22 22 LEU CA C 22 54.457 54.457 55.205 -0.748 19043 3695 1 12 . 1 1 22 22 LEU CB C 22 42.520 42.520 42.849 -0.329 19043 3696 1 12 . 1 1 22 22 LEU H H 22 6.563 6.563 8.117 -1.554 19043 3697 1 12 . 1 1 23 23 ASN N N 23 120.219 120.219 124.521 -4.302 19043 3698 1 12 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.729 0.139 19043 3699 1 12 . 1 1 23 23 ASN C C 23 175.507 175.507 176.459 -0.952 19043 3700 1 12 . 1 1 23 23 ASN CA C 23 51.416 51.416 51.885 -0.468 19043 3701 1 12 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.019 -0.307 19043 3702 1 12 . 1 1 23 23 ASN H H 23 8.612 8.612 8.107 0.505 19043 3703 1 12 . 1 1 24 24 GLU N N 24 118.801 118.801 118.653 0.148 19043 3704 1 12 . 1 1 24 24 GLU HA H 24 3.874 3.874 4.040 -0.166 19043 3705 1 12 . 1 1 24 24 GLU C C 24 177.799 177.799 178.489 -0.690 19043 3706 1 12 . 1 1 24 24 GLU CA C 24 60.191 60.191 59.962 0.229 19043 3707 1 12 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.413 -0.049 19043 3708 1 12 . 1 1 24 24 GLU H H 24 8.735 8.735 8.774 -0.039 19043 3709 1 12 . 1 1 25 25 GLU N N 25 119.198 119.198 119.827 -0.629 19043 3710 1 12 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.002 -0.024 19043 3711 1 12 . 1 1 25 25 GLU C C 25 180.078 180.078 179.043 1.035 19043 3712 1 12 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.175 0.716 19043 3713 1 12 . 1 1 25 25 GLU CB C 25 29.131 29.131 28.868 0.263 19043 3714 1 12 . 1 1 25 25 GLU H H 25 8.229 8.229 8.704 -0.475 19043 3715 1 12 . 1 1 26 26 GLN N N 26 119.646 119.646 119.161 0.485 19043 3716 1 12 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.010 -0.070 19043 3717 1 12 . 1 1 26 26 GLN C C 26 178.154 178.154 178.389 -0.235 19043 3718 1 12 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.427 -0.534 19043 3719 1 12 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.787 0.115 19043 3720 1 12 . 1 1 26 26 GLN H H 26 8.425 8.425 8.738 -0.313 19043 3721 1 12 . 1 1 27 27 ARG N N 27 119.454 119.454 120.367 -0.913 19043 3722 1 12 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.128 -0.342 19043 3723 1 12 . 1 1 27 27 ARG C C 27 177.863 177.863 178.283 -0.420 19043 3724 1 12 . 1 1 27 27 ARG CA C 27 60.630 60.630 60.080 0.550 19043 3725 1 12 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.107 -0.463 19043 3726 1 12 . 1 1 27 27 ARG H H 27 8.548 8.548 7.774 0.774 19043 3727 1 12 . 1 1 28 28 ASN N N 28 116.833 116.833 117.837 -1.004 19043 3728 1 12 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.426 -0.094 19043 3729 1 12 . 1 1 28 28 ASN C C 28 177.234 177.234 177.443 -0.209 19043 3730 1 12 . 1 1 28 28 ASN CA C 28 56.038 56.038 55.998 0.040 19043 3731 1 12 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.326 -0.641 19043 3732 1 12 . 1 1 28 28 ASN H H 28 8.569 8.569 8.428 0.141 19043 3733 1 12 . 1 1 29 29 ALA N N 29 122.687 122.687 121.904 0.783 19043 3734 1 12 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.049 0.005 19043 3735 1 12 . 1 1 29 29 ALA C C 29 181.045 181.045 179.319 1.726 19043 3736 1 12 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.630 0.620 19043 3737 1 12 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.247 -0.427 19043 3738 1 12 . 1 1 29 29 ALA H H 29 7.793 7.793 7.525 0.268 19043 3739 1 12 . 1 1 30 30 PHE N N 30 116.979 116.979 118.183 -1.204 19043 3740 1 12 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.283 0.095 19043 3741 1 12 . 1 1 30 30 PHE C C 30 177.887 177.887 177.700 0.187 19043 3742 1 12 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.172 1.447 19043 3743 1 12 . 1 1 30 30 PHE CB C 30 39.459 39.459 39.007 0.452 19043 3744 1 12 . 1 1 30 30 PHE H H 30 8.017 8.017 7.472 0.545 19043 3745 1 12 . 1 1 31 31 ILE N N 31 119.553 119.553 119.628 -0.075 19043 3746 1 12 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.631 0.147 19043 3747 1 12 . 1 1 31 31 ILE C C 31 177.084 177.084 178.173 -1.089 19043 3748 1 12 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.359 0.286 19043 3749 1 12 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.597 -0.482 19043 3750 1 12 . 1 1 31 31 ILE H H 31 8.372 8.372 8.399 -0.027 19043 3751 1 12 . 1 1 32 32 GLN N N 32 119.108 119.108 119.619 -0.511 19043 3752 1 12 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.947 -0.141 19043 3753 1 12 . 1 1 32 32 GLN C C 32 177.836 177.836 178.463 -0.627 19043 3754 1 12 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.622 -0.854 19043 3755 1 12 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.848 -0.870 19043 3756 1 12 . 1 1 32 32 GLN H H 32 8.389 8.389 8.499 -0.110 19043 3757 1 12 . 1 1 33 33 SER N N 33 114.437 114.437 115.351 -0.914 19043 3758 1 12 . 1 1 33 33 SER HA H 33 4.212 4.212 4.308 -0.096 19043 3759 1 12 . 1 1 33 33 SER C C 33 175.469 175.469 176.596 -1.127 19043 3760 1 12 . 1 1 33 33 SER CA C 33 62.403 62.403 60.808 1.595 19043 3761 1 12 . 1 1 33 33 SER CB C 33 63.794 63.794 63.305 0.489 19043 3762 1 12 . 1 1 33 33 SER H H 33 8.078 8.078 7.679 0.399 19043 3763 1 12 . 1 1 34 34 LEU N N 34 122.967 122.967 123.372 -0.405 19043 3764 1 12 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.222 -0.312 19043 3765 1 12 . 1 1 34 34 LEU C C 34 177.506 177.506 177.961 -0.455 19043 3766 1 12 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.348 0.080 19043 3767 1 12 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.115 0.697 19043 3768 1 12 . 1 1 34 34 LEU H H 34 8.495 8.495 8.364 0.131 19043 3769 1 12 . 1 1 35 35 LYS N N 35 115.859 115.859 119.093 -3.234 19043 3770 1 12 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.269 -0.456 19043 3771 1 12 . 1 1 35 35 LYS C C 35 177.628 177.628 178.236 -0.608 19043 3772 1 12 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.526 -1.649 19043 3773 1 12 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.264 -0.245 19043 3774 1 12 . 1 1 35 35 LYS H H 35 7.815 7.815 7.614 0.201 19043 3775 1 12 . 1 1 36 36 ASP N N 36 116.741 116.741 117.957 -1.216 19043 3776 1 12 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.618 -0.104 19043 3777 1 12 . 1 1 36 36 ASP C C 36 177.324 177.324 176.257 1.067 19043 3778 1 12 . 1 1 36 36 ASP CA C 36 56.686 56.686 56.087 0.599 19043 3779 1 12 . 1 1 36 36 ASP CB C 36 40.671 40.671 41.618 -0.947 19043 3780 1 12 . 1 1 36 36 ASP H H 36 7.943 7.943 7.781 0.162 19043 3781 1 12 . 1 1 37 37 ASP N N 37 116.686 116.686 118.299 -1.613 19043 3782 1 12 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.046 -0.005 19043 3783 1 12 . 1 1 37 37 ASP CA C 37 51.946 51.946 51.566 0.380 19043 3784 1 12 . 1 1 37 37 ASP CB C 37 40.523 40.523 41.734 -1.211 19043 3785 1 12 . 1 1 37 37 ASP H H 37 8.125 8.125 7.862 0.263 19043 3786 1 12 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.492 0.091 19043 3787 1 12 . 1 1 38 38 PRO C C 38 179.200 179.200 178.282 0.918 19043 3788 1 12 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.554 -0.017 19043 3789 1 12 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.096 -0.210 19043 3790 1 12 . 1 1 39 39 SER N N 39 114.963 114.963 112.540 2.423 19043 3791 1 12 . 1 1 39 39 SER HA H 39 4.178 4.178 4.232 -0.054 19043 3792 1 12 . 1 1 39 39 SER C C 39 176.151 176.151 176.108 0.043 19043 3793 1 12 . 1 1 39 39 SER CA C 39 61.197 61.197 60.515 0.682 19043 3794 1 12 . 1 1 39 39 SER CB C 39 62.729 62.729 62.266 0.463 19043 3795 1 12 . 1 1 39 39 SER H H 39 8.315 8.315 8.394 -0.079 19043 3796 1 12 . 1 1 40 40 GLN N N 40 120.058 120.058 120.102 -0.044 19043 3797 1 12 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.484 0.176 19043 3798 1 12 . 1 1 40 40 GLN C C 40 176.192 176.192 177.300 -1.108 19043 3799 1 12 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.569 -0.588 19043 3800 1 12 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.011 0.157 19043 3801 1 12 . 1 1 40 40 GLN H H 40 7.820 7.820 7.908 -0.088 19043 3802 1 12 . 1 1 41 41 SER N N 41 115.553 115.553 116.734 -1.181 19043 3803 1 12 . 1 1 41 41 SER HA H 41 3.845 3.845 4.105 -0.260 19043 3804 1 12 . 1 1 41 41 SER C C 41 174.181 174.181 175.465 -1.284 19043 3805 1 12 . 1 1 41 41 SER CA C 41 63.957 63.957 61.717 2.240 19043 3806 1 12 . 1 1 41 41 SER CB C 41 63.191 63.191 62.361 0.831 19043 3807 1 12 . 1 1 41 41 SER H H 41 7.666 7.666 7.851 -0.185 19043 3808 1 12 . 1 1 42 42 ALA N N 42 122.360 122.360 122.454 -0.094 19043 3809 1 12 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.219 -0.096 19043 3810 1 12 . 1 1 42 42 ALA C C 42 180.996 180.996 178.786 2.210 19043 3811 1 12 . 1 1 42 42 ALA CA C 42 55.563 55.563 53.833 1.730 19043 3812 1 12 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.321 -1.265 19043 3813 1 12 . 1 1 42 42 ALA H H 42 8.556 8.556 7.837 0.719 19043 3814 1 12 . 1 1 43 43 ASN N N 43 118.974 118.974 118.884 0.090 19043 3815 1 12 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.567 -0.048 19043 3816 1 12 . 1 1 43 43 ASN C C 43 177.972 177.972 177.708 0.264 19043 3817 1 12 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.321 -0.467 19043 3818 1 12 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.444 -0.295 19043 3819 1 12 . 1 1 43 43 ASN H H 43 7.950 7.950 7.687 0.263 19043 3820 1 12 . 1 1 44 44 LEU N N 44 122.070 122.070 120.665 1.405 19043 3821 1 12 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.366 -0.177 19043 3822 1 12 . 1 1 44 44 LEU C C 44 178.332 178.332 179.380 -1.048 19043 3823 1 12 . 1 1 44 44 LEU CA C 44 57.834 57.834 58.039 -0.205 19043 3824 1 12 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.853 0.498 19043 3825 1 12 . 1 1 44 44 LEU H H 44 8.789 8.789 8.564 0.225 19043 3826 1 12 . 1 1 45 45 LEU N N 45 118.621 118.621 119.113 -0.492 19043 3827 1 12 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.727 0.078 19043 3828 1 12 . 1 1 45 45 LEU C C 45 177.832 177.832 178.400 -0.568 19043 3829 1 12 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.672 0.213 19043 3830 1 12 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.587 0.220 19043 3831 1 12 . 1 1 45 45 LEU H H 45 8.283 8.283 7.557 0.726 19043 3832 1 12 . 1 1 46 46 ALA N N 46 119.525 119.525 120.528 -1.003 19043 3833 1 12 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.900 0.110 19043 3834 1 12 . 1 1 46 46 ALA C C 46 181.250 181.250 180.007 1.243 19043 3835 1 12 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.029 0.267 19043 3836 1 12 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.063 -0.112 19043 3837 1 12 . 1 1 46 46 ALA H H 46 7.640 7.640 7.706 -0.066 19043 3838 1 12 . 1 1 47 47 GLU N N 47 119.572 119.572 118.182 1.390 19043 3839 1 12 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.126 -0.096 19043 3840 1 12 . 1 1 47 47 GLU C C 47 178.895 178.895 178.779 0.116 19043 3841 1 12 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.819 0.347 19043 3842 1 12 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.848 -0.310 19043 3843 1 12 . 1 1 47 47 GLU H H 47 8.139 8.139 8.445 -0.306 19043 3844 1 12 . 1 1 48 48 ALA N N 48 123.953 123.953 122.609 1.344 19043 3845 1 12 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.684 -0.157 19043 3846 1 12 . 1 1 48 48 ALA C C 48 179.636 179.636 179.141 0.495 19043 3847 1 12 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.421 1.095 19043 3848 1 12 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.676 -0.431 19043 3849 1 12 . 1 1 48 48 ALA H H 48 8.468 8.468 7.605 0.863 19043 3850 1 12 . 1 1 49 49 LYS N N 49 117.926 117.926 118.075 -0.149 19043 3851 1 12 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.931 -0.192 19043 3852 1 12 . 1 1 49 49 LYS C C 49 178.761 178.761 178.696 0.065 19043 3853 1 12 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.582 0.810 19043 3854 1 12 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.344 -0.255 19043 3855 1 12 . 1 1 49 49 LYS H H 49 8.459 8.459 8.312 0.147 19043 3856 1 12 . 1 1 50 50 LYS N N 50 120.194 120.194 119.474 0.720 19043 3857 1 12 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.085 0.003 19043 3858 1 12 . 1 1 50 50 LYS C C 50 179.859 179.859 178.771 1.088 19043 3859 1 12 . 1 1 50 50 LYS CA C 50 59.735 59.735 58.993 0.742 19043 3860 1 12 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.542 -0.080 19043 3861 1 12 . 1 1 50 50 LYS H H 50 7.702 7.702 7.634 0.068 19043 3862 1 12 . 1 1 51 51 LEU N N 51 122.126 122.126 119.958 2.168 19043 3863 1 12 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.155 -0.028 19043 3864 1 12 . 1 1 51 51 LEU C C 51 178.123 178.123 178.225 -0.102 19043 3865 1 12 . 1 1 51 51 LEU CA C 51 57.597 57.597 57.110 0.487 19043 3866 1 12 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.028 0.325 19043 3867 1 12 . 1 1 51 51 LEU H H 51 8.023 8.023 7.544 0.479 19043 3868 1 12 . 1 1 52 52 ASN N N 52 116.675 116.675 116.559 0.116 19043 3869 1 12 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.426 -0.491 19043 3870 1 12 . 1 1 52 52 ASN C C 52 177.668 177.668 175.777 1.891 19043 3871 1 12 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.123 1.794 19043 3872 1 12 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.697 3.239 19043 3873 1 12 . 1 1 52 52 ASN H H 52 8.537 8.537 8.243 0.294 19043 3874 1 12 . 1 1 53 53 ASP N N 53 118.725 118.725 117.314 1.411 19043 3875 1 12 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.541 -0.097 19043 3876 1 12 . 1 1 53 53 ASP C C 53 178.936 178.936 176.947 1.989 19043 3877 1 12 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.325 1.608 19043 3878 1 12 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.312 -1.217 19043 3879 1 12 . 1 1 53 53 ASP H H 53 8.220 8.220 7.677 0.543 19043 3880 1 12 . 1 1 54 54 ALA N N 54 122.872 122.872 122.181 0.691 19043 3881 1 12 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.207 0.025 19043 3882 1 12 . 1 1 54 54 ALA C C 54 179.354 179.354 178.792 0.562 19043 3883 1 12 . 1 1 54 54 ALA CA C 54 54.341 54.341 53.860 0.481 19043 3884 1 12 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.310 -0.705 19043 3885 1 12 . 1 1 54 54 ALA H H 54 8.037 8.037 7.292 0.745 19043 3886 1 12 . 1 1 55 55 GLN N N 55 115.052 115.052 116.305 -1.253 19043 3887 1 12 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.311 0.067 19043 3888 1 12 . 1 1 55 55 GLN C C 55 174.116 174.116 175.120 -1.004 19043 3889 1 12 . 1 1 55 55 GLN CA C 55 54.954 54.954 54.978 -0.024 19043 3890 1 12 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.180 -0.956 19043 3891 1 12 . 1 1 55 55 GLN H H 55 7.512 7.512 7.753 -0.241 19043 3892 1 12 . 1 1 56 56 ALA N N 56 124.556 124.556 123.985 0.571 19043 3893 1 12 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.335 0.013 19043 3894 1 12 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.068 -0.031 19043 3895 1 12 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.530 -0.551 19043 3896 1 12 . 1 1 56 56 ALA H H 56 7.100 7.100 7.689 -0.589 19043 3897 1 12 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.474 -0.062 19043 3898 1 12 . 1 1 57 57 PRO C C 57 176.151 176.151 176.612 -0.461 19043 3899 1 12 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.482 0.801 19043 3900 1 12 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.204 -0.211 19043 3901 1 13 . 1 1 2 2 ASP N N 2 125.357 125.357 120.187 5.170 19043 3902 1 13 . 1 1 2 2 ASP C C 2 175.535 175.535 175.033 0.502 19043 3903 1 13 . 1 1 2 2 ASP CA C 2 54.307 54.307 54.503 -0.196 19043 3904 1 13 . 1 1 2 2 ASP CB C 2 41.470 41.470 41.780 -0.310 19043 3905 1 13 . 1 1 2 2 ASP H H 2 8.762 8.762 8.570 0.192 19043 3906 1 13 . 1 1 3 3 ASN N N 3 120.441 120.441 119.062 1.379 19043 3907 1 13 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.635 0.065 19043 3908 1 13 . 1 1 3 3 ASN C C 3 175.246 175.246 174.003 1.243 19043 3909 1 13 . 1 1 3 3 ASN CA C 3 53.289 53.289 52.620 0.669 19043 3910 1 13 . 1 1 3 3 ASN CB C 3 39.086 39.086 39.412 -0.326 19043 3911 1 13 . 1 1 3 3 ASN H H 3 8.548 8.548 7.699 0.849 19043 3912 1 13 . 1 1 4 4 LYS N N 4 121.461 121.461 119.508 1.953 19043 3913 1 13 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.258 -0.043 19043 3914 1 13 . 1 1 4 4 LYS C C 4 176.404 176.404 176.273 0.131 19043 3915 1 13 . 1 1 4 4 LYS CA C 4 56.853 56.853 57.127 -0.274 19043 3916 1 13 . 1 1 4 4 LYS CB C 4 32.780 32.780 32.233 0.547 19043 3917 1 13 . 1 1 4 4 LYS H H 4 8.337 8.337 8.531 -0.194 19043 3918 1 13 . 1 1 5 5 PHE N N 5 119.538 119.538 114.479 5.059 19043 3919 1 13 . 1 1 5 5 PHE C C 5 175.433 175.433 175.977 -0.544 19043 3920 1 13 . 1 1 5 5 PHE CA C 5 57.792 57.792 57.938 -0.146 19043 3921 1 13 . 1 1 5 5 PHE CB C 5 40.067 40.067 36.367 3.700 19043 3922 1 13 . 1 1 5 5 PHE H H 5 8.277 8.277 7.671 0.606 19043 3923 1 13 . 1 1 6 6 ASN N N 6 121.168 121.168 120.860 0.308 19043 3924 1 13 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.643 0.174 19043 3925 1 13 . 1 1 6 6 ASN C C 6 175.884 175.884 176.001 -0.117 19043 3926 1 13 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.011 -0.226 19043 3927 1 13 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.370 0.001 19043 3928 1 13 . 1 1 6 6 ASN H H 6 8.443 8.443 8.380 0.063 19043 3929 1 13 . 1 1 7 7 LYS N N 7 121.688 121.688 120.087 1.601 19043 3930 1 13 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.135 -0.190 19043 3931 1 13 . 1 1 7 7 LYS C C 7 178.196 178.196 178.494 -0.298 19043 3932 1 13 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.060 -0.159 19043 3933 1 13 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.158 -0.034 19043 3934 1 13 . 1 1 7 7 LYS H H 7 8.460 8.460 8.704 -0.244 19043 3935 1 13 . 1 1 8 8 GLU N N 8 119.926 119.926 118.451 1.475 19043 3936 1 13 . 1 1 8 8 GLU HA H 8 4.081 4.081 3.998 0.083 19043 3937 1 13 . 1 1 8 8 GLU C C 8 179.894 179.894 178.807 1.087 19043 3938 1 13 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.591 0.248 19043 3939 1 13 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.040 -0.099 19043 3940 1 13 . 1 1 8 8 GLU H H 8 8.386 8.386 8.886 -0.500 19043 3941 1 13 . 1 1 9 9 GLN N N 9 121.401 121.401 118.120 3.281 19043 3942 1 13 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.164 -0.067 19043 3943 1 13 . 1 1 9 9 GLN C C 9 177.324 177.324 178.249 -0.925 19043 3944 1 13 . 1 1 9 9 GLN CA C 9 59.383 59.383 58.892 0.492 19043 3945 1 13 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.571 0.298 19043 3946 1 13 . 1 1 9 9 GLN H H 9 8.307 8.307 8.611 -0.304 19043 3947 1 13 . 1 1 10 10 GLN N N 10 120.060 120.060 119.988 0.072 19043 3948 1 13 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.134 -0.912 19043 3949 1 13 . 1 1 10 10 GLN C C 10 176.888 176.888 178.290 -1.402 19043 3950 1 13 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.978 -0.029 19043 3951 1 13 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.674 0.167 19043 3952 1 13 . 1 1 10 10 GLN H H 10 8.040 8.040 7.758 0.282 19043 3953 1 13 . 1 1 11 11 ASN N N 11 116.214 116.214 118.999 -2.785 19043 3954 1 13 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.581 -0.231 19043 3955 1 13 . 1 1 11 11 ASN C C 11 177.828 177.828 177.598 0.230 19043 3956 1 13 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.202 0.056 19043 3957 1 13 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.047 0.163 19043 3958 1 13 . 1 1 11 11 ASN H H 11 8.366 8.366 8.524 -0.158 19043 3959 1 13 . 1 1 12 12 ALA N N 12 121.429 121.429 122.646 -1.217 19043 3960 1 13 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.081 -0.072 19043 3961 1 13 . 1 1 12 12 ALA C C 12 177.850 177.850 179.300 -1.450 19043 3962 1 13 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.780 0.513 19043 3963 1 13 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.402 -0.081 19043 3964 1 13 . 1 1 12 12 ALA H H 12 7.915 7.915 7.958 -0.043 19043 3965 1 13 . 1 1 13 13 PHE N N 13 118.052 118.052 120.254 -2.202 19043 3966 1 13 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.981 -0.408 19043 3967 1 13 . 1 1 13 13 PHE C C 13 175.832 175.832 177.143 -1.311 19043 3968 1 13 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.975 -0.120 19043 3969 1 13 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.996 -0.079 19043 3970 1 13 . 1 1 13 13 PHE H H 13 8.097 8.097 7.422 0.675 19043 3971 1 13 . 1 1 14 14 TYR N N 14 116.000 116.000 117.841 -1.841 19043 3972 1 13 . 1 1 14 14 TYR HA H 14 3.985 3.985 3.938 0.047 19043 3973 1 13 . 1 1 14 14 TYR C C 14 178.860 178.860 178.234 0.626 19043 3974 1 13 . 1 1 14 14 TYR CA C 14 59.795 59.795 62.362 -2.567 19043 3975 1 13 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.840 -0.860 19043 3976 1 13 . 1 1 14 14 TYR H H 14 8.040 8.040 7.820 0.220 19043 3977 1 13 . 1 1 15 15 GLU N N 15 118.737 118.737 118.298 0.439 19043 3978 1 13 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.812 0.159 19043 3979 1 13 . 1 1 15 15 GLU C C 15 180.184 180.184 178.822 1.362 19043 3980 1 13 . 1 1 15 15 GLU CA C 15 60.607 60.607 58.986 1.621 19043 3981 1 13 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.268 0.454 19043 3982 1 13 . 1 1 15 15 GLU H H 15 8.244 8.244 8.313 -0.069 19043 3983 1 13 . 1 1 16 16 ILE N N 16 119.695 119.695 118.492 1.203 19043 3984 1 13 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.744 -0.391 19043 3985 1 13 . 1 1 16 16 ILE C C 16 177.760 177.760 177.406 0.354 19043 3986 1 13 . 1 1 16 16 ILE CA C 16 65.654 65.654 63.956 1.698 19043 3987 1 13 . 1 1 16 16 ILE CB C 16 37.403 37.403 38.021 -0.618 19043 3988 1 13 . 1 1 16 16 ILE H H 16 8.336 8.336 7.354 0.982 19043 3989 1 13 . 1 1 17 17 LEU N N 17 117.709 117.709 120.181 -2.472 19043 3990 1 13 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.932 -0.379 19043 3991 1 13 . 1 1 17 17 LEU C C 17 176.565 176.565 178.090 -1.525 19043 3992 1 13 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.548 0.011 19043 3993 1 13 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.785 0.053 19043 3994 1 13 . 1 1 17 17 LEU H H 17 7.738 7.738 7.572 0.166 19043 3995 1 13 . 1 1 18 18 HIS N N 18 110.934 110.934 115.657 -4.723 19043 3996 1 13 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.275 0.222 19043 3997 1 13 . 1 1 18 18 HIS C C 18 175.243 175.243 175.883 -0.640 19043 3998 1 13 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.336 -1.280 19043 3999 1 13 . 1 1 18 18 HIS CB C 18 30.648 30.648 29.990 0.658 19043 4000 1 13 . 1 1 18 18 HIS H H 18 7.150 7.150 8.084 -0.934 19043 4001 1 13 . 1 1 19 19 LEU N N 19 123.586 123.586 121.982 1.604 19043 4002 1 13 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.296 0.122 19043 4003 1 13 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.694 -0.218 19043 4004 1 13 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.497 -1.175 19043 4005 1 13 . 1 1 19 19 LEU H H 19 7.249 7.249 7.728 -0.479 19043 4006 1 13 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.451 -0.020 19043 4007 1 13 . 1 1 20 20 PRO C C 20 178.092 178.092 177.641 0.451 19043 4008 1 13 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.674 0.223 19043 4009 1 13 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.181 0.390 19043 4010 1 13 . 1 1 21 21 ASN N N 21 113.952 113.952 116.717 -2.765 19043 4011 1 13 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.525 0.484 19043 4012 1 13 . 1 1 21 21 ASN C C 21 176.397 176.397 175.613 0.784 19043 4013 1 13 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.063 -1.434 19043 4014 1 13 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.413 0.397 19043 4015 1 13 . 1 1 21 21 ASN H H 21 8.871 8.871 8.158 0.713 19043 4016 1 13 . 1 1 22 22 LEU N N 22 117.526 117.526 121.890 -4.364 19043 4017 1 13 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.405 -0.004 19043 4018 1 13 . 1 1 22 22 LEU C C 22 176.879 176.879 174.906 1.973 19043 4019 1 13 . 1 1 22 22 LEU CA C 22 54.457 54.457 54.551 -0.094 19043 4020 1 13 . 1 1 22 22 LEU CB C 22 42.520 42.520 43.691 -1.171 19043 4021 1 13 . 1 1 22 22 LEU H H 22 6.563 6.563 8.168 -1.605 19043 4022 1 13 . 1 1 23 23 ASN N N 23 120.219 120.219 122.082 -1.863 19043 4023 1 13 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.720 0.148 19043 4024 1 13 . 1 1 23 23 ASN C C 23 175.507 175.507 176.466 -0.959 19043 4025 1 13 . 1 1 23 23 ASN CA C 23 51.416 51.416 51.724 -0.308 19043 4026 1 13 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.405 -0.693 19043 4027 1 13 . 1 1 23 23 ASN H H 23 8.612 8.612 8.244 0.368 19043 4028 1 13 . 1 1 24 24 GLU N N 24 118.801 118.801 119.593 -0.792 19043 4029 1 13 . 1 1 24 24 GLU HA H 24 3.874 3.874 3.982 -0.108 19043 4030 1 13 . 1 1 24 24 GLU C C 24 177.799 177.799 178.564 -0.765 19043 4031 1 13 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.349 -0.158 19043 4032 1 13 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.141 0.224 19043 4033 1 13 . 1 1 24 24 GLU H H 24 8.735 8.735 8.940 -0.205 19043 4034 1 13 . 1 1 25 25 GLU N N 25 119.198 119.198 119.101 0.097 19043 4035 1 13 . 1 1 25 25 GLU HA H 25 3.978 3.978 3.994 -0.016 19043 4036 1 13 . 1 1 25 25 GLU C C 25 180.078 180.078 179.369 0.709 19043 4037 1 13 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.412 0.479 19043 4038 1 13 . 1 1 25 25 GLU CB C 25 29.131 29.131 29.116 0.016 19043 4039 1 13 . 1 1 25 25 GLU H H 25 8.229 8.229 8.611 -0.382 19043 4040 1 13 . 1 1 26 26 GLN N N 26 119.646 119.646 117.636 2.010 19043 4041 1 13 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.174 -0.234 19043 4042 1 13 . 1 1 26 26 GLN C C 26 178.154 178.154 178.380 -0.226 19043 4043 1 13 . 1 1 26 26 GLN CA C 26 57.893 57.893 57.974 -0.081 19043 4044 1 13 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.805 0.097 19043 4045 1 13 . 1 1 26 26 GLN H H 26 8.425 8.425 8.519 -0.094 19043 4046 1 13 . 1 1 27 27 ARG N N 27 119.454 119.454 120.981 -1.527 19043 4047 1 13 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.172 -0.386 19043 4048 1 13 . 1 1 27 27 ARG C C 27 177.863 177.863 178.550 -0.687 19043 4049 1 13 . 1 1 27 27 ARG CA C 27 60.630 60.630 59.658 0.972 19043 4050 1 13 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.088 -0.445 19043 4051 1 13 . 1 1 27 27 ARG H H 27 8.548 8.548 8.414 0.134 19043 4052 1 13 . 1 1 28 28 ASN N N 28 116.833 116.833 117.536 -0.703 19043 4053 1 13 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.526 -0.194 19043 4054 1 13 . 1 1 28 28 ASN C C 28 177.234 177.234 177.283 -0.049 19043 4055 1 13 . 1 1 28 28 ASN CA C 28 56.038 56.038 56.002 0.036 19043 4056 1 13 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.451 -0.766 19043 4057 1 13 . 1 1 28 28 ASN H H 28 8.569 8.569 8.584 -0.015 19043 4058 1 13 . 1 1 29 29 ALA N N 29 122.687 122.687 123.501 -0.814 19043 4059 1 13 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.044 0.010 19043 4060 1 13 . 1 1 29 29 ALA C C 29 181.045 181.045 179.234 1.811 19043 4061 1 13 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.724 0.526 19043 4062 1 13 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.172 -0.353 19043 4063 1 13 . 1 1 29 29 ALA H H 29 7.793 7.793 7.747 0.046 19043 4064 1 13 . 1 1 30 30 PHE N N 30 116.979 116.979 118.340 -1.361 19043 4065 1 13 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.225 0.153 19043 4066 1 13 . 1 1 30 30 PHE C C 30 177.887 177.887 177.954 -0.067 19043 4067 1 13 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.919 0.700 19043 4068 1 13 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.869 0.590 19043 4069 1 13 . 1 1 30 30 PHE H H 30 8.017 8.017 7.790 0.227 19043 4070 1 13 . 1 1 31 31 ILE N N 31 119.553 119.553 119.056 0.497 19043 4071 1 13 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.611 0.167 19043 4072 1 13 . 1 1 31 31 ILE C C 31 177.084 177.084 178.040 -0.956 19043 4073 1 13 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.328 0.317 19043 4074 1 13 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.611 -0.496 19043 4075 1 13 . 1 1 31 31 ILE H H 31 8.372 8.372 8.476 -0.104 19043 4076 1 13 . 1 1 32 32 GLN N N 32 119.108 119.108 119.719 -0.611 19043 4077 1 13 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.912 -0.106 19043 4078 1 13 . 1 1 32 32 GLN C C 32 177.836 177.836 178.534 -0.698 19043 4079 1 13 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.646 -0.878 19043 4080 1 13 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.785 -0.807 19043 4081 1 13 . 1 1 32 32 GLN H H 32 8.389 8.389 8.100 0.289 19043 4082 1 13 . 1 1 33 33 SER N N 33 114.437 114.437 115.310 -0.873 19043 4083 1 13 . 1 1 33 33 SER HA H 33 4.212 4.212 4.231 -0.019 19043 4084 1 13 . 1 1 33 33 SER C C 33 175.469 175.469 176.725 -1.256 19043 4085 1 13 . 1 1 33 33 SER CA C 33 62.403 62.403 61.020 1.383 19043 4086 1 13 . 1 1 33 33 SER CB C 33 63.794 63.794 63.114 0.680 19043 4087 1 13 . 1 1 33 33 SER H H 33 8.078 8.078 7.840 0.238 19043 4088 1 13 . 1 1 34 34 LEU N N 34 122.967 122.967 123.541 -0.574 19043 4089 1 13 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.244 -0.334 19043 4090 1 13 . 1 1 34 34 LEU C C 34 177.506 177.506 177.973 -0.467 19043 4091 1 13 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.227 0.201 19043 4092 1 13 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.224 0.588 19043 4093 1 13 . 1 1 34 34 LEU H H 34 8.495 8.495 8.086 0.409 19043 4094 1 13 . 1 1 35 35 LYS N N 35 115.859 115.859 119.202 -3.343 19043 4095 1 13 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.194 -0.381 19043 4096 1 13 . 1 1 35 35 LYS C C 35 177.628 177.628 178.039 -0.411 19043 4097 1 13 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.533 -1.656 19043 4098 1 13 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.213 -0.194 19043 4099 1 13 . 1 1 35 35 LYS H H 35 7.815 7.815 7.693 0.122 19043 4100 1 13 . 1 1 36 36 ASP N N 36 116.741 116.741 116.802 -0.061 19043 4101 1 13 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.705 -0.191 19043 4102 1 13 . 1 1 36 36 ASP C C 36 177.324 177.324 176.166 1.158 19043 4103 1 13 . 1 1 36 36 ASP CA C 36 56.686 56.686 55.993 0.693 19043 4104 1 13 . 1 1 36 36 ASP CB C 36 40.671 40.671 42.142 -1.471 19043 4105 1 13 . 1 1 36 36 ASP H H 36 7.943 7.943 7.898 0.045 19043 4106 1 13 . 1 1 37 37 ASP N N 37 116.686 116.686 118.592 -1.906 19043 4107 1 13 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.098 -0.057 19043 4108 1 13 . 1 1 37 37 ASP CA C 37 51.946 51.946 51.571 0.375 19043 4109 1 13 . 1 1 37 37 ASP CB C 37 40.523 40.523 41.914 -1.391 19043 4110 1 13 . 1 1 37 37 ASP H H 37 8.125 8.125 7.935 0.190 19043 4111 1 13 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.476 0.107 19043 4112 1 13 . 1 1 38 38 PRO C C 38 179.200 179.200 177.873 1.327 19043 4113 1 13 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.497 0.040 19043 4114 1 13 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.015 -0.129 19043 4115 1 13 . 1 1 39 39 SER N N 39 114.963 114.963 114.908 0.055 19043 4116 1 13 . 1 1 39 39 SER HA H 39 4.178 4.178 4.310 -0.132 19043 4117 1 13 . 1 1 39 39 SER C C 39 176.151 176.151 175.796 0.355 19043 4118 1 13 . 1 1 39 39 SER CA C 39 61.197 61.197 60.766 0.431 19043 4119 1 13 . 1 1 39 39 SER CB C 39 62.729 62.729 62.103 0.626 19043 4120 1 13 . 1 1 39 39 SER H H 39 8.315 8.315 8.559 -0.244 19043 4121 1 13 . 1 1 40 40 GLN N N 40 120.058 120.058 120.842 -0.784 19043 4122 1 13 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.543 0.117 19043 4123 1 13 . 1 1 40 40 GLN C C 40 176.192 176.192 177.107 -0.915 19043 4124 1 13 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.431 -0.450 19043 4125 1 13 . 1 1 40 40 GLN CB C 40 28.168 28.168 27.912 0.256 19043 4126 1 13 . 1 1 40 40 GLN H H 40 7.820 7.820 7.907 -0.087 19043 4127 1 13 . 1 1 41 41 SER N N 41 115.553 115.553 116.648 -1.095 19043 4128 1 13 . 1 1 41 41 SER HA H 41 3.845 3.845 4.113 -0.268 19043 4129 1 13 . 1 1 41 41 SER C C 41 174.181 174.181 175.125 -0.944 19043 4130 1 13 . 1 1 41 41 SER CA C 41 63.957 63.957 60.957 3.000 19043 4131 1 13 . 1 1 41 41 SER CB C 41 63.191 63.191 63.041 0.151 19043 4132 1 13 . 1 1 41 41 SER H H 41 7.666 7.666 7.612 0.054 19043 4133 1 13 . 1 1 42 42 ALA N N 42 122.360 122.360 121.456 0.904 19043 4134 1 13 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.254 -0.131 19043 4135 1 13 . 1 1 42 42 ALA C C 42 180.996 180.996 178.506 2.490 19043 4136 1 13 . 1 1 42 42 ALA CA C 42 55.563 55.563 53.785 1.778 19043 4137 1 13 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.240 -1.184 19043 4138 1 13 . 1 1 42 42 ALA H H 42 8.556 8.556 8.058 0.498 19043 4139 1 13 . 1 1 43 43 ASN N N 43 118.974 118.974 119.008 -0.034 19043 4140 1 13 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.561 -0.042 19043 4141 1 13 . 1 1 43 43 ASN C C 43 177.972 177.972 177.716 0.256 19043 4142 1 13 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.169 -0.315 19043 4143 1 13 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.560 -0.411 19043 4144 1 13 . 1 1 43 43 ASN H H 43 7.950 7.950 7.781 0.169 19043 4145 1 13 . 1 1 44 44 LEU N N 44 122.070 122.070 120.651 1.419 19043 4146 1 13 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.243 -0.054 19043 4147 1 13 . 1 1 44 44 LEU C C 44 178.332 178.332 179.332 -1.000 19043 4148 1 13 . 1 1 44 44 LEU CA C 44 57.834 57.834 58.116 -0.282 19043 4149 1 13 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.883 0.468 19043 4150 1 13 . 1 1 44 44 LEU H H 44 8.789 8.789 8.517 0.272 19043 4151 1 13 . 1 1 45 45 LEU N N 45 118.621 118.621 119.157 -0.536 19043 4152 1 13 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.764 0.041 19043 4153 1 13 . 1 1 45 45 LEU C C 45 177.832 177.832 178.513 -0.681 19043 4154 1 13 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.741 0.144 19043 4155 1 13 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.611 0.195 19043 4156 1 13 . 1 1 45 45 LEU H H 45 8.283 8.283 7.607 0.676 19043 4157 1 13 . 1 1 46 46 ALA N N 46 119.525 119.525 120.680 -1.155 19043 4158 1 13 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.894 0.116 19043 4159 1 13 . 1 1 46 46 ALA C C 46 181.250 181.250 179.991 1.259 19043 4160 1 13 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.124 0.172 19043 4161 1 13 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.046 -0.095 19043 4162 1 13 . 1 1 46 46 ALA H H 46 7.640 7.640 7.745 -0.105 19043 4163 1 13 . 1 1 47 47 GLU N N 47 119.572 119.572 118.230 1.342 19043 4164 1 13 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.120 -0.090 19043 4165 1 13 . 1 1 47 47 GLU C C 47 178.895 178.895 178.904 -0.009 19043 4166 1 13 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.977 0.189 19043 4167 1 13 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.861 -0.323 19043 4168 1 13 . 1 1 47 47 GLU H H 47 8.139 8.139 8.480 -0.341 19043 4169 1 13 . 1 1 48 48 ALA N N 48 123.953 123.953 122.564 1.389 19043 4170 1 13 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.647 -0.120 19043 4171 1 13 . 1 1 48 48 ALA C C 48 179.636 179.636 179.168 0.468 19043 4172 1 13 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.422 1.094 19043 4173 1 13 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.691 -0.446 19043 4174 1 13 . 1 1 48 48 ALA H H 48 8.468 8.468 7.719 0.749 19043 4175 1 13 . 1 1 49 49 LYS N N 49 117.926 117.926 118.210 -0.284 19043 4176 1 13 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.922 -0.183 19043 4177 1 13 . 1 1 49 49 LYS C C 49 178.761 178.761 178.730 0.031 19043 4178 1 13 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.560 0.832 19043 4179 1 13 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.357 -0.268 19043 4180 1 13 . 1 1 49 49 LYS H H 49 8.459 8.459 8.401 0.058 19043 4181 1 13 . 1 1 50 50 LYS N N 50 120.194 120.194 119.611 0.583 19043 4182 1 13 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.079 0.009 19043 4183 1 13 . 1 1 50 50 LYS C C 50 179.859 179.859 178.886 0.973 19043 4184 1 13 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.067 0.668 19043 4185 1 13 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.555 -0.093 19043 4186 1 13 . 1 1 50 50 LYS H H 50 7.702 7.702 7.796 -0.094 19043 4187 1 13 . 1 1 51 51 LEU N N 51 122.126 122.126 120.057 2.069 19043 4188 1 13 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.131 -0.004 19043 4189 1 13 . 1 1 51 51 LEU C C 51 178.123 178.123 178.178 -0.055 19043 4190 1 13 . 1 1 51 51 LEU CA C 51 57.597 57.597 57.212 0.384 19043 4191 1 13 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.001 0.351 19043 4192 1 13 . 1 1 51 51 LEU H H 51 8.023 8.023 7.576 0.447 19043 4193 1 13 . 1 1 52 52 ASN N N 52 116.675 116.675 116.834 -0.159 19043 4194 1 13 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.375 -0.440 19043 4195 1 13 . 1 1 52 52 ASN C C 52 177.668 177.668 176.253 1.415 19043 4196 1 13 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.171 1.746 19043 4197 1 13 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.623 3.313 19043 4198 1 13 . 1 1 52 52 ASN H H 52 8.537 8.537 8.286 0.251 19043 4199 1 13 . 1 1 53 53 ASP N N 53 118.725 118.725 117.087 1.638 19043 4200 1 13 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.551 -0.107 19043 4201 1 13 . 1 1 53 53 ASP C C 53 178.936 178.936 176.882 2.054 19043 4202 1 13 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.227 1.706 19043 4203 1 13 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.393 -1.298 19043 4204 1 13 . 1 1 53 53 ASP H H 53 8.220 8.220 7.662 0.558 19043 4205 1 13 . 1 1 54 54 ALA N N 54 122.872 122.872 122.552 0.320 19043 4206 1 13 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.123 0.109 19043 4207 1 13 . 1 1 54 54 ALA C C 54 179.354 179.354 179.185 0.169 19043 4208 1 13 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.078 0.263 19043 4209 1 13 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.299 -0.694 19043 4210 1 13 . 1 1 54 54 ALA H H 54 8.037 8.037 7.176 0.861 19043 4211 1 13 . 1 1 55 55 GLN N N 55 115.052 115.052 116.686 -1.634 19043 4212 1 13 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.291 0.087 19043 4213 1 13 . 1 1 55 55 GLN C C 55 174.116 174.116 175.365 -1.249 19043 4214 1 13 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.264 -0.310 19043 4215 1 13 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.238 -1.014 19043 4216 1 13 . 1 1 55 55 GLN H H 55 7.512 7.512 7.915 -0.403 19043 4217 1 13 . 1 1 56 56 ALA N N 56 124.556 124.556 123.909 0.647 19043 4218 1 13 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.310 0.038 19043 4219 1 13 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.026 0.011 19043 4220 1 13 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.481 -0.502 19043 4221 1 13 . 1 1 56 56 ALA H H 56 7.100 7.100 7.463 -0.363 19043 4222 1 13 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.441 -0.029 19043 4223 1 13 . 1 1 57 57 PRO C C 57 176.151 176.151 176.617 -0.466 19043 4224 1 13 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.425 0.858 19043 4225 1 13 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.163 -0.170 19043 4226 1 14 . 1 1 2 2 ASP N N 2 125.357 125.357 120.778 4.579 19043 4227 1 14 . 1 1 2 2 ASP C C 2 175.535 175.535 175.893 -0.358 19043 4228 1 14 . 1 1 2 2 ASP CA C 2 54.307 54.307 54.596 -0.289 19043 4229 1 14 . 1 1 2 2 ASP CB C 2 41.470 41.470 41.788 -0.318 19043 4230 1 14 . 1 1 2 2 ASP H H 2 8.762 8.762 8.094 0.668 19043 4231 1 14 . 1 1 3 3 ASN N N 3 120.441 120.441 116.710 3.731 19043 4232 1 14 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.207 0.493 19043 4233 1 14 . 1 1 3 3 ASN C C 3 175.246 175.246 175.319 -0.073 19043 4234 1 14 . 1 1 3 3 ASN CA C 3 53.289 53.289 53.239 0.050 19043 4235 1 14 . 1 1 3 3 ASN CB C 3 39.086 39.086 38.688 0.398 19043 4236 1 14 . 1 1 3 3 ASN H H 3 8.548 8.548 8.043 0.505 19043 4237 1 14 . 1 1 4 4 LYS N N 4 121.461 121.461 119.420 2.041 19043 4238 1 14 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.011 0.204 19043 4239 1 14 . 1 1 4 4 LYS C C 4 176.404 176.404 175.795 0.609 19043 4240 1 14 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.854 -0.001 19043 4241 1 14 . 1 1 4 4 LYS CB C 4 32.780 32.780 31.573 1.207 19043 4242 1 14 . 1 1 4 4 LYS H H 4 8.337 8.337 7.853 0.484 19043 4243 1 14 . 1 1 5 5 PHE N N 5 119.538 119.538 114.882 4.656 19043 4244 1 14 . 1 1 5 5 PHE C C 5 175.433 175.433 174.918 0.515 19043 4245 1 14 . 1 1 5 5 PHE CA C 5 57.792 57.792 58.138 -0.346 19043 4246 1 14 . 1 1 5 5 PHE CB C 5 40.067 40.067 35.702 4.365 19043 4247 1 14 . 1 1 5 5 PHE H H 5 8.277 8.277 7.706 0.571 19043 4248 1 14 . 1 1 6 6 ASN N N 6 121.168 121.168 119.701 1.467 19043 4249 1 14 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.609 0.208 19043 4250 1 14 . 1 1 6 6 ASN C C 6 175.884 175.884 176.385 -0.501 19043 4251 1 14 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.946 -1.161 19043 4252 1 14 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.336 0.035 19043 4253 1 14 . 1 1 6 6 ASN H H 6 8.443 8.443 8.302 0.141 19043 4254 1 14 . 1 1 7 7 LYS N N 7 121.688 121.688 121.188 0.500 19043 4255 1 14 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.089 -0.144 19043 4256 1 14 . 1 1 7 7 LYS C C 7 178.196 178.196 178.210 -0.014 19043 4257 1 14 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.389 -0.488 19043 4258 1 14 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.279 -0.154 19043 4259 1 14 . 1 1 7 7 LYS H H 7 8.460 8.460 8.704 -0.244 19043 4260 1 14 . 1 1 8 8 GLU N N 8 119.926 119.926 117.614 2.312 19043 4261 1 14 . 1 1 8 8 GLU HA H 8 4.081 4.081 4.118 -0.037 19043 4262 1 14 . 1 1 8 8 GLU C C 8 179.894 179.894 179.420 0.474 19043 4263 1 14 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.979 -0.140 19043 4264 1 14 . 1 1 8 8 GLU CB C 8 28.941 28.941 28.629 0.312 19043 4265 1 14 . 1 1 8 8 GLU H H 8 8.386 8.386 8.901 -0.515 19043 4266 1 14 . 1 1 9 9 GLN N N 9 121.401 121.401 116.661 4.740 19043 4267 1 14 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.150 -0.053 19043 4268 1 14 . 1 1 9 9 GLN C C 9 177.324 177.324 178.030 -0.706 19043 4269 1 14 . 1 1 9 9 GLN CA C 9 59.383 59.383 58.575 0.808 19043 4270 1 14 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.647 0.222 19043 4271 1 14 . 1 1 9 9 GLN H H 9 8.307 8.307 7.756 0.551 19043 4272 1 14 . 1 1 10 10 GLN N N 10 120.060 120.060 120.513 -0.453 19043 4273 1 14 . 1 1 10 10 GLN HA H 10 3.222 3.222 3.961 -0.739 19043 4274 1 14 . 1 1 10 10 GLN C C 10 176.888 176.888 178.076 -1.188 19043 4275 1 14 . 1 1 10 10 GLN CA C 10 58.949 58.949 59.019 -0.070 19043 4276 1 14 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.785 0.056 19043 4277 1 14 . 1 1 10 10 GLN H H 10 8.040 8.040 7.875 0.165 19043 4278 1 14 . 1 1 11 11 ASN N N 11 116.214 116.214 118.668 -2.454 19043 4279 1 14 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.569 -0.219 19043 4280 1 14 . 1 1 11 11 ASN C C 11 177.828 177.828 177.467 0.361 19043 4281 1 14 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.217 0.040 19043 4282 1 14 . 1 1 11 11 ASN CB C 11 38.210 38.210 37.867 0.343 19043 4283 1 14 . 1 1 11 11 ASN H H 11 8.366 8.366 8.441 -0.075 19043 4284 1 14 . 1 1 12 12 ALA N N 12 121.429 121.429 122.481 -1.052 19043 4285 1 14 . 1 1 12 12 ALA HA H 12 4.009 4.009 3.999 0.010 19043 4286 1 14 . 1 1 12 12 ALA C C 12 177.850 177.850 179.142 -1.292 19043 4287 1 14 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.998 0.295 19043 4288 1 14 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.443 -0.122 19043 4289 1 14 . 1 1 12 12 ALA H H 12 7.915 7.915 7.787 0.128 19043 4290 1 14 . 1 1 13 13 PHE N N 13 118.052 118.052 120.178 -2.126 19043 4291 1 14 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.964 -0.391 19043 4292 1 14 . 1 1 13 13 PHE C C 13 175.832 175.832 177.188 -1.356 19043 4293 1 14 . 1 1 13 13 PHE CA C 13 61.855 61.855 62.010 -0.155 19043 4294 1 14 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.925 -0.008 19043 4295 1 14 . 1 1 13 13 PHE H H 13 8.097 8.097 7.429 0.668 19043 4296 1 14 . 1 1 14 14 TYR N N 14 116.000 116.000 117.323 -1.323 19043 4297 1 14 . 1 1 14 14 TYR HA H 14 3.985 3.985 4.070 -0.085 19043 4298 1 14 . 1 1 14 14 TYR C C 14 178.860 178.860 178.406 0.454 19043 4299 1 14 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.057 -1.262 19043 4300 1 14 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.734 -0.754 19043 4301 1 14 . 1 1 14 14 TYR H H 14 8.040 8.040 7.801 0.239 19043 4302 1 14 . 1 1 15 15 GLU N N 15 118.737 118.737 117.330 1.407 19043 4303 1 14 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.847 0.124 19043 4304 1 14 . 1 1 15 15 GLU C C 15 180.184 180.184 179.147 1.037 19043 4305 1 14 . 1 1 15 15 GLU CA C 15 60.607 60.607 58.990 1.617 19043 4306 1 14 . 1 1 15 15 GLU CB C 15 29.722 29.722 28.868 0.854 19043 4307 1 14 . 1 1 15 15 GLU H H 15 8.244 8.244 8.478 -0.234 19043 4308 1 14 . 1 1 16 16 ILE N N 16 119.695 119.695 118.402 1.293 19043 4309 1 14 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.770 -0.417 19043 4310 1 14 . 1 1 16 16 ILE C C 16 177.760 177.760 177.566 0.194 19043 4311 1 14 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.100 1.554 19043 4312 1 14 . 1 1 16 16 ILE CB C 16 37.403 37.403 37.944 -0.541 19043 4313 1 14 . 1 1 16 16 ILE H H 16 8.336 8.336 7.434 0.902 19043 4314 1 14 . 1 1 17 17 LEU N N 17 117.709 117.709 119.249 -1.540 19043 4315 1 14 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.973 -0.420 19043 4316 1 14 . 1 1 17 17 LEU C C 17 176.565 176.565 177.850 -1.285 19043 4317 1 14 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.061 0.498 19043 4318 1 14 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.550 0.288 19043 4319 1 14 . 1 1 17 17 LEU H H 17 7.738 7.738 7.561 0.177 19043 4320 1 14 . 1 1 18 18 HIS N N 18 110.934 110.934 115.999 -5.065 19043 4321 1 14 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.333 0.164 19043 4322 1 14 . 1 1 18 18 HIS C C 18 175.243 175.243 175.955 -0.712 19043 4323 1 14 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.317 -1.261 19043 4324 1 14 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.315 0.333 19043 4325 1 14 . 1 1 18 18 HIS H H 18 7.150 7.150 7.955 -0.805 19043 4326 1 14 . 1 1 19 19 LEU N N 19 123.586 123.586 121.876 1.710 19043 4327 1 14 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.274 0.144 19043 4328 1 14 . 1 1 19 19 LEU CA C 19 53.476 53.476 54.038 -0.562 19043 4329 1 14 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.374 -1.052 19043 4330 1 14 . 1 1 19 19 LEU H H 19 7.249 7.249 7.666 -0.417 19043 4331 1 14 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.456 -0.025 19043 4332 1 14 . 1 1 20 20 PRO C C 20 178.092 178.092 177.558 0.534 19043 4333 1 14 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.782 0.115 19043 4334 1 14 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.187 0.385 19043 4335 1 14 . 1 1 21 21 ASN N N 21 113.952 113.952 116.905 -2.953 19043 4336 1 14 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.519 0.490 19043 4337 1 14 . 1 1 21 21 ASN C C 21 176.397 176.397 175.625 0.772 19043 4338 1 14 . 1 1 21 21 ASN CA C 21 52.629 52.629 53.989 -1.360 19043 4339 1 14 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.461 0.349 19043 4340 1 14 . 1 1 21 21 ASN H H 21 8.871 8.871 8.214 0.657 19043 4341 1 14 . 1 1 22 22 LEU N N 22 117.526 117.526 122.278 -4.752 19043 4342 1 14 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.298 0.103 19043 4343 1 14 . 1 1 22 22 LEU C C 22 176.879 176.879 175.125 1.754 19043 4344 1 14 . 1 1 22 22 LEU CA C 22 54.457 54.457 54.993 -0.536 19043 4345 1 14 . 1 1 22 22 LEU CB C 22 42.520 42.520 43.089 -0.569 19043 4346 1 14 . 1 1 22 22 LEU H H 22 6.563 6.563 8.108 -1.545 19043 4347 1 14 . 1 1 23 23 ASN N N 23 120.219 120.219 122.602 -2.383 19043 4348 1 14 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.692 0.176 19043 4349 1 14 . 1 1 23 23 ASN C C 23 175.507 175.507 176.470 -0.963 19043 4350 1 14 . 1 1 23 23 ASN CA C 23 51.416 51.416 52.814 -1.398 19043 4351 1 14 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.542 -0.830 19043 4352 1 14 . 1 1 23 23 ASN H H 23 8.612 8.612 8.349 0.263 19043 4353 1 14 . 1 1 24 24 GLU N N 24 118.801 118.801 121.277 -2.476 19043 4354 1 14 . 1 1 24 24 GLU HA H 24 3.874 3.874 4.049 -0.175 19043 4355 1 14 . 1 1 24 24 GLU C C 24 177.799 177.799 178.541 -0.742 19043 4356 1 14 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.035 0.156 19043 4357 1 14 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.514 -0.149 19043 4358 1 14 . 1 1 24 24 GLU H H 24 8.735 8.735 8.985 -0.250 19043 4359 1 14 . 1 1 25 25 GLU N N 25 119.198 119.198 119.724 -0.526 19043 4360 1 14 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.078 -0.100 19043 4361 1 14 . 1 1 25 25 GLU C C 25 180.078 180.078 179.102 0.976 19043 4362 1 14 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.468 0.423 19043 4363 1 14 . 1 1 25 25 GLU CB C 25 29.131 29.131 29.169 -0.038 19043 4364 1 14 . 1 1 25 25 GLU H H 25 8.229 8.229 8.720 -0.491 19043 4365 1 14 . 1 1 26 26 GLN N N 26 119.646 119.646 118.376 1.270 19043 4366 1 14 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.062 -0.122 19043 4367 1 14 . 1 1 26 26 GLN C C 26 178.154 178.154 178.179 -0.025 19043 4368 1 14 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.572 -0.679 19043 4369 1 14 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.578 0.324 19043 4370 1 14 . 1 1 26 26 GLN H H 26 8.425 8.425 8.309 0.116 19043 4371 1 14 . 1 1 27 27 ARG N N 27 119.454 119.454 120.177 -0.723 19043 4372 1 14 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.165 -0.379 19043 4373 1 14 . 1 1 27 27 ARG C C 27 177.863 177.863 178.131 -0.268 19043 4374 1 14 . 1 1 27 27 ARG CA C 27 60.630 60.630 60.132 0.498 19043 4375 1 14 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.178 -0.534 19043 4376 1 14 . 1 1 27 27 ARG H H 27 8.548 8.548 8.383 0.165 19043 4377 1 14 . 1 1 28 28 ASN N N 28 116.833 116.833 117.772 -0.939 19043 4378 1 14 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.508 -0.176 19043 4379 1 14 . 1 1 28 28 ASN C C 28 177.234 177.234 177.219 0.015 19043 4380 1 14 . 1 1 28 28 ASN CA C 28 56.038 56.038 55.930 0.108 19043 4381 1 14 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.325 -0.640 19043 4382 1 14 . 1 1 28 28 ASN H H 28 8.569 8.569 8.409 0.160 19043 4383 1 14 . 1 1 29 29 ALA N N 29 122.687 122.687 123.045 -0.358 19043 4384 1 14 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.042 0.012 19043 4385 1 14 . 1 1 29 29 ALA C C 29 181.045 181.045 179.466 1.579 19043 4386 1 14 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.559 0.690 19043 4387 1 14 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.258 -0.438 19043 4388 1 14 . 1 1 29 29 ALA H H 29 7.793 7.793 7.256 0.537 19043 4389 1 14 . 1 1 30 30 PHE N N 30 116.979 116.979 117.599 -0.620 19043 4390 1 14 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.226 0.152 19043 4391 1 14 . 1 1 30 30 PHE C C 30 177.887 177.887 177.993 -0.106 19043 4392 1 14 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.549 1.070 19043 4393 1 14 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.692 0.767 19043 4394 1 14 . 1 1 30 30 PHE H H 30 8.017 8.017 7.370 0.647 19043 4395 1 14 . 1 1 31 31 ILE N N 31 119.553 119.553 119.128 0.425 19043 4396 1 14 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.628 0.150 19043 4397 1 14 . 1 1 31 31 ILE C C 31 177.084 177.084 178.223 -1.139 19043 4398 1 14 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.165 0.480 19043 4399 1 14 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.510 -0.395 19043 4400 1 14 . 1 1 31 31 ILE H H 31 8.372 8.372 8.196 0.176 19043 4401 1 14 . 1 1 32 32 GLN N N 32 119.108 119.108 119.623 -0.515 19043 4402 1 14 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.939 -0.133 19043 4403 1 14 . 1 1 32 32 GLN C C 32 177.836 177.836 178.541 -0.705 19043 4404 1 14 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.553 -0.785 19043 4405 1 14 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.868 -0.890 19043 4406 1 14 . 1 1 32 32 GLN H H 32 8.389 8.389 8.215 0.174 19043 4407 1 14 . 1 1 33 33 SER N N 33 114.437 114.437 115.424 -0.987 19043 4408 1 14 . 1 1 33 33 SER HA H 33 4.212 4.212 4.282 -0.070 19043 4409 1 14 . 1 1 33 33 SER C C 33 175.469 175.469 176.678 -1.209 19043 4410 1 14 . 1 1 33 33 SER CA C 33 62.403 62.403 61.380 1.022 19043 4411 1 14 . 1 1 33 33 SER CB C 33 63.794 63.794 63.244 0.550 19043 4412 1 14 . 1 1 33 33 SER H H 33 8.078 8.078 7.795 0.283 19043 4413 1 14 . 1 1 34 34 LEU N N 34 122.967 122.967 123.142 -0.175 19043 4414 1 14 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.240 -0.330 19043 4415 1 14 . 1 1 34 34 LEU C C 34 177.506 177.506 178.054 -0.548 19043 4416 1 14 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.400 0.028 19043 4417 1 14 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.098 0.714 19043 4418 1 14 . 1 1 34 34 LEU H H 34 8.495 8.495 8.289 0.206 19043 4419 1 14 . 1 1 35 35 LYS N N 35 115.859 115.859 118.954 -3.095 19043 4420 1 14 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.192 -0.379 19043 4421 1 14 . 1 1 35 35 LYS C C 35 177.628 177.628 177.949 -0.321 19043 4422 1 14 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.629 -1.752 19043 4423 1 14 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.171 -0.152 19043 4424 1 14 . 1 1 35 35 LYS H H 35 7.815 7.815 7.616 0.199 19043 4425 1 14 . 1 1 36 36 ASP N N 36 116.741 116.741 117.248 -0.507 19043 4426 1 14 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.672 -0.158 19043 4427 1 14 . 1 1 36 36 ASP C C 36 177.324 177.324 176.562 0.762 19043 4428 1 14 . 1 1 36 36 ASP CA C 36 56.686 56.686 56.048 0.638 19043 4429 1 14 . 1 1 36 36 ASP CB C 36 40.671 40.671 42.056 -1.385 19043 4430 1 14 . 1 1 36 36 ASP H H 36 7.943 7.943 7.671 0.272 19043 4431 1 14 . 1 1 37 37 ASP N N 37 116.686 116.686 119.000 -2.314 19043 4432 1 14 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.062 -0.021 19043 4433 1 14 . 1 1 37 37 ASP CA C 37 51.946 51.946 51.951 -0.005 19043 4434 1 14 . 1 1 37 37 ASP CB C 37 40.523 40.523 42.041 -1.518 19043 4435 1 14 . 1 1 37 37 ASP H H 37 8.125 8.125 7.969 0.156 19043 4436 1 14 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.494 0.089 19043 4437 1 14 . 1 1 38 38 PRO C C 38 179.200 179.200 178.547 0.653 19043 4438 1 14 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.520 0.017 19043 4439 1 14 . 1 1 38 38 PRO CB C 38 31.886 31.886 31.996 -0.110 19043 4440 1 14 . 1 1 39 39 SER N N 39 114.963 114.963 113.662 1.301 19043 4441 1 14 . 1 1 39 39 SER HA H 39 4.178 4.178 4.240 -0.062 19043 4442 1 14 . 1 1 39 39 SER C C 39 176.151 176.151 175.859 0.292 19043 4443 1 14 . 1 1 39 39 SER CA C 39 61.197 61.197 60.672 0.525 19043 4444 1 14 . 1 1 39 39 SER CB C 39 62.729 62.729 62.436 0.293 19043 4445 1 14 . 1 1 39 39 SER H H 39 8.315 8.315 8.472 -0.157 19043 4446 1 14 . 1 1 40 40 GLN N N 40 120.058 120.058 119.853 0.205 19043 4447 1 14 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.414 0.246 19043 4448 1 14 . 1 1 40 40 GLN C C 40 176.192 176.192 177.246 -1.054 19043 4449 1 14 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.633 -0.652 19043 4450 1 14 . 1 1 40 40 GLN CB C 40 28.168 28.168 27.911 0.257 19043 4451 1 14 . 1 1 40 40 GLN H H 40 7.820 7.820 7.865 -0.045 19043 4452 1 14 . 1 1 41 41 SER N N 41 115.553 115.553 117.029 -1.476 19043 4453 1 14 . 1 1 41 41 SER HA H 41 3.845 3.845 4.078 -0.233 19043 4454 1 14 . 1 1 41 41 SER C C 41 174.181 174.181 175.538 -1.357 19043 4455 1 14 . 1 1 41 41 SER CA C 41 63.957 63.957 61.580 2.377 19043 4456 1 14 . 1 1 41 41 SER CB C 41 63.191 63.191 62.482 0.709 19043 4457 1 14 . 1 1 41 41 SER H H 41 7.666 7.666 7.718 -0.052 19043 4458 1 14 . 1 1 42 42 ALA N N 42 122.360 122.360 122.196 0.164 19043 4459 1 14 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.175 -0.052 19043 4460 1 14 . 1 1 42 42 ALA C C 42 180.996 180.996 178.845 2.151 19043 4461 1 14 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.053 1.510 19043 4462 1 14 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.093 -1.038 19043 4463 1 14 . 1 1 42 42 ALA H H 42 8.556 8.556 7.705 0.851 19043 4464 1 14 . 1 1 43 43 ASN N N 43 118.974 118.974 118.845 0.129 19043 4465 1 14 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.543 -0.024 19043 4466 1 14 . 1 1 43 43 ASN C C 43 177.972 177.972 177.756 0.216 19043 4467 1 14 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.445 -0.591 19043 4468 1 14 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.357 -0.208 19043 4469 1 14 . 1 1 43 43 ASN H H 43 7.950 7.950 7.568 0.382 19043 4470 1 14 . 1 1 44 44 LEU N N 44 122.070 122.070 120.499 1.571 19043 4471 1 14 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.369 -0.180 19043 4472 1 14 . 1 1 44 44 LEU C C 44 178.332 178.332 179.359 -1.027 19043 4473 1 14 . 1 1 44 44 LEU CA C 44 57.834 57.834 57.945 -0.111 19043 4474 1 14 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.794 0.557 19043 4475 1 14 . 1 1 44 44 LEU H H 44 8.789 8.789 8.545 0.244 19043 4476 1 14 . 1 1 45 45 LEU N N 45 118.621 118.621 119.344 -0.723 19043 4477 1 14 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.716 0.089 19043 4478 1 14 . 1 1 45 45 LEU C C 45 177.832 177.832 178.522 -0.690 19043 4479 1 14 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.731 0.154 19043 4480 1 14 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.567 0.239 19043 4481 1 14 . 1 1 45 45 LEU H H 45 8.283 8.283 7.499 0.784 19043 4482 1 14 . 1 1 46 46 ALA N N 46 119.525 119.525 120.554 -1.029 19043 4483 1 14 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.881 0.129 19043 4484 1 14 . 1 1 46 46 ALA C C 46 181.250 181.250 180.007 1.243 19043 4485 1 14 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.087 0.209 19043 4486 1 14 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.030 -0.079 19043 4487 1 14 . 1 1 46 46 ALA H H 46 7.640 7.640 7.779 -0.139 19043 4488 1 14 . 1 1 47 47 GLU N N 47 119.572 119.572 118.139 1.433 19043 4489 1 14 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.120 -0.090 19043 4490 1 14 . 1 1 47 47 GLU C C 47 178.895 178.895 178.836 0.059 19043 4491 1 14 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.912 0.254 19043 4492 1 14 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.845 -0.307 19043 4493 1 14 . 1 1 47 47 GLU H H 47 8.139 8.139 8.408 -0.269 19043 4494 1 14 . 1 1 48 48 ALA N N 48 123.953 123.953 122.746 1.207 19043 4495 1 14 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.792 -0.265 19043 4496 1 14 . 1 1 48 48 ALA C C 48 179.636 179.636 179.189 0.447 19043 4497 1 14 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.493 1.023 19043 4498 1 14 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.730 -0.485 19043 4499 1 14 . 1 1 48 48 ALA H H 48 8.468 8.468 7.605 0.863 19043 4500 1 14 . 1 1 49 49 LYS N N 49 117.926 117.926 118.265 -0.339 19043 4501 1 14 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.899 -0.160 19043 4502 1 14 . 1 1 49 49 LYS C C 49 178.761 178.761 178.729 0.032 19043 4503 1 14 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.721 0.671 19043 4504 1 14 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.284 -0.195 19043 4505 1 14 . 1 1 49 49 LYS H H 49 8.459 8.459 8.407 0.052 19043 4506 1 14 . 1 1 50 50 LYS N N 50 120.194 120.194 119.718 0.476 19043 4507 1 14 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.072 0.016 19043 4508 1 14 . 1 1 50 50 LYS C C 50 179.859 179.859 178.906 0.953 19043 4509 1 14 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.161 0.574 19043 4510 1 14 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.539 -0.077 19043 4511 1 14 . 1 1 50 50 LYS H H 50 7.702 7.702 7.689 0.013 19043 4512 1 14 . 1 1 51 51 LEU N N 51 122.126 122.126 119.877 2.249 19043 4513 1 14 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.104 0.023 19043 4514 1 14 . 1 1 51 51 LEU C C 51 178.123 178.123 178.403 -0.280 19043 4515 1 14 . 1 1 51 51 LEU CA C 51 57.597 57.597 57.195 0.402 19043 4516 1 14 . 1 1 51 51 LEU CB C 51 42.352 42.352 41.896 0.456 19043 4517 1 14 . 1 1 51 51 LEU H H 51 8.023 8.023 7.653 0.370 19043 4518 1 14 . 1 1 52 52 ASN N N 52 116.675 116.675 116.896 -0.221 19043 4519 1 14 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.378 -0.443 19043 4520 1 14 . 1 1 52 52 ASN C C 52 177.668 177.668 176.347 1.321 19043 4521 1 14 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.280 1.637 19043 4522 1 14 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.681 3.255 19043 4523 1 14 . 1 1 52 52 ASN H H 52 8.537 8.537 8.212 0.325 19043 4524 1 14 . 1 1 53 53 ASP N N 53 118.725 118.725 117.604 1.121 19043 4525 1 14 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.592 -0.148 19043 4526 1 14 . 1 1 53 53 ASP C C 53 178.936 178.936 176.642 2.294 19043 4527 1 14 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.513 1.420 19043 4528 1 14 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.310 -1.216 19043 4529 1 14 . 1 1 53 53 ASP H H 53 8.220 8.220 7.687 0.533 19043 4530 1 14 . 1 1 54 54 ALA N N 54 122.872 122.872 120.879 1.993 19043 4531 1 14 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.176 0.056 19043 4532 1 14 . 1 1 54 54 ALA C C 54 179.354 179.354 179.050 0.304 19043 4533 1 14 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.199 0.142 19043 4534 1 14 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.332 -0.727 19043 4535 1 14 . 1 1 54 54 ALA H H 54 8.037 8.037 7.380 0.657 19043 4536 1 14 . 1 1 55 55 GLN N N 55 115.052 115.052 116.503 -1.451 19043 4537 1 14 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.349 0.029 19043 4538 1 14 . 1 1 55 55 GLN C C 55 174.116 174.116 175.253 -1.137 19043 4539 1 14 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.016 -0.062 19043 4540 1 14 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.340 -1.116 19043 4541 1 14 . 1 1 55 55 GLN H H 55 7.512 7.512 7.864 -0.352 19043 4542 1 14 . 1 1 56 56 ALA N N 56 124.556 124.556 123.898 0.658 19043 4543 1 14 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.342 0.006 19043 4544 1 14 . 1 1 56 56 ALA CA C 56 51.037 51.037 50.843 0.194 19043 4545 1 14 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.597 -0.618 19043 4546 1 14 . 1 1 56 56 ALA H H 56 7.100 7.100 7.392 -0.292 19043 4547 1 14 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.494 -0.082 19043 4548 1 14 . 1 1 57 57 PRO C C 57 176.151 176.151 176.308 -0.157 19043 4549 1 14 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.518 0.765 19043 4550 1 14 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.186 -0.193 19043 4551 1 15 . 1 1 2 2 ASP N N 2 125.357 125.357 118.933 6.424 19043 4552 1 15 . 1 1 2 2 ASP C C 2 175.535 175.535 176.444 -0.909 19043 4553 1 15 . 1 1 2 2 ASP CA C 2 54.307 54.307 54.496 -0.189 19043 4554 1 15 . 1 1 2 2 ASP CB C 2 41.470 41.470 41.149 0.321 19043 4555 1 15 . 1 1 2 2 ASP H H 2 8.762 8.762 8.268 0.494 19043 4556 1 15 . 1 1 3 3 ASN N N 3 120.441 120.441 118.783 1.658 19043 4557 1 15 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.062 0.638 19043 4558 1 15 . 1 1 3 3 ASN C C 3 175.246 175.246 175.956 -0.710 19043 4559 1 15 . 1 1 3 3 ASN CA C 3 53.289 53.289 54.758 -1.469 19043 4560 1 15 . 1 1 3 3 ASN CB C 3 39.086 39.086 38.268 0.818 19043 4561 1 15 . 1 1 3 3 ASN H H 3 8.548 8.548 8.390 0.158 19043 4562 1 15 . 1 1 4 4 LYS N N 4 121.461 121.461 117.379 4.082 19043 4563 1 15 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.195 0.020 19043 4564 1 15 . 1 1 4 4 LYS C C 4 176.404 176.404 176.655 -0.251 19043 4565 1 15 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.512 0.341 19043 4566 1 15 . 1 1 4 4 LYS CB C 4 32.780 32.780 32.264 0.516 19043 4567 1 15 . 1 1 4 4 LYS H H 4 8.337 8.337 7.681 0.656 19043 4568 1 15 . 1 1 5 5 PHE N N 5 119.538 119.538 116.603 2.935 19043 4569 1 15 . 1 1 5 5 PHE C C 5 175.433 175.433 175.088 0.345 19043 4570 1 15 . 1 1 5 5 PHE CA C 5 57.792 57.792 58.400 -0.608 19043 4571 1 15 . 1 1 5 5 PHE CB C 5 40.067 40.067 36.111 3.955 19043 4572 1 15 . 1 1 5 5 PHE H H 5 8.277 8.277 7.551 0.726 19043 4573 1 15 . 1 1 6 6 ASN N N 6 121.168 121.168 120.186 0.982 19043 4574 1 15 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.606 0.211 19043 4575 1 15 . 1 1 6 6 ASN C C 6 175.884 175.884 176.523 -0.639 19043 4576 1 15 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.391 -0.606 19043 4577 1 15 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.237 0.133 19043 4578 1 15 . 1 1 6 6 ASN H H 6 8.443 8.443 8.219 0.224 19043 4579 1 15 . 1 1 7 7 LYS N N 7 121.688 121.688 121.325 0.363 19043 4580 1 15 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.167 -0.222 19043 4581 1 15 . 1 1 7 7 LYS C C 7 178.196 178.196 178.464 -0.268 19043 4582 1 15 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.239 -0.338 19043 4583 1 15 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.410 -0.285 19043 4584 1 15 . 1 1 7 7 LYS H H 7 8.460 8.460 8.567 -0.107 19043 4585 1 15 . 1 1 8 8 GLU N N 8 119.926 119.926 118.429 1.497 19043 4586 1 15 . 1 1 8 8 GLU HA H 8 4.081 4.081 3.972 0.109 19043 4587 1 15 . 1 1 8 8 GLU C C 8 179.894 179.894 178.880 1.014 19043 4588 1 15 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.734 0.105 19043 4589 1 15 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.016 -0.075 19043 4590 1 15 . 1 1 8 8 GLU H H 8 8.386 8.386 8.876 -0.490 19043 4591 1 15 . 1 1 9 9 GLN N N 9 121.401 121.401 117.877 3.524 19043 4592 1 15 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.115 -0.018 19043 4593 1 15 . 1 1 9 9 GLN C C 9 177.324 177.324 178.275 -0.951 19043 4594 1 15 . 1 1 9 9 GLN CA C 9 59.383 59.383 58.952 0.431 19043 4595 1 15 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.521 0.348 19043 4596 1 15 . 1 1 9 9 GLN H H 9 8.307 8.307 8.693 -0.386 19043 4597 1 15 . 1 1 10 10 GLN N N 10 120.060 120.060 119.776 0.284 19043 4598 1 15 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.091 -0.869 19043 4599 1 15 . 1 1 10 10 GLN C C 10 176.888 176.888 178.331 -1.443 19043 4600 1 15 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.972 -0.023 19043 4601 1 15 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.733 0.108 19043 4602 1 15 . 1 1 10 10 GLN H H 10 8.040 8.040 7.909 0.131 19043 4603 1 15 . 1 1 11 11 ASN N N 11 116.214 116.214 119.032 -2.818 19043 4604 1 15 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.587 -0.237 19043 4605 1 15 . 1 1 11 11 ASN C C 11 177.828 177.828 177.607 0.221 19043 4606 1 15 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.126 0.131 19043 4607 1 15 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.001 0.209 19043 4608 1 15 . 1 1 11 11 ASN H H 11 8.366 8.366 8.589 -0.223 19043 4609 1 15 . 1 1 12 12 ALA N N 12 121.429 121.429 122.557 -1.128 19043 4610 1 15 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.076 -0.067 19043 4611 1 15 . 1 1 12 12 ALA C C 12 177.850 177.850 179.249 -1.399 19043 4612 1 15 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.814 0.479 19043 4613 1 15 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.413 -0.092 19043 4614 1 15 . 1 1 12 12 ALA H H 12 7.915 7.915 8.018 -0.103 19043 4615 1 15 . 1 1 13 13 PHE N N 13 118.052 118.052 119.572 -1.520 19043 4616 1 15 . 1 1 13 13 PHE HA H 13 3.573 3.573 4.022 -0.449 19043 4617 1 15 . 1 1 13 13 PHE C C 13 175.832 175.832 177.142 -1.310 19043 4618 1 15 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.713 0.142 19043 4619 1 15 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.991 -0.074 19043 4620 1 15 . 1 1 13 13 PHE H H 13 8.097 8.097 7.444 0.653 19043 4621 1 15 . 1 1 14 14 TYR N N 14 116.000 116.000 117.954 -1.954 19043 4622 1 15 . 1 1 14 14 TYR HA H 14 3.985 3.985 3.986 -0.001 19043 4623 1 15 . 1 1 14 14 TYR C C 14 178.860 178.860 178.370 0.490 19043 4624 1 15 . 1 1 14 14 TYR CA C 14 59.795 59.795 62.126 -2.331 19043 4625 1 15 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.720 -0.740 19043 4626 1 15 . 1 1 14 14 TYR H H 14 8.040 8.040 7.721 0.319 19043 4627 1 15 . 1 1 15 15 GLU N N 15 118.737 118.737 118.110 0.627 19043 4628 1 15 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.851 0.120 19043 4629 1 15 . 1 1 15 15 GLU C C 15 180.184 180.184 178.899 1.285 19043 4630 1 15 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.046 1.561 19043 4631 1 15 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.274 0.448 19043 4632 1 15 . 1 1 15 15 GLU H H 15 8.244 8.244 8.386 -0.142 19043 4633 1 15 . 1 1 16 16 ILE N N 16 119.695 119.695 118.472 1.223 19043 4634 1 15 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.781 -0.428 19043 4635 1 15 . 1 1 16 16 ILE C C 16 177.760 177.760 177.478 0.282 19043 4636 1 15 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.022 1.632 19043 4637 1 15 . 1 1 16 16 ILE CB C 16 37.403 37.403 38.100 -0.697 19043 4638 1 15 . 1 1 16 16 ILE H H 16 8.336 8.336 7.408 0.928 19043 4639 1 15 . 1 1 17 17 LEU N N 17 117.709 117.709 119.624 -1.915 19043 4640 1 15 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.930 -0.377 19043 4641 1 15 . 1 1 17 17 LEU C C 17 176.565 176.565 177.805 -1.240 19043 4642 1 15 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.050 0.509 19043 4643 1 15 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.610 0.228 19043 4644 1 15 . 1 1 17 17 LEU H H 17 7.738 7.738 7.528 0.210 19043 4645 1 15 . 1 1 18 18 HIS N N 18 110.934 110.934 115.636 -4.702 19043 4646 1 15 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.344 0.153 19043 4647 1 15 . 1 1 18 18 HIS C C 18 175.243 175.243 175.914 -0.671 19043 4648 1 15 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.181 -1.125 19043 4649 1 15 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.152 0.496 19043 4650 1 15 . 1 1 18 18 HIS H H 18 7.150 7.150 8.061 -0.911 19043 4651 1 15 . 1 1 19 19 LEU N N 19 123.586 123.586 122.336 1.250 19043 4652 1 15 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.304 0.114 19043 4653 1 15 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.804 -0.328 19043 4654 1 15 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.429 -1.107 19043 4655 1 15 . 1 1 19 19 LEU H H 19 7.249 7.249 7.710 -0.461 19043 4656 1 15 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.435 -0.004 19043 4657 1 15 . 1 1 20 20 PRO C C 20 178.092 178.092 177.574 0.518 19043 4658 1 15 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.726 0.171 19043 4659 1 15 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.275 0.297 19043 4660 1 15 . 1 1 21 21 ASN N N 21 113.952 113.952 116.403 -2.451 19043 4661 1 15 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.520 0.489 19043 4662 1 15 . 1 1 21 21 ASN C C 21 176.397 176.397 175.654 0.743 19043 4663 1 15 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.010 -1.381 19043 4664 1 15 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.406 0.404 19043 4665 1 15 . 1 1 21 21 ASN H H 21 8.871 8.871 8.105 0.766 19043 4666 1 15 . 1 1 22 22 LEU N N 22 117.526 117.526 121.797 -4.271 19043 4667 1 15 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.329 0.072 19043 4668 1 15 . 1 1 22 22 LEU C C 22 176.879 176.879 175.122 1.757 19043 4669 1 15 . 1 1 22 22 LEU CA C 22 54.457 54.457 54.561 -0.104 19043 4670 1 15 . 1 1 22 22 LEU CB C 22 42.520 42.520 43.407 -0.887 19043 4671 1 15 . 1 1 22 22 LEU H H 22 6.563 6.563 8.037 -1.474 19043 4672 1 15 . 1 1 23 23 ASN N N 23 120.219 120.219 120.583 -0.364 19043 4673 1 15 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.799 0.069 19043 4674 1 15 . 1 1 23 23 ASN C C 23 175.507 175.507 176.518 -1.011 19043 4675 1 15 . 1 1 23 23 ASN CA C 23 51.416 51.416 52.422 -1.006 19043 4676 1 15 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.892 -1.180 19043 4677 1 15 . 1 1 23 23 ASN H H 23 8.612 8.612 8.433 0.179 19043 4678 1 15 . 1 1 24 24 GLU N N 24 118.801 118.801 122.263 -3.462 19043 4679 1 15 . 1 1 24 24 GLU HA H 24 3.874 3.874 3.927 -0.053 19043 4680 1 15 . 1 1 24 24 GLU C C 24 177.799 177.799 178.156 -0.357 19043 4681 1 15 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.419 -0.228 19043 4682 1 15 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.289 0.076 19043 4683 1 15 . 1 1 24 24 GLU H H 24 8.735 8.735 9.021 -0.286 19043 4684 1 15 . 1 1 25 25 GLU N N 25 119.198 119.198 118.707 0.491 19043 4685 1 15 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.059 -0.081 19043 4686 1 15 . 1 1 25 25 GLU C C 25 180.078 180.078 179.163 0.915 19043 4687 1 15 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.536 0.355 19043 4688 1 15 . 1 1 25 25 GLU CB C 25 29.131 29.131 28.665 0.466 19043 4689 1 15 . 1 1 25 25 GLU H H 25 8.229 8.229 8.774 -0.545 19043 4690 1 15 . 1 1 26 26 GLN N N 26 119.646 119.646 117.937 1.709 19043 4691 1 15 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.048 -0.108 19043 4692 1 15 . 1 1 26 26 GLN C C 26 178.154 178.154 178.452 -0.298 19043 4693 1 15 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.258 -0.365 19043 4694 1 15 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.525 0.377 19043 4695 1 15 . 1 1 26 26 GLN H H 26 8.425 8.425 7.640 0.785 19043 4696 1 15 . 1 1 27 27 ARG N N 27 119.454 119.454 120.629 -1.175 19043 4697 1 15 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.193 -0.407 19043 4698 1 15 . 1 1 27 27 ARG C C 27 177.863 177.863 178.475 -0.612 19043 4699 1 15 . 1 1 27 27 ARG CA C 27 60.630 60.630 59.542 1.088 19043 4700 1 15 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.111 -0.467 19043 4701 1 15 . 1 1 27 27 ARG H H 27 8.548 8.548 8.407 0.141 19043 4702 1 15 . 1 1 28 28 ASN N N 28 116.833 116.833 117.275 -0.442 19043 4703 1 15 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.547 -0.215 19043 4704 1 15 . 1 1 28 28 ASN C C 28 177.234 177.234 177.216 0.018 19043 4705 1 15 . 1 1 28 28 ASN CA C 28 56.038 56.038 55.677 0.361 19043 4706 1 15 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.495 -0.810 19043 4707 1 15 . 1 1 28 28 ASN H H 28 8.569 8.569 8.366 0.203 19043 4708 1 15 . 1 1 29 29 ALA N N 29 122.687 122.687 123.471 -0.784 19043 4709 1 15 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.100 -0.046 19043 4710 1 15 . 1 1 29 29 ALA C C 29 181.045 181.045 179.004 2.041 19043 4711 1 15 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.572 0.678 19043 4712 1 15 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.326 -0.506 19043 4713 1 15 . 1 1 29 29 ALA H H 29 7.793 7.793 7.609 0.184 19043 4714 1 15 . 1 1 30 30 PHE N N 30 116.979 116.979 118.673 -1.694 19043 4715 1 15 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.237 0.141 19043 4716 1 15 . 1 1 30 30 PHE C C 30 177.887 177.887 177.903 -0.016 19043 4717 1 15 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.677 0.942 19043 4718 1 15 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.871 0.588 19043 4719 1 15 . 1 1 30 30 PHE H H 30 8.017 8.017 7.675 0.342 19043 4720 1 15 . 1 1 31 31 ILE N N 31 119.553 119.553 118.670 0.883 19043 4721 1 15 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.628 0.150 19043 4722 1 15 . 1 1 31 31 ILE C C 31 177.084 177.084 177.984 -0.900 19043 4723 1 15 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.418 0.227 19043 4724 1 15 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.549 -0.434 19043 4725 1 15 . 1 1 31 31 ILE H H 31 8.372 8.372 8.475 -0.103 19043 4726 1 15 . 1 1 32 32 GLN N N 32 119.108 119.108 119.607 -0.499 19043 4727 1 15 . 1 1 32 32 GLN HA H 32 3.806 3.806 4.004 -0.198 19043 4728 1 15 . 1 1 32 32 GLN C C 32 177.836 177.836 178.609 -0.773 19043 4729 1 15 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.512 -0.744 19043 4730 1 15 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.651 -0.673 19043 4731 1 15 . 1 1 32 32 GLN H H 32 8.389 8.389 7.784 0.605 19043 4732 1 15 . 1 1 33 33 SER N N 33 114.437 114.437 114.651 -0.214 19043 4733 1 15 . 1 1 33 33 SER HA H 33 4.212 4.212 4.328 -0.116 19043 4734 1 15 . 1 1 33 33 SER C C 33 175.469 175.469 176.856 -1.387 19043 4735 1 15 . 1 1 33 33 SER CA C 33 62.403 62.403 61.231 1.172 19043 4736 1 15 . 1 1 33 33 SER CB C 33 63.794 63.794 62.819 0.975 19043 4737 1 15 . 1 1 33 33 SER H H 33 8.078 8.078 7.798 0.280 19043 4738 1 15 . 1 1 34 34 LEU N N 34 122.967 122.967 124.395 -1.428 19043 4739 1 15 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.231 -0.321 19043 4740 1 15 . 1 1 34 34 LEU C C 34 177.506 177.506 178.282 -0.776 19043 4741 1 15 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.472 -0.044 19043 4742 1 15 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.161 0.651 19043 4743 1 15 . 1 1 34 34 LEU H H 34 8.495 8.495 8.194 0.301 19043 4744 1 15 . 1 1 35 35 LYS N N 35 115.859 115.859 118.727 -2.868 19043 4745 1 15 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.116 -0.303 19043 4746 1 15 . 1 1 35 35 LYS C C 35 177.628 177.628 177.969 -0.341 19043 4747 1 15 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.876 -1.999 19043 4748 1 15 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.131 -0.112 19043 4749 1 15 . 1 1 35 35 LYS H H 35 7.815 7.815 8.070 -0.255 19043 4750 1 15 . 1 1 36 36 ASP N N 36 116.741 116.741 117.202 -0.461 19043 4751 1 15 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.589 -0.075 19043 4752 1 15 . 1 1 36 36 ASP C C 36 177.324 177.324 175.684 1.640 19043 4753 1 15 . 1 1 36 36 ASP CA C 36 56.686 56.686 55.670 1.016 19043 4754 1 15 . 1 1 36 36 ASP CB C 36 40.671 40.671 42.052 -1.381 19043 4755 1 15 . 1 1 36 36 ASP H H 36 7.943 7.943 7.712 0.231 19043 4756 1 15 . 1 1 37 37 ASP N N 37 116.686 116.686 119.410 -2.724 19043 4757 1 15 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.061 -0.020 19043 4758 1 15 . 1 1 37 37 ASP CA C 37 51.946 51.946 52.023 -0.077 19043 4759 1 15 . 1 1 37 37 ASP CB C 37 40.523 40.523 42.001 -1.478 19043 4760 1 15 . 1 1 37 37 ASP H H 37 8.125 8.125 7.834 0.291 19043 4761 1 15 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.491 0.092 19043 4762 1 15 . 1 1 38 38 PRO C C 38 179.200 179.200 178.240 0.960 19043 4763 1 15 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.743 -0.205 19043 4764 1 15 . 1 1 38 38 PRO CB C 38 31.886 31.886 31.941 -0.055 19043 4765 1 15 . 1 1 39 39 SER N N 39 114.963 114.963 113.409 1.554 19043 4766 1 15 . 1 1 39 39 SER HA H 39 4.178 4.178 4.235 -0.057 19043 4767 1 15 . 1 1 39 39 SER C C 39 176.151 176.151 175.983 0.168 19043 4768 1 15 . 1 1 39 39 SER CA C 39 61.197 61.197 60.507 0.690 19043 4769 1 15 . 1 1 39 39 SER CB C 39 62.729 62.729 61.731 0.998 19043 4770 1 15 . 1 1 39 39 SER H H 39 8.315 8.315 8.538 -0.223 19043 4771 1 15 . 1 1 40 40 GLN N N 40 120.058 120.058 120.402 -0.344 19043 4772 1 15 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.588 0.072 19043 4773 1 15 . 1 1 40 40 GLN C C 40 176.192 176.192 177.296 -1.104 19043 4774 1 15 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.537 -0.556 19043 4775 1 15 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.076 0.092 19043 4776 1 15 . 1 1 40 40 GLN H H 40 7.820 7.820 7.998 -0.178 19043 4777 1 15 . 1 1 41 41 SER N N 41 115.553 115.553 116.987 -1.434 19043 4778 1 15 . 1 1 41 41 SER HA H 41 3.845 3.845 4.093 -0.248 19043 4779 1 15 . 1 1 41 41 SER C C 41 174.181 174.181 175.456 -1.275 19043 4780 1 15 . 1 1 41 41 SER CA C 41 63.957 63.957 61.625 2.332 19043 4781 1 15 . 1 1 41 41 SER CB C 41 63.191 63.191 62.385 0.806 19043 4782 1 15 . 1 1 41 41 SER H H 41 7.666 7.666 7.894 -0.228 19043 4783 1 15 . 1 1 42 42 ALA N N 42 122.360 122.360 122.352 0.008 19043 4784 1 15 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.192 -0.069 19043 4785 1 15 . 1 1 42 42 ALA C C 42 180.996 180.996 178.865 2.131 19043 4786 1 15 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.012 1.551 19043 4787 1 15 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.063 -1.007 19043 4788 1 15 . 1 1 42 42 ALA H H 42 8.556 8.556 8.040 0.516 19043 4789 1 15 . 1 1 43 43 ASN N N 43 118.974 118.974 118.871 0.103 19043 4790 1 15 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.527 -0.008 19043 4791 1 15 . 1 1 43 43 ASN C C 43 177.972 177.972 177.738 0.234 19043 4792 1 15 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.144 -0.290 19043 4793 1 15 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.484 -0.335 19043 4794 1 15 . 1 1 43 43 ASN H H 43 7.950 7.950 7.687 0.263 19043 4795 1 15 . 1 1 44 44 LEU N N 44 122.070 122.070 120.541 1.529 19043 4796 1 15 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.361 -0.172 19043 4797 1 15 . 1 1 44 44 LEU C C 44 178.332 178.332 179.234 -0.902 19043 4798 1 15 . 1 1 44 44 LEU CA C 44 57.834 57.834 58.084 -0.250 19043 4799 1 15 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.837 0.514 19043 4800 1 15 . 1 1 44 44 LEU H H 44 8.789 8.789 8.594 0.195 19043 4801 1 15 . 1 1 45 45 LEU N N 45 118.621 118.621 119.324 -0.703 19043 4802 1 15 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.732 0.073 19043 4803 1 15 . 1 1 45 45 LEU C C 45 177.832 177.832 178.528 -0.696 19043 4804 1 15 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.670 0.215 19043 4805 1 15 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.587 0.219 19043 4806 1 15 . 1 1 45 45 LEU H H 45 8.283 8.283 7.500 0.783 19043 4807 1 15 . 1 1 46 46 ALA N N 46 119.525 119.525 120.575 -1.050 19043 4808 1 15 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.895 0.115 19043 4809 1 15 . 1 1 46 46 ALA C C 46 181.250 181.250 179.984 1.266 19043 4810 1 15 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.090 0.206 19043 4811 1 15 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.048 -0.097 19043 4812 1 15 . 1 1 46 46 ALA H H 46 7.640 7.640 7.751 -0.111 19043 4813 1 15 . 1 1 47 47 GLU N N 47 119.572 119.572 118.246 1.326 19043 4814 1 15 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.122 -0.092 19043 4815 1 15 . 1 1 47 47 GLU C C 47 178.895 178.895 178.842 0.053 19043 4816 1 15 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.875 0.291 19043 4817 1 15 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.849 -0.311 19043 4818 1 15 . 1 1 47 47 GLU H H 47 8.139 8.139 8.419 -0.280 19043 4819 1 15 . 1 1 48 48 ALA N N 48 123.953 123.953 122.495 1.458 19043 4820 1 15 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.803 -0.276 19043 4821 1 15 . 1 1 48 48 ALA C C 48 179.636 179.636 179.152 0.484 19043 4822 1 15 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.428 1.088 19043 4823 1 15 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.765 -0.520 19043 4824 1 15 . 1 1 48 48 ALA H H 48 8.468 8.468 7.666 0.802 19043 4825 1 15 . 1 1 49 49 LYS N N 49 117.926 117.926 118.330 -0.404 19043 4826 1 15 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.931 -0.192 19043 4827 1 15 . 1 1 49 49 LYS C C 49 178.761 178.761 178.638 0.123 19043 4828 1 15 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.640 0.752 19043 4829 1 15 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.352 -0.263 19043 4830 1 15 . 1 1 49 49 LYS H H 49 8.459 8.459 8.413 0.046 19043 4831 1 15 . 1 1 50 50 LYS N N 50 120.194 120.194 119.456 0.738 19043 4832 1 15 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.070 0.018 19043 4833 1 15 . 1 1 50 50 LYS C C 50 179.859 179.859 178.360 1.499 19043 4834 1 15 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.051 0.684 19043 4835 1 15 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.504 -0.042 19043 4836 1 15 . 1 1 50 50 LYS H H 50 7.702 7.702 7.756 -0.054 19043 4837 1 15 . 1 1 51 51 LEU N N 51 122.126 122.126 119.241 2.885 19043 4838 1 15 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.238 -0.111 19043 4839 1 15 . 1 1 51 51 LEU C C 51 178.123 178.123 178.195 -0.072 19043 4840 1 15 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.806 0.791 19043 4841 1 15 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.261 0.090 19043 4842 1 15 . 1 1 51 51 LEU H H 51 8.023 8.023 7.433 0.590 19043 4843 1 15 . 1 1 52 52 ASN N N 52 116.675 116.675 117.355 -0.680 19043 4844 1 15 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.402 -0.467 19043 4845 1 15 . 1 1 52 52 ASN C C 52 177.668 177.668 176.941 0.727 19043 4846 1 15 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.256 1.661 19043 4847 1 15 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.612 3.324 19043 4848 1 15 . 1 1 52 52 ASN H H 52 8.537 8.537 8.335 0.202 19043 4849 1 15 . 1 1 53 53 ASP N N 53 118.725 118.725 118.445 0.280 19043 4850 1 15 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.567 -0.123 19043 4851 1 15 . 1 1 53 53 ASP C C 53 178.936 178.936 177.173 1.763 19043 4852 1 15 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.498 1.435 19043 4853 1 15 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.099 -1.004 19043 4854 1 15 . 1 1 53 53 ASP H H 53 8.220 8.220 7.973 0.247 19043 4855 1 15 . 1 1 54 54 ALA N N 54 122.872 122.872 121.291 1.581 19043 4856 1 15 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.111 0.121 19043 4857 1 15 . 1 1 54 54 ALA C C 54 179.354 179.354 178.856 0.498 19043 4858 1 15 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.150 0.191 19043 4859 1 15 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.122 -0.517 19043 4860 1 15 . 1 1 54 54 ALA H H 54 8.037 8.037 7.226 0.811 19043 4861 1 15 . 1 1 55 55 GLN N N 55 115.052 115.052 116.343 -1.291 19043 4862 1 15 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.346 0.032 19043 4863 1 15 . 1 1 55 55 GLN C C 55 174.116 174.116 175.427 -1.311 19043 4864 1 15 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.092 -0.138 19043 4865 1 15 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.368 -1.144 19043 4866 1 15 . 1 1 55 55 GLN H H 55 7.512 7.512 7.837 -0.325 19043 4867 1 15 . 1 1 56 56 ALA N N 56 124.556 124.556 124.414 0.142 19043 4868 1 15 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.305 0.043 19043 4869 1 15 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.026 0.011 19043 4870 1 15 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.533 -0.554 19043 4871 1 15 . 1 1 56 56 ALA H H 56 7.100 7.100 7.339 -0.239 19043 4872 1 15 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.528 -0.116 19043 4873 1 15 . 1 1 57 57 PRO C C 57 176.151 176.151 176.948 -0.797 19043 4874 1 15 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.133 1.150 19043 4875 1 15 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.117 -0.124 19043 4876 1 16 . 1 1 2 2 ASP N N 2 125.357 125.357 120.193 5.164 19043 4877 1 16 . 1 1 2 2 ASP C C 2 175.535 175.535 176.689 -1.154 19043 4878 1 16 . 1 1 2 2 ASP CA C 2 54.307 54.307 55.040 -0.733 19043 4879 1 16 . 1 1 2 2 ASP CB C 2 41.470 41.470 41.429 0.041 19043 4880 1 16 . 1 1 2 2 ASP H H 2 8.762 8.762 8.478 0.284 19043 4881 1 16 . 1 1 3 3 ASN N N 3 120.441 120.441 117.283 3.158 19043 4882 1 16 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.219 0.481 19043 4883 1 16 . 1 1 3 3 ASN C C 3 175.246 175.246 175.322 -0.076 19043 4884 1 16 . 1 1 3 3 ASN CA C 3 53.289 53.289 54.104 -0.815 19043 4885 1 16 . 1 1 3 3 ASN CB C 3 39.086 39.086 38.174 0.912 19043 4886 1 16 . 1 1 3 3 ASN H H 3 8.548 8.548 8.164 0.384 19043 4887 1 16 . 1 1 4 4 LYS N N 4 121.461 121.461 118.860 2.601 19043 4888 1 16 . 1 1 4 4 LYS HA H 4 4.215 4.215 3.994 0.221 19043 4889 1 16 . 1 1 4 4 LYS C C 4 176.404 176.404 176.261 0.143 19043 4890 1 16 . 1 1 4 4 LYS CA C 4 56.853 56.853 57.083 -0.230 19043 4891 1 16 . 1 1 4 4 LYS CB C 4 32.780 32.780 31.997 0.783 19043 4892 1 16 . 1 1 4 4 LYS H H 4 8.337 8.337 7.646 0.691 19043 4893 1 16 . 1 1 5 5 PHE N N 5 119.538 119.538 115.517 4.021 19043 4894 1 16 . 1 1 5 5 PHE C C 5 175.433 175.433 175.436 -0.003 19043 4895 1 16 . 1 1 5 5 PHE CA C 5 57.792 57.792 57.935 -0.143 19043 4896 1 16 . 1 1 5 5 PHE CB C 5 40.067 40.067 35.886 4.181 19043 4897 1 16 . 1 1 5 5 PHE H H 5 8.277 8.277 7.642 0.635 19043 4898 1 16 . 1 1 6 6 ASN N N 6 121.168 121.168 119.866 1.302 19043 4899 1 16 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.686 0.131 19043 4900 1 16 . 1 1 6 6 ASN C C 6 175.884 175.884 176.074 -0.190 19043 4901 1 16 . 1 1 6 6 ASN CA C 6 52.785 52.785 52.771 0.014 19043 4902 1 16 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.440 -0.069 19043 4903 1 16 . 1 1 6 6 ASN H H 6 8.443 8.443 8.206 0.237 19043 4904 1 16 . 1 1 7 7 LYS N N 7 121.688 121.688 119.967 1.721 19043 4905 1 16 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.136 -0.191 19043 4906 1 16 . 1 1 7 7 LYS C C 7 178.196 178.196 178.446 -0.250 19043 4907 1 16 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.048 -0.147 19043 4908 1 16 . 1 1 7 7 LYS CB C 7 32.125 32.125 31.973 0.152 19043 4909 1 16 . 1 1 7 7 LYS H H 7 8.460 8.460 8.687 -0.227 19043 4910 1 16 . 1 1 8 8 GLU N N 8 119.926 119.926 118.731 1.195 19043 4911 1 16 . 1 1 8 8 GLU HA H 8 4.081 4.081 4.095 -0.014 19043 4912 1 16 . 1 1 8 8 GLU C C 8 179.894 179.894 179.103 0.791 19043 4913 1 16 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.808 0.031 19043 4914 1 16 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.120 -0.179 19043 4915 1 16 . 1 1 8 8 GLU H H 8 8.386 8.386 8.807 -0.421 19043 4916 1 16 . 1 1 9 9 GLN N N 9 121.401 121.401 117.559 3.842 19043 4917 1 16 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.163 -0.066 19043 4918 1 16 . 1 1 9 9 GLN C C 9 177.324 177.324 178.371 -1.047 19043 4919 1 16 . 1 1 9 9 GLN CA C 9 59.383 59.383 58.925 0.458 19043 4920 1 16 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.545 0.324 19043 4921 1 16 . 1 1 9 9 GLN H H 9 8.307 8.307 8.563 -0.256 19043 4922 1 16 . 1 1 10 10 GLN N N 10 120.060 120.060 120.231 -0.171 19043 4923 1 16 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.089 -0.867 19043 4924 1 16 . 1 1 10 10 GLN C C 10 176.888 176.888 178.231 -1.343 19043 4925 1 16 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.987 -0.038 19043 4926 1 16 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.663 0.177 19043 4927 1 16 . 1 1 10 10 GLN H H 10 8.040 8.040 7.768 0.272 19043 4928 1 16 . 1 1 11 11 ASN N N 11 116.214 116.214 118.846 -2.632 19043 4929 1 16 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.556 -0.206 19043 4930 1 16 . 1 1 11 11 ASN C C 11 177.828 177.828 177.506 0.322 19043 4931 1 16 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.142 0.115 19043 4932 1 16 . 1 1 11 11 ASN CB C 11 38.210 38.210 37.901 0.309 19043 4933 1 16 . 1 1 11 11 ASN H H 11 8.366 8.366 8.311 0.055 19043 4934 1 16 . 1 1 12 12 ALA N N 12 121.429 121.429 122.732 -1.303 19043 4935 1 16 . 1 1 12 12 ALA HA H 12 4.009 4.009 3.979 0.030 19043 4936 1 16 . 1 1 12 12 ALA C C 12 177.850 177.850 179.183 -1.333 19043 4937 1 16 . 1 1 12 12 ALA CA C 12 55.293 55.293 55.080 0.214 19043 4938 1 16 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.437 -0.116 19043 4939 1 16 . 1 1 12 12 ALA H H 12 7.915 7.915 8.036 -0.121 19043 4940 1 16 . 1 1 13 13 PHE N N 13 118.052 118.052 120.018 -1.966 19043 4941 1 16 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.968 -0.395 19043 4942 1 16 . 1 1 13 13 PHE C C 13 175.832 175.832 177.143 -1.311 19043 4943 1 16 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.978 -0.123 19043 4944 1 16 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.995 -0.078 19043 4945 1 16 . 1 1 13 13 PHE H H 13 8.097 8.097 7.486 0.611 19043 4946 1 16 . 1 1 14 14 TYR N N 14 116.000 116.000 117.477 -1.477 19043 4947 1 16 . 1 1 14 14 TYR HA H 14 3.985 3.985 3.973 0.012 19043 4948 1 16 . 1 1 14 14 TYR C C 14 178.860 178.860 178.323 0.537 19043 4949 1 16 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.753 -1.958 19043 4950 1 16 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.784 -0.804 19043 4951 1 16 . 1 1 14 14 TYR H H 14 8.040 8.040 7.773 0.267 19043 4952 1 16 . 1 1 15 15 GLU N N 15 118.737 118.737 117.455 1.282 19043 4953 1 16 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.854 0.117 19043 4954 1 16 . 1 1 15 15 GLU C C 15 180.184 180.184 178.960 1.224 19043 4955 1 16 . 1 1 15 15 GLU CA C 15 60.607 60.607 58.756 1.851 19043 4956 1 16 . 1 1 15 15 GLU CB C 15 29.722 29.722 28.755 0.967 19043 4957 1 16 . 1 1 15 15 GLU H H 15 8.244 8.244 8.559 -0.315 19043 4958 1 16 . 1 1 16 16 ILE N N 16 119.695 119.695 118.591 1.104 19043 4959 1 16 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.753 -0.400 19043 4960 1 16 . 1 1 16 16 ILE C C 16 177.760 177.760 177.602 0.158 19043 4961 1 16 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.087 1.567 19043 4962 1 16 . 1 1 16 16 ILE CB C 16 37.403 37.403 37.948 -0.545 19043 4963 1 16 . 1 1 16 16 ILE H H 16 8.336 8.336 7.296 1.040 19043 4964 1 16 . 1 1 17 17 LEU N N 17 117.709 117.709 119.959 -2.250 19043 4965 1 16 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.926 -0.373 19043 4966 1 16 . 1 1 17 17 LEU C C 17 176.565 176.565 178.391 -1.826 19043 4967 1 16 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.426 0.133 19043 4968 1 16 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.591 0.247 19043 4969 1 16 . 1 1 17 17 LEU H H 17 7.738 7.738 7.307 0.431 19043 4970 1 16 . 1 1 18 18 HIS N N 18 110.934 110.934 116.382 -5.448 19043 4971 1 16 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.305 0.192 19043 4972 1 16 . 1 1 18 18 HIS C C 18 175.243 175.243 175.870 -0.627 19043 4973 1 16 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.235 -1.179 19043 4974 1 16 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.067 0.581 19043 4975 1 16 . 1 1 18 18 HIS H H 18 7.150 7.150 8.201 -1.051 19043 4976 1 16 . 1 1 19 19 LEU N N 19 123.586 123.586 121.915 1.671 19043 4977 1 16 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.267 0.151 19043 4978 1 16 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.891 -0.415 19043 4979 1 16 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.400 -1.077 19043 4980 1 16 . 1 1 19 19 LEU H H 19 7.249 7.249 7.678 -0.429 19043 4981 1 16 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.428 0.003 19043 4982 1 16 . 1 1 20 20 PRO C C 20 178.092 178.092 177.630 0.462 19043 4983 1 16 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.826 0.071 19043 4984 1 16 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.191 0.381 19043 4985 1 16 . 1 1 21 21 ASN N N 21 113.952 113.952 117.028 -3.076 19043 4986 1 16 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.530 0.479 19043 4987 1 16 . 1 1 21 21 ASN C C 21 176.397 176.397 176.057 0.340 19043 4988 1 16 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.137 -1.508 19043 4989 1 16 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.430 0.380 19043 4990 1 16 . 1 1 21 21 ASN H H 21 8.871 8.871 8.260 0.611 19043 4991 1 16 . 1 1 22 22 LEU N N 22 117.526 117.526 122.614 -5.088 19043 4992 1 16 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.433 -0.032 19043 4993 1 16 . 1 1 22 22 LEU C C 22 176.879 176.879 175.400 1.479 19043 4994 1 16 . 1 1 22 22 LEU CA C 22 54.457 54.457 55.294 -0.837 19043 4995 1 16 . 1 1 22 22 LEU CB C 22 42.520 42.520 42.877 -0.357 19043 4996 1 16 . 1 1 22 22 LEU H H 22 6.563 6.563 8.168 -1.605 19043 4997 1 16 . 1 1 23 23 ASN N N 23 120.219 120.219 124.094 -3.875 19043 4998 1 16 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.807 0.061 19043 4999 1 16 . 1 1 23 23 ASN C C 23 175.507 175.507 176.468 -0.961 19043 5000 1 16 . 1 1 23 23 ASN CA C 23 51.416 51.416 51.803 -0.388 19043 5001 1 16 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.689 -0.977 19043 5002 1 16 . 1 1 23 23 ASN H H 23 8.612 8.612 8.078 0.534 19043 5003 1 16 . 1 1 24 24 GLU N N 24 118.801 118.801 119.494 -0.693 19043 5004 1 16 . 1 1 24 24 GLU HA H 24 3.874 3.874 4.025 -0.151 19043 5005 1 16 . 1 1 24 24 GLU C C 24 177.799 177.799 178.195 -0.396 19043 5006 1 16 . 1 1 24 24 GLU CA C 24 60.191 60.191 59.937 0.254 19043 5007 1 16 . 1 1 24 24 GLU CB C 24 29.365 29.365 28.747 0.619 19043 5008 1 16 . 1 1 24 24 GLU H H 24 8.735 8.735 8.929 -0.194 19043 5009 1 16 . 1 1 25 25 GLU N N 25 119.198 119.198 118.812 0.386 19043 5010 1 16 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.019 -0.041 19043 5011 1 16 . 1 1 25 25 GLU C C 25 180.078 180.078 179.148 0.930 19043 5012 1 16 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.550 0.341 19043 5013 1 16 . 1 1 25 25 GLU CB C 25 29.131 29.131 29.086 0.045 19043 5014 1 16 . 1 1 25 25 GLU H H 25 8.229 8.229 8.871 -0.642 19043 5015 1 16 . 1 1 26 26 GLN N N 26 119.646 119.646 118.149 1.497 19043 5016 1 16 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.033 -0.093 19043 5017 1 16 . 1 1 26 26 GLN C C 26 178.154 178.154 178.346 -0.192 19043 5018 1 16 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.379 -0.486 19043 5019 1 16 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.904 -0.001 19043 5020 1 16 . 1 1 26 26 GLN H H 26 8.425 8.425 7.822 0.603 19043 5021 1 16 . 1 1 27 27 ARG N N 27 119.454 119.454 120.428 -0.974 19043 5022 1 16 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.200 -0.414 19043 5023 1 16 . 1 1 27 27 ARG C C 27 177.863 177.863 178.400 -0.537 19043 5024 1 16 . 1 1 27 27 ARG CA C 27 60.630 60.630 59.690 0.940 19043 5025 1 16 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.081 -0.437 19043 5026 1 16 . 1 1 27 27 ARG H H 27 8.548 8.548 8.333 0.215 19043 5027 1 16 . 1 1 28 28 ASN N N 28 116.833 116.833 117.622 -0.789 19043 5028 1 16 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.476 -0.144 19043 5029 1 16 . 1 1 28 28 ASN C C 28 177.234 177.234 177.287 -0.053 19043 5030 1 16 . 1 1 28 28 ASN CA C 28 56.038 56.038 56.055 -0.017 19043 5031 1 16 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.332 -0.647 19043 5032 1 16 . 1 1 28 28 ASN H H 28 8.569 8.569 8.534 0.035 19043 5033 1 16 . 1 1 29 29 ALA N N 29 122.687 122.687 123.270 -0.583 19043 5034 1 16 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.043 0.011 19043 5035 1 16 . 1 1 29 29 ALA C C 29 181.045 181.045 179.560 1.485 19043 5036 1 16 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.598 0.652 19043 5037 1 16 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.234 -0.414 19043 5038 1 16 . 1 1 29 29 ALA H H 29 7.793 7.793 7.396 0.397 19043 5039 1 16 . 1 1 30 30 PHE N N 30 116.979 116.979 118.114 -1.135 19043 5040 1 16 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.232 0.146 19043 5041 1 16 . 1 1 30 30 PHE C C 30 177.887 177.887 177.911 -0.024 19043 5042 1 16 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.638 0.981 19043 5043 1 16 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.754 0.705 19043 5044 1 16 . 1 1 30 30 PHE H H 30 8.017 8.017 7.473 0.544 19043 5045 1 16 . 1 1 31 31 ILE N N 31 119.553 119.553 119.084 0.469 19043 5046 1 16 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.614 0.164 19043 5047 1 16 . 1 1 31 31 ILE C C 31 177.084 177.084 178.221 -1.137 19043 5048 1 16 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.267 0.377 19043 5049 1 16 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.518 -0.403 19043 5050 1 16 . 1 1 31 31 ILE H H 31 8.372 8.372 8.417 -0.045 19043 5051 1 16 . 1 1 32 32 GLN N N 32 119.108 119.108 119.660 -0.552 19043 5052 1 16 . 1 1 32 32 GLN HA H 32 3.806 3.806 4.014 -0.208 19043 5053 1 16 . 1 1 32 32 GLN C C 32 177.836 177.836 178.644 -0.808 19043 5054 1 16 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.437 -0.669 19043 5055 1 16 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.779 -0.801 19043 5056 1 16 . 1 1 32 32 GLN H H 32 8.389 8.389 8.147 0.242 19043 5057 1 16 . 1 1 33 33 SER N N 33 114.437 114.437 115.467 -1.030 19043 5058 1 16 . 1 1 33 33 SER HA H 33 4.212 4.212 4.264 -0.052 19043 5059 1 16 . 1 1 33 33 SER C C 33 175.469 175.469 176.882 -1.413 19043 5060 1 16 . 1 1 33 33 SER CA C 33 62.403 62.403 61.923 0.480 19043 5061 1 16 . 1 1 33 33 SER CB C 33 63.794 63.794 63.112 0.682 19043 5062 1 16 . 1 1 33 33 SER H H 33 8.078 8.078 7.878 0.200 19043 5063 1 16 . 1 1 34 34 LEU N N 34 122.967 122.967 123.379 -0.412 19043 5064 1 16 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.241 -0.331 19043 5065 1 16 . 1 1 34 34 LEU C C 34 177.506 177.506 178.097 -0.591 19043 5066 1 16 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.517 -0.089 19043 5067 1 16 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.151 0.661 19043 5068 1 16 . 1 1 34 34 LEU H H 34 8.495 8.495 8.354 0.141 19043 5069 1 16 . 1 1 35 35 LYS N N 35 115.859 115.859 118.184 -2.325 19043 5070 1 16 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.218 -0.405 19043 5071 1 16 . 1 1 35 35 LYS C C 35 177.628 177.628 177.986 -0.358 19043 5072 1 16 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.567 -1.690 19043 5073 1 16 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.272 -0.253 19043 5074 1 16 . 1 1 35 35 LYS H H 35 7.815 7.815 7.717 0.098 19043 5075 1 16 . 1 1 36 36 ASP N N 36 116.741 116.741 117.032 -0.291 19043 5076 1 16 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.663 -0.149 19043 5077 1 16 . 1 1 36 36 ASP C C 36 177.324 177.324 176.453 0.871 19043 5078 1 16 . 1 1 36 36 ASP CA C 36 56.686 56.686 55.434 1.252 19043 5079 1 16 . 1 1 36 36 ASP CB C 36 40.671 40.671 42.374 -1.703 19043 5080 1 16 . 1 1 36 36 ASP H H 36 7.943 7.943 7.762 0.181 19043 5081 1 16 . 1 1 37 37 ASP N N 37 116.686 116.686 118.903 -2.217 19043 5082 1 16 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.020 0.021 19043 5083 1 16 . 1 1 37 37 ASP CA C 37 51.946 51.946 52.068 -0.122 19043 5084 1 16 . 1 1 37 37 ASP CB C 37 40.523 40.523 41.981 -1.458 19043 5085 1 16 . 1 1 37 37 ASP H H 37 8.125 8.125 8.013 0.112 19043 5086 1 16 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.515 0.068 19043 5087 1 16 . 1 1 38 38 PRO C C 38 179.200 179.200 178.217 0.983 19043 5088 1 16 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.773 -0.236 19043 5089 1 16 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.011 -0.125 19043 5090 1 16 . 1 1 39 39 SER N N 39 114.963 114.963 113.173 1.790 19043 5091 1 16 . 1 1 39 39 SER HA H 39 4.178 4.178 4.245 -0.067 19043 5092 1 16 . 1 1 39 39 SER C C 39 176.151 176.151 175.909 0.242 19043 5093 1 16 . 1 1 39 39 SER CA C 39 61.197 61.197 60.469 0.728 19043 5094 1 16 . 1 1 39 39 SER CB C 39 62.729 62.729 61.739 0.990 19043 5095 1 16 . 1 1 39 39 SER H H 39 8.315 8.315 8.639 -0.324 19043 5096 1 16 . 1 1 40 40 GLN N N 40 120.058 120.058 120.485 -0.427 19043 5097 1 16 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.521 0.139 19043 5098 1 16 . 1 1 40 40 GLN C C 40 176.192 176.192 177.313 -1.121 19043 5099 1 16 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.434 -0.454 19043 5100 1 16 . 1 1 40 40 GLN CB C 40 28.168 28.168 27.923 0.245 19043 5101 1 16 . 1 1 40 40 GLN H H 40 7.820 7.820 7.935 -0.115 19043 5102 1 16 . 1 1 41 41 SER N N 41 115.553 115.553 116.807 -1.254 19043 5103 1 16 . 1 1 41 41 SER HA H 41 3.845 3.845 4.066 -0.221 19043 5104 1 16 . 1 1 41 41 SER C C 41 174.181 174.181 175.456 -1.275 19043 5105 1 16 . 1 1 41 41 SER CA C 41 63.957 63.957 61.656 2.301 19043 5106 1 16 . 1 1 41 41 SER CB C 41 63.191 63.191 63.031 0.160 19043 5107 1 16 . 1 1 41 41 SER H H 41 7.666 7.666 7.794 -0.128 19043 5108 1 16 . 1 1 42 42 ALA N N 42 122.360 122.360 121.758 0.602 19043 5109 1 16 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.225 -0.102 19043 5110 1 16 . 1 1 42 42 ALA C C 42 180.996 180.996 178.781 2.215 19043 5111 1 16 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.240 1.323 19043 5112 1 16 . 1 1 42 42 ALA CB C 42 18.056 18.056 18.969 -0.913 19043 5113 1 16 . 1 1 42 42 ALA H H 42 8.556 8.556 8.158 0.398 19043 5114 1 16 . 1 1 43 43 ASN N N 43 118.974 118.974 119.051 -0.077 19043 5115 1 16 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.563 -0.044 19043 5116 1 16 . 1 1 43 43 ASN C C 43 177.972 177.972 177.704 0.268 19043 5117 1 16 . 1 1 43 43 ASN CA C 43 55.854 55.854 55.786 0.068 19043 5118 1 16 . 1 1 43 43 ASN CB C 43 38.149 38.149 37.946 0.203 19043 5119 1 16 . 1 1 43 43 ASN H H 43 7.950 7.950 7.536 0.414 19043 5120 1 16 . 1 1 44 44 LEU N N 44 122.070 122.070 120.611 1.459 19043 5121 1 16 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.141 0.048 19043 5122 1 16 . 1 1 44 44 LEU C C 44 178.332 178.332 178.857 -0.525 19043 5123 1 16 . 1 1 44 44 LEU CA C 44 57.834 57.834 58.012 -0.178 19043 5124 1 16 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.733 0.618 19043 5125 1 16 . 1 1 44 44 LEU H H 44 8.789 8.789 8.534 0.255 19043 5126 1 16 . 1 1 45 45 LEU N N 45 118.621 118.621 119.259 -0.638 19043 5127 1 16 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.741 0.064 19043 5128 1 16 . 1 1 45 45 LEU C C 45 177.832 177.832 178.482 -0.650 19043 5129 1 16 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.694 0.191 19043 5130 1 16 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.580 0.226 19043 5131 1 16 . 1 1 45 45 LEU H H 45 8.283 8.283 7.580 0.703 19043 5132 1 16 . 1 1 46 46 ALA N N 46 119.525 119.525 120.689 -1.164 19043 5133 1 16 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.910 0.100 19043 5134 1 16 . 1 1 46 46 ALA C C 46 181.250 181.250 180.113 1.137 19043 5135 1 16 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.254 0.042 19043 5136 1 16 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.048 -0.097 19043 5137 1 16 . 1 1 46 46 ALA H H 46 7.640 7.640 7.780 -0.140 19043 5138 1 16 . 1 1 47 47 GLU N N 47 119.572 119.572 117.751 1.821 19043 5139 1 16 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.180 -0.150 19043 5140 1 16 . 1 1 47 47 GLU C C 47 178.895 178.895 178.864 0.031 19043 5141 1 16 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.811 0.355 19043 5142 1 16 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.694 -0.156 19043 5143 1 16 . 1 1 47 47 GLU H H 47 8.139 8.139 8.325 -0.186 19043 5144 1 16 . 1 1 48 48 ALA N N 48 123.953 123.953 122.831 1.122 19043 5145 1 16 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.546 -0.019 19043 5146 1 16 . 1 1 48 48 ALA C C 48 179.636 179.636 179.373 0.263 19043 5147 1 16 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.649 0.867 19043 5148 1 16 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.640 -0.395 19043 5149 1 16 . 1 1 48 48 ALA H H 48 8.468 8.468 7.804 0.664 19043 5150 1 16 . 1 1 49 49 LYS N N 49 117.926 117.926 117.830 0.096 19043 5151 1 16 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.928 -0.189 19043 5152 1 16 . 1 1 49 49 LYS C C 49 178.761 178.761 178.682 0.079 19043 5153 1 16 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.517 0.875 19043 5154 1 16 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.330 -0.241 19043 5155 1 16 . 1 1 49 49 LYS H H 49 8.459 8.459 8.324 0.135 19043 5156 1 16 . 1 1 50 50 LYS N N 50 120.194 120.194 119.837 0.357 19043 5157 1 16 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.083 0.005 19043 5158 1 16 . 1 1 50 50 LYS C C 50 179.859 179.859 178.893 0.966 19043 5159 1 16 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.076 0.659 19043 5160 1 16 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.541 -0.079 19043 5161 1 16 . 1 1 50 50 LYS H H 50 7.702 7.702 7.644 0.058 19043 5162 1 16 . 1 1 51 51 LEU N N 51 122.126 122.126 119.447 2.679 19043 5163 1 16 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.232 -0.105 19043 5164 1 16 . 1 1 51 51 LEU C C 51 178.123 178.123 177.966 0.157 19043 5165 1 16 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.770 0.827 19043 5166 1 16 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.062 0.290 19043 5167 1 16 . 1 1 51 51 LEU H H 51 8.023 8.023 7.720 0.303 19043 5168 1 16 . 1 1 52 52 ASN N N 52 116.675 116.675 117.121 -0.446 19043 5169 1 16 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.444 -0.509 19043 5170 1 16 . 1 1 52 52 ASN C C 52 177.668 177.668 177.007 0.661 19043 5171 1 16 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.234 1.683 19043 5172 1 16 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.602 3.334 19043 5173 1 16 . 1 1 52 52 ASN H H 52 8.537 8.537 8.262 0.275 19043 5174 1 16 . 1 1 53 53 ASP N N 53 118.725 118.725 119.214 -0.489 19043 5175 1 16 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.575 -0.131 19043 5176 1 16 . 1 1 53 53 ASP C C 53 178.936 178.936 177.087 1.849 19043 5177 1 16 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.518 1.415 19043 5178 1 16 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.018 -0.923 19043 5179 1 16 . 1 1 53 53 ASP H H 53 8.220 8.220 7.897 0.323 19043 5180 1 16 . 1 1 54 54 ALA N N 54 122.872 122.872 121.367 1.505 19043 5181 1 16 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.116 0.116 19043 5182 1 16 . 1 1 54 54 ALA C C 54 179.354 179.354 179.074 0.280 19043 5183 1 16 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.383 -0.042 19043 5184 1 16 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.121 -0.516 19043 5185 1 16 . 1 1 54 54 ALA H H 54 8.037 8.037 7.351 0.686 19043 5186 1 16 . 1 1 55 55 GLN N N 55 115.052 115.052 115.732 -0.680 19043 5187 1 16 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.347 0.031 19043 5188 1 16 . 1 1 55 55 GLN C C 55 174.116 174.116 175.919 -1.803 19043 5189 1 16 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.581 -0.628 19043 5190 1 16 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.620 -1.396 19043 5191 1 16 . 1 1 55 55 GLN H H 55 7.512 7.512 7.576 -0.064 19043 5192 1 16 . 1 1 56 56 ALA N N 56 124.556 124.556 124.432 0.124 19043 5193 1 16 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.244 0.104 19043 5194 1 16 . 1 1 56 56 ALA CA C 56 51.037 51.037 50.977 0.060 19043 5195 1 16 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.633 -0.654 19043 5196 1 16 . 1 1 56 56 ALA H H 56 7.100 7.100 7.337 -0.237 19043 5197 1 16 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.626 -0.214 19043 5198 1 16 . 1 1 57 57 PRO C C 57 176.151 176.151 176.296 -0.145 19043 5199 1 16 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.191 1.092 19043 5200 1 16 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.337 -0.344 19043 5201 1 17 . 1 1 2 2 ASP N N 2 125.357 125.357 120.905 4.452 19043 5202 1 17 . 1 1 2 2 ASP C C 2 175.535 175.535 175.115 0.420 19043 5203 1 17 . 1 1 2 2 ASP CA C 2 54.307 54.307 53.367 0.940 19043 5204 1 17 . 1 1 2 2 ASP CB C 2 41.470 41.470 43.360 -1.890 19043 5205 1 17 . 1 1 2 2 ASP H H 2 8.762 8.762 7.881 0.881 19043 5206 1 17 . 1 1 3 3 ASN N N 3 120.441 120.441 116.316 4.125 19043 5207 1 17 . 1 1 3 3 ASN HA H 3 4.700 4.700 3.911 0.789 19043 5208 1 17 . 1 1 3 3 ASN C C 3 175.246 175.246 174.615 0.631 19043 5209 1 17 . 1 1 3 3 ASN CA C 3 53.289 53.289 54.274 -0.985 19043 5210 1 17 . 1 1 3 3 ASN CB C 3 39.086 39.086 38.056 1.030 19043 5211 1 17 . 1 1 3 3 ASN H H 3 8.548 8.548 8.616 -0.068 19043 5212 1 17 . 1 1 4 4 LYS N N 4 121.461 121.461 116.477 4.984 19043 5213 1 17 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.058 0.157 19043 5214 1 17 . 1 1 4 4 LYS C C 4 176.404 176.404 176.011 0.393 19043 5215 1 17 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.214 0.639 19043 5216 1 17 . 1 1 4 4 LYS CB C 4 32.780 32.780 31.897 0.883 19043 5217 1 17 . 1 1 4 4 LYS H H 4 8.337 8.337 7.992 0.345 19043 5218 1 17 . 1 1 5 5 PHE N N 5 119.538 119.538 116.186 3.352 19043 5219 1 17 . 1 1 5 5 PHE C C 5 175.433 175.433 174.822 0.611 19043 5220 1 17 . 1 1 5 5 PHE CA C 5 57.792 57.792 58.431 -0.639 19043 5221 1 17 . 1 1 5 5 PHE CB C 5 40.067 40.067 35.588 4.479 19043 5222 1 17 . 1 1 5 5 PHE H H 5 8.277 8.277 7.451 0.826 19043 5223 1 17 . 1 1 6 6 ASN N N 6 121.168 121.168 119.063 2.105 19043 5224 1 17 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.602 0.215 19043 5225 1 17 . 1 1 6 6 ASN C C 6 175.884 175.884 176.340 -0.456 19043 5226 1 17 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.419 -0.634 19043 5227 1 17 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.344 0.027 19043 5228 1 17 . 1 1 6 6 ASN H H 6 8.443 8.443 7.984 0.459 19043 5229 1 17 . 1 1 7 7 LYS N N 7 121.688 121.688 121.216 0.472 19043 5230 1 17 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.117 -0.172 19043 5231 1 17 . 1 1 7 7 LYS C C 7 178.196 178.196 178.511 -0.315 19043 5232 1 17 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.349 -0.448 19043 5233 1 17 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.310 -0.186 19043 5234 1 17 . 1 1 7 7 LYS H H 7 8.460 8.460 8.625 -0.165 19043 5235 1 17 . 1 1 8 8 GLU N N 8 119.926 119.926 119.005 0.921 19043 5236 1 17 . 1 1 8 8 GLU HA H 8 4.081 4.081 4.134 -0.053 19043 5237 1 17 . 1 1 8 8 GLU C C 8 179.894 179.894 179.283 0.611 19043 5238 1 17 . 1 1 8 8 GLU CA C 8 59.839 59.839 60.118 -0.279 19043 5239 1 17 . 1 1 8 8 GLU CB C 8 28.941 28.941 28.861 0.080 19043 5240 1 17 . 1 1 8 8 GLU H H 8 8.386 8.386 8.757 -0.371 19043 5241 1 17 . 1 1 9 9 GLN N N 9 121.401 121.401 117.681 3.720 19043 5242 1 17 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.079 0.018 19043 5243 1 17 . 1 1 9 9 GLN C C 9 177.324 177.324 178.221 -0.897 19043 5244 1 17 . 1 1 9 9 GLN CA C 9 59.383 59.383 59.131 0.252 19043 5245 1 17 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.433 0.436 19043 5246 1 17 . 1 1 9 9 GLN H H 9 8.307 8.307 8.776 -0.469 19043 5247 1 17 . 1 1 10 10 GLN N N 10 120.060 120.060 119.624 0.436 19043 5248 1 17 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.064 -0.842 19043 5249 1 17 . 1 1 10 10 GLN C C 10 176.888 176.888 178.361 -1.473 19043 5250 1 17 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.947 0.003 19043 5251 1 17 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.649 0.192 19043 5252 1 17 . 1 1 10 10 GLN H H 10 8.040 8.040 7.809 0.231 19043 5253 1 17 . 1 1 11 11 ASN N N 11 116.214 116.214 118.956 -2.742 19043 5254 1 17 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.621 -0.271 19043 5255 1 17 . 1 1 11 11 ASN C C 11 177.828 177.828 177.481 0.347 19043 5256 1 17 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.019 0.238 19043 5257 1 17 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.061 0.149 19043 5258 1 17 . 1 1 11 11 ASN H H 11 8.366 8.366 8.427 -0.061 19043 5259 1 17 . 1 1 12 12 ALA N N 12 121.429 121.429 122.981 -1.552 19043 5260 1 17 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.006 0.003 19043 5261 1 17 . 1 1 12 12 ALA C C 12 177.850 177.850 179.097 -1.247 19043 5262 1 17 . 1 1 12 12 ALA CA C 12 55.293 55.293 55.191 0.102 19043 5263 1 17 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.446 -0.125 19043 5264 1 17 . 1 1 12 12 ALA H H 12 7.915 7.915 8.304 -0.389 19043 5265 1 17 . 1 1 13 13 PHE N N 13 118.052 118.052 119.538 -1.486 19043 5266 1 17 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.993 -0.420 19043 5267 1 17 . 1 1 13 13 PHE C C 13 175.832 175.832 177.198 -1.366 19043 5268 1 17 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.834 0.021 19043 5269 1 17 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.921 -0.004 19043 5270 1 17 . 1 1 13 13 PHE H H 13 8.097 8.097 7.535 0.562 19043 5271 1 17 . 1 1 14 14 TYR N N 14 116.000 116.000 117.522 -1.522 19043 5272 1 17 . 1 1 14 14 TYR HA H 14 3.985 3.985 3.979 0.006 19043 5273 1 17 . 1 1 14 14 TYR C C 14 178.860 178.860 178.512 0.348 19043 5274 1 17 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.635 -1.840 19043 5275 1 17 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.658 -0.678 19043 5276 1 17 . 1 1 14 14 TYR H H 14 8.040 8.040 7.661 0.379 19043 5277 1 17 . 1 1 15 15 GLU N N 15 118.737 118.737 118.225 0.512 19043 5278 1 17 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.855 0.116 19043 5279 1 17 . 1 1 15 15 GLU C C 15 180.184 180.184 179.352 0.832 19043 5280 1 17 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.251 1.356 19043 5281 1 17 . 1 1 15 15 GLU CB C 15 29.722 29.722 28.950 0.772 19043 5282 1 17 . 1 1 15 15 GLU H H 15 8.244 8.244 8.386 -0.142 19043 5283 1 17 . 1 1 16 16 ILE N N 16 119.695 119.695 118.120 1.575 19043 5284 1 17 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.768 -0.415 19043 5285 1 17 . 1 1 16 16 ILE C C 16 177.760 177.760 177.538 0.222 19043 5286 1 17 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.088 1.566 19043 5287 1 17 . 1 1 16 16 ILE CB C 16 37.403 37.403 37.867 -0.464 19043 5288 1 17 . 1 1 16 16 ILE H H 16 8.336 8.336 7.583 0.753 19043 5289 1 17 . 1 1 17 17 LEU N N 17 117.709 117.709 118.664 -0.955 19043 5290 1 17 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.963 -0.410 19043 5291 1 17 . 1 1 17 17 LEU C C 17 176.565 176.565 177.844 -1.279 19043 5292 1 17 . 1 1 17 17 LEU CA C 17 57.559 57.559 56.944 0.615 19043 5293 1 17 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.813 0.025 19043 5294 1 17 . 1 1 17 17 LEU H H 17 7.738 7.738 7.479 0.259 19043 5295 1 17 . 1 1 18 18 HIS N N 18 110.934 110.934 115.690 -4.756 19043 5296 1 17 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.332 0.165 19043 5297 1 17 . 1 1 18 18 HIS C C 18 175.243 175.243 176.007 -0.764 19043 5298 1 17 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.240 -1.184 19043 5299 1 17 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.158 0.490 19043 5300 1 17 . 1 1 18 18 HIS H H 18 7.150 7.150 8.010 -0.860 19043 5301 1 17 . 1 1 19 19 LEU N N 19 123.586 123.586 122.119 1.467 19043 5302 1 17 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.206 0.212 19043 5303 1 17 . 1 1 19 19 LEU CA C 19 53.476 53.476 54.109 -0.633 19043 5304 1 17 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.555 -1.233 19043 5305 1 17 . 1 1 19 19 LEU H H 19 7.249 7.249 7.554 -0.305 19043 5306 1 17 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.449 -0.018 19043 5307 1 17 . 1 1 20 20 PRO C C 20 178.092 178.092 177.370 0.722 19043 5308 1 17 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.112 0.785 19043 5309 1 17 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.445 0.127 19043 5310 1 17 . 1 1 21 21 ASN N N 21 113.952 113.952 116.430 -2.478 19043 5311 1 17 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.517 0.492 19043 5312 1 17 . 1 1 21 21 ASN C C 21 176.397 176.397 175.800 0.597 19043 5313 1 17 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.036 -1.407 19043 5314 1 17 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.294 0.516 19043 5315 1 17 . 1 1 21 21 ASN H H 21 8.871 8.871 8.015 0.856 19043 5316 1 17 . 1 1 22 22 LEU N N 22 117.526 117.526 121.440 -3.914 19043 5317 1 17 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.348 0.053 19043 5318 1 17 . 1 1 22 22 LEU C C 22 176.879 176.879 175.161 1.718 19043 5319 1 17 . 1 1 22 22 LEU CA C 22 54.457 54.457 54.723 -0.266 19043 5320 1 17 . 1 1 22 22 LEU CB C 22 42.520 42.520 43.532 -1.012 19043 5321 1 17 . 1 1 22 22 LEU H H 22 6.563 6.563 8.100 -1.537 19043 5322 1 17 . 1 1 23 23 ASN N N 23 120.219 120.219 120.889 -0.670 19043 5323 1 17 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.745 0.123 19043 5324 1 17 . 1 1 23 23 ASN C C 23 175.507 175.507 175.994 -0.487 19043 5325 1 17 . 1 1 23 23 ASN CA C 23 51.416 51.416 51.798 -0.382 19043 5326 1 17 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.845 -1.133 19043 5327 1 17 . 1 1 23 23 ASN H H 23 8.612 8.612 8.043 0.569 19043 5328 1 17 . 1 1 24 24 GLU N N 24 118.801 118.801 119.940 -1.139 19043 5329 1 17 . 1 1 24 24 GLU HA H 24 3.874 3.874 4.030 -0.156 19043 5330 1 17 . 1 1 24 24 GLU C C 24 177.799 177.799 178.759 -0.960 19043 5331 1 17 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.197 -0.006 19043 5332 1 17 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.118 0.247 19043 5333 1 17 . 1 1 24 24 GLU H H 24 8.735 8.735 9.108 -0.373 19043 5334 1 17 . 1 1 25 25 GLU N N 25 119.198 119.198 118.051 1.147 19043 5335 1 17 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.050 -0.072 19043 5336 1 17 . 1 1 25 25 GLU C C 25 180.078 180.078 179.309 0.769 19043 5337 1 17 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.450 0.441 19043 5338 1 17 . 1 1 25 25 GLU CB C 25 29.131 29.131 28.613 0.517 19043 5339 1 17 . 1 1 25 25 GLU H H 25 8.229 8.229 8.450 -0.221 19043 5340 1 17 . 1 1 26 26 GLN N N 26 119.646 119.646 118.330 1.316 19043 5341 1 17 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.160 -0.220 19043 5342 1 17 . 1 1 26 26 GLN C C 26 178.154 178.154 178.449 -0.295 19043 5343 1 17 . 1 1 26 26 GLN CA C 26 57.893 57.893 57.787 0.106 19043 5344 1 17 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.885 0.017 19043 5345 1 17 . 1 1 26 26 GLN H H 26 8.425 8.425 8.001 0.424 19043 5346 1 17 . 1 1 27 27 ARG N N 27 119.454 119.454 120.604 -1.150 19043 5347 1 17 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.186 -0.400 19043 5348 1 17 . 1 1 27 27 ARG C C 27 177.863 177.863 178.249 -0.386 19043 5349 1 17 . 1 1 27 27 ARG CA C 27 60.630 60.630 60.198 0.432 19043 5350 1 17 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.174 -0.530 19043 5351 1 17 . 1 1 27 27 ARG H H 27 8.548 8.548 8.607 -0.059 19043 5352 1 17 . 1 1 28 28 ASN N N 28 116.833 116.833 117.475 -0.642 19043 5353 1 17 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.484 -0.152 19043 5354 1 17 . 1 1 28 28 ASN C C 28 177.234 177.234 177.303 -0.069 19043 5355 1 17 . 1 1 28 28 ASN CA C 28 56.038 56.038 56.083 -0.045 19043 5356 1 17 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.337 -0.651 19043 5357 1 17 . 1 1 28 28 ASN H H 28 8.569 8.569 8.505 0.064 19043 5358 1 17 . 1 1 29 29 ALA N N 29 122.687 122.687 122.396 0.291 19043 5359 1 17 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.035 0.019 19043 5360 1 17 . 1 1 29 29 ALA C C 29 181.045 181.045 179.497 1.548 19043 5361 1 17 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.942 0.308 19043 5362 1 17 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.041 -0.221 19043 5363 1 17 . 1 1 29 29 ALA H H 29 7.793 7.793 7.702 0.091 19043 5364 1 17 . 1 1 30 30 PHE N N 30 116.979 116.979 118.358 -1.379 19043 5365 1 17 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.242 0.136 19043 5366 1 17 . 1 1 30 30 PHE C C 30 177.887 177.887 177.795 0.092 19043 5367 1 17 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.182 1.437 19043 5368 1 17 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.954 0.505 19043 5369 1 17 . 1 1 30 30 PHE H H 30 8.017 8.017 7.199 0.818 19043 5370 1 17 . 1 1 31 31 ILE N N 31 119.553 119.553 119.358 0.195 19043 5371 1 17 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.625 0.153 19043 5372 1 17 . 1 1 31 31 ILE C C 31 177.084 177.084 178.042 -0.958 19043 5373 1 17 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.532 0.113 19043 5374 1 17 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.609 -0.494 19043 5375 1 17 . 1 1 31 31 ILE H H 31 8.372 8.372 8.554 -0.182 19043 5376 1 17 . 1 1 32 32 GLN N N 32 119.108 119.108 119.250 -0.142 19043 5377 1 17 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.974 -0.168 19043 5378 1 17 . 1 1 32 32 GLN C C 32 177.836 177.836 178.551 -0.715 19043 5379 1 17 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.545 -0.777 19043 5380 1 17 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.567 -0.589 19043 5381 1 17 . 1 1 32 32 GLN H H 32 8.389 8.389 8.183 0.206 19043 5382 1 17 . 1 1 33 33 SER N N 33 114.437 114.437 114.089 0.348 19043 5383 1 17 . 1 1 33 33 SER HA H 33 4.212 4.212 4.355 -0.143 19043 5384 1 17 . 1 1 33 33 SER C C 33 175.469 175.469 176.588 -1.119 19043 5385 1 17 . 1 1 33 33 SER CA C 33 62.403 62.403 60.225 2.178 19043 5386 1 17 . 1 1 33 33 SER CB C 33 63.794 63.794 63.004 0.790 19043 5387 1 17 . 1 1 33 33 SER H H 33 8.078 8.078 7.666 0.412 19043 5388 1 17 . 1 1 34 34 LEU N N 34 122.967 122.967 124.104 -1.137 19043 5389 1 17 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.242 -0.332 19043 5390 1 17 . 1 1 34 34 LEU C C 34 177.506 177.506 178.195 -0.689 19043 5391 1 17 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.196 0.232 19043 5392 1 17 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.002 0.810 19043 5393 1 17 . 1 1 34 34 LEU H H 34 8.495 8.495 8.210 0.285 19043 5394 1 17 . 1 1 35 35 LYS N N 35 115.859 115.859 118.763 -2.904 19043 5395 1 17 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.152 -0.339 19043 5396 1 17 . 1 1 35 35 LYS C C 35 177.628 177.628 177.775 -0.147 19043 5397 1 17 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.672 -1.795 19043 5398 1 17 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.161 -0.142 19043 5399 1 17 . 1 1 35 35 LYS H H 35 7.815 7.815 7.991 -0.176 19043 5400 1 17 . 1 1 36 36 ASP N N 36 116.741 116.741 116.715 0.026 19043 5401 1 17 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.604 -0.090 19043 5402 1 17 . 1 1 36 36 ASP C C 36 177.324 177.324 176.121 1.203 19043 5403 1 17 . 1 1 36 36 ASP CA C 36 56.686 56.686 55.437 1.249 19043 5404 1 17 . 1 1 36 36 ASP CB C 36 40.671 40.671 42.291 -1.620 19043 5405 1 17 . 1 1 36 36 ASP H H 36 7.943 7.943 7.686 0.257 19043 5406 1 17 . 1 1 37 37 ASP N N 37 116.686 116.686 118.704 -2.018 19043 5407 1 17 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.121 -0.080 19043 5408 1 17 . 1 1 37 37 ASP CA C 37 51.946 51.946 52.103 -0.157 19043 5409 1 17 . 1 1 37 37 ASP CB C 37 40.523 40.523 42.453 -1.929 19043 5410 1 17 . 1 1 37 37 ASP H H 37 8.125 8.125 7.966 0.159 19043 5411 1 17 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.505 0.078 19043 5412 1 17 . 1 1 38 38 PRO C C 38 179.200 179.200 178.396 0.804 19043 5413 1 17 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.412 0.126 19043 5414 1 17 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.025 -0.139 19043 5415 1 17 . 1 1 39 39 SER N N 39 114.963 114.963 113.715 1.248 19043 5416 1 17 . 1 1 39 39 SER HA H 39 4.178 4.178 4.259 -0.081 19043 5417 1 17 . 1 1 39 39 SER C C 39 176.151 176.151 175.914 0.237 19043 5418 1 17 . 1 1 39 39 SER CA C 39 61.197 61.197 61.296 -0.099 19043 5419 1 17 . 1 1 39 39 SER CB C 39 62.729 62.729 62.450 0.279 19043 5420 1 17 . 1 1 39 39 SER H H 39 8.315 8.315 8.511 -0.196 19043 5421 1 17 . 1 1 40 40 GLN N N 40 120.058 120.058 119.640 0.418 19043 5422 1 17 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.520 0.140 19043 5423 1 17 . 1 1 40 40 GLN C C 40 176.192 176.192 177.106 -0.914 19043 5424 1 17 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.467 -0.486 19043 5425 1 17 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.049 0.119 19043 5426 1 17 . 1 1 40 40 GLN H H 40 7.820 7.820 7.826 -0.006 19043 5427 1 17 . 1 1 41 41 SER N N 41 115.553 115.553 116.911 -1.358 19043 5428 1 17 . 1 1 41 41 SER HA H 41 3.845 3.845 4.091 -0.246 19043 5429 1 17 . 1 1 41 41 SER C C 41 174.181 174.181 175.482 -1.301 19043 5430 1 17 . 1 1 41 41 SER CA C 41 63.957 63.957 61.617 2.340 19043 5431 1 17 . 1 1 41 41 SER CB C 41 63.191 63.191 62.478 0.713 19043 5432 1 17 . 1 1 41 41 SER H H 41 7.666 7.666 7.837 -0.171 19043 5433 1 17 . 1 1 42 42 ALA N N 42 122.360 122.360 122.284 0.076 19043 5434 1 17 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.166 -0.043 19043 5435 1 17 . 1 1 42 42 ALA C C 42 180.996 180.996 178.882 2.114 19043 5436 1 17 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.118 1.445 19043 5437 1 17 . 1 1 42 42 ALA CB C 42 18.056 18.056 18.979 -0.923 19043 5438 1 17 . 1 1 42 42 ALA H H 42 8.556 8.556 7.970 0.586 19043 5439 1 17 . 1 1 43 43 ASN N N 43 118.974 118.974 118.391 0.583 19043 5440 1 17 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.522 -0.003 19043 5441 1 17 . 1 1 43 43 ASN C C 43 177.972 177.972 177.637 0.335 19043 5442 1 17 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.339 -0.485 19043 5443 1 17 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.545 -0.396 19043 5444 1 17 . 1 1 43 43 ASN H H 43 7.950 7.950 7.689 0.261 19043 5445 1 17 . 1 1 44 44 LEU N N 44 122.070 122.070 120.338 1.732 19043 5446 1 17 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.215 -0.026 19043 5447 1 17 . 1 1 44 44 LEU C C 44 178.332 178.332 179.048 -0.716 19043 5448 1 17 . 1 1 44 44 LEU CA C 44 57.834 57.834 58.026 -0.192 19043 5449 1 17 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.786 0.565 19043 5450 1 17 . 1 1 44 44 LEU H H 44 8.789 8.789 8.536 0.253 19043 5451 1 17 . 1 1 45 45 LEU N N 45 118.621 118.621 119.447 -0.826 19043 5452 1 17 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.778 0.027 19043 5453 1 17 . 1 1 45 45 LEU C C 45 177.832 177.832 178.464 -0.632 19043 5454 1 17 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.615 0.270 19043 5455 1 17 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.578 0.229 19043 5456 1 17 . 1 1 45 45 LEU H H 45 8.283 8.283 7.516 0.767 19043 5457 1 17 . 1 1 46 46 ALA N N 46 119.525 119.525 121.107 -1.582 19043 5458 1 17 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.899 0.111 19043 5459 1 17 . 1 1 46 46 ALA C C 46 181.250 181.250 180.029 1.221 19043 5460 1 17 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.358 -0.062 19043 5461 1 17 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.042 -0.091 19043 5462 1 17 . 1 1 46 46 ALA H H 46 7.640 7.640 7.824 -0.184 19043 5463 1 17 . 1 1 47 47 GLU N N 47 119.572 119.572 117.806 1.766 19043 5464 1 17 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.142 -0.112 19043 5465 1 17 . 1 1 47 47 GLU C C 47 178.895 178.895 178.944 -0.049 19043 5466 1 17 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.923 0.243 19043 5467 1 17 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.632 -0.094 19043 5468 1 17 . 1 1 47 47 GLU H H 47 8.139 8.139 8.531 -0.392 19043 5469 1 17 . 1 1 48 48 ALA N N 48 123.953 123.953 122.452 1.501 19043 5470 1 17 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.618 -0.091 19043 5471 1 17 . 1 1 48 48 ALA C C 48 179.636 179.636 179.426 0.210 19043 5472 1 17 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.639 0.877 19043 5473 1 17 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.684 -0.439 19043 5474 1 17 . 1 1 48 48 ALA H H 48 8.468 8.468 7.669 0.799 19043 5475 1 17 . 1 1 49 49 LYS N N 49 117.926 117.926 117.961 -0.035 19043 5476 1 17 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.930 -0.191 19043 5477 1 17 . 1 1 49 49 LYS C C 49 178.761 178.761 178.689 0.072 19043 5478 1 17 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.502 0.890 19043 5479 1 17 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.351 -0.262 19043 5480 1 17 . 1 1 49 49 LYS H H 49 8.459 8.459 8.307 0.152 19043 5481 1 17 . 1 1 50 50 LYS N N 50 120.194 120.194 119.703 0.491 19043 5482 1 17 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.070 0.018 19043 5483 1 17 . 1 1 50 50 LYS C C 50 179.859 179.859 178.169 1.690 19043 5484 1 17 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.044 0.691 19043 5485 1 17 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.522 -0.059 19043 5486 1 17 . 1 1 50 50 LYS H H 50 7.702 7.702 7.682 0.020 19043 5487 1 17 . 1 1 51 51 LEU N N 51 122.126 122.126 118.861 3.265 19043 5488 1 17 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.305 -0.178 19043 5489 1 17 . 1 1 51 51 LEU C C 51 178.123 178.123 177.812 0.311 19043 5490 1 17 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.556 1.041 19043 5491 1 17 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.570 -0.218 19043 5492 1 17 . 1 1 51 51 LEU H H 51 8.023 8.023 7.628 0.395 19043 5493 1 17 . 1 1 52 52 ASN N N 52 116.675 116.675 117.423 -0.748 19043 5494 1 17 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.381 -0.446 19043 5495 1 17 . 1 1 52 52 ASN C C 52 177.668 177.668 176.351 1.317 19043 5496 1 17 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.283 1.634 19043 5497 1 17 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.653 3.283 19043 5498 1 17 . 1 1 52 52 ASN H H 52 8.537 8.537 8.215 0.322 19043 5499 1 17 . 1 1 53 53 ASP N N 53 118.725 118.725 117.185 1.540 19043 5500 1 17 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.534 -0.090 19043 5501 1 17 . 1 1 53 53 ASP C C 53 178.936 178.936 176.928 2.008 19043 5502 1 17 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.368 1.565 19043 5503 1 17 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.304 -1.209 19043 5504 1 17 . 1 1 53 53 ASP H H 53 8.220 8.220 7.837 0.383 19043 5505 1 17 . 1 1 54 54 ALA N N 54 122.872 122.872 122.257 0.615 19043 5506 1 17 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.218 0.014 19043 5507 1 17 . 1 1 54 54 ALA C C 54 179.354 179.354 178.943 0.411 19043 5508 1 17 . 1 1 54 54 ALA CA C 54 54.341 54.341 53.817 0.524 19043 5509 1 17 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.410 -0.805 19043 5510 1 17 . 1 1 54 54 ALA H H 54 8.037 8.037 7.286 0.751 19043 5511 1 17 . 1 1 55 55 GLN N N 55 115.052 115.052 116.641 -1.589 19043 5512 1 17 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.329 0.049 19043 5513 1 17 . 1 1 55 55 GLN C C 55 174.116 174.116 175.276 -1.160 19043 5514 1 17 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.044 -0.090 19043 5515 1 17 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.279 -1.054 19043 5516 1 17 . 1 1 55 55 GLN H H 55 7.512 7.512 7.890 -0.378 19043 5517 1 17 . 1 1 56 56 ALA N N 56 124.556 124.556 123.913 0.643 19043 5518 1 17 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.298 0.050 19043 5519 1 17 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.095 -0.058 19043 5520 1 17 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.529 -0.550 19043 5521 1 17 . 1 1 56 56 ALA H H 56 7.100 7.100 7.399 -0.299 19043 5522 1 17 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.445 -0.033 19043 5523 1 17 . 1 1 57 57 PRO C C 57 176.151 176.151 176.649 -0.498 19043 5524 1 17 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.389 0.894 19043 5525 1 17 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.155 -0.162 19043 5526 1 18 . 1 1 2 2 ASP N N 2 125.357 125.357 122.975 2.382 19043 5527 1 18 . 1 1 2 2 ASP C C 2 175.535 175.535 175.624 -0.089 19043 5528 1 18 . 1 1 2 2 ASP CA C 2 54.307 54.307 55.277 -0.970 19043 5529 1 18 . 1 1 2 2 ASP CB C 2 41.470 41.470 41.607 -0.137 19043 5530 1 18 . 1 1 2 2 ASP H H 2 8.762 8.762 8.549 0.213 19043 5531 1 18 . 1 1 3 3 ASN N N 3 120.441 120.441 118.392 2.049 19043 5532 1 18 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.701 -0.001 19043 5533 1 18 . 1 1 3 3 ASN C C 3 175.246 175.246 175.618 -0.372 19043 5534 1 18 . 1 1 3 3 ASN CA C 3 53.289 53.289 53.459 -0.170 19043 5535 1 18 . 1 1 3 3 ASN CB C 3 39.086 39.086 39.256 -0.170 19043 5536 1 18 . 1 1 3 3 ASN H H 3 8.548 8.548 8.649 -0.101 19043 5537 1 18 . 1 1 4 4 LYS N N 4 121.461 121.461 120.359 1.102 19043 5538 1 18 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.259 -0.044 19043 5539 1 18 . 1 1 4 4 LYS C C 4 176.404 176.404 175.324 1.080 19043 5540 1 18 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.492 0.360 19043 5541 1 18 . 1 1 4 4 LYS CB C 4 32.780 32.780 32.793 -0.013 19043 5542 1 18 . 1 1 4 4 LYS H H 4 8.337 8.337 8.282 0.055 19043 5543 1 18 . 1 1 5 5 PHE N N 5 119.538 119.538 117.938 1.600 19043 5544 1 18 . 1 1 5 5 PHE C C 5 175.433 175.433 174.998 0.435 19043 5545 1 18 . 1 1 5 5 PHE CA C 5 57.792 57.792 56.766 1.026 19043 5546 1 18 . 1 1 5 5 PHE CB C 5 40.067 40.067 37.558 2.509 19043 5547 1 18 . 1 1 5 5 PHE H H 5 8.277 8.277 7.929 0.348 19043 5548 1 18 . 1 1 6 6 ASN N N 6 121.168 121.168 121.645 -0.477 19043 5549 1 18 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.634 0.183 19043 5550 1 18 . 1 1 6 6 ASN C C 6 175.884 175.884 176.180 -0.296 19043 5551 1 18 . 1 1 6 6 ASN CA C 6 52.785 52.785 52.997 -0.212 19043 5552 1 18 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.379 -0.008 19043 5553 1 18 . 1 1 6 6 ASN H H 6 8.443 8.443 7.785 0.658 19043 5554 1 18 . 1 1 7 7 LYS N N 7 121.688 121.688 118.878 2.810 19043 5555 1 18 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.138 -0.193 19043 5556 1 18 . 1 1 7 7 LYS C C 7 178.196 178.196 178.459 -0.263 19043 5557 1 18 . 1 1 7 7 LYS CA C 7 58.901 58.901 58.976 -0.075 19043 5558 1 18 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.366 -0.241 19043 5559 1 18 . 1 1 7 7 LYS H H 7 8.460 8.460 8.466 -0.006 19043 5560 1 18 . 1 1 8 8 GLU N N 8 119.926 119.926 119.050 0.876 19043 5561 1 18 . 1 1 8 8 GLU HA H 8 4.081 4.081 4.023 0.058 19043 5562 1 18 . 1 1 8 8 GLU C C 8 179.894 179.894 178.952 0.942 19043 5563 1 18 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.399 0.440 19043 5564 1 18 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.334 -0.393 19043 5565 1 18 . 1 1 8 8 GLU H H 8 8.386 8.386 8.339 0.047 19043 5566 1 18 . 1 1 9 9 GLN N N 9 121.401 121.401 117.457 3.944 19043 5567 1 18 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.141 -0.044 19043 5568 1 18 . 1 1 9 9 GLN C C 9 177.324 177.324 178.048 -0.724 19043 5569 1 18 . 1 1 9 9 GLN CA C 9 59.383 59.383 58.554 0.829 19043 5570 1 18 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.888 -0.019 19043 5571 1 18 . 1 1 9 9 GLN H H 9 8.307 8.307 8.294 0.013 19043 5572 1 18 . 1 1 10 10 GLN N N 10 120.060 120.060 120.251 -0.191 19043 5573 1 18 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.041 -0.819 19043 5574 1 18 . 1 1 10 10 GLN C C 10 176.888 176.888 178.237 -1.349 19043 5575 1 18 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.964 -0.015 19043 5576 1 18 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.648 0.193 19043 5577 1 18 . 1 1 10 10 GLN H H 10 8.040 8.040 7.768 0.272 19043 5578 1 18 . 1 1 11 11 ASN N N 11 116.214 116.214 119.138 -2.924 19043 5579 1 18 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.615 -0.265 19043 5580 1 18 . 1 1 11 11 ASN C C 11 177.828 177.828 177.565 0.263 19043 5581 1 18 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.134 0.123 19043 5582 1 18 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.041 0.169 19043 5583 1 18 . 1 1 11 11 ASN H H 11 8.366 8.366 8.434 -0.068 19043 5584 1 18 . 1 1 12 12 ALA N N 12 121.429 121.429 123.015 -1.586 19043 5585 1 18 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.073 -0.064 19043 5586 1 18 . 1 1 12 12 ALA C C 12 177.850 177.850 179.277 -1.427 19043 5587 1 18 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.925 0.368 19043 5588 1 18 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.419 -0.099 19043 5589 1 18 . 1 1 12 12 ALA H H 12 7.915 7.915 8.047 -0.132 19043 5590 1 18 . 1 1 13 13 PHE N N 13 118.052 118.052 120.186 -2.134 19043 5591 1 18 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.982 -0.409 19043 5592 1 18 . 1 1 13 13 PHE C C 13 175.832 175.832 177.214 -1.382 19043 5593 1 18 . 1 1 13 13 PHE CA C 13 61.855 61.855 62.089 -0.234 19043 5594 1 18 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.928 -0.011 19043 5595 1 18 . 1 1 13 13 PHE H H 13 8.097 8.097 7.555 0.542 19043 5596 1 18 . 1 1 14 14 TYR N N 14 116.000 116.000 117.193 -1.193 19043 5597 1 18 . 1 1 14 14 TYR HA H 14 3.985 3.985 4.028 -0.043 19043 5598 1 18 . 1 1 14 14 TYR C C 14 178.860 178.860 178.322 0.538 19043 5599 1 18 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.432 -1.637 19043 5600 1 18 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.863 -0.883 19043 5601 1 18 . 1 1 14 14 TYR H H 14 8.040 8.040 7.678 0.362 19043 5602 1 18 . 1 1 15 15 GLU N N 15 118.737 118.737 119.171 -0.434 19043 5603 1 18 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.885 0.086 19043 5604 1 18 . 1 1 15 15 GLU C C 15 180.184 180.184 179.246 0.938 19043 5605 1 18 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.491 1.116 19043 5606 1 18 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.302 0.420 19043 5607 1 18 . 1 1 15 15 GLU H H 15 8.244 8.244 8.297 -0.053 19043 5608 1 18 . 1 1 16 16 ILE N N 16 119.695 119.695 118.470 1.225 19043 5609 1 18 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.755 -0.402 19043 5610 1 18 . 1 1 16 16 ILE C C 16 177.760 177.760 177.507 0.253 19043 5611 1 18 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.444 1.210 19043 5612 1 18 . 1 1 16 16 ILE CB C 16 37.403 37.403 38.017 -0.614 19043 5613 1 18 . 1 1 16 16 ILE H H 16 8.336 8.336 7.645 0.691 19043 5614 1 18 . 1 1 17 17 LEU N N 17 117.709 117.709 119.535 -1.826 19043 5615 1 18 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.952 -0.399 19043 5616 1 18 . 1 1 17 17 LEU C C 17 176.565 176.565 177.945 -1.380 19043 5617 1 18 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.251 0.308 19043 5618 1 18 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.715 0.123 19043 5619 1 18 . 1 1 17 17 LEU H H 17 7.738 7.738 7.707 0.031 19043 5620 1 18 . 1 1 18 18 HIS N N 18 110.934 110.934 115.824 -4.890 19043 5621 1 18 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.322 0.175 19043 5622 1 18 . 1 1 18 18 HIS C C 18 175.243 175.243 175.940 -0.697 19043 5623 1 18 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.857 -1.801 19043 5624 1 18 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.199 0.449 19043 5625 1 18 . 1 1 18 18 HIS H H 18 7.150 7.150 8.137 -0.987 19043 5626 1 18 . 1 1 19 19 LEU N N 19 123.586 123.586 122.039 1.547 19043 5627 1 18 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.310 0.108 19043 5628 1 18 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.859 -0.383 19043 5629 1 18 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.399 -1.077 19043 5630 1 18 . 1 1 19 19 LEU H H 19 7.249 7.249 7.619 -0.370 19043 5631 1 18 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.443 -0.012 19043 5632 1 18 . 1 1 20 20 PRO C C 20 178.092 178.092 177.669 0.423 19043 5633 1 18 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.826 0.071 19043 5634 1 18 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.159 0.413 19043 5635 1 18 . 1 1 21 21 ASN N N 21 113.952 113.952 116.798 -2.846 19043 5636 1 18 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.506 0.503 19043 5637 1 18 . 1 1 21 21 ASN C C 21 176.397 176.397 175.633 0.764 19043 5638 1 18 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.079 -1.450 19043 5639 1 18 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.378 0.432 19043 5640 1 18 . 1 1 21 21 ASN H H 21 8.871 8.871 8.134 0.737 19043 5641 1 18 . 1 1 22 22 LEU N N 22 117.526 117.526 122.510 -4.984 19043 5642 1 18 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.474 -0.073 19043 5643 1 18 . 1 1 22 22 LEU C C 22 176.879 176.879 175.424 1.455 19043 5644 1 18 . 1 1 22 22 LEU CA C 22 54.457 54.457 55.029 -0.572 19043 5645 1 18 . 1 1 22 22 LEU CB C 22 42.520 42.520 42.945 -0.425 19043 5646 1 18 . 1 1 22 22 LEU H H 22 6.563 6.563 8.194 -1.631 19043 5647 1 18 . 1 1 23 23 ASN N N 23 120.219 120.219 123.859 -3.640 19043 5648 1 18 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.745 0.123 19043 5649 1 18 . 1 1 23 23 ASN C C 23 175.507 175.507 176.457 -0.950 19043 5650 1 18 . 1 1 23 23 ASN CA C 23 51.416 51.416 52.538 -1.122 19043 5651 1 18 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.565 -0.853 19043 5652 1 18 . 1 1 23 23 ASN H H 23 8.612 8.612 8.041 0.571 19043 5653 1 18 . 1 1 24 24 GLU N N 24 118.801 118.801 118.543 0.258 19043 5654 1 18 . 1 1 24 24 GLU HA H 24 3.874 3.874 4.095 -0.221 19043 5655 1 18 . 1 1 24 24 GLU C C 24 177.799 177.799 178.317 -0.518 19043 5656 1 18 . 1 1 24 24 GLU CA C 24 60.191 60.191 59.509 0.682 19043 5657 1 18 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.120 0.244 19043 5658 1 18 . 1 1 24 24 GLU H H 24 8.735 8.735 8.870 -0.135 19043 5659 1 18 . 1 1 25 25 GLU N N 25 119.198 119.198 120.282 -1.084 19043 5660 1 18 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.058 -0.080 19043 5661 1 18 . 1 1 25 25 GLU C C 25 180.078 180.078 179.116 0.962 19043 5662 1 18 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.581 0.310 19043 5663 1 18 . 1 1 25 25 GLU CB C 25 29.131 29.131 28.971 0.160 19043 5664 1 18 . 1 1 25 25 GLU H H 25 8.229 8.229 8.845 -0.616 19043 5665 1 18 . 1 1 26 26 GLN N N 26 119.646 119.646 118.070 1.576 19043 5666 1 18 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.055 -0.115 19043 5667 1 18 . 1 1 26 26 GLN C C 26 178.154 178.154 178.186 -0.032 19043 5668 1 18 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.705 -0.812 19043 5669 1 18 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.508 0.394 19043 5670 1 18 . 1 1 26 26 GLN H H 26 8.425 8.425 8.373 0.052 19043 5671 1 18 . 1 1 27 27 ARG N N 27 119.454 119.454 120.207 -0.753 19043 5672 1 18 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.167 -0.381 19043 5673 1 18 . 1 1 27 27 ARG C C 27 177.863 177.863 178.367 -0.504 19043 5674 1 18 . 1 1 27 27 ARG CA C 27 60.630 60.630 59.950 0.680 19043 5675 1 18 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.054 -0.410 19043 5676 1 18 . 1 1 27 27 ARG H H 27 8.548 8.548 7.903 0.645 19043 5677 1 18 . 1 1 28 28 ASN N N 28 116.833 116.833 117.679 -0.846 19043 5678 1 18 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.519 -0.187 19043 5679 1 18 . 1 1 28 28 ASN C C 28 177.234 177.234 177.223 0.011 19043 5680 1 18 . 1 1 28 28 ASN CA C 28 56.038 56.038 55.994 0.044 19043 5681 1 18 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.377 -0.692 19043 5682 1 18 . 1 1 28 28 ASN H H 28 8.569 8.569 8.551 0.018 19043 5683 1 18 . 1 1 29 29 ALA N N 29 122.687 122.687 123.443 -0.756 19043 5684 1 18 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.037 0.017 19043 5685 1 18 . 1 1 29 29 ALA C C 29 181.045 181.045 179.575 1.470 19043 5686 1 18 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.749 0.500 19043 5687 1 18 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.018 -0.199 19043 5688 1 18 . 1 1 29 29 ALA H H 29 7.793 7.793 7.347 0.446 19043 5689 1 18 . 1 1 30 30 PHE N N 30 116.979 116.979 117.669 -0.690 19043 5690 1 18 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.212 0.166 19043 5691 1 18 . 1 1 30 30 PHE C C 30 177.887 177.887 178.138 -0.251 19043 5692 1 18 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.642 0.977 19043 5693 1 18 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.682 0.777 19043 5694 1 18 . 1 1 30 30 PHE H H 30 8.017 8.017 7.548 0.469 19043 5695 1 18 . 1 1 31 31 ILE N N 31 119.553 119.553 119.136 0.417 19043 5696 1 18 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.628 0.150 19043 5697 1 18 . 1 1 31 31 ILE C C 31 177.084 177.084 178.092 -1.008 19043 5698 1 18 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.254 0.391 19043 5699 1 18 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.626 -0.511 19043 5700 1 18 . 1 1 31 31 ILE H H 31 8.372 8.372 8.343 0.029 19043 5701 1 18 . 1 1 32 32 GLN N N 32 119.108 119.108 119.258 -0.150 19043 5702 1 18 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.936 -0.130 19043 5703 1 18 . 1 1 32 32 GLN C C 32 177.836 177.836 178.378 -0.542 19043 5704 1 18 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.559 -0.791 19043 5705 1 18 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.723 -0.744 19043 5706 1 18 . 1 1 32 32 GLN H H 32 8.389 8.389 8.206 0.183 19043 5707 1 18 . 1 1 33 33 SER N N 33 114.437 114.437 114.705 -0.268 19043 5708 1 18 . 1 1 33 33 SER HA H 33 4.212 4.212 4.322 -0.110 19043 5709 1 18 . 1 1 33 33 SER C C 33 175.469 175.469 176.890 -1.421 19043 5710 1 18 . 1 1 33 33 SER CA C 33 62.403 62.403 60.251 2.152 19043 5711 1 18 . 1 1 33 33 SER CB C 33 63.794 63.794 62.686 1.108 19043 5712 1 18 . 1 1 33 33 SER H H 33 8.078 8.078 7.844 0.234 19043 5713 1 18 . 1 1 34 34 LEU N N 34 122.967 122.967 123.790 -0.823 19043 5714 1 18 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.244 -0.334 19043 5715 1 18 . 1 1 34 34 LEU C C 34 177.506 177.506 178.288 -0.782 19043 5716 1 18 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.236 0.192 19043 5717 1 18 . 1 1 34 34 LEU CB C 34 42.812 42.812 41.756 1.056 19043 5718 1 18 . 1 1 34 34 LEU H H 34 8.495 8.495 8.038 0.457 19043 5719 1 18 . 1 1 35 35 LYS N N 35 115.859 115.859 119.120 -3.261 19043 5720 1 18 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.167 -0.354 19043 5721 1 18 . 1 1 35 35 LYS C C 35 177.628 177.628 177.996 -0.368 19043 5722 1 18 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.618 -1.741 19043 5723 1 18 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.192 -0.173 19043 5724 1 18 . 1 1 35 35 LYS H H 35 7.815 7.815 7.570 0.245 19043 5725 1 18 . 1 1 36 36 ASP N N 36 116.741 116.741 117.132 -0.391 19043 5726 1 18 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.606 -0.092 19043 5727 1 18 . 1 1 36 36 ASP C C 36 177.324 177.324 177.056 0.268 19043 5728 1 18 . 1 1 36 36 ASP CA C 36 56.686 56.686 56.631 0.055 19043 5729 1 18 . 1 1 36 36 ASP CB C 36 40.671 40.671 41.705 -1.034 19043 5730 1 18 . 1 1 36 36 ASP H H 36 7.943 7.943 7.845 0.098 19043 5731 1 18 . 1 1 37 37 ASP N N 37 116.686 116.686 118.414 -1.728 19043 5732 1 18 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.005 0.036 19043 5733 1 18 . 1 1 37 37 ASP CA C 37 51.946 51.946 52.233 -0.287 19043 5734 1 18 . 1 1 37 37 ASP CB C 37 40.523 40.523 41.406 -0.883 19043 5735 1 18 . 1 1 37 37 ASP H H 37 8.125 8.125 7.898 0.227 19043 5736 1 18 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.532 0.051 19043 5737 1 18 . 1 1 38 38 PRO C C 38 179.200 179.200 178.459 0.741 19043 5738 1 18 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.649 -0.112 19043 5739 1 18 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.109 -0.223 19043 5740 1 18 . 1 1 39 39 SER N N 39 114.963 114.963 112.881 2.082 19043 5741 1 18 . 1 1 39 39 SER HA H 39 4.178 4.178 4.257 -0.079 19043 5742 1 18 . 1 1 39 39 SER C C 39 176.151 176.151 175.715 0.436 19043 5743 1 18 . 1 1 39 39 SER CA C 39 61.197 61.197 61.115 0.082 19043 5744 1 18 . 1 1 39 39 SER CB C 39 62.729 62.729 62.751 -0.022 19043 5745 1 18 . 1 1 39 39 SER H H 39 8.315 8.315 8.487 -0.172 19043 5746 1 18 . 1 1 40 40 GLN N N 40 120.058 120.058 119.241 0.817 19043 5747 1 18 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.548 0.112 19043 5748 1 18 . 1 1 40 40 GLN C C 40 176.192 176.192 177.162 -0.970 19043 5749 1 18 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.247 -0.266 19043 5750 1 18 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.138 0.030 19043 5751 1 18 . 1 1 40 40 GLN H H 40 7.820 7.820 7.859 -0.039 19043 5752 1 18 . 1 1 41 41 SER N N 41 115.553 115.553 117.287 -1.734 19043 5753 1 18 . 1 1 41 41 SER HA H 41 3.845 3.845 4.084 -0.239 19043 5754 1 18 . 1 1 41 41 SER C C 41 174.181 174.181 175.592 -1.411 19043 5755 1 18 . 1 1 41 41 SER CA C 41 63.957 63.957 61.835 2.122 19043 5756 1 18 . 1 1 41 41 SER CB C 41 63.191 63.191 62.302 0.889 19043 5757 1 18 . 1 1 41 41 SER H H 41 7.666 7.666 7.925 -0.259 19043 5758 1 18 . 1 1 42 42 ALA N N 42 122.360 122.360 122.398 -0.038 19043 5759 1 18 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.179 -0.056 19043 5760 1 18 . 1 1 42 42 ALA C C 42 180.996 180.996 178.932 2.064 19043 5761 1 18 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.169 1.394 19043 5762 1 18 . 1 1 42 42 ALA CB C 42 18.056 18.056 18.874 -0.818 19043 5763 1 18 . 1 1 42 42 ALA H H 42 8.556 8.556 8.101 0.455 19043 5764 1 18 . 1 1 43 43 ASN N N 43 118.974 118.974 118.860 0.114 19043 5765 1 18 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.538 -0.019 19043 5766 1 18 . 1 1 43 43 ASN C C 43 177.972 177.972 177.756 0.216 19043 5767 1 18 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.401 -0.547 19043 5768 1 18 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.416 -0.267 19043 5769 1 18 . 1 1 43 43 ASN H H 43 7.950 7.950 7.683 0.267 19043 5770 1 18 . 1 1 44 44 LEU N N 44 122.070 122.070 120.567 1.503 19043 5771 1 18 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.375 -0.186 19043 5772 1 18 . 1 1 44 44 LEU C C 44 178.332 178.332 179.323 -0.991 19043 5773 1 18 . 1 1 44 44 LEU CA C 44 57.834 57.834 57.979 -0.145 19043 5774 1 18 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.781 0.571 19043 5775 1 18 . 1 1 44 44 LEU H H 44 8.789 8.789 8.632 0.157 19043 5776 1 18 . 1 1 45 45 LEU N N 45 118.621 118.621 119.427 -0.806 19043 5777 1 18 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.753 0.052 19043 5778 1 18 . 1 1 45 45 LEU C C 45 177.832 177.832 178.493 -0.661 19043 5779 1 18 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.602 0.283 19043 5780 1 18 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.579 0.227 19043 5781 1 18 . 1 1 45 45 LEU H H 45 8.283 8.283 7.494 0.789 19043 5782 1 18 . 1 1 46 46 ALA N N 46 119.525 119.525 120.741 -1.216 19043 5783 1 18 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.899 0.111 19043 5784 1 18 . 1 1 46 46 ALA C C 46 181.250 181.250 179.827 1.423 19043 5785 1 18 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.117 0.179 19043 5786 1 18 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.062 -0.111 19043 5787 1 18 . 1 1 46 46 ALA H H 46 7.640 7.640 7.673 -0.033 19043 5788 1 18 . 1 1 47 47 GLU N N 47 119.572 119.572 118.420 1.152 19043 5789 1 18 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.071 -0.041 19043 5790 1 18 . 1 1 47 47 GLU C C 47 178.895 178.895 178.872 0.023 19043 5791 1 18 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.981 0.185 19043 5792 1 18 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.802 -0.264 19043 5793 1 18 . 1 1 47 47 GLU H H 47 8.139 8.139 8.361 -0.222 19043 5794 1 18 . 1 1 48 48 ALA N N 48 123.953 123.953 122.415 1.538 19043 5795 1 18 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.675 -0.148 19043 5796 1 18 . 1 1 48 48 ALA C C 48 179.636 179.636 179.136 0.500 19043 5797 1 18 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.457 1.059 19043 5798 1 18 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.689 -0.445 19043 5799 1 18 . 1 1 48 48 ALA H H 48 8.468 8.468 7.717 0.751 19043 5800 1 18 . 1 1 49 49 LYS N N 49 117.926 117.926 118.393 -0.467 19043 5801 1 18 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.895 -0.156 19043 5802 1 18 . 1 1 49 49 LYS C C 49 178.761 178.761 178.801 -0.040 19043 5803 1 18 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.676 0.716 19043 5804 1 18 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.291 -0.202 19043 5805 1 18 . 1 1 49 49 LYS H H 49 8.459 8.459 8.202 0.257 19043 5806 1 18 . 1 1 50 50 LYS N N 50 120.194 120.194 119.579 0.615 19043 5807 1 18 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.071 0.017 19043 5808 1 18 . 1 1 50 50 LYS C C 50 179.859 179.859 178.933 0.926 19043 5809 1 18 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.124 0.611 19043 5810 1 18 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.554 -0.092 19043 5811 1 18 . 1 1 50 50 LYS H H 50 7.702 7.702 7.757 -0.055 19043 5812 1 18 . 1 1 51 51 LEU N N 51 122.126 122.126 120.037 2.089 19043 5813 1 18 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.109 0.018 19043 5814 1 18 . 1 1 51 51 LEU C C 51 178.123 178.123 178.346 -0.223 19043 5815 1 18 . 1 1 51 51 LEU CA C 51 57.597 57.597 57.198 0.399 19043 5816 1 18 . 1 1 51 51 LEU CB C 51 42.352 42.352 41.952 0.400 19043 5817 1 18 . 1 1 51 51 LEU H H 51 8.023 8.023 7.614 0.409 19043 5818 1 18 . 1 1 52 52 ASN N N 52 116.675 116.675 116.360 0.315 19043 5819 1 18 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.431 -0.496 19043 5820 1 18 . 1 1 52 52 ASN C C 52 177.668 177.668 175.966 1.702 19043 5821 1 18 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.147 1.770 19043 5822 1 18 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.683 3.253 19043 5823 1 18 . 1 1 52 52 ASN H H 52 8.537 8.537 8.381 0.156 19043 5824 1 18 . 1 1 53 53 ASP N N 53 118.725 118.725 117.648 1.077 19043 5825 1 18 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.596 -0.152 19043 5826 1 18 . 1 1 53 53 ASP C C 53 178.936 178.936 177.438 1.498 19043 5827 1 18 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.725 1.208 19043 5828 1 18 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.306 -1.211 19043 5829 1 18 . 1 1 53 53 ASP H H 53 8.220 8.220 7.582 0.638 19043 5830 1 18 . 1 1 54 54 ALA N N 54 122.872 122.872 121.730 1.142 19043 5831 1 18 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.180 0.052 19043 5832 1 18 . 1 1 54 54 ALA C C 54 179.354 179.354 178.926 0.428 19043 5833 1 18 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.374 -0.033 19043 5834 1 18 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.122 -0.517 19043 5835 1 18 . 1 1 54 54 ALA H H 54 8.037 8.037 7.462 0.575 19043 5836 1 18 . 1 1 55 55 GLN N N 55 115.052 115.052 116.103 -1.051 19043 5837 1 18 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.397 -0.019 19043 5838 1 18 . 1 1 55 55 GLN C C 55 174.116 174.116 174.922 -0.806 19043 5839 1 18 . 1 1 55 55 GLN CA C 55 54.954 54.954 54.827 0.127 19043 5840 1 18 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.391 -1.167 19043 5841 1 18 . 1 1 55 55 GLN H H 55 7.512 7.512 7.858 -0.346 19043 5842 1 18 . 1 1 56 56 ALA N N 56 124.556 124.556 124.165 0.391 19043 5843 1 18 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.315 0.033 19043 5844 1 18 . 1 1 56 56 ALA CA C 56 51.037 51.037 50.994 0.043 19043 5845 1 18 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.585 -0.606 19043 5846 1 18 . 1 1 56 56 ALA H H 56 7.100 7.100 7.128 -0.028 19043 5847 1 18 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.474 -0.062 19043 5848 1 18 . 1 1 57 57 PRO C C 57 176.151 176.151 176.726 -0.575 19043 5849 1 18 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.358 0.925 19043 5850 1 18 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.130 -0.137 19043 5851 1 19 . 1 1 2 2 ASP N N 2 125.357 125.357 119.657 5.700 19043 5852 1 19 . 1 1 2 2 ASP C C 2 175.535 175.535 175.422 0.113 19043 5853 1 19 . 1 1 2 2 ASP CA C 2 54.307 54.307 53.996 0.311 19043 5854 1 19 . 1 1 2 2 ASP CB C 2 41.470 41.470 42.742 -1.272 19043 5855 1 19 . 1 1 2 2 ASP H H 2 8.762 8.762 7.690 1.072 19043 5856 1 19 . 1 1 3 3 ASN N N 3 120.441 120.441 118.305 2.136 19043 5857 1 19 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.015 0.685 19043 5858 1 19 . 1 1 3 3 ASN C C 3 175.246 175.246 175.043 0.203 19043 5859 1 19 . 1 1 3 3 ASN CA C 3 53.289 53.289 53.724 -0.435 19043 5860 1 19 . 1 1 3 3 ASN CB C 3 39.086 39.086 38.185 0.901 19043 5861 1 19 . 1 1 3 3 ASN H H 3 8.548 8.548 8.580 -0.032 19043 5862 1 19 . 1 1 4 4 LYS N N 4 121.461 121.461 116.164 5.297 19043 5863 1 19 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.011 0.204 19043 5864 1 19 . 1 1 4 4 LYS C C 4 176.404 176.404 176.172 0.232 19043 5865 1 19 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.738 0.115 19043 5866 1 19 . 1 1 4 4 LYS CB C 4 32.780 32.780 32.174 0.606 19043 5867 1 19 . 1 1 4 4 LYS H H 4 8.337 8.337 8.074 0.263 19043 5868 1 19 . 1 1 5 5 PHE N N 5 119.538 119.538 115.276 4.262 19043 5869 1 19 . 1 1 5 5 PHE C C 5 175.433 175.433 174.941 0.492 19043 5870 1 19 . 1 1 5 5 PHE CA C 5 57.792 57.792 58.260 -0.468 19043 5871 1 19 . 1 1 5 5 PHE CB C 5 40.067 40.067 36.048 4.019 19043 5872 1 19 . 1 1 5 5 PHE H H 5 8.277 8.277 7.423 0.854 19043 5873 1 19 . 1 1 6 6 ASN N N 6 121.168 121.168 119.389 1.779 19043 5874 1 19 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.681 0.136 19043 5875 1 19 . 1 1 6 6 ASN C C 6 175.884 175.884 176.448 -0.564 19043 5876 1 19 . 1 1 6 6 ASN CA C 6 52.785 52.785 52.904 -0.119 19043 5877 1 19 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.174 0.197 19043 5878 1 19 . 1 1 6 6 ASN H H 6 8.443 8.443 8.050 0.393 19043 5879 1 19 . 1 1 7 7 LYS N N 7 121.688 121.688 121.292 0.396 19043 5880 1 19 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.101 -0.156 19043 5881 1 19 . 1 1 7 7 LYS C C 7 178.196 178.196 178.277 -0.081 19043 5882 1 19 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.377 -0.475 19043 5883 1 19 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.247 -0.122 19043 5884 1 19 . 1 1 7 7 LYS H H 7 8.460 8.460 8.622 -0.162 19043 5885 1 19 . 1 1 8 8 GLU N N 8 119.926 119.926 118.459 1.467 19043 5886 1 19 . 1 1 8 8 GLU HA H 8 4.081 4.081 3.992 0.089 19043 5887 1 19 . 1 1 8 8 GLU C C 8 179.894 179.894 178.843 1.051 19043 5888 1 19 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.690 0.150 19043 5889 1 19 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.043 -0.102 19043 5890 1 19 . 1 1 8 8 GLU H H 8 8.386 8.386 8.877 -0.491 19043 5891 1 19 . 1 1 9 9 GLN N N 9 121.401 121.401 118.272 3.129 19043 5892 1 19 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.131 -0.034 19043 5893 1 19 . 1 1 9 9 GLN C C 9 177.324 177.324 178.325 -1.001 19043 5894 1 19 . 1 1 9 9 GLN CA C 9 59.383 59.383 59.067 0.316 19043 5895 1 19 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.512 0.357 19043 5896 1 19 . 1 1 9 9 GLN H H 9 8.307 8.307 8.518 -0.211 19043 5897 1 19 . 1 1 10 10 GLN N N 10 120.060 120.060 119.837 0.223 19043 5898 1 19 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.117 -0.895 19043 5899 1 19 . 1 1 10 10 GLN C C 10 176.888 176.888 178.328 -1.440 19043 5900 1 19 . 1 1 10 10 GLN CA C 10 58.949 58.949 59.033 -0.084 19043 5901 1 19 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.590 0.251 19043 5902 1 19 . 1 1 10 10 GLN H H 10 8.040 8.040 7.551 0.489 19043 5903 1 19 . 1 1 11 11 ASN N N 11 116.214 116.214 118.939 -2.725 19043 5904 1 19 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.560 -0.210 19043 5905 1 19 . 1 1 11 11 ASN C C 11 177.828 177.828 177.674 0.154 19043 5906 1 19 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.180 0.077 19043 5907 1 19 . 1 1 11 11 ASN CB C 11 38.210 38.210 37.992 0.218 19043 5908 1 19 . 1 1 11 11 ASN H H 11 8.366 8.366 8.628 -0.262 19043 5909 1 19 . 1 1 12 12 ALA N N 12 121.429 121.429 123.032 -1.603 19043 5910 1 19 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.095 -0.086 19043 5911 1 19 . 1 1 12 12 ALA C C 12 177.850 177.850 179.328 -1.478 19043 5912 1 19 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.844 0.449 19043 5913 1 19 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.456 -0.135 19043 5914 1 19 . 1 1 12 12 ALA H H 12 7.915 7.915 8.131 -0.216 19043 5915 1 19 . 1 1 13 13 PHE N N 13 118.052 118.052 120.278 -2.226 19043 5916 1 19 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.992 -0.419 19043 5917 1 19 . 1 1 13 13 PHE C C 13 175.832 175.832 177.302 -1.470 19043 5918 1 19 . 1 1 13 13 PHE CA C 13 61.855 61.855 62.042 -0.188 19043 5919 1 19 . 1 1 13 13 PHE CB C 13 38.917 38.917 39.042 -0.125 19043 5920 1 19 . 1 1 13 13 PHE H H 13 8.097 8.097 7.523 0.574 19043 5921 1 19 . 1 1 14 14 TYR N N 14 116.000 116.000 117.620 -1.620 19043 5922 1 19 . 1 1 14 14 TYR HA H 14 3.985 3.985 4.082 -0.097 19043 5923 1 19 . 1 1 14 14 TYR C C 14 178.860 178.860 178.199 0.661 19043 5924 1 19 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.643 -1.848 19043 5925 1 19 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.945 -0.965 19043 5926 1 19 . 1 1 14 14 TYR H H 14 8.040 8.040 8.000 0.040 19043 5927 1 19 . 1 1 15 15 GLU N N 15 118.737 118.737 118.678 0.059 19043 5928 1 19 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.879 0.092 19043 5929 1 19 . 1 1 15 15 GLU C C 15 180.184 180.184 178.972 1.212 19043 5930 1 19 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.239 1.368 19043 5931 1 19 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.297 0.425 19043 5932 1 19 . 1 1 15 15 GLU H H 15 8.244 8.244 8.631 -0.387 19043 5933 1 19 . 1 1 16 16 ILE N N 16 119.695 119.695 119.185 0.510 19043 5934 1 19 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.705 -0.352 19043 5935 1 19 . 1 1 16 16 ILE C C 16 177.760 177.760 177.288 0.472 19043 5936 1 19 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.107 1.547 19043 5937 1 19 . 1 1 16 16 ILE CB C 16 37.403 37.403 38.028 -0.625 19043 5938 1 19 . 1 1 16 16 ILE H H 16 8.336 8.336 7.414 0.922 19043 5939 1 19 . 1 1 17 17 LEU N N 17 117.709 117.709 120.053 -2.344 19043 5940 1 19 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.819 -0.266 19043 5941 1 19 . 1 1 17 17 LEU C C 17 176.565 176.565 178.388 -1.823 19043 5942 1 19 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.634 -0.075 19043 5943 1 19 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.231 0.607 19043 5944 1 19 . 1 1 17 17 LEU H H 17 7.738 7.738 7.455 0.283 19043 5945 1 19 . 1 1 18 18 HIS N N 18 110.934 110.934 114.004 -3.070 19043 5946 1 19 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.295 0.202 19043 5947 1 19 . 1 1 18 18 HIS C C 18 175.243 175.243 176.258 -1.015 19043 5948 1 19 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.290 -1.234 19043 5949 1 19 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.260 0.388 19043 5950 1 19 . 1 1 18 18 HIS H H 18 7.150 7.150 8.254 -1.104 19043 5951 1 19 . 1 1 19 19 LEU N N 19 123.586 123.586 121.859 1.727 19043 5952 1 19 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.246 0.172 19043 5953 1 19 . 1 1 19 19 LEU CA C 19 53.476 53.476 54.070 -0.594 19043 5954 1 19 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.414 -1.092 19043 5955 1 19 . 1 1 19 19 LEU H H 19 7.249 7.249 7.671 -0.422 19043 5956 1 19 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.427 0.004 19043 5957 1 19 . 1 1 20 20 PRO C C 20 178.092 178.092 177.715 0.377 19043 5958 1 19 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.918 -0.021 19043 5959 1 19 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.172 0.400 19043 5960 1 19 . 1 1 21 21 ASN N N 21 113.952 113.952 116.545 -2.593 19043 5961 1 19 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.506 0.503 19043 5962 1 19 . 1 1 21 21 ASN C C 21 176.397 176.397 175.635 0.762 19043 5963 1 19 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.102 -1.473 19043 5964 1 19 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.294 0.516 19043 5965 1 19 . 1 1 21 21 ASN H H 21 8.871 8.871 8.024 0.847 19043 5966 1 19 . 1 1 22 22 LEU N N 22 117.526 117.526 121.701 -4.175 19043 5967 1 19 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.369 0.032 19043 5968 1 19 . 1 1 22 22 LEU C C 22 176.879 176.879 175.295 1.584 19043 5969 1 19 . 1 1 22 22 LEU CA C 22 54.457 54.457 54.931 -0.474 19043 5970 1 19 . 1 1 22 22 LEU CB C 22 42.520 42.520 43.452 -0.932 19043 5971 1 19 . 1 1 22 22 LEU H H 22 6.563 6.563 8.083 -1.520 19043 5972 1 19 . 1 1 23 23 ASN N N 23 120.219 120.219 123.059 -2.840 19043 5973 1 19 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.774 0.094 19043 5974 1 19 . 1 1 23 23 ASN C C 23 175.507 175.507 176.184 -0.677 19043 5975 1 19 . 1 1 23 23 ASN CA C 23 51.416 51.416 51.626 -0.210 19043 5976 1 19 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.273 -0.561 19043 5977 1 19 . 1 1 23 23 ASN H H 23 8.612 8.612 8.226 0.386 19043 5978 1 19 . 1 1 24 24 GLU N N 24 118.801 118.801 118.670 0.131 19043 5979 1 19 . 1 1 24 24 GLU HA H 24 3.874 3.874 3.956 -0.082 19043 5980 1 19 . 1 1 24 24 GLU C C 24 177.799 177.799 177.917 -0.118 19043 5981 1 19 . 1 1 24 24 GLU CA C 24 60.191 60.191 59.840 0.351 19043 5982 1 19 . 1 1 24 24 GLU CB C 24 29.365 29.365 28.969 0.396 19043 5983 1 19 . 1 1 24 24 GLU H H 24 8.735 8.735 8.878 -0.143 19043 5984 1 19 . 1 1 25 25 GLU N N 25 119.198 119.198 119.411 -0.213 19043 5985 1 19 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.060 -0.082 19043 5986 1 19 . 1 1 25 25 GLU C C 25 180.078 180.078 179.337 0.741 19043 5987 1 19 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.318 0.573 19043 5988 1 19 . 1 1 25 25 GLU CB C 25 29.131 29.131 28.792 0.339 19043 5989 1 19 . 1 1 25 25 GLU H H 25 8.229 8.229 8.700 -0.471 19043 5990 1 19 . 1 1 26 26 GLN N N 26 119.646 119.646 118.600 1.046 19043 5991 1 19 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.139 -0.199 19043 5992 1 19 . 1 1 26 26 GLN C C 26 178.154 178.154 178.385 -0.231 19043 5993 1 19 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.366 -0.473 19043 5994 1 19 . 1 1 26 26 GLN CB C 26 28.902 28.902 29.102 -0.199 19043 5995 1 19 . 1 1 26 26 GLN H H 26 8.425 8.425 8.699 -0.274 19043 5996 1 19 . 1 1 27 27 ARG N N 27 119.454 119.454 120.532 -1.078 19043 5997 1 19 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.148 -0.362 19043 5998 1 19 . 1 1 27 27 ARG C C 27 177.863 177.863 178.519 -0.656 19043 5999 1 19 . 1 1 27 27 ARG CA C 27 60.630 60.630 59.587 1.043 19043 6000 1 19 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.065 -0.421 19043 6001 1 19 . 1 1 27 27 ARG H H 27 8.548 8.548 8.389 0.159 19043 6002 1 19 . 1 1 28 28 ASN N N 28 116.833 116.833 117.784 -0.951 19043 6003 1 19 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.524 -0.192 19043 6004 1 19 . 1 1 28 28 ASN C C 28 177.234 177.234 177.205 0.029 19043 6005 1 19 . 1 1 28 28 ASN CA C 28 56.038 56.038 56.056 -0.018 19043 6006 1 19 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.345 -0.660 19043 6007 1 19 . 1 1 28 28 ASN H H 28 8.569 8.569 8.521 0.048 19043 6008 1 19 . 1 1 29 29 ALA N N 29 122.687 122.687 123.384 -0.697 19043 6009 1 19 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.017 0.037 19043 6010 1 19 . 1 1 29 29 ALA C C 29 181.045 181.045 179.611 1.434 19043 6011 1 19 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.722 0.527 19043 6012 1 19 . 1 1 29 29 ALA CB C 29 17.820 17.820 17.995 -0.175 19043 6013 1 19 . 1 1 29 29 ALA H H 29 7.793 7.793 7.359 0.434 19043 6014 1 19 . 1 1 30 30 PHE N N 30 116.979 116.979 117.680 -0.701 19043 6015 1 19 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.274 0.104 19043 6016 1 19 . 1 1 30 30 PHE C C 30 177.887 177.887 177.902 -0.015 19043 6017 1 19 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.660 0.959 19043 6018 1 19 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.840 0.619 19043 6019 1 19 . 1 1 30 30 PHE H H 30 8.017 8.017 7.646 0.371 19043 6020 1 19 . 1 1 31 31 ILE N N 31 119.553 119.553 119.388 0.165 19043 6021 1 19 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.640 0.138 19043 6022 1 19 . 1 1 31 31 ILE C C 31 177.084 177.084 178.093 -1.009 19043 6023 1 19 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.166 0.478 19043 6024 1 19 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.563 -0.448 19043 6025 1 19 . 1 1 31 31 ILE H H 31 8.372 8.372 8.316 0.056 19043 6026 1 19 . 1 1 32 32 GLN N N 32 119.108 119.108 119.560 -0.452 19043 6027 1 19 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.995 -0.189 19043 6028 1 19 . 1 1 32 32 GLN C C 32 177.836 177.836 178.420 -0.584 19043 6029 1 19 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.530 -0.762 19043 6030 1 19 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.687 -0.709 19043 6031 1 19 . 1 1 32 32 GLN H H 32 8.389 8.389 8.151 0.238 19043 6032 1 19 . 1 1 33 33 SER N N 33 114.437 114.437 115.311 -0.874 19043 6033 1 19 . 1 1 33 33 SER HA H 33 4.212 4.212 4.284 -0.072 19043 6034 1 19 . 1 1 33 33 SER C C 33 175.469 175.469 176.866 -1.397 19043 6035 1 19 . 1 1 33 33 SER CA C 33 62.403 62.403 60.806 1.597 19043 6036 1 19 . 1 1 33 33 SER CB C 33 63.794 63.794 62.716 1.078 19043 6037 1 19 . 1 1 33 33 SER H H 33 8.078 8.078 7.710 0.368 19043 6038 1 19 . 1 1 34 34 LEU N N 34 122.967 122.967 123.729 -0.762 19043 6039 1 19 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.170 -0.260 19043 6040 1 19 . 1 1 34 34 LEU C C 34 177.506 177.506 178.466 -0.960 19043 6041 1 19 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.658 -0.230 19043 6042 1 19 . 1 1 34 34 LEU CB C 34 42.812 42.812 41.826 0.986 19043 6043 1 19 . 1 1 34 34 LEU H H 34 8.495 8.495 8.287 0.208 19043 6044 1 19 . 1 1 35 35 LYS N N 35 115.859 115.859 119.168 -3.309 19043 6045 1 19 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.208 -0.395 19043 6046 1 19 . 1 1 35 35 LYS C C 35 177.628 177.628 178.420 -0.792 19043 6047 1 19 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.829 -1.952 19043 6048 1 19 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.046 -0.027 19043 6049 1 19 . 1 1 35 35 LYS H H 35 7.815 7.815 7.634 0.181 19043 6050 1 19 . 1 1 36 36 ASP N N 36 116.741 116.741 117.495 -0.754 19043 6051 1 19 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.602 -0.088 19043 6052 1 19 . 1 1 36 36 ASP C C 36 177.324 177.324 176.293 1.031 19043 6053 1 19 . 1 1 36 36 ASP CA C 36 56.686 56.686 56.049 0.637 19043 6054 1 19 . 1 1 36 36 ASP CB C 36 40.671 40.671 41.518 -0.847 19043 6055 1 19 . 1 1 36 36 ASP H H 36 7.943 7.943 7.954 -0.011 19043 6056 1 19 . 1 1 37 37 ASP N N 37 116.686 116.686 117.645 -0.959 19043 6057 1 19 . 1 1 37 37 ASP HA H 37 5.041 5.041 4.998 0.043 19043 6058 1 19 . 1 1 37 37 ASP CA C 37 51.946 51.946 51.762 0.184 19043 6059 1 19 . 1 1 37 37 ASP CB C 37 40.523 40.523 41.679 -1.157 19043 6060 1 19 . 1 1 37 37 ASP H H 37 8.125 8.125 7.862 0.263 19043 6061 1 19 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.543 0.040 19043 6062 1 19 . 1 1 38 38 PRO C C 38 179.200 179.200 177.873 1.327 19043 6063 1 19 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.531 0.006 19043 6064 1 19 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.006 -0.120 19043 6065 1 19 . 1 1 39 39 SER N N 39 114.963 114.963 115.183 -0.220 19043 6066 1 19 . 1 1 39 39 SER HA H 39 4.178 4.178 4.289 -0.111 19043 6067 1 19 . 1 1 39 39 SER C C 39 176.151 176.151 175.946 0.205 19043 6068 1 19 . 1 1 39 39 SER CA C 39 61.197 61.197 60.646 0.551 19043 6069 1 19 . 1 1 39 39 SER CB C 39 62.729 62.729 61.889 0.840 19043 6070 1 19 . 1 1 39 39 SER H H 39 8.315 8.315 8.533 -0.218 19043 6071 1 19 . 1 1 40 40 GLN N N 40 120.058 120.058 120.631 -0.573 19043 6072 1 19 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.517 0.143 19043 6073 1 19 . 1 1 40 40 GLN C C 40 176.192 176.192 177.305 -1.113 19043 6074 1 19 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.416 -0.436 19043 6075 1 19 . 1 1 40 40 GLN CB C 40 28.168 28.168 27.865 0.303 19043 6076 1 19 . 1 1 40 40 GLN H H 40 7.820 7.820 7.883 -0.063 19043 6077 1 19 . 1 1 41 41 SER N N 41 115.553 115.553 116.888 -1.335 19043 6078 1 19 . 1 1 41 41 SER HA H 41 3.845 3.845 4.077 -0.232 19043 6079 1 19 . 1 1 41 41 SER C C 41 174.181 174.181 175.213 -1.032 19043 6080 1 19 . 1 1 41 41 SER CA C 41 63.957 63.957 61.218 2.739 19043 6081 1 19 . 1 1 41 41 SER CB C 41 63.191 63.191 63.072 0.119 19043 6082 1 19 . 1 1 41 41 SER H H 41 7.666 7.666 7.689 -0.023 19043 6083 1 19 . 1 1 42 42 ALA N N 42 122.360 122.360 120.850 1.510 19043 6084 1 19 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.228 -0.105 19043 6085 1 19 . 1 1 42 42 ALA C C 42 180.996 180.996 178.567 2.429 19043 6086 1 19 . 1 1 42 42 ALA CA C 42 55.563 55.563 53.816 1.746 19043 6087 1 19 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.110 -1.054 19043 6088 1 19 . 1 1 42 42 ALA H H 42 8.556 8.556 8.155 0.401 19043 6089 1 19 . 1 1 43 43 ASN N N 43 118.974 118.974 118.965 0.009 19043 6090 1 19 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.583 -0.064 19043 6091 1 19 . 1 1 43 43 ASN C C 43 177.972 177.972 177.689 0.283 19043 6092 1 19 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.307 -0.453 19043 6093 1 19 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.505 -0.356 19043 6094 1 19 . 1 1 43 43 ASN H H 43 7.950 7.950 7.907 0.043 19043 6095 1 19 . 1 1 44 44 LEU N N 44 122.070 122.070 120.566 1.504 19043 6096 1 19 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.338 -0.149 19043 6097 1 19 . 1 1 44 44 LEU C C 44 178.332 178.332 179.344 -1.012 19043 6098 1 19 . 1 1 44 44 LEU CA C 44 57.834 57.834 57.985 -0.151 19043 6099 1 19 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.791 0.560 19043 6100 1 19 . 1 1 44 44 LEU H H 44 8.789 8.789 8.469 0.320 19043 6101 1 19 . 1 1 45 45 LEU N N 45 118.621 118.621 119.218 -0.597 19043 6102 1 19 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.742 0.063 19043 6103 1 19 . 1 1 45 45 LEU C C 45 177.832 177.832 178.480 -0.648 19043 6104 1 19 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.781 0.104 19043 6105 1 19 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.593 0.213 19043 6106 1 19 . 1 1 45 45 LEU H H 45 8.283 8.283 7.587 0.696 19043 6107 1 19 . 1 1 46 46 ALA N N 46 119.525 119.525 120.591 -1.066 19043 6108 1 19 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.877 0.133 19043 6109 1 19 . 1 1 46 46 ALA C C 46 181.250 181.250 179.970 1.280 19043 6110 1 19 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.109 0.187 19043 6111 1 19 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.024 -0.073 19043 6112 1 19 . 1 1 46 46 ALA H H 46 7.640 7.640 7.707 -0.067 19043 6113 1 19 . 1 1 47 47 GLU N N 47 119.572 119.572 118.275 1.297 19043 6114 1 19 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.094 -0.064 19043 6115 1 19 . 1 1 47 47 GLU C C 47 178.895 178.895 178.863 0.032 19043 6116 1 19 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.948 0.218 19043 6117 1 19 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.833 -0.295 19043 6118 1 19 . 1 1 47 47 GLU H H 47 8.139 8.139 8.325 -0.186 19043 6119 1 19 . 1 1 48 48 ALA N N 48 123.953 123.953 122.470 1.483 19043 6120 1 19 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.546 -0.019 19043 6121 1 19 . 1 1 48 48 ALA C C 48 179.636 179.636 179.136 0.500 19043 6122 1 19 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.373 1.143 19043 6123 1 19 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.660 -0.415 19043 6124 1 19 . 1 1 48 48 ALA H H 48 8.468 8.468 7.638 0.830 19043 6125 1 19 . 1 1 49 49 LYS N N 49 117.926 117.926 118.216 -0.290 19043 6126 1 19 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.888 -0.149 19043 6127 1 19 . 1 1 49 49 LYS C C 49 178.761 178.761 178.725 0.036 19043 6128 1 19 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.648 0.744 19043 6129 1 19 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.300 -0.211 19043 6130 1 19 . 1 1 49 49 LYS H H 49 8.459 8.459 8.378 0.081 19043 6131 1 19 . 1 1 50 50 LYS N N 50 120.194 120.194 119.404 0.790 19043 6132 1 19 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.067 0.021 19043 6133 1 19 . 1 1 50 50 LYS C C 50 179.859 179.859 178.829 1.030 19043 6134 1 19 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.075 0.660 19043 6135 1 19 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.513 -0.051 19043 6136 1 19 . 1 1 50 50 LYS H H 50 7.702 7.702 7.758 -0.056 19043 6137 1 19 . 1 1 51 51 LEU N N 51 122.126 122.126 119.385 2.741 19043 6138 1 19 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.220 -0.093 19043 6139 1 19 . 1 1 51 51 LEU C C 51 178.123 178.123 178.127 -0.004 19043 6140 1 19 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.715 0.882 19043 6141 1 19 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.052 0.300 19043 6142 1 19 . 1 1 51 51 LEU H H 51 8.023 8.023 7.489 0.534 19043 6143 1 19 . 1 1 52 52 ASN N N 52 116.675 116.675 116.974 -0.299 19043 6144 1 19 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.363 -0.428 19043 6145 1 19 . 1 1 52 52 ASN C C 52 177.668 177.668 176.487 1.181 19043 6146 1 19 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.232 1.685 19043 6147 1 19 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.700 3.236 19043 6148 1 19 . 1 1 52 52 ASN H H 52 8.537 8.537 8.256 0.281 19043 6149 1 19 . 1 1 53 53 ASP N N 53 118.725 118.725 117.346 1.379 19043 6150 1 19 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.566 -0.122 19043 6151 1 19 . 1 1 53 53 ASP C C 53 178.936 178.936 177.181 1.755 19043 6152 1 19 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.223 1.710 19043 6153 1 19 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.270 -1.175 19043 6154 1 19 . 1 1 53 53 ASP H H 53 8.220 8.220 7.636 0.584 19043 6155 1 19 . 1 1 54 54 ALA N N 54 122.872 122.872 121.558 1.314 19043 6156 1 19 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.117 0.115 19043 6157 1 19 . 1 1 54 54 ALA C C 54 179.354 179.354 179.058 0.296 19043 6158 1 19 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.279 0.062 19043 6159 1 19 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.206 -0.601 19043 6160 1 19 . 1 1 54 54 ALA H H 54 8.037 8.037 7.576 0.461 19043 6161 1 19 . 1 1 55 55 GLN N N 55 115.052 115.052 116.386 -1.334 19043 6162 1 19 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.341 0.037 19043 6163 1 19 . 1 1 55 55 GLN C C 55 174.116 174.116 175.034 -0.918 19043 6164 1 19 . 1 1 55 55 GLN CA C 55 54.954 54.954 54.824 0.130 19043 6165 1 19 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.246 -1.022 19043 6166 1 19 . 1 1 55 55 GLN H H 55 7.512 7.512 7.720 -0.208 19043 6167 1 19 . 1 1 56 56 ALA N N 56 124.556 124.556 123.938 0.618 19043 6168 1 19 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.316 0.032 19043 6169 1 19 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.150 -0.113 19043 6170 1 19 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.664 -0.685 19043 6171 1 19 . 1 1 56 56 ALA H H 56 7.100 7.100 7.681 -0.581 19043 6172 1 19 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.592 -0.180 19043 6173 1 19 . 1 1 57 57 PRO C C 57 176.151 176.151 176.539 -0.388 19043 6174 1 19 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.284 0.999 19043 6175 1 19 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.301 -0.308 19043 6176 1 20 . 1 1 2 2 ASP N N 2 125.357 125.357 125.400 -0.043 19043 6177 1 20 . 1 1 2 2 ASP C C 2 175.535 175.535 174.320 1.215 19043 6178 1 20 . 1 1 2 2 ASP CA C 2 54.307 54.307 53.570 0.737 19043 6179 1 20 . 1 1 2 2 ASP CB C 2 41.470 41.470 41.838 -0.368 19043 6180 1 20 . 1 1 2 2 ASP H H 2 8.762 8.762 8.243 0.519 19043 6181 1 20 . 1 1 3 3 ASN N N 3 120.441 120.441 116.304 4.137 19043 6182 1 20 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.478 0.222 19043 6183 1 20 . 1 1 3 3 ASN C C 3 175.246 175.246 174.891 0.355 19043 6184 1 20 . 1 1 3 3 ASN CA C 3 53.289 53.289 52.618 0.671 19043 6185 1 20 . 1 1 3 3 ASN CB C 3 39.086 39.086 38.719 0.367 19043 6186 1 20 . 1 1 3 3 ASN H H 3 8.548 8.548 7.617 0.931 19043 6187 1 20 . 1 1 4 4 LYS N N 4 121.461 121.461 120.192 1.269 19043 6188 1 20 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.474 -0.259 19043 6189 1 20 . 1 1 4 4 LYS C C 4 176.404 176.404 175.803 0.601 19043 6190 1 20 . 1 1 4 4 LYS CA C 4 56.853 56.853 55.249 1.604 19043 6191 1 20 . 1 1 4 4 LYS CB C 4 32.780 32.780 33.020 -0.240 19043 6192 1 20 . 1 1 4 4 LYS H H 4 8.337 8.337 8.143 0.194 19043 6193 1 20 . 1 1 5 5 PHE N N 5 119.538 119.538 115.811 3.727 19043 6194 1 20 . 1 1 5 5 PHE C C 5 175.433 175.433 175.087 0.346 19043 6195 1 20 . 1 1 5 5 PHE CA C 5 57.792 57.792 57.925 -0.133 19043 6196 1 20 . 1 1 5 5 PHE CB C 5 40.067 40.067 35.619 4.448 19043 6197 1 20 . 1 1 5 5 PHE H H 5 8.277 8.277 7.967 0.310 19043 6198 1 20 . 1 1 6 6 ASN N N 6 121.168 121.168 120.500 0.668 19043 6199 1 20 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.579 0.238 19043 6200 1 20 . 1 1 6 6 ASN C C 6 175.884 175.884 176.311 -0.427 19043 6201 1 20 . 1 1 6 6 ASN CA C 6 52.785 52.785 54.095 -1.310 19043 6202 1 20 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.277 0.094 19043 6203 1 20 . 1 1 6 6 ASN H H 6 8.443 8.443 8.218 0.225 19043 6204 1 20 . 1 1 7 7 LYS N N 7 121.688 121.688 120.863 0.825 19043 6205 1 20 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.100 -0.155 19043 6206 1 20 . 1 1 7 7 LYS C C 7 178.196 178.196 178.411 -0.215 19043 6207 1 20 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.351 -0.450 19043 6208 1 20 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.439 -0.314 19043 6209 1 20 . 1 1 7 7 LYS H H 7 8.460 8.460 8.576 -0.116 19043 6210 1 20 . 1 1 8 8 GLU N N 8 119.926 119.926 118.539 1.387 19043 6211 1 20 . 1 1 8 8 GLU HA H 8 4.081 4.081 3.970 0.111 19043 6212 1 20 . 1 1 8 8 GLU C C 8 179.894 179.894 178.788 1.106 19043 6213 1 20 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.737 0.102 19043 6214 1 20 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.017 -0.076 19043 6215 1 20 . 1 1 8 8 GLU H H 8 8.386 8.386 8.872 -0.486 19043 6216 1 20 . 1 1 9 9 GLN N N 9 121.401 121.401 118.005 3.396 19043 6217 1 20 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.083 0.014 19043 6218 1 20 . 1 1 9 9 GLN C C 9 177.324 177.324 178.286 -0.962 19043 6219 1 20 . 1 1 9 9 GLN CA C 9 59.383 59.383 59.044 0.339 19043 6220 1 20 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.486 0.383 19043 6221 1 20 . 1 1 9 9 GLN H H 9 8.307 8.307 8.714 -0.407 19043 6222 1 20 . 1 1 10 10 GLN N N 10 120.060 120.060 119.470 0.590 19043 6223 1 20 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.053 -0.831 19043 6224 1 20 . 1 1 10 10 GLN C C 10 176.888 176.888 178.354 -1.466 19043 6225 1 20 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.854 0.095 19043 6226 1 20 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.660 0.181 19043 6227 1 20 . 1 1 10 10 GLN H H 10 8.040 8.040 7.815 0.225 19043 6228 1 20 . 1 1 11 11 ASN N N 11 116.214 116.214 119.192 -2.978 19043 6229 1 20 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.594 -0.244 19043 6230 1 20 . 1 1 11 11 ASN C C 11 177.828 177.828 177.582 0.246 19043 6231 1 20 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.081 0.176 19043 6232 1 20 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.066 0.144 19043 6233 1 20 . 1 1 11 11 ASN H H 11 8.366 8.366 8.534 -0.168 19043 6234 1 20 . 1 1 12 12 ALA N N 12 121.429 121.429 122.593 -1.164 19043 6235 1 20 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.072 -0.063 19043 6236 1 20 . 1 1 12 12 ALA C C 12 177.850 177.850 179.264 -1.414 19043 6237 1 20 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.836 0.457 19043 6238 1 20 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.334 -0.013 19043 6239 1 20 . 1 1 12 12 ALA H H 12 7.915 7.915 8.256 -0.341 19043 6240 1 20 . 1 1 13 13 PHE N N 13 118.052 118.052 120.372 -2.320 19043 6241 1 20 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.970 -0.397 19043 6242 1 20 . 1 1 13 13 PHE C C 13 175.832 175.832 176.960 -1.128 19043 6243 1 20 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.873 -0.018 19043 6244 1 20 . 1 1 13 13 PHE CB C 13 38.917 38.917 39.059 -0.142 19043 6245 1 20 . 1 1 13 13 PHE H H 13 8.097 8.097 7.389 0.708 19043 6246 1 20 . 1 1 14 14 TYR N N 14 116.000 116.000 117.825 -1.825 19043 6247 1 20 . 1 1 14 14 TYR HA H 14 3.985 3.985 3.875 0.110 19043 6248 1 20 . 1 1 14 14 TYR C C 14 178.860 178.860 178.072 0.788 19043 6249 1 20 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.676 -1.881 19043 6250 1 20 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.499 -0.519 19043 6251 1 20 . 1 1 14 14 TYR H H 14 8.040 8.040 7.741 0.299 19043 6252 1 20 . 1 1 15 15 GLU N N 15 118.737 118.737 119.535 -0.798 19043 6253 1 20 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.753 0.218 19043 6254 1 20 . 1 1 15 15 GLU C C 15 180.184 180.184 179.007 1.177 19043 6255 1 20 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.055 1.552 19043 6256 1 20 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.361 0.361 19043 6257 1 20 . 1 1 15 15 GLU H H 15 8.244 8.244 8.247 -0.003 19043 6258 1 20 . 1 1 16 16 ILE N N 16 119.695 119.695 118.425 1.270 19043 6259 1 20 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.688 -0.335 19043 6260 1 20 . 1 1 16 16 ILE C C 16 177.760 177.760 177.348 0.412 19043 6261 1 20 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.376 1.278 19043 6262 1 20 . 1 1 16 16 ILE CB C 16 37.403 37.403 37.889 -0.486 19043 6263 1 20 . 1 1 16 16 ILE H H 16 8.336 8.336 7.385 0.951 19043 6264 1 20 . 1 1 17 17 LEU N N 17 117.709 117.709 119.227 -1.518 19043 6265 1 20 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.915 -0.362 19043 6266 1 20 . 1 1 17 17 LEU C C 17 176.565 176.565 177.851 -1.286 19043 6267 1 20 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.091 0.468 19043 6268 1 20 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.783 0.055 19043 6269 1 20 . 1 1 17 17 LEU H H 17 7.738 7.738 7.184 0.554 19043 6270 1 20 . 1 1 18 18 HIS N N 18 110.934 110.934 115.776 -4.842 19043 6271 1 20 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.301 0.196 19043 6272 1 20 . 1 1 18 18 HIS C C 18 175.243 175.243 176.073 -0.830 19043 6273 1 20 . 1 1 18 18 HIS CA C 18 56.056 56.056 56.760 -0.703 19043 6274 1 20 . 1 1 18 18 HIS CB C 18 30.648 30.648 29.989 0.659 19043 6275 1 20 . 1 1 18 18 HIS H H 18 7.150 7.150 7.828 -0.678 19043 6276 1 20 . 1 1 19 19 LEU N N 19 123.586 123.586 122.172 1.414 19043 6277 1 20 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.265 0.153 19043 6278 1 20 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.864 -0.388 19043 6279 1 20 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.348 -1.026 19043 6280 1 20 . 1 1 19 19 LEU H H 19 7.249 7.249 7.609 -0.360 19043 6281 1 20 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.459 -0.028 19043 6282 1 20 . 1 1 20 20 PRO C C 20 178.092 178.092 177.667 0.425 19043 6283 1 20 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.794 0.103 19043 6284 1 20 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.189 0.383 19043 6285 1 20 . 1 1 21 21 ASN N N 21 113.952 113.952 116.790 -2.838 19043 6286 1 20 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.500 0.509 19043 6287 1 20 . 1 1 21 21 ASN C C 21 176.397 176.397 175.694 0.703 19043 6288 1 20 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.098 -1.469 19043 6289 1 20 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.444 0.366 19043 6290 1 20 . 1 1 21 21 ASN H H 21 8.871 8.871 8.227 0.644 19043 6291 1 20 . 1 1 22 22 LEU N N 22 117.526 117.526 122.028 -4.502 19043 6292 1 20 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.328 0.073 19043 6293 1 20 . 1 1 22 22 LEU C C 22 176.879 176.879 175.135 1.744 19043 6294 1 20 . 1 1 22 22 LEU CA C 22 54.457 54.457 55.003 -0.546 19043 6295 1 20 . 1 1 22 22 LEU CB C 22 42.520 42.520 43.324 -0.804 19043 6296 1 20 . 1 1 22 22 LEU H H 22 6.563 6.563 8.160 -1.597 19043 6297 1 20 . 1 1 23 23 ASN N N 23 120.219 120.219 122.027 -1.808 19043 6298 1 20 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.713 0.155 19043 6299 1 20 . 1 1 23 23 ASN C C 23 175.507 175.507 176.173 -0.666 19043 6300 1 20 . 1 1 23 23 ASN CA C 23 51.416 51.416 52.403 -0.987 19043 6301 1 20 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.777 -1.065 19043 6302 1 20 . 1 1 23 23 ASN H H 23 8.612 8.612 8.219 0.393 19043 6303 1 20 . 1 1 24 24 GLU N N 24 118.801 118.801 119.745 -0.944 19043 6304 1 20 . 1 1 24 24 GLU HA H 24 3.874 3.874 4.041 -0.167 19043 6305 1 20 . 1 1 24 24 GLU C C 24 177.799 177.799 178.590 -0.791 19043 6306 1 20 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.086 0.105 19043 6307 1 20 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.421 -0.056 19043 6308 1 20 . 1 1 24 24 GLU H H 24 8.735 8.735 8.937 -0.202 19043 6309 1 20 . 1 1 25 25 GLU N N 25 119.198 119.198 119.785 -0.587 19043 6310 1 20 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.064 -0.086 19043 6311 1 20 . 1 1 25 25 GLU C C 25 180.078 180.078 179.156 0.922 19043 6312 1 20 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.621 0.270 19043 6313 1 20 . 1 1 25 25 GLU CB C 25 29.131 29.131 29.131 -0.000 19043 6314 1 20 . 1 1 25 25 GLU H H 25 8.229 8.229 8.765 -0.536 19043 6315 1 20 . 1 1 26 26 GLN N N 26 119.646 119.646 118.213 1.433 19043 6316 1 20 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.086 -0.146 19043 6317 1 20 . 1 1 26 26 GLN C C 26 178.154 178.154 178.260 -0.106 19043 6318 1 20 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.668 -0.775 19043 6319 1 20 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.555 0.347 19043 6320 1 20 . 1 1 26 26 GLN H H 26 8.425 8.425 8.330 0.095 19043 6321 1 20 . 1 1 27 27 ARG N N 27 119.454 119.454 120.464 -1.010 19043 6322 1 20 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.127 -0.341 19043 6323 1 20 . 1 1 27 27 ARG C C 27 177.863 177.863 178.358 -0.495 19043 6324 1 20 . 1 1 27 27 ARG CA C 27 60.630 60.630 60.133 0.497 19043 6325 1 20 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.121 -0.477 19043 6326 1 20 . 1 1 27 27 ARG H H 27 8.548 8.548 8.194 0.354 19043 6327 1 20 . 1 1 28 28 ASN N N 28 116.833 116.833 117.974 -1.141 19043 6328 1 20 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.467 -0.135 19043 6329 1 20 . 1 1 28 28 ASN C C 28 177.234 177.234 177.297 -0.063 19043 6330 1 20 . 1 1 28 28 ASN CA C 28 56.038 56.038 56.136 -0.098 19043 6331 1 20 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.213 -0.528 19043 6332 1 20 . 1 1 28 28 ASN H H 28 8.569 8.569 8.544 0.025 19043 6333 1 20 . 1 1 29 29 ALA N N 29 122.687 122.687 122.833 -0.146 19043 6334 1 20 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.059 -0.005 19043 6335 1 20 . 1 1 29 29 ALA C C 29 181.045 181.045 179.766 1.279 19043 6336 1 20 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.608 0.642 19043 6337 1 20 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.339 -0.519 19043 6338 1 20 . 1 1 29 29 ALA H H 29 7.793 7.793 7.373 0.420 19043 6339 1 20 . 1 1 30 30 PHE N N 30 116.979 116.979 117.852 -0.873 19043 6340 1 20 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.283 0.095 19043 6341 1 20 . 1 1 30 30 PHE C C 30 177.887 177.887 177.845 0.042 19043 6342 1 20 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.634 0.985 19043 6343 1 20 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.853 0.606 19043 6344 1 20 . 1 1 30 30 PHE H H 30 8.017 8.017 7.481 0.536 19043 6345 1 20 . 1 1 31 31 ILE N N 31 119.553 119.553 119.417 0.136 19043 6346 1 20 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.637 0.141 19043 6347 1 20 . 1 1 31 31 ILE C C 31 177.084 177.084 178.215 -1.131 19043 6348 1 20 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.203 0.442 19043 6349 1 20 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.481 -0.366 19043 6350 1 20 . 1 1 31 31 ILE H H 31 8.372 8.372 8.496 -0.124 19043 6351 1 20 . 1 1 32 32 GLN N N 32 119.108 119.108 120.040 -0.932 19043 6352 1 20 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.962 -0.156 19043 6353 1 20 . 1 1 32 32 GLN C C 32 177.836 177.836 178.553 -0.717 19043 6354 1 20 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.721 -0.953 19043 6355 1 20 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.907 -0.929 19043 6356 1 20 . 1 1 32 32 GLN H H 32 8.389 8.389 8.361 0.028 19043 6357 1 20 . 1 1 33 33 SER N N 33 114.437 114.437 116.176 -1.739 19043 6358 1 20 . 1 1 33 33 SER HA H 33 4.212 4.212 4.203 0.009 19043 6359 1 20 . 1 1 33 33 SER C C 33 175.469 175.469 177.054 -1.585 19043 6360 1 20 . 1 1 33 33 SER CA C 33 62.403 62.403 61.606 0.797 19043 6361 1 20 . 1 1 33 33 SER CB C 33 63.794 63.794 62.663 1.131 19043 6362 1 20 . 1 1 33 33 SER H H 33 8.078 8.078 7.866 0.212 19043 6363 1 20 . 1 1 34 34 LEU N N 34 122.967 122.967 123.065 -0.098 19043 6364 1 20 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.091 -0.181 19043 6365 1 20 . 1 1 34 34 LEU C C 34 177.506 177.506 178.363 -0.857 19043 6366 1 20 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.812 -0.383 19043 6367 1 20 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.041 0.771 19043 6368 1 20 . 1 1 34 34 LEU H H 34 8.495 8.495 8.537 -0.042 19043 6369 1 20 . 1 1 35 35 LYS N N 35 115.859 115.859 117.803 -1.944 19043 6370 1 20 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.145 -0.332 19043 6371 1 20 . 1 1 35 35 LYS C C 35 177.628 177.628 178.024 -0.396 19043 6372 1 20 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.438 -1.561 19043 6373 1 20 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.009 0.010 19043 6374 1 20 . 1 1 35 35 LYS H H 35 7.815 7.815 7.607 0.208 19043 6375 1 20 . 1 1 36 36 ASP N N 36 116.741 116.741 117.083 -0.342 19043 6376 1 20 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.561 -0.047 19043 6377 1 20 . 1 1 36 36 ASP C C 36 177.324 177.324 176.410 0.914 19043 6378 1 20 . 1 1 36 36 ASP CA C 36 56.686 56.686 56.463 0.223 19043 6379 1 20 . 1 1 36 36 ASP CB C 36 40.671 40.671 41.963 -1.292 19043 6380 1 20 . 1 1 36 36 ASP H H 36 7.943 7.943 7.939 0.004 19043 6381 1 20 . 1 1 37 37 ASP N N 37 116.686 116.686 117.893 -1.207 19043 6382 1 20 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.062 -0.021 19043 6383 1 20 . 1 1 37 37 ASP CA C 37 51.946 51.946 51.998 -0.052 19043 6384 1 20 . 1 1 37 37 ASP CB C 37 40.523 40.523 42.268 -1.745 19043 6385 1 20 . 1 1 37 37 ASP H H 37 8.125 8.125 7.917 0.208 19043 6386 1 20 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.628 -0.045 19043 6387 1 20 . 1 1 38 38 PRO C C 38 179.200 179.200 177.878 1.322 19043 6388 1 20 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.379 0.158 19043 6389 1 20 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.320 -0.434 19043 6390 1 20 . 1 1 39 39 SER N N 39 114.963 114.963 113.708 1.255 19043 6391 1 20 . 1 1 39 39 SER HA H 39 4.178 4.178 4.246 -0.068 19043 6392 1 20 . 1 1 39 39 SER C C 39 176.151 176.151 176.173 -0.022 19043 6393 1 20 . 1 1 39 39 SER CA C 39 61.197 61.197 61.028 0.169 19043 6394 1 20 . 1 1 39 39 SER CB C 39 62.729 62.729 62.892 -0.163 19043 6395 1 20 . 1 1 39 39 SER H H 39 8.315 8.315 7.762 0.553 19043 6396 1 20 . 1 1 40 40 GLN N N 40 120.058 120.058 119.053 1.005 19043 6397 1 20 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.520 0.140 19043 6398 1 20 . 1 1 40 40 GLN C C 40 176.192 176.192 177.066 -0.874 19043 6399 1 20 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.208 -0.227 19043 6400 1 20 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.221 -0.053 19043 6401 1 20 . 1 1 40 40 GLN H H 40 7.820 7.820 7.885 -0.065 19043 6402 1 20 . 1 1 41 41 SER N N 41 115.553 115.553 116.845 -1.292 19043 6403 1 20 . 1 1 41 41 SER HA H 41 3.845 3.845 4.097 -0.252 19043 6404 1 20 . 1 1 41 41 SER C C 41 174.181 174.181 175.606 -1.425 19043 6405 1 20 . 1 1 41 41 SER CA C 41 63.957 63.957 62.007 1.950 19043 6406 1 20 . 1 1 41 41 SER CB C 41 63.191 63.191 62.346 0.845 19043 6407 1 20 . 1 1 41 41 SER H H 41 7.666 7.666 7.763 -0.097 19043 6408 1 20 . 1 1 42 42 ALA N N 42 122.360 122.360 122.756 -0.396 19043 6409 1 20 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.186 -0.063 19043 6410 1 20 . 1 1 42 42 ALA C C 42 180.996 180.996 178.951 2.045 19043 6411 1 20 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.141 1.422 19043 6412 1 20 . 1 1 42 42 ALA CB C 42 18.056 18.056 18.981 -0.925 19043 6413 1 20 . 1 1 42 42 ALA H H 42 8.556 8.556 8.104 0.452 19043 6414 1 20 . 1 1 43 43 ASN N N 43 118.974 118.974 118.841 0.133 19043 6415 1 20 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.552 -0.033 19043 6416 1 20 . 1 1 43 43 ASN C C 43 177.972 177.972 177.747 0.225 19043 6417 1 20 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.389 -0.535 19043 6418 1 20 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.508 -0.359 19043 6419 1 20 . 1 1 43 43 ASN H H 43 7.950 7.950 7.899 0.051 19043 6420 1 20 . 1 1 44 44 LEU N N 44 122.070 122.070 120.565 1.505 19043 6421 1 20 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.436 -0.247 19043 6422 1 20 . 1 1 44 44 LEU C C 44 178.332 178.332 179.388 -1.056 19043 6423 1 20 . 1 1 44 44 LEU CA C 44 57.834 57.834 57.903 -0.069 19043 6424 1 20 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.790 0.561 19043 6425 1 20 . 1 1 44 44 LEU H H 44 8.789 8.789 8.692 0.097 19043 6426 1 20 . 1 1 45 45 LEU N N 45 118.621 118.621 119.772 -1.151 19043 6427 1 20 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.757 0.048 19043 6428 1 20 . 1 1 45 45 LEU C C 45 177.832 177.832 178.518 -0.686 19043 6429 1 20 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.628 0.257 19043 6430 1 20 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.595 0.211 19043 6431 1 20 . 1 1 45 45 LEU H H 45 8.283 8.283 7.508 0.775 19043 6432 1 20 . 1 1 46 46 ALA N N 46 119.525 119.525 120.797 -1.272 19043 6433 1 20 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.883 0.127 19043 6434 1 20 . 1 1 46 46 ALA C C 46 181.250 181.250 179.764 1.486 19043 6435 1 20 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.170 0.126 19043 6436 1 20 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.044 -0.093 19043 6437 1 20 . 1 1 46 46 ALA H H 46 7.640 7.640 7.665 -0.025 19043 6438 1 20 . 1 1 47 47 GLU N N 47 119.572 119.572 118.562 1.010 19043 6439 1 20 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.042 -0.012 19043 6440 1 20 . 1 1 47 47 GLU C C 47 178.895 178.895 178.965 -0.070 19043 6441 1 20 . 1 1 47 47 GLU CA C 47 59.166 59.166 59.110 0.056 19043 6442 1 20 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.771 -0.234 19043 6443 1 20 . 1 1 47 47 GLU H H 47 8.139 8.139 8.336 -0.197 19043 6444 1 20 . 1 1 48 48 ALA N N 48 123.953 123.953 122.158 1.795 19043 6445 1 20 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.563 -0.036 19043 6446 1 20 . 1 1 48 48 ALA C C 48 179.636 179.636 179.190 0.446 19043 6447 1 20 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.427 1.089 19043 6448 1 20 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.554 -0.309 19043 6449 1 20 . 1 1 48 48 ALA H H 48 8.468 8.468 7.680 0.788 19043 6450 1 20 . 1 1 49 49 LYS N N 49 117.926 117.926 118.323 -0.397 19043 6451 1 20 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.882 -0.143 19043 6452 1 20 . 1 1 49 49 LYS C C 49 178.761 178.761 178.764 -0.003 19043 6453 1 20 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.603 0.789 19043 6454 1 20 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.283 -0.195 19043 6455 1 20 . 1 1 49 49 LYS H H 49 8.459 8.459 8.090 0.369 19043 6456 1 20 . 1 1 50 50 LYS N N 50 120.194 120.194 119.723 0.471 19043 6457 1 20 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.061 0.027 19043 6458 1 20 . 1 1 50 50 LYS C C 50 179.859 179.859 179.010 0.849 19043 6459 1 20 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.187 0.548 19043 6460 1 20 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.542 -0.080 19043 6461 1 20 . 1 1 50 50 LYS H H 50 7.702 7.702 7.900 -0.198 19043 6462 1 20 . 1 1 51 51 LEU N N 51 122.126 122.126 119.509 2.617 19043 6463 1 20 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.183 -0.056 19043 6464 1 20 . 1 1 51 51 LEU C C 51 178.123 178.123 178.178 -0.055 19043 6465 1 20 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.893 0.704 19043 6466 1 20 . 1 1 51 51 LEU CB C 51 42.352 42.352 41.954 0.398 19043 6467 1 20 . 1 1 51 51 LEU H H 51 8.023 8.023 7.665 0.358 19043 6468 1 20 . 1 1 52 52 ASN N N 52 116.675 116.675 116.955 -0.280 19043 6469 1 20 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.394 -0.459 19043 6470 1 20 . 1 1 52 52 ASN C C 52 177.668 177.668 176.346 1.322 19043 6471 1 20 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.175 1.742 19043 6472 1 20 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.652 3.284 19043 6473 1 20 . 1 1 52 52 ASN H H 52 8.537 8.537 8.155 0.382 19043 6474 1 20 . 1 1 53 53 ASP N N 53 118.725 118.725 117.560 1.165 19043 6475 1 20 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.531 -0.087 19043 6476 1 20 . 1 1 53 53 ASP C C 53 178.936 178.936 177.008 1.928 19043 6477 1 20 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.513 1.420 19043 6478 1 20 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.273 -1.178 19043 6479 1 20 . 1 1 53 53 ASP H H 53 8.220 8.220 7.750 0.470 19043 6480 1 20 . 1 1 54 54 ALA N N 54 122.872 122.872 121.833 1.039 19043 6481 1 20 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.142 0.090 19043 6482 1 20 . 1 1 54 54 ALA C C 54 179.354 179.354 178.835 0.519 19043 6483 1 20 . 1 1 54 54 ALA CA C 54 54.341 54.341 53.971 0.370 19043 6484 1 20 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.270 -0.665 19043 6485 1 20 . 1 1 54 54 ALA H H 54 8.037 8.037 7.184 0.853 19043 6486 1 20 . 1 1 55 55 GLN N N 55 115.052 115.052 116.562 -1.510 19043 6487 1 20 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.324 0.054 19043 6488 1 20 . 1 1 55 55 GLN C C 55 174.116 174.116 174.972 -0.856 19043 6489 1 20 . 1 1 55 55 GLN CA C 55 54.954 54.954 54.902 0.052 19043 6490 1 20 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.184 -0.960 19043 6491 1 20 . 1 1 55 55 GLN H H 55 7.512 7.512 7.737 -0.225 19043 6492 1 20 . 1 1 56 56 ALA N N 56 124.556 124.556 123.920 0.636 19043 6493 1 20 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.382 -0.034 19043 6494 1 20 . 1 1 56 56 ALA CA C 56 51.037 51.037 50.926 0.111 19043 6495 1 20 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.660 -0.681 19043 6496 1 20 . 1 1 56 56 ALA H H 56 7.100 7.100 7.650 -0.550 19043 6497 1 20 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.512 -0.100 19043 6498 1 20 . 1 1 57 57 PRO C C 57 176.151 176.151 176.679 -0.528 19043 6499 1 20 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.347 0.936 19043 6500 1 20 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.182 -0.189 19043 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 53 1.810 0.166 1.820 19043 2 1 1 "Average Difference" HA 54 0.232 0.061 0.226 19043 3 1 1 "Average Difference" C 53 0.956 0.028 0.965 19043 4 1 1 "Average Difference" CA 56 0.905 -0.144 0.902 19043 5 1 1 "Average Difference" CB 56 0.990 -0.011 0.998 19043 6 1 1 "Average Difference" HN 53 0.474 -0.139 0.457 19043 7 1 2 "Average Difference" N 53 2.119 0.040 2.139 19043 8 1 2 "Average Difference" HA 54 0.233 0.069 0.225 19043 9 1 2 "Average Difference" C 53 0.962 -0.033 0.970 19043 10 1 2 "Average Difference" CA 56 0.891 -0.189 0.879 19043 11 1 2 "Average Difference" CB 56 0.885 0.004 0.893 19043 12 1 2 "Average Difference" HN 53 0.459 -0.134 0.443 19043 13 1 3 "Average Difference" N 53 1.838 0.233 1.840 19043 14 1 3 "Average Difference" HA 54 0.213 0.064 0.206 19043 15 1 3 "Average Difference" C 53 0.963 -0.038 0.971 19043 16 1 3 "Average Difference" CA 56 0.822 -0.145 0.817 19043 17 1 3 "Average Difference" CB 56 0.939 0.060 0.946 19043 18 1 3 "Average Difference" HN 53 0.463 -0.105 0.455 19043 19 1 4 "Average Difference" N 53 1.854 0.035 1.872 19043 20 1 4 "Average Difference" HA 54 0.241 0.068 0.233 19043 21 1 4 "Average Difference" C 53 0.921 -0.038 0.929 19043 22 1 4 "Average Difference" CA 56 0.918 -0.224 0.898 19043 23 1 4 "Average Difference" CB 56 0.957 0.018 0.966 19043 24 1 4 "Average Difference" HN 53 0.487 -0.124 0.475 19043 25 1 5 "Average Difference" N 53 1.909 -0.051 1.927 19043 26 1 5 "Average Difference" HA 54 0.245 0.066 0.238 19043 27 1 5 "Average Difference" C 53 0.965 -0.043 0.973 19043 28 1 5 "Average Difference" CA 56 0.909 -0.142 0.906 19043 29 1 5 "Average Difference" CB 56 0.980 -0.023 0.988 19043 30 1 5 "Average Difference" HN 53 0.465 -0.152 0.444 19043 31 1 6 "Average Difference" N 53 1.928 0.082 1.944 19043 32 1 6 "Average Difference" HA 54 0.227 0.058 0.222 19043 33 1 6 "Average Difference" C 53 0.853 -0.015 0.861 19043 34 1 6 "Average Difference" CA 56 0.916 -0.223 0.897 19043 35 1 6 "Average Difference" CB 56 1.023 -0.085 1.029 19043 36 1 6 "Average Difference" HN 53 0.479 -0.163 0.454 19043 37 1 7 "Average Difference" N 53 1.687 0.292 1.677 19043 38 1 7 "Average Difference" HA 54 0.220 0.074 0.209 19043 39 1 7 "Average Difference" C 53 0.961 -0.011 0.970 19043 40 1 7 "Average Difference" CA 56 0.913 -0.214 0.896 19043 41 1 7 "Average Difference" CB 56 0.904 0.040 0.911 19043 42 1 7 "Average Difference" HN 53 0.469 -0.105 0.461 19043 43 1 8 "Average Difference" N 53 1.824 0.162 1.834 19043 44 1 8 "Average Difference" HA 54 0.214 0.068 0.205 19043 45 1 8 "Average Difference" C 53 1.019 0.011 1.029 19043 46 1 8 "Average Difference" CA 56 0.804 -0.210 0.783 19043 47 1 8 "Average Difference" CB 56 0.765 0.057 0.770 19043 48 1 8 "Average Difference" HN 53 0.426 -0.081 0.422 19043 49 1 9 "Average Difference" N 53 1.900 0.100 1.915 19043 50 1 9 "Average Difference" HA 54 0.234 0.055 0.230 19043 51 1 9 "Average Difference" C 53 0.931 0.027 0.940 19043 52 1 9 "Average Difference" CA 56 0.870 -0.238 0.845 19043 53 1 9 "Average Difference" CB 56 0.946 -0.050 0.954 19043 54 1 9 "Average Difference" HN 53 0.462 -0.155 0.439 19043 55 1 10 "Average Difference" N 53 2.042 0.079 2.060 19043 56 1 10 "Average Difference" HA 54 0.238 0.044 0.236 19043 57 1 10 "Average Difference" C 53 0.937 -0.021 0.946 19043 58 1 10 "Average Difference" CA 56 0.792 -0.174 0.779 19043 59 1 10 "Average Difference" CB 56 0.928 -0.055 0.935 19043 60 1 10 "Average Difference" HN 53 0.459 -0.118 0.447 19043 61 1 11 "Average Difference" N 53 1.819 0.100 1.834 19043 62 1 11 "Average Difference" HA 54 0.219 0.065 0.211 19043 63 1 11 "Average Difference" C 53 0.925 -0.022 0.934 19043 64 1 11 "Average Difference" CA 56 0.882 -0.191 0.869 19043 65 1 11 "Average Difference" CB 56 0.872 -0.044 0.879 19043 66 1 11 "Average Difference" HN 53 0.465 -0.109 0.456 19043 67 1 12 "Average Difference" N 53 1.724 0.260 1.720 19043 68 1 12 "Average Difference" HA 54 0.223 0.067 0.214 19043 69 1 12 "Average Difference" C 53 0.984 -0.097 0.988 19043 70 1 12 "Average Difference" CA 56 0.914 -0.310 0.868 19043 71 1 12 "Average Difference" CB 56 0.735 0.094 0.735 19043 72 1 12 "Average Difference" HN 53 0.496 -0.141 0.480 19043 73 1 13 "Average Difference" N 53 1.948 0.113 1.963 19043 74 1 13 "Average Difference" HA 54 0.229 0.072 0.219 19043 75 1 13 "Average Difference" C 53 0.996 -0.059 1.004 19043 76 1 13 "Average Difference" CA 56 0.922 -0.238 0.898 19043 77 1 13 "Average Difference" CB 56 0.888 0.064 0.893 19043 78 1 13 "Average Difference" HN 53 0.462 -0.084 0.459 19043 79 1 14 "Average Difference" N 53 2.072 -0.001 2.091 19043 80 1 14 "Average Difference" HA 54 0.232 0.059 0.226 19043 81 1 14 "Average Difference" C 53 0.914 -0.015 0.923 19043 82 1 14 "Average Difference" CA 56 0.843 -0.148 0.838 19043 83 1 14 "Average Difference" CB 56 0.944 -0.007 0.952 19043 84 1 14 "Average Difference" HN 53 0.477 -0.159 0.454 19043 85 1 15 "Average Difference" N 53 2.035 0.061 2.053 19043 86 1 15 "Average Difference" HA 54 0.244 0.068 0.236 19043 87 1 15 "Average Difference" C 53 0.981 0.023 0.990 19043 88 1 15 "Average Difference" CA 56 0.914 -0.178 0.904 19043 89 1 15 "Average Difference" CB 56 0.922 -0.009 0.931 19043 90 1 15 "Average Difference" HN 53 0.478 -0.116 0.469 19043 91 1 16 "Average Difference" N 53 2.076 0.047 2.095 19043 92 1 16 "Average Difference" HA 54 0.237 0.063 0.231 19043 93 1 16 "Average Difference" C 53 0.926 0.062 0.932 19043 94 1 16 "Average Difference" CA 56 0.856 -0.162 0.848 19043 95 1 16 "Average Difference" CB 56 0.945 -0.037 0.952 19043 96 1 16 "Average Difference" HN 53 0.470 -0.123 0.458 19043 97 1 17 "Average Difference" N 53 2.000 -0.162 2.012 19043 98 1 17 "Average Difference" HA 54 0.250 0.058 0.245 19043 99 1 17 "Average Difference" C 53 0.921 -0.055 0.928 19043 100 1 17 "Average Difference" CA 56 0.911 -0.225 0.891 19043 101 1 17 "Average Difference" CB 56 1.015 0.036 1.023 19043 102 1 17 "Average Difference" HN 53 0.484 -0.123 0.473 19043 103 1 18 "Average Difference" N 53 1.834 0.199 1.841 19043 104 1 18 "Average Difference" HA 54 0.222 0.081 0.209 19043 105 1 18 "Average Difference" C 53 0.901 0.005 0.910 19043 106 1 18 "Average Difference" CA 56 0.865 -0.171 0.856 19043 107 1 18 "Average Difference" CB 56 0.776 0.033 0.782 19043 108 1 18 "Average Difference" HN 53 0.449 -0.129 0.434 19043 109 1 19 "Average Difference" N 53 1.995 -0.019 2.014 19043 110 1 19 "Average Difference" HA 54 0.239 0.056 0.235 19043 111 1 19 "Average Difference" C 53 0.956 -0.009 0.965 19043 112 1 19 "Average Difference" CA 56 0.896 -0.214 0.878 19043 113 1 19 "Average Difference" CB 56 0.916 -0.017 0.924 19043 114 1 19 "Average Difference" HN 53 0.488 -0.105 0.481 19043 115 1 20 "Average Difference" N 53 1.791 0.170 1.800 19043 116 1 20 "Average Difference" HA 54 0.220 0.059 0.214 19043 117 1 20 "Average Difference" C 53 0.954 -0.044 0.962 19043 118 1 20 "Average Difference" CA 56 0.839 -0.195 0.824 19043 119 1 20 "Average Difference" CB 56 0.946 0.033 0.954 19043 120 1 20 "Average Difference" HN 53 0.477 -0.128 0.464 19043 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 19043 _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 ASP N N 2 125.357 125.357 122.753 2.605 19043 2 1 . 1 1 2 2 ASP C C 2 175.535 175.535 175.403 0.132 19043 3 1 . 1 1 2 2 ASP CA C 2 54.307 54.307 54.224 0.083 19043 4 1 . 1 1 2 2 ASP CB C 2 41.470 41.470 41.374 0.095 19043 5 1 . 1 1 2 2 ASP H H 2 8.762 8.762 8.317 0.445 19043 6 1 . 1 1 3 3 ASN N N 3 120.441 120.441 117.988 2.453 19043 7 1 . 1 1 3 3 ASN HA H 3 4.700 4.700 4.325 0.375 19043 8 1 . 1 1 3 3 ASN C C 3 175.246 175.246 175.054 0.192 19043 9 1 . 1 1 3 3 ASN CA C 3 53.289 53.289 53.559 -0.269 19043 10 1 . 1 1 3 3 ASN CB C 3 39.086 39.086 38.559 0.527 19043 11 1 . 1 1 3 3 ASN H H 3 8.548 8.548 8.204 0.344 19043 12 1 . 1 1 4 4 LYS N N 4 121.461 121.461 118.537 2.924 19043 13 1 . 1 1 4 4 LYS HA H 4 4.215 4.215 4.121 0.094 19043 14 1 . 1 1 4 4 LYS C C 4 176.404 176.404 176.154 0.250 19043 15 1 . 1 1 4 4 LYS CA C 4 56.853 56.853 56.598 0.255 19043 16 1 . 1 1 4 4 LYS CB C 4 32.780 32.780 32.227 0.552 19043 17 1 . 1 1 4 4 LYS H H 4 8.337 8.337 8.017 0.320 19043 18 1 . 1 1 5 5 PHE N N 5 119.538 119.538 116.154 3.384 19043 19 1 . 1 1 5 5 PHE C C 5 175.433 175.433 175.056 0.377 19043 20 1 . 1 1 5 5 PHE CA C 5 57.792 57.792 57.785 0.007 19043 21 1 . 1 1 5 5 PHE CB C 5 40.067 40.067 36.265 3.802 19043 22 1 . 1 1 5 5 PHE H H 5 8.277 8.277 7.557 0.721 19043 23 1 . 1 1 6 6 ASN N N 6 121.168 121.168 120.303 0.865 19043 24 1 . 1 1 6 6 ASN HA H 6 4.817 4.817 4.650 0.167 19043 25 1 . 1 1 6 6 ASN C C 6 175.884 175.884 176.391 -0.507 19043 26 1 . 1 1 6 6 ASN CA C 6 52.785 52.785 53.401 -0.616 19043 27 1 . 1 1 6 6 ASN CB C 6 39.371 39.371 39.328 0.043 19043 28 1 . 1 1 6 6 ASN H H 6 8.443 8.443 8.083 0.360 19043 29 1 . 1 1 7 7 LYS N N 7 121.688 121.688 120.995 0.693 19043 30 1 . 1 1 7 7 LYS HA H 7 3.945 3.945 4.117 -0.172 19043 31 1 . 1 1 7 7 LYS C C 7 178.196 178.196 178.416 -0.220 19043 32 1 . 1 1 7 7 LYS CA C 7 58.901 58.901 59.319 -0.418 19043 33 1 . 1 1 7 7 LYS CB C 7 32.125 32.125 32.277 -0.153 19043 34 1 . 1 1 7 7 LYS H H 7 8.460 8.460 8.609 -0.149 19043 35 1 . 1 1 8 8 GLU N N 8 119.926 119.926 118.450 1.476 19043 36 1 . 1 1 8 8 GLU HA H 8 4.081 4.081 4.029 0.052 19043 37 1 . 1 1 8 8 GLU C C 8 179.894 179.894 178.981 0.913 19043 38 1 . 1 1 8 8 GLU CA C 8 59.839 59.839 59.794 0.045 19043 39 1 . 1 1 8 8 GLU CB C 8 28.941 28.941 29.011 -0.070 19043 40 1 . 1 1 8 8 GLU H H 8 8.386 8.386 8.806 -0.420 19043 41 1 . 1 1 9 9 GLN N N 9 121.401 121.401 117.819 3.582 19043 42 1 . 1 1 9 9 GLN HA H 9 4.097 4.097 4.122 -0.025 19043 43 1 . 1 1 9 9 GLN C C 9 177.324 177.324 178.244 -0.920 19043 44 1 . 1 1 9 9 GLN CA C 9 59.383 59.383 58.990 0.393 19043 45 1 . 1 1 9 9 GLN CB C 9 28.869 28.869 28.523 0.346 19043 46 1 . 1 1 9 9 GLN H H 9 8.307 8.307 8.557 -0.250 19043 47 1 . 1 1 10 10 GLN N N 10 120.060 120.060 119.944 0.116 19043 48 1 . 1 1 10 10 GLN HA H 10 3.222 3.222 4.047 -0.825 19043 49 1 . 1 1 10 10 GLN C C 10 176.888 176.888 178.291 -1.403 19043 50 1 . 1 1 10 10 GLN CA C 10 58.949 58.949 58.999 -0.050 19043 51 1 . 1 1 10 10 GLN CB C 10 28.841 28.841 28.675 0.166 19043 52 1 . 1 1 10 10 GLN H H 10 8.040 8.040 7.837 0.203 19043 53 1 . 1 1 11 11 ASN N N 11 116.214 116.214 118.894 -2.680 19043 54 1 . 1 1 11 11 ASN HA H 11 4.350 4.350 4.587 -0.236 19043 55 1 . 1 1 11 11 ASN C C 11 177.828 177.828 177.519 0.308 19043 56 1 . 1 1 11 11 ASN CA C 11 56.257 56.257 56.140 0.117 19043 57 1 . 1 1 11 11 ASN CB C 11 38.210 38.210 38.018 0.192 19043 58 1 . 1 1 11 11 ASN H H 11 8.366 8.366 8.478 -0.112 19043 59 1 . 1 1 12 12 ALA N N 12 121.429 121.429 122.913 -1.484 19043 60 1 . 1 1 12 12 ALA HA H 12 4.009 4.009 4.049 -0.040 19043 61 1 . 1 1 12 12 ALA C C 12 177.850 177.850 179.224 -1.374 19043 62 1 . 1 1 12 12 ALA CA C 12 55.293 55.293 54.952 0.341 19043 63 1 . 1 1 12 12 ALA CB C 12 18.321 18.321 18.413 -0.092 19043 64 1 . 1 1 12 12 ALA H H 12 7.915 7.915 8.076 -0.161 19043 65 1 . 1 1 13 13 PHE N N 13 118.052 118.052 119.939 -1.887 19043 66 1 . 1 1 13 13 PHE HA H 13 3.573 3.573 3.978 -0.405 19043 67 1 . 1 1 13 13 PHE C C 13 175.832 175.832 177.174 -1.342 19043 68 1 . 1 1 13 13 PHE CA C 13 61.855 61.855 61.940 -0.085 19043 69 1 . 1 1 13 13 PHE CB C 13 38.917 38.917 38.961 -0.043 19043 70 1 . 1 1 13 13 PHE H H 13 8.097 8.097 7.504 0.593 19043 71 1 . 1 1 14 14 TYR N N 14 116.000 116.000 117.542 -1.542 19043 72 1 . 1 1 14 14 TYR HA H 14 3.985 3.985 3.987 -0.002 19043 73 1 . 1 1 14 14 TYR C C 14 178.860 178.860 178.288 0.572 19043 74 1 . 1 1 14 14 TYR CA C 14 59.795 59.795 61.529 -1.734 19043 75 1 . 1 1 14 14 TYR CB C 14 36.980 36.980 37.704 -0.724 19043 76 1 . 1 1 14 14 TYR H H 14 8.040 8.040 7.781 0.260 19043 77 1 . 1 1 15 15 GLU N N 15 118.737 118.737 118.558 0.179 19043 78 1 . 1 1 15 15 GLU HA H 15 3.971 3.971 3.832 0.139 19043 79 1 . 1 1 15 15 GLU C C 15 180.184 180.184 179.100 1.084 19043 80 1 . 1 1 15 15 GLU CA C 15 60.607 60.607 59.120 1.487 19043 81 1 . 1 1 15 15 GLU CB C 15 29.722 29.722 29.141 0.581 19043 82 1 . 1 1 15 15 GLU H H 15 8.244 8.244 8.330 -0.086 19043 83 1 . 1 1 16 16 ILE N N 16 119.695 119.695 118.437 1.258 19043 84 1 . 1 1 16 16 ILE HA H 16 3.353 3.353 3.739 -0.386 19043 85 1 . 1 1 16 16 ILE C C 16 177.760 177.760 177.469 0.291 19043 86 1 . 1 1 16 16 ILE CA C 16 65.654 65.654 64.166 1.488 19043 87 1 . 1 1 16 16 ILE CB C 16 37.403 37.403 37.976 -0.573 19043 88 1 . 1 1 16 16 ILE H H 16 8.336 8.336 7.494 0.842 19043 89 1 . 1 1 17 17 LEU N N 17 117.709 117.709 119.327 -1.618 19043 90 1 . 1 1 17 17 LEU HA H 17 3.553 3.553 3.933 -0.380 19043 91 1 . 1 1 17 17 LEU C C 17 176.565 176.565 178.061 -1.496 19043 92 1 . 1 1 17 17 LEU CA C 17 57.559 57.559 57.171 0.388 19043 93 1 . 1 1 17 17 LEU CB C 17 41.838 41.838 41.625 0.213 19043 94 1 . 1 1 17 17 LEU H H 17 7.738 7.738 7.447 0.291 19043 95 1 . 1 1 18 18 HIS N N 18 110.934 110.934 115.811 -4.877 19043 96 1 . 1 1 18 18 HIS HA H 18 4.497 4.497 4.327 0.170 19043 97 1 . 1 1 18 18 HIS C C 18 175.243 175.243 175.905 -0.662 19043 98 1 . 1 1 18 18 HIS CA C 18 56.056 56.056 57.171 -1.114 19043 99 1 . 1 1 18 18 HIS CB C 18 30.648 30.648 30.122 0.526 19043 100 1 . 1 1 18 18 HIS H H 18 7.150 7.150 7.990 -0.840 19043 101 1 . 1 1 19 19 LEU N N 19 123.586 123.586 122.038 1.548 19043 102 1 . 1 1 19 19 LEU HA H 19 4.418 4.418 4.270 0.148 19043 103 1 . 1 1 19 19 LEU CA C 19 53.476 53.476 53.898 -0.422 19043 104 1 . 1 1 19 19 LEU CB C 19 40.322 40.322 41.487 -1.165 19043 105 1 . 1 1 19 19 LEU H H 19 7.249 7.249 7.592 -0.343 19043 106 1 . 1 1 20 20 PRO HA H 20 4.431 4.431 4.443 -0.012 19043 107 1 . 1 1 20 20 PRO C C 20 178.092 178.092 177.588 0.504 19043 108 1 . 1 1 20 20 PRO CA C 20 64.897 64.897 64.642 0.255 19043 109 1 . 1 1 20 20 PRO CB C 20 32.572 32.572 32.286 0.286 19043 110 1 . 1 1 21 21 ASN N N 21 113.952 113.952 116.632 -2.680 19043 111 1 . 1 1 21 21 ASN HA H 21 5.009 5.009 4.514 0.495 19043 112 1 . 1 1 21 21 ASN C C 21 176.397 176.397 175.745 0.652 19043 113 1 . 1 1 21 21 ASN CA C 21 52.629 52.629 54.066 -1.437 19043 114 1 . 1 1 21 21 ASN CB C 21 38.810 38.810 38.393 0.417 19043 115 1 . 1 1 21 21 ASN H H 21 8.871 8.871 8.146 0.725 19043 116 1 . 1 1 22 22 LEU N N 22 117.526 117.526 121.941 -4.415 19043 117 1 . 1 1 22 22 LEU HA H 22 4.401 4.401 4.327 0.074 19043 118 1 . 1 1 22 22 LEU C C 22 176.879 176.879 175.347 1.532 19043 119 1 . 1 1 22 22 LEU CA C 22 54.457 54.457 55.008 -0.551 19043 120 1 . 1 1 22 22 LEU CB C 22 42.520 42.520 43.167 -0.647 19043 121 1 . 1 1 22 22 LEU H H 22 6.563 6.563 8.105 -1.542 19043 122 1 . 1 1 23 23 ASN N N 23 120.219 120.219 122.501 -2.282 19043 123 1 . 1 1 23 23 ASN HA H 23 4.868 4.868 4.759 0.109 19043 124 1 . 1 1 23 23 ASN C C 23 175.507 175.507 176.290 -0.783 19043 125 1 . 1 1 23 23 ASN CA C 23 51.416 51.416 51.992 -0.576 19043 126 1 . 1 1 23 23 ASN CB C 23 38.712 38.712 39.508 -0.796 19043 127 1 . 1 1 23 23 ASN H H 23 8.612 8.612 8.181 0.431 19043 128 1 . 1 1 24 24 GLU N N 24 118.801 118.801 119.771 -0.970 19043 129 1 . 1 1 24 24 GLU HA H 24 3.874 3.874 4.002 -0.128 19043 130 1 . 1 1 24 24 GLU C C 24 177.799 177.799 178.380 -0.581 19043 131 1 . 1 1 24 24 GLU CA C 24 60.191 60.191 60.127 0.064 19043 132 1 . 1 1 24 24 GLU CB C 24 29.365 29.365 29.220 0.145 19043 133 1 . 1 1 24 24 GLU H H 24 8.735 8.735 8.934 -0.199 19043 134 1 . 1 1 25 25 GLU N N 25 119.198 119.198 119.344 -0.146 19043 135 1 . 1 1 25 25 GLU HA H 25 3.978 3.978 4.044 -0.066 19043 136 1 . 1 1 25 25 GLU C C 25 180.078 180.078 179.181 0.897 19043 137 1 . 1 1 25 25 GLU CA C 25 59.891 59.891 59.433 0.458 19043 138 1 . 1 1 25 25 GLU CB C 25 29.131 29.131 28.950 0.181 19043 139 1 . 1 1 25 25 GLU H H 25 8.229 8.229 8.724 -0.495 19043 140 1 . 1 1 26 26 GLN N N 26 119.646 119.646 118.356 1.290 19043 141 1 . 1 1 26 26 GLN HA H 26 3.940 3.940 4.079 -0.139 19043 142 1 . 1 1 26 26 GLN C C 26 178.154 178.154 178.380 -0.226 19043 143 1 . 1 1 26 26 GLN CA C 26 57.893 57.893 58.410 -0.517 19043 144 1 . 1 1 26 26 GLN CB C 26 28.902 28.902 28.709 0.193 19043 145 1 . 1 1 26 26 GLN H H 26 8.425 8.425 8.256 0.169 19043 146 1 . 1 1 27 27 ARG N N 27 119.454 119.454 120.464 -1.010 19043 147 1 . 1 1 27 27 ARG HA H 27 3.786 3.786 4.159 -0.373 19043 148 1 . 1 1 27 27 ARG C C 27 177.863 177.863 178.376 -0.513 19043 149 1 . 1 1 27 27 ARG CA C 27 60.630 60.630 59.886 0.743 19043 150 1 . 1 1 27 27 ARG CB C 27 29.644 29.644 30.119 -0.475 19043 151 1 . 1 1 27 27 ARG H H 27 8.548 8.548 8.306 0.242 19043 152 1 . 1 1 28 28 ASN N N 28 116.833 116.833 117.674 -0.841 19043 153 1 . 1 1 28 28 ASN HA H 28 4.332 4.332 4.490 -0.158 19043 154 1 . 1 1 28 28 ASN C C 28 177.234 177.234 177.297 -0.063 19043 155 1 . 1 1 28 28 ASN CA C 28 56.038 56.038 56.014 0.024 19043 156 1 . 1 1 28 28 ASN CB C 28 37.685 37.685 38.346 -0.661 19043 157 1 . 1 1 28 28 ASN H H 28 8.569 8.569 8.500 0.069 19043 158 1 . 1 1 29 29 ALA N N 29 122.687 122.687 123.017 -0.330 19043 159 1 . 1 1 29 29 ALA HA H 29 4.054 4.054 4.048 0.006 19043 160 1 . 1 1 29 29 ALA C C 29 181.045 181.045 179.414 1.631 19043 161 1 . 1 1 29 29 ALA CA C 29 55.250 55.250 54.677 0.573 19043 162 1 . 1 1 29 29 ALA CB C 29 17.820 17.820 18.200 -0.380 19043 163 1 . 1 1 29 29 ALA H H 29 7.793 7.793 7.475 0.318 19043 164 1 . 1 1 30 30 PHE N N 30 116.979 116.979 118.044 -1.065 19043 165 1 . 1 1 30 30 PHE HA H 30 4.378 4.378 4.244 0.134 19043 166 1 . 1 1 30 30 PHE C C 30 177.887 177.887 177.932 -0.045 19043 167 1 . 1 1 30 30 PHE CA C 30 62.619 62.619 61.602 1.017 19043 168 1 . 1 1 30 30 PHE CB C 30 39.459 39.459 38.838 0.621 19043 169 1 . 1 1 30 30 PHE H H 30 8.017 8.017 7.548 0.469 19043 170 1 . 1 1 31 31 ILE N N 31 119.553 119.553 119.244 0.309 19043 171 1 . 1 1 31 31 ILE HA H 31 3.778 3.778 3.628 0.150 19043 172 1 . 1 1 31 31 ILE C C 31 177.084 177.084 178.077 -0.993 19043 173 1 . 1 1 31 31 ILE CA C 31 65.645 65.645 65.299 0.346 19043 174 1 . 1 1 31 31 ILE CB C 31 37.115 37.115 37.578 -0.463 19043 175 1 . 1 1 31 31 ILE H H 31 8.372 8.372 8.444 -0.072 19043 176 1 . 1 1 32 32 GLN N N 32 119.108 119.108 119.636 -0.528 19043 177 1 . 1 1 32 32 GLN HA H 32 3.806 3.806 3.975 -0.169 19043 178 1 . 1 1 32 32 GLN C C 32 177.836 177.836 178.492 -0.656 19043 179 1 . 1 1 32 32 GLN CA C 32 58.768 58.768 59.563 -0.795 19043 180 1 . 1 1 32 32 GLN CB C 32 27.978 27.978 28.722 -0.744 19043 181 1 . 1 1 32 32 GLN H H 32 8.389 8.389 8.190 0.199 19043 182 1 . 1 1 33 33 SER N N 33 114.437 114.437 115.157 -0.720 19043 183 1 . 1 1 33 33 SER HA H 33 4.212 4.212 4.278 -0.066 19043 184 1 . 1 1 33 33 SER C C 33 175.469 175.469 176.780 -1.311 19043 185 1 . 1 1 33 33 SER CA C 33 62.403 62.403 61.088 1.315 19043 186 1 . 1 1 33 33 SER CB C 33 63.794 63.794 62.990 0.804 19043 187 1 . 1 1 33 33 SER H H 33 8.078 8.078 7.802 0.276 19043 188 1 . 1 1 34 34 LEU N N 34 122.967 122.967 123.488 -0.521 19043 189 1 . 1 1 34 34 LEU HA H 34 3.910 3.910 4.205 -0.295 19043 190 1 . 1 1 34 34 LEU C C 34 177.506 177.506 178.173 -0.667 19043 191 1 . 1 1 34 34 LEU CA C 34 57.428 57.428 57.412 0.016 19043 192 1 . 1 1 34 34 LEU CB C 34 42.812 42.812 42.040 0.772 19043 193 1 . 1 1 34 34 LEU H H 34 8.495 8.495 8.196 0.299 19043 194 1 . 1 1 35 35 LYS N N 35 115.859 115.859 118.810 -2.951 19043 195 1 . 1 1 35 35 LYS HA H 35 3.813 3.813 4.173 -0.360 19043 196 1 . 1 1 35 35 LYS C C 35 177.628 177.628 178.089 -0.460 19043 197 1 . 1 1 35 35 LYS CA C 35 56.877 56.877 58.668 -1.791 19043 198 1 . 1 1 35 35 LYS CB C 35 32.019 32.019 32.163 -0.144 19043 199 1 . 1 1 35 35 LYS H H 35 7.815 7.815 7.702 0.113 19043 200 1 . 1 1 36 36 ASP N N 36 116.741 116.741 117.226 -0.485 19043 201 1 . 1 1 36 36 ASP HA H 36 4.514 4.514 4.601 -0.087 19043 202 1 . 1 1 36 36 ASP C C 36 177.324 177.324 176.299 1.025 19043 203 1 . 1 1 36 36 ASP CA C 36 56.686 56.686 55.957 0.729 19043 204 1 . 1 1 36 36 ASP CB C 36 40.671 40.671 41.936 -1.265 19043 205 1 . 1 1 36 36 ASP H H 36 7.943 7.943 7.799 0.144 19043 206 1 . 1 1 37 37 ASP N N 37 116.686 116.686 118.293 -1.607 19043 207 1 . 1 1 37 37 ASP HA H 37 5.041 5.041 5.058 -0.017 19043 208 1 . 1 1 37 37 ASP CA C 37 51.946 51.946 52.016 -0.070 19043 209 1 . 1 1 37 37 ASP CB C 37 40.523 40.523 41.992 -1.469 19043 210 1 . 1 1 37 37 ASP H H 37 8.125 8.125 7.914 0.211 19043 211 1 . 1 1 38 38 PRO HA H 38 4.583 4.583 4.521 0.062 19043 212 1 . 1 1 38 38 PRO C C 38 179.200 179.200 178.226 0.974 19043 213 1 . 1 1 38 38 PRO CA C 38 64.537 64.537 64.522 0.015 19043 214 1 . 1 1 38 38 PRO CB C 38 31.886 31.886 32.062 -0.176 19043 215 1 . 1 1 39 39 SER N N 39 114.963 114.963 113.734 1.229 19043 216 1 . 1 1 39 39 SER HA H 39 4.178 4.178 4.263 -0.085 19043 217 1 . 1 1 39 39 SER C C 39 176.151 176.151 175.974 0.177 19043 218 1 . 1 1 39 39 SER CA C 39 61.197 61.197 60.850 0.347 19043 219 1 . 1 1 39 39 SER CB C 39 62.729 62.729 62.343 0.386 19043 220 1 . 1 1 39 39 SER H H 39 8.315 8.315 8.430 -0.115 19043 221 1 . 1 1 40 40 GLN N N 40 120.058 120.058 119.917 0.141 19043 222 1 . 1 1 40 40 GLN HA H 40 4.660 4.660 4.501 0.159 19043 223 1 . 1 1 40 40 GLN C C 40 176.192 176.192 177.195 -1.003 19043 224 1 . 1 1 40 40 GLN CA C 40 54.981 54.981 55.441 -0.461 19043 225 1 . 1 1 40 40 GLN CB C 40 28.168 28.168 28.039 0.129 19043 226 1 . 1 1 40 40 GLN H H 40 7.820 7.820 7.867 -0.047 19043 227 1 . 1 1 41 41 SER N N 41 115.553 115.553 116.783 -1.230 19043 228 1 . 1 1 41 41 SER HA H 41 3.845 3.845 4.087 -0.242 19043 229 1 . 1 1 41 41 SER C C 41 174.181 174.181 175.465 -1.284 19043 230 1 . 1 1 41 41 SER CA C 41 63.957 63.957 61.555 2.402 19043 231 1 . 1 1 41 41 SER CB C 41 63.191 63.191 62.609 0.582 19043 232 1 . 1 1 41 41 SER H H 41 7.666 7.666 7.793 -0.127 19043 233 1 . 1 1 42 42 ALA N N 42 122.360 122.360 122.210 0.150 19043 234 1 . 1 1 42 42 ALA HA H 42 4.123 4.123 4.204 -0.081 19043 235 1 . 1 1 42 42 ALA C C 42 180.996 180.996 178.843 2.153 19043 236 1 . 1 1 42 42 ALA CA C 42 55.563 55.563 54.066 1.497 19043 237 1 . 1 1 42 42 ALA CB C 42 18.056 18.056 19.062 -1.006 19043 238 1 . 1 1 42 42 ALA H H 42 8.556 8.556 8.014 0.542 19043 239 1 . 1 1 43 43 ASN N N 43 118.974 118.974 118.838 0.136 19043 240 1 . 1 1 43 43 ASN HA H 43 4.519 4.519 4.545 -0.026 19043 241 1 . 1 1 43 43 ASN C C 43 177.972 177.972 177.744 0.228 19043 242 1 . 1 1 43 43 ASN CA C 43 55.854 55.854 56.288 -0.434 19043 243 1 . 1 1 43 43 ASN CB C 43 38.149 38.149 38.385 -0.236 19043 244 1 . 1 1 43 43 ASN H H 43 7.950 7.950 7.668 0.282 19043 245 1 . 1 1 44 44 LEU N N 44 122.070 122.070 120.567 1.503 19043 246 1 . 1 1 44 44 LEU HA H 44 4.189 4.189 4.320 -0.131 19043 247 1 . 1 1 44 44 LEU C C 44 178.332 178.332 179.246 -0.914 19043 248 1 . 1 1 44 44 LEU CA C 44 57.834 57.834 58.011 -0.177 19043 249 1 . 1 1 44 44 LEU CB C 44 42.351 42.351 41.809 0.542 19043 250 1 . 1 1 44 44 LEU H H 44 8.789 8.789 8.578 0.211 19043 251 1 . 1 1 45 45 LEU N N 45 118.621 118.621 119.368 -0.747 19043 252 1 . 1 1 45 45 LEU HA H 45 3.805 3.805 3.745 0.060 19043 253 1 . 1 1 45 45 LEU C C 45 177.832 177.832 178.487 -0.655 19043 254 1 . 1 1 45 45 LEU CA C 45 57.885 57.885 57.689 0.196 19043 255 1 . 1 1 45 45 LEU CB C 45 41.806 41.806 41.584 0.222 19043 256 1 . 1 1 45 45 LEU H H 45 8.283 8.283 7.547 0.736 19043 257 1 . 1 1 46 46 ALA N N 46 119.525 119.525 120.661 -1.136 19043 258 1 . 1 1 46 46 ALA HA H 46 4.010 4.010 3.894 0.116 19043 259 1 . 1 1 46 46 ALA C C 46 181.250 181.250 179.966 1.284 19043 260 1 . 1 1 46 46 ALA CA C 46 55.296 55.296 55.152 0.144 19043 261 1 . 1 1 46 46 ALA CB C 46 17.951 17.951 18.046 -0.095 19043 262 1 . 1 1 46 46 ALA H H 46 7.640 7.640 7.759 -0.119 19043 263 1 . 1 1 47 47 GLU N N 47 119.572 119.572 118.172 1.400 19043 264 1 . 1 1 47 47 GLU HA H 47 4.030 4.030 4.116 -0.087 19043 265 1 . 1 1 47 47 GLU C C 47 178.895 178.895 178.868 0.028 19043 266 1 . 1 1 47 47 GLU CA C 47 59.166 59.166 58.914 0.252 19043 267 1 . 1 1 47 47 GLU CB C 47 29.538 29.538 29.786 -0.248 19043 268 1 . 1 1 47 47 GLU H H 47 8.139 8.139 8.393 -0.254 19043 269 1 . 1 1 48 48 ALA N N 48 123.953 123.953 122.505 1.448 19043 270 1 . 1 1 48 48 ALA HA H 48 3.527 3.527 3.633 -0.106 19043 271 1 . 1 1 48 48 ALA C C 48 179.636 179.636 179.213 0.423 19043 272 1 . 1 1 48 48 ALA CA C 48 55.516 55.516 54.457 1.060 19043 273 1 . 1 1 48 48 ALA CB C 48 17.245 17.245 17.680 -0.435 19043 274 1 . 1 1 48 48 ALA H H 48 8.468 8.468 7.718 0.750 19043 275 1 . 1 1 49 49 LYS N N 49 117.926 117.926 118.143 -0.217 19043 276 1 . 1 1 49 49 LYS HA H 49 3.739 3.739 3.917 -0.178 19043 277 1 . 1 1 49 49 LYS C C 49 178.761 178.761 178.711 0.050 19043 278 1 . 1 1 49 49 LYS CA C 49 60.392 60.392 59.579 0.813 19043 279 1 . 1 1 49 49 LYS CB C 49 32.089 32.089 32.327 -0.238 19043 280 1 . 1 1 49 49 LYS H H 49 8.459 8.459 8.313 0.146 19043 281 1 . 1 1 50 50 LYS N N 50 120.194 120.194 119.574 0.620 19043 282 1 . 1 1 50 50 LYS HA H 50 4.088 4.088 4.072 0.016 19043 283 1 . 1 1 50 50 LYS C C 50 179.859 179.859 178.672 1.187 19043 284 1 . 1 1 50 50 LYS CA C 50 59.735 59.735 59.078 0.657 19043 285 1 . 1 1 50 50 LYS CB C 50 32.462 32.462 32.523 -0.061 19043 286 1 . 1 1 50 50 LYS H H 50 7.702 7.702 7.729 -0.027 19043 287 1 . 1 1 51 51 LEU N N 51 122.126 122.126 119.468 2.658 19043 288 1 . 1 1 51 51 LEU HA H 51 4.127 4.127 4.214 -0.087 19043 289 1 . 1 1 51 51 LEU C C 51 178.123 178.123 178.053 0.070 19043 290 1 . 1 1 51 51 LEU CA C 51 57.597 57.597 56.820 0.777 19043 291 1 . 1 1 51 51 LEU CB C 51 42.352 42.352 42.143 0.209 19043 292 1 . 1 1 51 51 LEU H H 51 8.023 8.023 7.576 0.448 19043 293 1 . 1 1 52 52 ASN N N 52 116.675 116.675 117.031 -0.356 19043 294 1 . 1 1 52 52 ASN HA H 52 3.935 3.935 4.396 -0.461 19043 295 1 . 1 1 52 52 ASN C C 52 177.668 177.668 176.358 1.310 19043 296 1 . 1 1 52 52 ASN CA C 52 57.917 57.917 56.211 1.706 19043 297 1 . 1 1 52 52 ASN CB C 52 41.936 41.936 38.644 3.292 19043 298 1 . 1 1 52 52 ASN H H 52 8.537 8.537 8.242 0.295 19043 299 1 . 1 1 53 53 ASP N N 53 118.725 118.725 117.664 1.061 19043 300 1 . 1 1 53 53 ASP HA H 53 4.444 4.444 4.564 -0.120 19043 301 1 . 1 1 53 53 ASP C C 53 178.936 178.936 177.005 1.931 19043 302 1 . 1 1 53 53 ASP CA C 53 56.933 56.933 55.379 1.554 19043 303 1 . 1 1 53 53 ASP CB C 53 40.095 40.095 41.288 -1.193 19043 304 1 . 1 1 53 53 ASP H H 53 8.220 8.220 7.762 0.458 19043 305 1 . 1 1 54 54 ALA N N 54 122.872 122.872 121.691 1.181 19043 306 1 . 1 1 54 54 ALA HA H 54 4.232 4.232 4.168 0.064 19043 307 1 . 1 1 54 54 ALA C C 54 179.354 179.354 178.965 0.389 19043 308 1 . 1 1 54 54 ALA CA C 54 54.341 54.341 54.126 0.215 19043 309 1 . 1 1 54 54 ALA CB C 54 18.605 18.605 19.226 -0.621 19043 310 1 . 1 1 54 54 ALA H H 54 8.037 8.037 7.340 0.697 19043 311 1 . 1 1 55 55 GLN N N 55 115.052 115.052 116.359 -1.307 19043 312 1 . 1 1 55 55 GLN HA H 55 4.378 4.378 4.343 0.035 19043 313 1 . 1 1 55 55 GLN C C 55 174.116 174.116 175.227 -1.111 19043 314 1 . 1 1 55 55 GLN CA C 55 54.954 54.954 55.092 -0.138 19043 315 1 . 1 1 55 55 GLN CB C 55 28.224 28.224 29.361 -1.137 19043 316 1 . 1 1 55 55 GLN H H 55 7.512 7.512 7.732 -0.220 19043 317 1 . 1 1 56 56 ALA N N 56 124.556 124.556 124.180 0.376 19043 318 1 . 1 1 56 56 ALA HA H 56 4.348 4.348 4.362 -0.014 19043 319 1 . 1 1 56 56 ALA CA C 56 51.037 51.037 51.029 0.008 19043 320 1 . 1 1 56 56 ALA CB C 56 17.979 17.979 18.592 -0.613 19043 321 1 . 1 1 56 56 ALA H H 56 7.100 7.100 7.521 -0.421 19043 322 1 . 1 1 57 57 PRO HA H 57 4.412 4.412 4.524 -0.112 19043 323 1 . 1 1 57 57 PRO C C 57 176.151 176.151 176.617 -0.466 19043 324 1 . 1 1 57 57 PRO CA C 57 63.283 63.283 62.395 0.888 19043 325 1 . 1 1 57 57 PRO CB C 57 31.993 31.993 32.187 -0.194 19043 stop_ save_