data_19168 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19168 _Entry.PDB_ID 2M71 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 19168 _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 5 5 VAL N N 5 123.289 123.289 122.545 0.744 19168 2 1 1 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.172 -0.153 19168 3 1 1 . 1 1 5 5 VAL C C 5 175.799 175.799 175.849 -0.050 19168 4 1 1 . 1 1 5 5 VAL CA C 5 62.120 62.120 62.824 -0.704 19168 5 1 1 . 1 1 5 5 VAL CB C 5 32.757 32.757 32.330 0.427 19168 6 1 1 . 1 1 6 6 ILE N N 6 126.794 126.794 123.019 3.775 19168 7 1 1 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.074 -0.107 19168 8 1 1 . 1 1 6 6 ILE C C 6 175.103 175.103 174.613 0.490 19168 9 1 1 . 1 1 6 6 ILE CA C 6 60.227 60.227 61.024 -0.797 19168 10 1 1 . 1 1 6 6 ILE CB C 6 38.565 38.565 37.569 0.996 19168 11 1 1 . 1 1 7 7 ASP N N 7 127.797 127.797 128.610 -0.813 19168 12 1 1 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.750 -0.206 19168 13 1 1 . 1 1 7 7 ASP C C 7 174.000 174.000 174.831 -0.831 19168 14 1 1 . 1 1 7 7 ASP CA C 7 53.591 53.591 53.590 0.001 19168 15 1 1 . 1 1 7 7 ASP CB C 7 42.152 42.152 42.536 -0.384 19168 16 1 1 . 1 1 8 8 ILE N N 8 122.764 122.764 123.861 -1.097 19168 17 1 1 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.445 -0.125 19168 18 1 1 . 1 1 8 8 ILE C C 8 176.337 176.337 175.225 1.112 19168 19 1 1 . 1 1 8 8 ILE CA C 8 60.176 60.176 59.840 0.336 19168 20 1 1 . 1 1 8 8 ILE CB C 8 39.542 39.542 40.608 -1.067 19168 21 1 1 . 1 1 9 9 LYS N N 9 127.990 127.990 126.349 1.641 19168 22 1 1 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.463 -0.141 19168 23 1 1 . 1 1 9 9 LYS C C 9 174.759 174.759 175.349 -0.590 19168 24 1 1 . 1 1 9 9 LYS CA C 9 52.315 52.315 53.734 -1.419 19168 25 1 1 . 1 1 9 9 LYS CB C 9 32.902 32.902 33.000 -0.098 19168 26 1 1 . 1 1 10 10 GLU N N 10 123.021 123.021 124.573 -1.552 19168 27 1 1 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.725 0.410 19168 28 1 1 . 1 1 10 10 GLU C C 10 176.215 176.215 175.443 0.772 19168 29 1 1 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.236 -0.334 19168 30 1 1 . 1 1 10 10 GLU CB C 10 32.037 32.037 30.015 2.022 19168 31 1 1 . 1 1 11 11 ILE N N 11 126.526 126.526 125.872 0.654 19168 32 1 1 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.100 0.235 19168 33 1 1 . 1 1 11 11 ILE C C 11 174.334 174.334 174.928 -0.594 19168 34 1 1 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.808 -0.498 19168 35 1 1 . 1 1 11 11 ILE CB C 11 39.826 39.826 39.178 0.648 19168 36 1 1 . 1 1 12 12 LYS N N 12 128.164 128.164 127.894 0.270 19168 37 1 1 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.512 -0.167 19168 38 1 1 . 1 1 12 12 LYS C C 12 176.378 176.378 175.669 0.709 19168 39 1 1 . 1 1 12 12 LYS CA C 12 55.940 55.940 55.503 0.437 19168 40 1 1 . 1 1 12 12 LYS CB C 12 34.056 34.056 34.768 -0.712 19168 41 1 1 . 1 1 13 13 LEU N N 13 121.881 121.881 124.707 -2.826 19168 42 1 1 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.844 0.110 19168 43 1 1 . 1 1 13 13 LEU C C 13 175.137 175.137 175.072 0.065 19168 44 1 1 . 1 1 13 13 LEU CA C 13 53.974 53.974 54.090 -0.117 19168 45 1 1 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.484 -0.200 19168 46 1 1 . 1 1 14 14 SER N N 14 115.759 115.759 112.779 2.980 19168 47 1 1 . 1 1 14 14 SER HA H 14 4.889 4.889 4.899 -0.010 19168 48 1 1 . 1 1 14 14 SER C C 14 173.993 173.993 174.339 -0.346 19168 49 1 1 . 1 1 14 14 SER CA C 14 56.052 56.052 56.658 -0.606 19168 50 1 1 . 1 1 14 14 SER CB C 14 64.775 64.775 66.409 -1.633 19168 51 1 1 . 1 1 15 15 VAL N N 15 120.993 120.993 120.490 0.503 19168 52 1 1 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.798 -0.064 19168 53 1 1 . 1 1 15 15 VAL C C 15 176.964 176.964 177.167 -0.203 19168 54 1 1 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.650 -0.223 19168 55 1 1 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.984 -0.199 19168 56 1 1 . 1 1 16 16 LYS N N 16 118.897 118.897 119.151 -0.254 19168 57 1 1 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.393 0.008 19168 58 1 1 . 1 1 16 16 LYS C C 16 175.489 175.489 175.300 0.189 19168 59 1 1 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.586 -0.431 19168 60 1 1 . 1 1 16 16 LYS CB C 16 30.929 30.929 31.159 -0.230 19168 61 1 1 . 1 1 17 17 ILE N N 17 122.247 122.247 121.390 0.857 19168 62 1 1 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.291 -0.106 19168 63 1 1 . 1 1 17 17 ILE C C 17 173.426 173.426 174.704 -1.278 19168 64 1 1 . 1 1 17 17 ILE CA C 17 61.276 61.276 59.958 1.318 19168 65 1 1 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.670 -1.590 19168 66 1 1 . 1 1 18 18 ALA N N 18 129.434 129.434 128.498 0.936 19168 67 1 1 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.508 -0.029 19168 68 1 1 . 1 1 18 18 ALA C C 18 179.130 179.130 177.969 1.161 19168 69 1 1 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.728 -0.291 19168 70 1 1 . 1 1 18 18 ALA CB C 18 19.909 19.909 19.946 -0.037 19168 71 1 1 . 1 1 19 19 GLN HA H 19 3.797 3.797 3.984 -0.187 19168 72 1 1 . 1 1 19 19 GLN CA C 19 59.231 59.231 58.751 0.480 19168 73 1 1 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.517 -0.342 19168 74 1 1 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.429 0.001 19168 75 1 1 . 1 1 20 20 ASN C C 20 177.272 177.272 177.376 -0.104 19168 76 1 1 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.357 -0.173 19168 77 1 1 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.883 -0.430 19168 78 1 1 . 1 1 21 21 ASP N N 21 119.132 119.132 120.161 -1.029 19168 79 1 1 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.524 0.274 19168 80 1 1 . 1 1 21 21 ASP C C 21 178.707 178.707 178.615 0.092 19168 81 1 1 . 1 1 21 21 ASP CA C 21 56.886 56.886 57.058 -0.172 19168 82 1 1 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.860 -0.195 19168 83 1 1 . 1 1 22 22 ILE N N 22 122.030 122.030 119.858 2.172 19168 84 1 1 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.625 -0.207 19168 85 1 1 . 1 1 22 22 ILE C C 22 177.454 177.454 177.878 -0.424 19168 86 1 1 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.867 0.859 19168 87 1 1 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.854 -0.288 19168 88 1 1 . 1 1 23 23 ASN N N 23 116.728 116.728 118.581 -1.853 19168 89 1 1 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.461 -0.248 19168 90 1 1 . 1 1 23 23 ASN C C 23 178.260 178.260 177.921 0.339 19168 91 1 1 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.196 0.078 19168 92 1 1 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.134 -0.926 19168 93 1 1 . 1 1 24 24 TYR N N 24 119.864 119.864 121.643 -1.779 19168 94 1 1 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.205 0.088 19168 95 1 1 . 1 1 24 24 TYR C C 24 177.719 177.719 177.399 0.320 19168 96 1 1 . 1 1 24 24 TYR CA C 24 61.048 61.048 61.996 -0.948 19168 97 1 1 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.759 -0.476 19168 98 1 1 . 1 1 25 25 LYS N N 25 119.730 119.730 119.133 0.597 19168 99 1 1 . 1 1 25 25 LYS HA H 25 4.111 4.111 3.994 0.117 19168 100 1 1 . 1 1 25 25 LYS C C 25 179.152 179.152 179.032 0.120 19168 101 1 1 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.761 -0.599 19168 102 1 1 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.872 -0.578 19168 103 1 1 . 1 1 26 26 VAL N N 26 119.387 119.387 116.486 2.901 19168 104 1 1 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.836 -0.216 19168 105 1 1 . 1 1 26 26 VAL C C 26 177.017 177.017 177.335 -0.318 19168 106 1 1 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.182 1.479 19168 107 1 1 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.188 0.362 19168 108 1 1 . 1 1 27 27 LYS N N 27 120.420 120.420 121.381 -0.961 19168 109 1 1 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.844 0.102 19168 110 1 1 . 1 1 27 27 LYS C C 27 179.458 179.458 178.641 0.817 19168 111 1 1 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.749 0.129 19168 112 1 1 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.124 -0.276 19168 113 1 1 . 1 1 28 28 HIS N N 28 118.160 118.160 118.247 -0.087 19168 114 1 1 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.539 -0.352 19168 115 1 1 . 1 1 28 28 HIS C C 28 177.085 177.085 177.666 -0.581 19168 116 1 1 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.764 -1.879 19168 117 1 1 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.727 0.029 19168 118 1 1 . 1 1 29 29 ALA N N 29 120.579 120.579 122.815 -2.236 19168 119 1 1 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.185 -0.187 19168 120 1 1 . 1 1 29 29 ALA C C 29 179.299 179.299 179.749 -0.450 19168 121 1 1 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.442 0.125 19168 122 1 1 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.374 1.075 19168 123 1 1 . 1 1 30 30 LEU N N 30 117.262 117.262 118.466 -1.204 19168 124 1 1 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.902 0.173 19168 125 1 1 . 1 1 30 30 LEU C C 30 180.017 180.017 179.287 0.730 19168 126 1 1 . 1 1 30 30 LEU CA C 30 58.232 58.232 58.110 0.122 19168 127 1 1 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.691 -0.365 19168 128 1 1 . 1 1 31 31 GLU N N 31 120.625 120.625 119.793 0.832 19168 129 1 1 . 1 1 31 31 GLU HA H 31 4.068 4.068 4.250 -0.182 19168 130 1 1 . 1 1 31 31 GLU C C 31 179.572 179.572 179.571 0.001 19168 131 1 1 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.009 0.266 19168 132 1 1 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.365 -0.390 19168 133 1 1 . 1 1 32 32 PHE N N 32 118.245 118.245 118.712 -0.467 19168 134 1 1 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.271 0.255 19168 135 1 1 . 1 1 32 32 PHE C C 32 179.123 179.123 177.703 1.420 19168 136 1 1 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.927 -3.230 19168 137 1 1 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.893 -1.641 19168 138 1 1 . 1 1 33 33 LEU N N 33 121.684 121.684 120.905 0.779 19168 139 1 1 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.270 0.321 19168 140 1 1 . 1 1 33 33 LEU C C 33 181.655 181.655 179.992 1.663 19168 141 1 1 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.494 0.678 19168 142 1 1 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.624 0.068 19168 143 1 1 . 1 1 34 34 GLU N N 34 122.046 122.046 118.655 3.391 19168 144 1 1 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.081 0.071 19168 145 1 1 . 1 1 34 34 GLU C C 34 178.237 178.237 177.872 0.365 19168 146 1 1 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.702 0.444 19168 147 1 1 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.309 -0.075 19168 148 1 1 . 1 1 35 35 GLN N N 35 115.697 115.697 115.854 -0.157 19168 149 1 1 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.347 0.040 19168 150 1 1 . 1 1 35 35 GLN C C 35 176.456 176.456 176.413 0.043 19168 151 1 1 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.674 0.012 19168 152 1 1 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.196 -0.000 19168 153 1 1 . 1 1 36 36 GLY N N 36 108.291 108.291 107.408 0.883 19168 154 1 1 . 1 1 36 36 GLY C C 36 174.673 174.673 174.353 0.320 19168 155 1 1 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.296 0.231 19168 156 1 1 . 1 1 37 37 LYS N N 37 120.464 120.464 119.057 1.407 19168 157 1 1 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.623 -0.126 19168 158 1 1 . 1 1 37 37 LYS C C 37 174.580 174.580 175.227 -0.647 19168 159 1 1 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.568 0.521 19168 160 1 1 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.920 -2.175 19168 161 1 1 . 1 1 38 38 HIS N N 38 116.878 116.878 118.064 -1.186 19168 162 1 1 . 1 1 38 38 HIS HA H 38 5.019 5.019 5.057 -0.038 19168 163 1 1 . 1 1 38 38 HIS C C 38 175.268 175.268 174.400 0.868 19168 164 1 1 . 1 1 38 38 HIS CA C 38 54.150 54.150 56.056 -1.906 19168 165 1 1 . 1 1 38 38 HIS CB C 38 32.877 32.877 32.344 0.533 19168 166 1 1 . 1 1 39 39 VAL N N 39 119.782 119.782 121.547 -1.765 19168 167 1 1 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.920 -0.124 19168 168 1 1 . 1 1 39 39 VAL C C 39 173.320 173.320 174.266 -0.946 19168 169 1 1 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.539 0.227 19168 170 1 1 . 1 1 39 39 VAL CB C 39 35.433 35.433 33.484 1.949 19168 171 1 1 . 1 1 40 40 ARG N N 40 128.358 128.358 127.389 0.969 19168 172 1 1 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.589 0.526 19168 173 1 1 . 1 1 40 40 ARG C C 40 175.659 175.659 174.822 0.837 19168 174 1 1 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.434 -0.612 19168 175 1 1 . 1 1 40 40 ARG CB C 40 33.007 33.007 31.869 1.138 19168 176 1 1 . 1 1 41 41 PHE N N 41 126.396 126.396 127.464 -1.068 19168 177 1 1 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.298 -0.120 19168 178 1 1 . 1 1 41 41 PHE C C 41 176.107 176.107 175.384 0.723 19168 179 1 1 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.521 0.175 19168 180 1 1 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.749 2.297 19168 181 1 1 . 1 1 42 42 ARG N N 42 120.641 120.641 123.914 -3.273 19168 182 1 1 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.307 0.232 19168 183 1 1 . 1 1 42 42 ARG C C 42 175.010 175.010 174.551 0.459 19168 184 1 1 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.815 -0.120 19168 185 1 1 . 1 1 42 42 ARG CB C 42 34.374 34.374 33.530 0.844 19168 186 1 1 . 1 1 43 43 VAL N N 43 125.565 125.565 123.586 1.979 19168 187 1 1 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.225 -0.560 19168 188 1 1 . 1 1 43 43 VAL C C 43 175.325 175.325 173.608 1.717 19168 189 1 1 . 1 1 43 43 VAL CA C 43 60.816 60.816 60.155 0.661 19168 190 1 1 . 1 1 43 43 VAL CB C 43 32.983 32.983 36.144 -3.160 19168 191 1 1 . 1 1 44 44 PHE N N 44 128.291 128.291 130.048 -1.757 19168 192 1 1 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.994 -0.376 19168 193 1 1 . 1 1 44 44 PHE C C 44 174.477 174.477 174.569 -0.092 19168 194 1 1 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.446 0.702 19168 195 1 1 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.444 -1.503 19168 196 1 1 . 1 1 45 45 LEU N N 45 128.360 128.360 127.895 0.465 19168 197 1 1 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.234 0.157 19168 198 1 1 . 1 1 45 45 LEU C C 45 174.342 174.342 177.010 -2.668 19168 199 1 1 . 1 1 45 45 LEU CA C 45 53.586 53.586 54.238 -0.652 19168 200 1 1 . 1 1 45 45 LEU CB C 45 41.113 41.113 41.981 -0.869 19168 201 1 1 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.081 0.011 19168 202 1 1 . 1 1 46 46 LYS CA C 46 55.079 55.079 58.323 -3.244 19168 203 1 1 . 1 1 46 46 LYS CB C 46 34.295 34.295 32.805 1.490 19168 204 1 1 . 1 1 47 47 GLY CA C 47 46.813 46.813 45.465 1.348 19168 205 1 1 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.192 0.008 19168 206 1 1 . 1 1 48 48 ARG C C 48 178.069 178.069 178.053 0.016 19168 207 1 1 . 1 1 48 48 ARG CA C 48 57.862 57.862 58.113 -0.251 19168 208 1 1 . 1 1 48 48 ARG CB C 48 29.444 29.444 29.459 -0.015 19168 209 1 1 . 1 1 49 49 GLU N N 49 119.779 119.779 117.878 1.901 19168 210 1 1 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.161 -0.108 19168 211 1 1 . 1 1 49 49 GLU C C 49 178.227 178.227 177.343 0.884 19168 212 1 1 . 1 1 49 49 GLU CA C 49 57.436 57.436 57.612 -0.176 19168 213 1 1 . 1 1 49 49 GLU CB C 49 29.745 29.745 28.111 1.634 19168 214 1 1 . 1 1 50 50 MET N N 50 116.370 116.370 120.404 -4.034 19168 215 1 1 . 1 1 50 50 MET HA H 50 4.024 4.024 4.043 -0.019 19168 216 1 1 . 1 1 50 50 MET C C 50 175.912 175.912 176.342 -0.430 19168 217 1 1 . 1 1 50 50 MET CA C 50 56.664 56.664 57.314 -0.650 19168 218 1 1 . 1 1 50 50 MET CB C 50 32.033 32.033 32.428 -0.395 19168 219 1 1 . 1 1 51 51 ALA N N 51 118.880 118.880 119.916 -1.036 19168 220 1 1 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.264 0.080 19168 221 1 1 . 1 1 51 51 ALA C C 51 177.746 177.746 177.399 0.347 19168 222 1 1 . 1 1 51 51 ALA CA C 51 52.391 52.391 52.754 -0.363 19168 223 1 1 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.461 -0.018 19168 224 1 1 . 1 1 52 52 THR N N 52 108.299 108.299 115.231 -6.932 19168 225 1 1 . 1 1 52 52 THR HA H 52 4.869 4.869 4.540 0.329 19168 226 1 1 . 1 1 52 52 THR C C 52 173.933 173.933 172.386 1.547 19168 227 1 1 . 1 1 52 52 THR CA C 52 57.554 57.554 58.840 -1.286 19168 228 1 1 . 1 1 52 52 THR CB C 52 69.479 69.479 69.580 -0.101 19168 229 1 1 . 1 1 53 53 PRO HA H 53 3.931 3.931 3.915 0.016 19168 230 1 1 . 1 1 53 53 PRO C C 53 178.185 178.185 178.033 0.152 19168 231 1 1 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.558 0.461 19168 232 1 1 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.596 -1.080 19168 233 1 1 . 1 1 54 54 GLU N N 54 120.653 120.653 117.410 3.243 19168 234 1 1 . 1 1 54 54 GLU HA H 54 4.016 4.016 3.940 0.076 19168 235 1 1 . 1 1 54 54 GLU C C 54 178.608 178.608 178.225 0.383 19168 236 1 1 . 1 1 54 54 GLU CA C 54 59.472 59.472 59.023 0.449 19168 237 1 1 . 1 1 54 54 GLU CB C 54 27.419 27.419 29.156 -1.737 19168 238 1 1 . 1 1 55 55 ALA N N 55 124.380 124.380 121.179 3.201 19168 239 1 1 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.099 0.224 19168 240 1 1 . 1 1 55 55 ALA C C 55 181.502 181.502 179.745 1.757 19168 241 1 1 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.163 -0.383 19168 242 1 1 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.007 0.394 19168 243 1 1 . 1 1 56 56 GLY N N 56 105.673 105.673 106.827 -1.154 19168 244 1 1 . 1 1 56 56 GLY C C 56 174.278 174.278 176.259 -1.981 19168 245 1 1 . 1 1 56 56 GLY CA C 56 46.879 46.879 47.000 -0.121 19168 246 1 1 . 1 1 57 57 VAL N N 57 122.685 122.685 123.352 -0.667 19168 247 1 1 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.670 -0.348 19168 248 1 1 . 1 1 57 57 VAL C C 57 177.134 177.134 177.739 -0.605 19168 249 1 1 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.492 0.904 19168 250 1 1 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.477 0.292 19168 251 1 1 . 1 1 58 58 ALA N N 58 119.580 119.580 122.464 -2.884 19168 252 1 1 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.419 -0.325 19168 253 1 1 . 1 1 58 58 ALA C C 58 180.788 180.788 179.915 0.873 19168 254 1 1 . 1 1 58 58 ALA CA C 58 55.053 55.053 54.854 0.199 19168 255 1 1 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.570 -0.716 19168 256 1 1 . 1 1 59 59 LEU N N 59 119.723 119.723 120.417 -0.694 19168 257 1 1 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.001 0.257 19168 258 1 1 . 1 1 59 59 LEU C C 59 178.024 178.024 178.652 -0.628 19168 259 1 1 . 1 1 59 59 LEU CA C 59 57.710 57.710 58.128 -0.418 19168 260 1 1 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.078 -0.377 19168 261 1 1 . 1 1 60 60 LEU N N 60 117.978 117.978 118.539 -0.561 19168 262 1 1 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.814 0.043 19168 263 1 1 . 1 1 60 60 LEU C C 60 178.851 178.851 179.120 -0.269 19168 264 1 1 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.102 -0.458 19168 265 1 1 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.414 -1.126 19168 266 1 1 . 1 1 61 61 GLU N N 61 119.906 119.906 119.197 0.709 19168 267 1 1 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.045 0.446 19168 268 1 1 . 1 1 61 61 GLU C C 61 179.519 179.519 179.043 0.476 19168 269 1 1 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.948 -1.206 19168 270 1 1 . 1 1 61 61 GLU CB C 61 28.813 28.813 29.197 -0.384 19168 271 1 1 . 1 1 62 62 LYS N N 62 122.015 122.015 120.807 1.208 19168 272 1 1 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.089 0.039 19168 273 1 1 . 1 1 62 62 LYS C C 62 179.843 179.843 178.799 1.044 19168 274 1 1 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.330 0.007 19168 275 1 1 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.367 -0.720 19168 276 1 1 . 1 1 63 63 ILE N N 63 120.882 120.882 119.965 0.917 19168 277 1 1 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.567 -0.071 19168 278 1 1 . 1 1 63 63 ILE C C 63 177.761 177.761 177.208 0.553 19168 279 1 1 . 1 1 63 63 ILE CA C 63 65.182 65.182 65.522 -0.340 19168 280 1 1 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.668 -0.282 19168 281 1 1 . 1 1 64 64 TRP N N 64 120.279 120.279 121.502 -1.223 19168 282 1 1 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.132 0.352 19168 283 1 1 . 1 1 64 64 TRP C C 64 177.056 177.056 177.845 -0.789 19168 284 1 1 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.100 -1.006 19168 285 1 1 . 1 1 64 64 TRP CB C 64 29.635 29.635 29.930 -0.295 19168 286 1 1 . 1 1 65 65 THR N N 65 109.483 109.483 114.757 -5.274 19168 287 1 1 . 1 1 65 65 THR HA H 65 3.744 3.744 3.637 0.107 19168 288 1 1 . 1 1 65 65 THR C C 65 176.224 176.224 176.414 -0.190 19168 289 1 1 . 1 1 65 65 THR CA C 65 65.568 65.568 65.975 -0.407 19168 290 1 1 . 1 1 65 65 THR CB C 65 69.308 69.308 68.257 1.051 19168 291 1 1 . 1 1 66 66 MET N N 66 117.791 117.791 117.689 0.102 19168 292 1 1 . 1 1 66 66 MET HA H 66 4.110 4.110 4.252 -0.142 19168 293 1 1 . 1 1 66 66 MET C C 66 177.782 177.782 178.102 -0.320 19168 294 1 1 . 1 1 66 66 MET CA C 66 58.304 58.304 57.169 1.135 19168 295 1 1 . 1 1 66 66 MET CB C 66 34.040 34.040 32.736 1.304 19168 296 1 1 . 1 1 67 67 ILE N N 67 109.871 109.871 111.291 -1.420 19168 297 1 1 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.531 0.111 19168 298 1 1 . 1 1 67 67 ILE C C 67 176.713 176.713 176.444 0.269 19168 299 1 1 . 1 1 67 67 ILE CA C 67 61.174 61.174 60.822 0.353 19168 300 1 1 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.480 1.333 19168 301 1 1 . 1 1 68 68 GLU N N 68 121.972 121.972 121.624 0.348 19168 302 1 1 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.276 -0.528 19168 303 1 1 . 1 1 68 68 GLU C C 68 175.855 175.855 177.248 -1.393 19168 304 1 1 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.318 -0.027 19168 305 1 1 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.221 1.271 19168 306 1 1 . 1 1 69 69 ASN N N 69 114.338 114.338 116.401 -2.063 19168 307 1 1 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.372 0.208 19168 308 1 1 . 1 1 69 69 ASN C C 69 175.904 175.904 177.362 -1.458 19168 309 1 1 . 1 1 69 69 ASN CA C 69 54.597 54.597 55.485 -0.888 19168 310 1 1 . 1 1 69 69 ASN CB C 69 38.323 38.323 37.934 0.389 19168 311 1 1 . 1 1 70 70 GLU N N 70 116.936 116.936 118.348 -1.412 19168 312 1 1 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.565 -0.017 19168 313 1 1 . 1 1 70 70 GLU C C 70 174.941 174.941 174.868 0.073 19168 314 1 1 . 1 1 70 70 GLU CA C 70 55.983 55.983 55.569 0.414 19168 315 1 1 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.152 0.195 19168 316 1 1 . 1 1 71 71 ALA N N 71 122.966 122.966 121.611 1.355 19168 317 1 1 . 1 1 71 71 ALA HA H 71 5.246 5.246 4.859 0.387 19168 318 1 1 . 1 1 71 71 ALA C C 71 173.907 173.907 175.661 -1.754 19168 319 1 1 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.544 0.274 19168 320 1 1 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.101 1.959 19168 321 1 1 . 1 1 72 72 ASN N N 72 115.820 115.820 118.713 -2.893 19168 322 1 1 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.300 0.141 19168 323 1 1 . 1 1 72 72 ASN C C 72 174.137 174.137 174.154 -0.017 19168 324 1 1 . 1 1 72 72 ASN CA C 72 51.659 51.659 52.127 -0.468 19168 325 1 1 . 1 1 72 72 ASN CB C 72 42.186 42.186 42.039 0.147 19168 326 1 1 . 1 1 73 73 ARG N N 73 118.340 118.340 122.273 -3.933 19168 327 1 1 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.914 0.864 19168 328 1 1 . 1 1 73 73 ARG C C 73 174.674 174.674 175.846 -1.172 19168 329 1 1 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.026 -1.157 19168 330 1 1 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.999 2.126 19168 331 1 1 . 1 1 74 74 ASP N N 74 124.007 124.007 128.236 -4.229 19168 332 1 1 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.519 0.023 19168 333 1 1 . 1 1 74 74 ASP C C 74 175.935 175.935 176.239 -0.304 19168 334 1 1 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.108 -0.711 19168 335 1 1 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.893 0.327 19168 336 1 1 . 1 1 75 75 LYS N N 75 116.482 116.482 115.451 1.031 19168 337 1 1 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.518 -0.073 19168 338 1 1 . 1 1 75 75 LYS C C 75 175.135 175.135 174.274 0.861 19168 339 1 1 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.473 -0.688 19168 340 1 1 . 1 1 75 75 LYS CB C 75 35.475 35.475 33.562 1.913 19168 341 1 1 . 1 1 76 76 GLU N N 76 120.126 120.126 119.744 0.382 19168 342 1 1 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.556 -0.648 19168 343 1 1 . 1 1 76 76 GLU C C 76 173.204 173.204 175.052 -1.848 19168 344 1 1 . 1 1 76 76 GLU CA C 76 55.524 55.524 53.718 1.806 19168 345 1 1 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.305 -1.794 19168 346 1 1 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.713 0.064 19168 347 1 1 . 1 1 77 77 PRO C C 77 174.933 174.933 175.918 -0.985 19168 348 1 1 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.562 0.860 19168 349 1 1 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.014 0.377 19168 350 1 1 . 1 1 78 78 ASN N N 78 119.292 119.292 120.910 -1.618 19168 351 1 1 . 1 1 78 78 ASN HA H 78 5.093 5.093 4.865 0.228 19168 352 1 1 . 1 1 78 78 ASN C C 78 172.876 172.876 173.592 -0.716 19168 353 1 1 . 1 1 78 78 ASN CA C 78 51.928 51.928 52.045 -0.117 19168 354 1 1 . 1 1 78 78 ASN CB C 78 42.017 42.017 41.874 0.142 19168 355 1 1 . 1 1 79 79 PHE N N 79 125.023 125.023 123.370 1.653 19168 356 1 1 . 1 1 79 79 PHE HA H 79 5.423 5.423 4.875 0.548 19168 357 1 1 . 1 1 79 79 PHE C C 79 174.552 174.552 174.827 -0.275 19168 358 1 1 . 1 1 79 79 PHE CA C 79 55.210 55.210 58.292 -3.082 19168 359 1 1 . 1 1 79 79 PHE CB C 79 40.109 40.109 39.920 0.189 19168 360 1 1 . 1 1 80 80 GLU N N 80 128.920 128.920 128.586 0.334 19168 361 1 1 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.324 -0.116 19168 362 1 1 . 1 1 80 80 GLU C C 80 175.538 175.538 176.030 -0.492 19168 363 1 1 . 1 1 80 80 GLU CA C 80 55.724 55.724 55.949 -0.225 19168 364 1 1 . 1 1 80 80 GLU CB C 80 32.135 32.135 31.437 0.698 19168 365 1 1 . 1 1 81 81 GLY N N 81 116.695 116.695 113.583 3.112 19168 366 1 1 . 1 1 81 81 GLY C C 81 173.950 173.950 174.847 -0.897 19168 367 1 1 . 1 1 81 81 GLY CA C 81 46.967 46.967 45.394 1.573 19168 368 1 1 . 1 1 82 82 ARG N N 82 124.481 124.481 112.274 12.207 19168 369 1 1 . 1 1 82 82 ARG HA H 82 4.539 4.539 3.514 1.025 19168 370 1 1 . 1 1 82 82 ARG C C 82 173.437 173.437 173.636 -0.199 19168 371 1 1 . 1 1 82 82 ARG CA C 82 55.156 55.156 57.794 -2.638 19168 372 1 1 . 1 1 82 82 ARG CB C 82 30.255 30.255 29.058 1.197 19168 373 1 1 . 1 1 83 83 TYR N N 83 114.539 114.539 115.641 -1.102 19168 374 1 1 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.505 0.443 19168 375 1 1 . 1 1 83 83 TYR C C 83 175.909 175.909 175.497 0.412 19168 376 1 1 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.512 -0.455 19168 377 1 1 . 1 1 83 83 TYR CB C 83 42.999 42.999 41.545 1.454 19168 378 1 1 . 1 1 84 84 VAL N N 84 118.812 118.812 124.046 -5.234 19168 379 1 1 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.921 -0.054 19168 380 1 1 . 1 1 84 84 VAL C C 84 174.982 174.982 175.018 -0.036 19168 381 1 1 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.394 -0.159 19168 382 1 1 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.667 -0.176 19168 383 1 1 . 1 1 85 85 ASN N N 85 124.630 124.630 124.516 0.114 19168 384 1 1 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.090 -0.086 19168 385 1 1 . 1 1 85 85 ASN C C 85 175.392 175.392 173.982 1.410 19168 386 1 1 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.514 1.083 19168 387 1 1 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.465 1.741 19168 388 1 1 . 1 1 86 86 MET N N 86 118.969 118.969 121.062 -2.093 19168 389 1 1 . 1 1 86 86 MET HA H 86 4.640 4.640 4.912 -0.272 19168 390 1 1 . 1 1 86 86 MET C C 86 172.378 172.378 173.431 -1.053 19168 391 1 1 . 1 1 86 86 MET CA C 86 56.158 56.158 54.122 2.036 19168 392 1 1 . 1 1 86 86 MET CB C 86 39.138 39.138 37.349 1.788 19168 393 1 1 . 1 1 87 87 LEU N N 87 131.886 131.886 126.348 5.538 19168 394 1 1 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.220 0.161 19168 395 1 1 . 1 1 87 87 LEU C C 87 176.003 176.003 174.803 1.200 19168 396 1 1 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.007 1.123 19168 397 1 1 . 1 1 87 87 LEU CB C 87 44.473 44.473 45.760 -1.287 19168 398 1 1 . 1 1 88 88 VAL N N 88 121.165 121.165 120.817 0.348 19168 399 1 1 . 1 1 88 88 VAL HA H 88 5.510 5.510 5.196 0.314 19168 400 1 1 . 1 1 88 88 VAL C C 88 173.666 173.666 175.084 -1.418 19168 401 1 1 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.751 -1.151 19168 402 1 1 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.041 0.752 19168 403 1 1 . 1 1 89 89 THR N N 89 111.786 111.786 122.196 -10.410 19168 404 1 1 . 1 1 89 89 THR HA H 89 4.720 4.720 4.578 0.142 19168 405 1 1 . 1 1 89 89 THR C C 89 171.898 171.898 172.747 -0.849 19168 406 1 1 . 1 1 89 89 THR CA C 89 57.985 57.985 59.920 -1.935 19168 407 1 1 . 1 1 89 89 THR CB C 89 69.113 69.113 69.714 -0.601 19168 408 1 1 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.432 0.151 19168 409 1 1 . 1 1 90 90 PRO C C 90 177.403 177.403 177.151 0.252 19168 410 1 1 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.873 0.658 19168 411 1 1 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.474 -0.431 19168 412 1 1 . 1 1 91 91 LYS N N 91 123.696 123.696 123.251 0.445 19168 413 1 1 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.191 -0.080 19168 414 1 1 . 1 1 91 91 LYS C C 91 176.568 176.568 177.239 -0.671 19168 415 1 1 . 1 1 91 91 LYS CA C 91 57.208 57.208 57.646 -0.438 19168 416 1 1 . 1 1 91 91 LYS CB C 91 33.183 33.183 32.400 0.783 19168 417 1 1 . 1 1 92 92 LYS N N 92 122.054 122.054 118.389 3.665 19168 418 1 1 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.304 0.012 19168 419 1 1 . 1 1 92 92 LYS C C 92 175.956 175.956 175.828 0.128 19168 420 1 1 . 1 1 92 92 LYS CA C 92 55.942 55.942 55.768 0.174 19168 421 1 1 . 1 1 92 92 LYS CB C 92 33.000 33.000 32.080 0.920 19168 422 1 1 . 1 1 93 93 ALA N N 93 126.278 126.278 122.812 3.466 19168 423 1 1 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.265 0.076 19168 424 1 1 . 1 1 93 93 ALA C C 93 177.592 177.592 177.204 0.388 19168 425 1 1 . 1 1 93 93 ALA CA C 93 52.279 52.279 52.150 0.129 19168 426 1 1 . 1 1 93 93 ALA CB C 93 19.332 19.332 19.119 0.213 19168 427 1 1 . 1 1 94 94 GLU N N 94 120.522 120.522 115.872 4.650 19168 428 1 1 . 1 1 94 94 GLU HA H 94 4.284 4.284 3.583 0.701 19168 429 1 1 . 1 1 94 94 GLU C C 94 177.041 177.041 176.607 0.434 19168 430 1 1 . 1 1 94 94 GLU CA C 94 56.606 56.606 57.090 -0.484 19168 431 1 1 . 1 1 94 94 GLU CB C 94 30.353 30.353 27.954 2.399 19168 432 1 1 . 1 1 95 95 GLY N N 95 109.755 109.755 107.042 2.713 19168 433 1 1 . 1 1 95 95 GLY C C 95 173.939 173.939 174.989 -1.050 19168 434 1 1 . 1 1 95 95 GLY CA C 95 45.168 45.168 45.833 -0.665 19168 435 1 2 . 1 1 5 5 VAL N N 5 123.289 123.289 120.704 2.585 19168 436 1 2 . 1 1 5 5 VAL HA H 5 4.019 4.019 3.930 0.089 19168 437 1 2 . 1 1 5 5 VAL C C 5 175.799 175.799 176.308 -0.509 19168 438 1 2 . 1 1 5 5 VAL CA C 5 62.120 62.120 63.627 -1.507 19168 439 1 2 . 1 1 5 5 VAL CB C 5 32.757 32.757 32.037 0.720 19168 440 1 2 . 1 1 6 6 ILE N N 6 126.794 126.794 121.991 4.803 19168 441 1 2 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.153 -0.186 19168 442 1 2 . 1 1 6 6 ILE C C 6 175.103 175.103 174.920 0.183 19168 443 1 2 . 1 1 6 6 ILE CA C 6 60.227 60.227 59.867 0.360 19168 444 1 2 . 1 1 6 6 ILE CB C 6 38.565 38.565 37.814 0.751 19168 445 1 2 . 1 1 7 7 ASP N N 7 127.797 127.797 129.214 -1.417 19168 446 1 2 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.624 -0.080 19168 447 1 2 . 1 1 7 7 ASP C C 7 174.000 174.000 174.954 -0.954 19168 448 1 2 . 1 1 7 7 ASP CA C 7 53.591 53.591 54.693 -1.102 19168 449 1 2 . 1 1 7 7 ASP CB C 7 42.152 42.152 40.736 1.417 19168 450 1 2 . 1 1 8 8 ILE N N 8 122.764 122.764 124.500 -1.736 19168 451 1 2 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.420 -0.100 19168 452 1 2 . 1 1 8 8 ILE C C 8 176.337 176.337 175.405 0.932 19168 453 1 2 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.155 0.021 19168 454 1 2 . 1 1 8 8 ILE CB C 8 39.542 39.542 39.088 0.454 19168 455 1 2 . 1 1 9 9 LYS N N 9 127.990 127.990 128.571 -0.581 19168 456 1 2 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.266 0.056 19168 457 1 2 . 1 1 9 9 LYS C C 9 174.759 174.759 175.143 -0.384 19168 458 1 2 . 1 1 9 9 LYS CA C 9 52.315 52.315 54.393 -2.078 19168 459 1 2 . 1 1 9 9 LYS CB C 9 32.902 32.902 32.861 0.041 19168 460 1 2 . 1 1 10 10 GLU N N 10 123.021 123.021 123.750 -0.729 19168 461 1 2 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.816 0.319 19168 462 1 2 . 1 1 10 10 GLU C C 10 176.215 176.215 175.908 0.307 19168 463 1 2 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.525 -0.623 19168 464 1 2 . 1 1 10 10 GLU CB C 10 32.037 32.037 30.666 1.371 19168 465 1 2 . 1 1 11 11 ILE N N 11 126.526 126.526 127.415 -0.889 19168 466 1 2 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.212 0.123 19168 467 1 2 . 1 1 11 11 ILE C C 11 174.334 174.334 174.560 -0.226 19168 468 1 2 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.285 0.025 19168 469 1 2 . 1 1 11 11 ILE CB C 11 39.826 39.826 39.331 0.495 19168 470 1 2 . 1 1 12 12 LYS N N 12 128.164 128.164 128.622 -0.458 19168 471 1 2 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.550 -0.205 19168 472 1 2 . 1 1 12 12 LYS C C 12 176.378 176.378 175.522 0.856 19168 473 1 2 . 1 1 12 12 LYS CA C 12 55.940 55.940 55.397 0.543 19168 474 1 2 . 1 1 12 12 LYS CB C 12 34.056 34.056 34.688 -0.631 19168 475 1 2 . 1 1 13 13 LEU N N 13 121.881 121.881 125.832 -3.951 19168 476 1 2 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.795 0.159 19168 477 1 2 . 1 1 13 13 LEU C C 13 175.137 175.137 174.834 0.303 19168 478 1 2 . 1 1 13 13 LEU CA C 13 53.974 53.974 54.403 -0.429 19168 479 1 2 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.685 -0.401 19168 480 1 2 . 1 1 14 14 SER N N 14 115.759 115.759 113.629 2.130 19168 481 1 2 . 1 1 14 14 SER HA H 14 4.889 4.889 5.209 -0.320 19168 482 1 2 . 1 1 14 14 SER C C 14 173.993 173.993 174.442 -0.449 19168 483 1 2 . 1 1 14 14 SER CA C 14 56.052 56.052 56.435 -0.383 19168 484 1 2 . 1 1 14 14 SER CB C 14 64.775 64.775 65.960 -1.185 19168 485 1 2 . 1 1 15 15 VAL N N 15 120.993 120.993 120.553 0.440 19168 486 1 2 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.867 -0.133 19168 487 1 2 . 1 1 15 15 VAL C C 15 176.964 176.964 176.949 0.015 19168 488 1 2 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.253 0.174 19168 489 1 2 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.683 0.102 19168 490 1 2 . 1 1 16 16 LYS N N 16 118.897 118.897 120.296 -1.399 19168 491 1 2 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.411 -0.010 19168 492 1 2 . 1 1 16 16 LYS C C 16 175.489 175.489 174.637 0.852 19168 493 1 2 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.711 -0.556 19168 494 1 2 . 1 1 16 16 LYS CB C 16 30.929 30.929 30.738 0.192 19168 495 1 2 . 1 1 17 17 ILE N N 17 122.247 122.247 120.229 2.018 19168 496 1 2 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.306 -0.121 19168 497 1 2 . 1 1 17 17 ILE C C 17 173.426 173.426 174.370 -0.944 19168 498 1 2 . 1 1 17 17 ILE CA C 17 61.276 61.276 59.710 1.566 19168 499 1 2 . 1 1 17 17 ILE CB C 17 39.080 39.080 41.337 -2.257 19168 500 1 2 . 1 1 18 18 ALA N N 18 129.434 129.434 128.834 0.600 19168 501 1 2 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.431 0.048 19168 502 1 2 . 1 1 18 18 ALA C C 18 179.130 179.130 178.284 0.846 19168 503 1 2 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.893 -0.456 19168 504 1 2 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.110 -0.201 19168 505 1 2 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.021 -0.224 19168 506 1 2 . 1 1 19 19 GLN CA C 19 59.231 59.231 59.052 0.179 19168 507 1 2 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.601 -0.426 19168 508 1 2 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.533 -0.103 19168 509 1 2 . 1 1 20 20 ASN C C 20 177.272 177.272 177.663 -0.391 19168 510 1 2 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.096 0.088 19168 511 1 2 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.526 -0.073 19168 512 1 2 . 1 1 21 21 ASP N N 21 119.132 119.132 120.743 -1.611 19168 513 1 2 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.517 0.281 19168 514 1 2 . 1 1 21 21 ASP C C 21 178.707 178.707 178.436 0.271 19168 515 1 2 . 1 1 21 21 ASP CA C 21 56.886 56.886 57.231 -0.345 19168 516 1 2 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.943 -0.278 19168 517 1 2 . 1 1 22 22 ILE N N 22 122.030 122.030 119.616 2.414 19168 518 1 2 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.628 -0.210 19168 519 1 2 . 1 1 22 22 ILE C C 22 177.454 177.454 178.041 -0.587 19168 520 1 2 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.447 1.279 19168 521 1 2 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.688 -0.122 19168 522 1 2 . 1 1 23 23 ASN N N 23 116.728 116.728 118.533 -1.805 19168 523 1 2 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.433 -0.220 19168 524 1 2 . 1 1 23 23 ASN C C 23 178.260 178.260 177.943 0.317 19168 525 1 2 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.901 -0.627 19168 526 1 2 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.608 -1.400 19168 527 1 2 . 1 1 24 24 TYR N N 24 119.864 119.864 121.655 -1.791 19168 528 1 2 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.225 0.068 19168 529 1 2 . 1 1 24 24 TYR C C 24 177.719 177.719 177.480 0.239 19168 530 1 2 . 1 1 24 24 TYR CA C 24 61.048 61.048 61.982 -0.934 19168 531 1 2 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.705 -0.422 19168 532 1 2 . 1 1 25 25 LYS N N 25 119.730 119.730 118.970 0.760 19168 533 1 2 . 1 1 25 25 LYS HA H 25 4.111 4.111 3.898 0.212 19168 534 1 2 . 1 1 25 25 LYS C C 25 179.152 179.152 178.959 0.193 19168 535 1 2 . 1 1 25 25 LYS CA C 25 59.162 59.162 60.121 -0.959 19168 536 1 2 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.800 -0.506 19168 537 1 2 . 1 1 26 26 VAL N N 26 119.387 119.387 116.594 2.793 19168 538 1 2 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.823 -0.203 19168 539 1 2 . 1 1 26 26 VAL C C 26 177.017 177.017 177.653 -0.636 19168 540 1 2 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.392 1.268 19168 541 1 2 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.253 0.297 19168 542 1 2 . 1 1 27 27 LYS N N 27 120.420 120.420 119.471 0.949 19168 543 1 2 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.928 0.018 19168 544 1 2 . 1 1 27 27 LYS C C 27 179.458 179.458 178.878 0.580 19168 545 1 2 . 1 1 27 27 LYS CA C 27 59.878 59.878 60.052 -0.174 19168 546 1 2 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.116 -0.268 19168 547 1 2 . 1 1 28 28 HIS N N 28 118.160 118.160 118.242 -0.082 19168 548 1 2 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.310 -0.123 19168 549 1 2 . 1 1 28 28 HIS C C 28 177.085 177.085 177.488 -0.403 19168 550 1 2 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.597 -1.712 19168 551 1 2 . 1 1 28 28 HIS CB C 28 29.756 29.756 30.265 -0.509 19168 552 1 2 . 1 1 29 29 ALA N N 29 120.579 120.579 122.422 -1.843 19168 553 1 2 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.248 -0.250 19168 554 1 2 . 1 1 29 29 ALA C C 29 179.299 179.299 179.862 -0.563 19168 555 1 2 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.423 0.144 19168 556 1 2 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.380 1.069 19168 557 1 2 . 1 1 30 30 LEU N N 30 117.262 117.262 117.946 -0.684 19168 558 1 2 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.952 0.123 19168 559 1 2 . 1 1 30 30 LEU C C 30 180.017 180.017 178.890 1.127 19168 560 1 2 . 1 1 30 30 LEU CA C 30 58.232 58.232 58.346 -0.114 19168 561 1 2 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.402 -0.076 19168 562 1 2 . 1 1 31 31 GLU N N 31 120.625 120.625 119.116 1.509 19168 563 1 2 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.968 0.100 19168 564 1 2 . 1 1 31 31 GLU C C 31 179.572 179.572 179.345 0.227 19168 565 1 2 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.110 0.165 19168 566 1 2 . 1 1 31 31 GLU CB C 31 28.975 28.975 28.804 0.171 19168 567 1 2 . 1 1 32 32 PHE N N 32 118.245 118.245 119.178 -0.933 19168 568 1 2 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.242 0.284 19168 569 1 2 . 1 1 32 32 PHE C C 32 179.123 179.123 177.973 1.150 19168 570 1 2 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.947 -3.250 19168 571 1 2 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.755 -1.503 19168 572 1 2 . 1 1 33 33 LEU N N 33 121.684 121.684 120.697 0.987 19168 573 1 2 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.417 0.174 19168 574 1 2 . 1 1 33 33 LEU C C 33 181.655 181.655 180.083 1.572 19168 575 1 2 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.638 0.534 19168 576 1 2 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.697 -0.005 19168 577 1 2 . 1 1 34 34 GLU N N 34 122.046 122.046 118.947 3.099 19168 578 1 2 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.110 0.042 19168 579 1 2 . 1 1 34 34 GLU C C 34 178.237 178.237 178.093 0.144 19168 580 1 2 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.894 0.252 19168 581 1 2 . 1 1 34 34 GLU CB C 34 29.234 29.234 28.883 0.351 19168 582 1 2 . 1 1 35 35 GLN N N 35 115.697 115.697 116.053 -0.356 19168 583 1 2 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.335 0.052 19168 584 1 2 . 1 1 35 35 GLN C C 35 176.456 176.456 176.636 -0.180 19168 585 1 2 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.452 0.234 19168 586 1 2 . 1 1 35 35 GLN CB C 35 29.196 29.196 28.721 0.475 19168 587 1 2 . 1 1 36 36 GLY N N 36 108.291 108.291 107.212 1.079 19168 588 1 2 . 1 1 36 36 GLY C C 36 174.673 174.673 174.324 0.349 19168 589 1 2 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.160 0.367 19168 590 1 2 . 1 1 37 37 LYS N N 37 120.464 120.464 120.182 0.282 19168 591 1 2 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.699 -0.202 19168 592 1 2 . 1 1 37 37 LYS C C 37 174.580 174.580 176.040 -1.460 19168 593 1 2 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.486 0.603 19168 594 1 2 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.400 -1.655 19168 595 1 2 . 1 1 38 38 HIS N N 38 116.878 116.878 118.244 -1.366 19168 596 1 2 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.792 0.227 19168 597 1 2 . 1 1 38 38 HIS C C 38 175.268 175.268 173.792 1.476 19168 598 1 2 . 1 1 38 38 HIS CA C 38 54.150 54.150 54.910 -0.759 19168 599 1 2 . 1 1 38 38 HIS CB C 38 32.877 32.877 32.823 0.054 19168 600 1 2 . 1 1 39 39 VAL N N 39 119.782 119.782 120.917 -1.135 19168 601 1 2 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.660 0.136 19168 602 1 2 . 1 1 39 39 VAL C C 39 173.320 173.320 174.454 -1.134 19168 603 1 2 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.569 0.197 19168 604 1 2 . 1 1 39 39 VAL CB C 39 35.433 35.433 33.266 2.167 19168 605 1 2 . 1 1 40 40 ARG N N 40 128.358 128.358 127.476 0.882 19168 606 1 2 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.586 0.529 19168 607 1 2 . 1 1 40 40 ARG C C 40 175.659 175.659 174.690 0.969 19168 608 1 2 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.410 -0.589 19168 609 1 2 . 1 1 40 40 ARG CB C 40 33.007 33.007 31.948 1.059 19168 610 1 2 . 1 1 41 41 PHE N N 41 126.396 126.396 127.454 -1.058 19168 611 1 2 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.388 -0.210 19168 612 1 2 . 1 1 41 41 PHE C C 41 176.107 176.107 175.282 0.825 19168 613 1 2 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.331 0.365 19168 614 1 2 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.969 2.076 19168 615 1 2 . 1 1 42 42 ARG N N 42 120.641 120.641 123.578 -2.937 19168 616 1 2 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.485 0.054 19168 617 1 2 . 1 1 42 42 ARG C C 42 175.010 175.010 174.466 0.544 19168 618 1 2 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.792 -0.097 19168 619 1 2 . 1 1 42 42 ARG CB C 42 34.374 34.374 34.178 0.196 19168 620 1 2 . 1 1 43 43 VAL N N 43 125.565 125.565 123.590 1.975 19168 621 1 2 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.443 -0.778 19168 622 1 2 . 1 1 43 43 VAL C C 43 175.325 175.325 173.722 1.603 19168 623 1 2 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.487 1.329 19168 624 1 2 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.664 -2.682 19168 625 1 2 . 1 1 44 44 PHE N N 44 128.291 128.291 130.270 -1.979 19168 626 1 2 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.770 -0.152 19168 627 1 2 . 1 1 44 44 PHE C C 44 174.477 174.477 174.268 0.209 19168 628 1 2 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.592 0.556 19168 629 1 2 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.426 -1.485 19168 630 1 2 . 1 1 45 45 LEU N N 45 128.360 128.360 128.493 -0.133 19168 631 1 2 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.216 0.175 19168 632 1 2 . 1 1 45 45 LEU C C 45 174.342 174.342 175.941 -1.599 19168 633 1 2 . 1 1 45 45 LEU CA C 45 53.586 53.586 54.656 -1.070 19168 634 1 2 . 1 1 45 45 LEU CB C 45 41.113 41.113 41.968 -0.855 19168 635 1 2 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.434 -0.342 19168 636 1 2 . 1 1 46 46 LYS CA C 46 55.079 55.079 55.456 -0.378 19168 637 1 2 . 1 1 46 46 LYS CB C 46 34.295 34.295 34.251 0.044 19168 638 1 2 . 1 1 47 47 GLY CA C 47 46.813 46.813 45.576 1.237 19168 639 1 2 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.188 0.012 19168 640 1 2 . 1 1 48 48 ARG C C 48 178.069 178.069 178.160 -0.091 19168 641 1 2 . 1 1 48 48 ARG CA C 48 57.862 57.862 57.416 0.446 19168 642 1 2 . 1 1 48 48 ARG CB C 48 29.444 29.444 30.044 -0.600 19168 643 1 2 . 1 1 49 49 GLU N N 49 119.779 119.779 121.167 -1.388 19168 644 1 2 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.001 0.052 19168 645 1 2 . 1 1 49 49 GLU C C 49 178.227 178.227 178.570 -0.343 19168 646 1 2 . 1 1 49 49 GLU CA C 49 57.436 57.436 58.675 -1.239 19168 647 1 2 . 1 1 49 49 GLU CB C 49 29.745 29.745 29.137 0.609 19168 648 1 2 . 1 1 50 50 MET N N 50 116.370 116.370 117.355 -0.985 19168 649 1 2 . 1 1 50 50 MET HA H 50 4.024 4.024 4.116 -0.092 19168 650 1 2 . 1 1 50 50 MET C C 50 175.912 175.912 177.413 -1.501 19168 651 1 2 . 1 1 50 50 MET CA C 50 56.664 56.664 57.907 -1.244 19168 652 1 2 . 1 1 50 50 MET CB C 50 32.033 32.033 32.533 -0.500 19168 653 1 2 . 1 1 51 51 ALA N N 51 118.880 118.880 119.441 -0.561 19168 654 1 2 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.267 0.077 19168 655 1 2 . 1 1 51 51 ALA C C 51 177.746 177.746 177.530 0.216 19168 656 1 2 . 1 1 51 51 ALA CA C 51 52.391 52.391 52.906 -0.514 19168 657 1 2 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.428 0.015 19168 658 1 2 . 1 1 52 52 THR N N 52 108.299 108.299 114.246 -5.947 19168 659 1 2 . 1 1 52 52 THR HA H 52 4.869 4.869 4.635 0.234 19168 660 1 2 . 1 1 52 52 THR C C 52 173.933 173.933 173.149 0.784 19168 661 1 2 . 1 1 52 52 THR CA C 52 57.554 57.554 59.664 -2.111 19168 662 1 2 . 1 1 52 52 THR CB C 52 69.479 69.479 69.918 -0.439 19168 663 1 2 . 1 1 53 53 PRO HA H 53 3.931 3.931 3.970 -0.039 19168 664 1 2 . 1 1 53 53 PRO C C 53 178.185 178.185 178.148 0.037 19168 665 1 2 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.293 0.726 19168 666 1 2 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.736 -1.220 19168 667 1 2 . 1 1 54 54 GLU N N 54 120.653 120.653 118.836 1.817 19168 668 1 2 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.051 -0.035 19168 669 1 2 . 1 1 54 54 GLU C C 54 178.608 178.608 177.849 0.759 19168 670 1 2 . 1 1 54 54 GLU CA C 54 59.472 59.472 59.047 0.425 19168 671 1 2 . 1 1 54 54 GLU CB C 54 27.419 27.419 29.214 -1.795 19168 672 1 2 . 1 1 55 55 ALA N N 55 124.380 124.380 120.916 3.464 19168 673 1 2 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.111 0.212 19168 674 1 2 . 1 1 55 55 ALA C C 55 181.502 181.502 179.679 1.823 19168 675 1 2 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.090 -0.310 19168 676 1 2 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.035 0.365 19168 677 1 2 . 1 1 56 56 GLY N N 56 105.673 105.673 106.751 -1.078 19168 678 1 2 . 1 1 56 56 GLY C C 56 174.278 174.278 176.213 -1.935 19168 679 1 2 . 1 1 56 56 GLY CA C 56 46.879 46.879 46.934 -0.055 19168 680 1 2 . 1 1 57 57 VAL N N 57 122.685 122.685 122.948 -0.263 19168 681 1 2 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.602 -0.280 19168 682 1 2 . 1 1 57 57 VAL C C 57 177.134 177.134 177.526 -0.392 19168 683 1 2 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.518 0.878 19168 684 1 2 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.590 0.179 19168 685 1 2 . 1 1 58 58 ALA N N 58 119.580 119.580 122.423 -2.843 19168 686 1 2 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.047 0.047 19168 687 1 2 . 1 1 58 58 ALA C C 58 180.788 180.788 179.681 1.107 19168 688 1 2 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.290 -0.237 19168 689 1 2 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.260 -0.406 19168 690 1 2 . 1 1 59 59 LEU N N 59 119.723 119.723 120.275 -0.552 19168 691 1 2 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.015 0.243 19168 692 1 2 . 1 1 59 59 LEU C C 59 178.024 178.024 178.609 -0.585 19168 693 1 2 . 1 1 59 59 LEU CA C 59 57.710 57.710 58.118 -0.408 19168 694 1 2 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.091 -0.390 19168 695 1 2 . 1 1 60 60 LEU N N 60 117.978 117.978 119.074 -1.096 19168 696 1 2 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.839 0.018 19168 697 1 2 . 1 1 60 60 LEU C C 60 178.851 178.851 179.265 -0.414 19168 698 1 2 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.190 -0.546 19168 699 1 2 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.316 -1.028 19168 700 1 2 . 1 1 61 61 GLU N N 61 119.906 119.906 118.703 1.203 19168 701 1 2 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.121 0.370 19168 702 1 2 . 1 1 61 61 GLU C C 61 179.519 179.519 179.101 0.418 19168 703 1 2 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.385 -0.643 19168 704 1 2 . 1 1 61 61 GLU CB C 61 28.813 28.813 28.914 -0.101 19168 705 1 2 . 1 1 62 62 LYS N N 62 122.015 122.015 121.167 0.848 19168 706 1 2 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.106 0.022 19168 707 1 2 . 1 1 62 62 LYS C C 62 179.843 179.843 179.148 0.695 19168 708 1 2 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.296 0.041 19168 709 1 2 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.336 -0.689 19168 710 1 2 . 1 1 63 63 ILE N N 63 120.882 120.882 119.621 1.261 19168 711 1 2 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.612 -0.116 19168 712 1 2 . 1 1 63 63 ILE C C 63 177.761 177.761 177.392 0.369 19168 713 1 2 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.888 0.294 19168 714 1 2 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.575 -0.189 19168 715 1 2 . 1 1 64 64 TRP N N 64 120.279 120.279 121.820 -1.541 19168 716 1 2 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.097 0.387 19168 717 1 2 . 1 1 64 64 TRP C C 64 177.056 177.056 177.790 -0.734 19168 718 1 2 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.121 -1.027 19168 719 1 2 . 1 1 64 64 TRP CB C 64 29.635 29.635 29.942 -0.307 19168 720 1 2 . 1 1 65 65 THR N N 65 109.483 109.483 114.093 -4.610 19168 721 1 2 . 1 1 65 65 THR HA H 65 3.744 3.744 3.702 0.042 19168 722 1 2 . 1 1 65 65 THR C C 65 176.224 176.224 176.254 -0.030 19168 723 1 2 . 1 1 65 65 THR CA C 65 65.568 65.568 66.087 -0.519 19168 724 1 2 . 1 1 65 65 THR CB C 65 69.308 69.308 68.115 1.193 19168 725 1 2 . 1 1 66 66 MET N N 66 117.791 117.791 117.488 0.303 19168 726 1 2 . 1 1 66 66 MET HA H 66 4.110 4.110 4.243 -0.133 19168 727 1 2 . 1 1 66 66 MET C C 66 177.782 177.782 177.973 -0.191 19168 728 1 2 . 1 1 66 66 MET CA C 66 58.304 58.304 56.936 1.368 19168 729 1 2 . 1 1 66 66 MET CB C 66 34.040 34.040 32.477 1.563 19168 730 1 2 . 1 1 67 67 ILE N N 67 109.871 109.871 111.436 -1.565 19168 731 1 2 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.430 0.212 19168 732 1 2 . 1 1 67 67 ILE C C 67 176.713 176.713 176.916 -0.203 19168 733 1 2 . 1 1 67 67 ILE CA C 67 61.174 61.174 61.264 -0.090 19168 734 1 2 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.670 1.143 19168 735 1 2 . 1 1 68 68 GLU N N 68 121.972 121.972 120.846 1.126 19168 736 1 2 . 1 1 68 68 GLU HA H 68 2.748 2.748 2.960 -0.212 19168 737 1 2 . 1 1 68 68 GLU C C 68 175.855 175.855 176.570 -0.715 19168 738 1 2 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.196 0.095 19168 739 1 2 . 1 1 68 68 GLU CB C 68 28.492 28.492 28.220 0.273 19168 740 1 2 . 1 1 69 69 ASN N N 69 114.338 114.338 114.986 -0.648 19168 741 1 2 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.418 0.162 19168 742 1 2 . 1 1 69 69 ASN C C 69 175.904 175.904 176.282 -0.378 19168 743 1 2 . 1 1 69 69 ASN CA C 69 54.597 54.597 54.994 -0.397 19168 744 1 2 . 1 1 69 69 ASN CB C 69 38.323 38.323 37.971 0.352 19168 745 1 2 . 1 1 70 70 GLU N N 70 116.936 116.936 116.889 0.047 19168 746 1 2 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.671 -0.123 19168 747 1 2 . 1 1 70 70 GLU C C 70 174.941 174.941 174.514 0.427 19168 748 1 2 . 1 1 70 70 GLU CA C 70 55.983 55.983 55.148 0.835 19168 749 1 2 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.307 0.041 19168 750 1 2 . 1 1 71 71 ALA N N 71 122.966 122.966 121.487 1.479 19168 751 1 2 . 1 1 71 71 ALA HA H 71 5.246 5.246 4.824 0.422 19168 752 1 2 . 1 1 71 71 ALA C C 71 173.907 173.907 175.690 -1.783 19168 753 1 2 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.447 0.372 19168 754 1 2 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.026 2.034 19168 755 1 2 . 1 1 72 72 ASN N N 72 115.820 115.820 118.193 -2.373 19168 756 1 2 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.291 0.150 19168 757 1 2 . 1 1 72 72 ASN C C 72 174.137 174.137 173.992 0.145 19168 758 1 2 . 1 1 72 72 ASN CA C 72 51.659 51.659 52.446 -0.787 19168 759 1 2 . 1 1 72 72 ASN CB C 72 42.186 42.186 41.727 0.459 19168 760 1 2 . 1 1 73 73 ARG N N 73 118.340 118.340 123.360 -5.020 19168 761 1 2 . 1 1 73 73 ARG HA H 73 4.778 4.778 4.132 0.646 19168 762 1 2 . 1 1 73 73 ARG C C 73 174.674 174.674 175.257 -0.583 19168 763 1 2 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.103 -1.234 19168 764 1 2 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.913 2.212 19168 765 1 2 . 1 1 74 74 ASP N N 74 124.007 124.007 128.014 -4.007 19168 766 1 2 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.491 0.051 19168 767 1 2 . 1 1 74 74 ASP C C 74 175.935 175.935 175.747 0.188 19168 768 1 2 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.158 -0.761 19168 769 1 2 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.748 0.472 19168 770 1 2 . 1 1 75 75 LYS N N 75 116.482 116.482 117.783 -1.301 19168 771 1 2 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.507 -0.062 19168 772 1 2 . 1 1 75 75 LYS C C 75 175.135 175.135 174.549 0.586 19168 773 1 2 . 1 1 75 75 LYS CA C 75 54.785 54.785 54.995 -0.210 19168 774 1 2 . 1 1 75 75 LYS CB C 75 35.475 35.475 35.630 -0.155 19168 775 1 2 . 1 1 76 76 GLU N N 76 120.126 120.126 122.531 -2.405 19168 776 1 2 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.377 -0.469 19168 777 1 2 . 1 1 76 76 GLU C C 76 173.204 173.204 175.238 -2.034 19168 778 1 2 . 1 1 76 76 GLU CA C 76 55.524 55.524 54.247 1.277 19168 779 1 2 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.198 -1.687 19168 780 1 2 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.751 0.026 19168 781 1 2 . 1 1 77 77 PRO C C 77 174.933 174.933 176.216 -1.283 19168 782 1 2 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.981 0.441 19168 783 1 2 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.062 0.329 19168 784 1 2 . 1 1 78 78 ASN N N 78 119.292 119.292 119.588 -0.296 19168 785 1 2 . 1 1 78 78 ASN HA H 78 5.093 5.093 4.875 0.218 19168 786 1 2 . 1 1 78 78 ASN C C 78 172.876 172.876 172.715 0.161 19168 787 1 2 . 1 1 78 78 ASN CA C 78 51.928 51.928 51.709 0.219 19168 788 1 2 . 1 1 78 78 ASN CB C 78 42.017 42.017 40.861 1.156 19168 789 1 2 . 1 1 79 79 PHE N N 79 125.023 125.023 121.742 3.281 19168 790 1 2 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.227 0.196 19168 791 1 2 . 1 1 79 79 PHE C C 79 174.552 174.552 174.796 -0.244 19168 792 1 2 . 1 1 79 79 PHE CA C 79 55.210 55.210 57.167 -1.957 19168 793 1 2 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.254 -0.145 19168 794 1 2 . 1 1 80 80 GLU N N 80 128.920 128.920 127.622 1.298 19168 795 1 2 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.525 -0.317 19168 796 1 2 . 1 1 80 80 GLU C C 80 175.538 175.538 176.227 -0.689 19168 797 1 2 . 1 1 80 80 GLU CA C 80 55.724 55.724 55.021 0.703 19168 798 1 2 . 1 1 80 80 GLU CB C 80 32.135 32.135 32.078 0.057 19168 799 1 2 . 1 1 81 81 GLY N N 81 116.695 116.695 114.218 2.477 19168 800 1 2 . 1 1 81 81 GLY C C 81 173.950 173.950 174.452 -0.502 19168 801 1 2 . 1 1 81 81 GLY CA C 81 46.967 46.967 46.813 0.154 19168 802 1 2 . 1 1 82 82 ARG N N 82 124.481 124.481 122.489 1.992 19168 803 1 2 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.417 0.122 19168 804 1 2 . 1 1 82 82 ARG C C 82 173.437 173.437 174.376 -0.939 19168 805 1 2 . 1 1 82 82 ARG CA C 82 55.156 55.156 55.218 -0.062 19168 806 1 2 . 1 1 82 82 ARG CB C 82 30.255 30.255 32.183 -1.928 19168 807 1 2 . 1 1 83 83 TYR N N 83 114.539 114.539 118.197 -3.658 19168 808 1 2 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.456 0.492 19168 809 1 2 . 1 1 83 83 TYR C C 83 175.909 175.909 174.512 1.397 19168 810 1 2 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.645 -0.588 19168 811 1 2 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.031 0.968 19168 812 1 2 . 1 1 84 84 VAL N N 84 118.812 118.812 123.125 -4.313 19168 813 1 2 . 1 1 84 84 VAL HA H 84 4.867 4.867 5.155 -0.288 19168 814 1 2 . 1 1 84 84 VAL C C 84 174.982 174.982 175.435 -0.453 19168 815 1 2 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.616 -0.381 19168 816 1 2 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.507 -0.016 19168 817 1 2 . 1 1 85 85 ASN N N 85 124.630 124.630 126.110 -1.480 19168 818 1 2 . 1 1 85 85 ASN HA H 85 6.004 6.004 5.927 0.077 19168 819 1 2 . 1 1 85 85 ASN C C 85 175.392 175.392 173.822 1.570 19168 820 1 2 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.976 0.620 19168 821 1 2 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.660 1.546 19168 822 1 2 . 1 1 86 86 MET N N 86 118.969 118.969 121.946 -2.977 19168 823 1 2 . 1 1 86 86 MET HA H 86 4.640 4.640 4.821 -0.181 19168 824 1 2 . 1 1 86 86 MET C C 86 172.378 172.378 173.057 -0.679 19168 825 1 2 . 1 1 86 86 MET CA C 86 56.158 56.158 54.497 1.661 19168 826 1 2 . 1 1 86 86 MET CB C 86 39.138 39.138 36.722 2.416 19168 827 1 2 . 1 1 87 87 LEU N N 87 131.886 131.886 127.279 4.607 19168 828 1 2 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.264 0.117 19168 829 1 2 . 1 1 87 87 LEU C C 87 176.003 176.003 174.652 1.351 19168 830 1 2 . 1 1 87 87 LEU CA C 87 54.130 54.130 52.969 1.161 19168 831 1 2 . 1 1 87 87 LEU CB C 87 44.473 44.473 45.672 -1.199 19168 832 1 2 . 1 1 88 88 VAL N N 88 121.165 121.165 120.200 0.965 19168 833 1 2 . 1 1 88 88 VAL HA H 88 5.510 5.510 5.154 0.356 19168 834 1 2 . 1 1 88 88 VAL C C 88 173.666 173.666 174.763 -1.097 19168 835 1 2 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.590 -0.990 19168 836 1 2 . 1 1 88 88 VAL CB C 88 34.793 34.793 35.728 -0.935 19168 837 1 2 . 1 1 89 89 THR N N 89 111.786 111.786 117.159 -5.373 19168 838 1 2 . 1 1 89 89 THR HA H 89 4.720 4.720 4.290 0.430 19168 839 1 2 . 1 1 89 89 THR C C 89 171.898 171.898 172.142 -0.244 19168 840 1 2 . 1 1 89 89 THR CA C 89 57.985 57.985 59.057 -1.072 19168 841 1 2 . 1 1 89 89 THR CB C 89 69.113 69.113 70.296 -1.183 19168 842 1 2 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.509 0.074 19168 843 1 2 . 1 1 90 90 PRO C C 90 177.403 177.403 177.070 0.333 19168 844 1 2 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.499 1.032 19168 845 1 2 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.438 -0.395 19168 846 1 2 . 1 1 91 91 LYS N N 91 123.696 123.696 121.912 1.784 19168 847 1 2 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.417 -0.306 19168 848 1 2 . 1 1 91 91 LYS C C 91 176.568 176.568 176.857 -0.289 19168 849 1 2 . 1 1 91 91 LYS CA C 91 57.208 57.208 57.033 0.175 19168 850 1 2 . 1 1 91 91 LYS CB C 91 33.183 33.183 30.668 2.515 19168 851 1 2 . 1 1 92 92 LYS N N 92 122.054 122.054 123.133 -1.079 19168 852 1 2 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.334 -0.018 19168 853 1 2 . 1 1 92 92 LYS C C 92 175.956 175.956 176.717 -0.761 19168 854 1 2 . 1 1 92 92 LYS CA C 92 55.942 55.942 56.841 -0.899 19168 855 1 2 . 1 1 92 92 LYS CB C 92 33.000 33.000 33.465 -0.465 19168 856 1 2 . 1 1 93 93 ALA N N 93 126.278 126.278 122.989 3.289 19168 857 1 2 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.670 -0.329 19168 858 1 2 . 1 1 93 93 ALA C C 93 177.592 177.592 176.883 0.709 19168 859 1 2 . 1 1 93 93 ALA CA C 93 52.279 52.279 51.883 0.396 19168 860 1 2 . 1 1 93 93 ALA CB C 93 19.332 19.332 18.289 1.043 19168 861 1 2 . 1 1 94 94 GLU N N 94 120.522 120.522 123.326 -2.804 19168 862 1 2 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.332 -0.048 19168 863 1 2 . 1 1 94 94 GLU C C 94 177.041 177.041 177.844 -0.803 19168 864 1 2 . 1 1 94 94 GLU CA C 94 56.606 56.606 57.253 -0.647 19168 865 1 2 . 1 1 94 94 GLU CB C 94 30.353 30.353 30.028 0.325 19168 866 1 2 . 1 1 95 95 GLY N N 95 109.755 109.755 108.199 1.556 19168 867 1 2 . 1 1 95 95 GLY C C 95 173.939 173.939 174.652 -0.713 19168 868 1 2 . 1 1 95 95 GLY CA C 95 45.168 45.168 44.895 0.273 19168 869 1 3 . 1 1 5 5 VAL N N 5 123.289 123.289 123.021 0.268 19168 870 1 3 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.547 -0.528 19168 871 1 3 . 1 1 5 5 VAL C C 5 175.799 175.799 175.369 0.430 19168 872 1 3 . 1 1 5 5 VAL CA C 5 62.120 62.120 61.060 1.060 19168 873 1 3 . 1 1 5 5 VAL CB C 5 32.757 32.757 33.539 -0.782 19168 874 1 3 . 1 1 6 6 ILE N N 6 126.794 126.794 122.402 4.392 19168 875 1 3 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.078 -0.111 19168 876 1 3 . 1 1 6 6 ILE C C 6 175.103 175.103 175.659 -0.556 19168 877 1 3 . 1 1 6 6 ILE CA C 6 60.227 60.227 61.366 -1.139 19168 878 1 3 . 1 1 6 6 ILE CB C 6 38.565 38.565 38.334 0.231 19168 879 1 3 . 1 1 7 7 ASP N N 7 127.797 127.797 127.949 -0.152 19168 880 1 3 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.562 -0.018 19168 881 1 3 . 1 1 7 7 ASP C C 7 174.000 174.000 174.950 -0.950 19168 882 1 3 . 1 1 7 7 ASP CA C 7 53.591 53.591 54.351 -0.760 19168 883 1 3 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.268 0.884 19168 884 1 3 . 1 1 8 8 ILE N N 8 122.764 122.764 124.481 -1.717 19168 885 1 3 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.185 0.135 19168 886 1 3 . 1 1 8 8 ILE C C 8 176.337 176.337 175.254 1.083 19168 887 1 3 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.144 0.032 19168 888 1 3 . 1 1 8 8 ILE CB C 8 39.542 39.542 40.866 -1.324 19168 889 1 3 . 1 1 9 9 LYS N N 9 127.990 127.990 125.992 1.998 19168 890 1 3 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.480 -0.158 19168 891 1 3 . 1 1 9 9 LYS C C 9 174.759 174.759 175.214 -0.455 19168 892 1 3 . 1 1 9 9 LYS CA C 9 52.315 52.315 54.102 -1.786 19168 893 1 3 . 1 1 9 9 LYS CB C 9 32.902 32.902 34.145 -1.243 19168 894 1 3 . 1 1 10 10 GLU N N 10 123.021 123.021 120.133 2.888 19168 895 1 3 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.882 0.253 19168 896 1 3 . 1 1 10 10 GLU C C 10 176.215 176.215 175.559 0.656 19168 897 1 3 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.311 -0.409 19168 898 1 3 . 1 1 10 10 GLU CB C 10 32.037 32.037 32.004 0.033 19168 899 1 3 . 1 1 11 11 ILE N N 11 126.526 126.526 126.641 -0.115 19168 900 1 3 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.233 0.102 19168 901 1 3 . 1 1 11 11 ILE C C 11 174.334 174.334 174.433 -0.099 19168 902 1 3 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.196 0.114 19168 903 1 3 . 1 1 11 11 ILE CB C 11 39.826 39.826 39.620 0.207 19168 904 1 3 . 1 1 12 12 LYS N N 12 128.164 128.164 128.715 -0.551 19168 905 1 3 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.523 -0.178 19168 906 1 3 . 1 1 12 12 LYS C C 12 176.378 176.378 175.541 0.837 19168 907 1 3 . 1 1 12 12 LYS CA C 12 55.940 55.940 55.578 0.362 19168 908 1 3 . 1 1 12 12 LYS CB C 12 34.056 34.056 34.447 -0.390 19168 909 1 3 . 1 1 13 13 LEU N N 13 121.881 121.881 125.495 -3.614 19168 910 1 3 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.865 0.089 19168 911 1 3 . 1 1 13 13 LEU C C 13 175.137 175.137 175.068 0.069 19168 912 1 3 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.775 0.199 19168 913 1 3 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.459 -0.175 19168 914 1 3 . 1 1 14 14 SER N N 14 115.759 115.759 112.586 3.173 19168 915 1 3 . 1 1 14 14 SER HA H 14 4.889 4.889 5.100 -0.211 19168 916 1 3 . 1 1 14 14 SER C C 14 173.993 173.993 174.284 -0.291 19168 917 1 3 . 1 1 14 14 SER CA C 14 56.052 56.052 56.585 -0.533 19168 918 1 3 . 1 1 14 14 SER CB C 14 64.775 64.775 66.419 -1.644 19168 919 1 3 . 1 1 15 15 VAL N N 15 120.993 120.993 118.977 2.016 19168 920 1 3 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.847 -0.113 19168 921 1 3 . 1 1 15 15 VAL C C 15 176.964 176.964 177.076 -0.112 19168 922 1 3 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.121 0.306 19168 923 1 3 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.531 0.254 19168 924 1 3 . 1 1 16 16 LYS N N 16 118.897 118.897 119.950 -1.053 19168 925 1 3 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.351 0.050 19168 926 1 3 . 1 1 16 16 LYS C C 16 175.489 175.489 174.833 0.656 19168 927 1 3 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.598 -0.443 19168 928 1 3 . 1 1 16 16 LYS CB C 16 30.929 30.929 29.824 1.105 19168 929 1 3 . 1 1 17 17 ILE N N 17 122.247 122.247 120.104 2.143 19168 930 1 3 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.328 -0.143 19168 931 1 3 . 1 1 17 17 ILE C C 17 173.426 173.426 174.267 -0.841 19168 932 1 3 . 1 1 17 17 ILE CA C 17 61.276 61.276 59.733 1.543 19168 933 1 3 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.651 -1.571 19168 934 1 3 . 1 1 18 18 ALA N N 18 129.434 129.434 126.223 3.211 19168 935 1 3 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.618 -0.139 19168 936 1 3 . 1 1 18 18 ALA C C 18 179.130 179.130 177.707 1.423 19168 937 1 3 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.193 0.244 19168 938 1 3 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.261 -0.352 19168 939 1 3 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.001 -0.204 19168 940 1 3 . 1 1 19 19 GLN CA C 19 59.231 59.231 58.748 0.483 19168 941 1 3 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.546 -0.371 19168 942 1 3 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.455 -0.025 19168 943 1 3 . 1 1 20 20 ASN C C 20 177.272 177.272 177.596 -0.324 19168 944 1 3 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.428 -0.244 19168 945 1 3 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.879 -0.426 19168 946 1 3 . 1 1 21 21 ASP N N 21 119.132 119.132 120.322 -1.190 19168 947 1 3 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.518 0.280 19168 948 1 3 . 1 1 21 21 ASP C C 21 178.707 178.707 178.668 0.039 19168 949 1 3 . 1 1 21 21 ASP CA C 21 56.886 56.886 56.945 -0.059 19168 950 1 3 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.890 -0.225 19168 951 1 3 . 1 1 22 22 ILE N N 22 122.030 122.030 120.071 1.959 19168 952 1 3 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.645 -0.227 19168 953 1 3 . 1 1 22 22 ILE C C 22 177.454 177.454 177.933 -0.479 19168 954 1 3 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.422 1.304 19168 955 1 3 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.690 -0.124 19168 956 1 3 . 1 1 23 23 ASN N N 23 116.728 116.728 118.836 -2.108 19168 957 1 3 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.484 -0.271 19168 958 1 3 . 1 1 23 23 ASN C C 23 178.260 178.260 177.799 0.461 19168 959 1 3 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.235 0.039 19168 960 1 3 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.183 -0.975 19168 961 1 3 . 1 1 24 24 TYR N N 24 119.864 119.864 122.079 -2.215 19168 962 1 3 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.220 0.073 19168 963 1 3 . 1 1 24 24 TYR C C 24 177.719 177.719 177.519 0.200 19168 964 1 3 . 1 1 24 24 TYR CA C 24 61.048 61.048 62.197 -1.149 19168 965 1 3 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.752 -0.469 19168 966 1 3 . 1 1 25 25 LYS N N 25 119.730 119.730 118.746 0.984 19168 967 1 3 . 1 1 25 25 LYS HA H 25 4.111 4.111 4.088 0.023 19168 968 1 3 . 1 1 25 25 LYS C C 25 179.152 179.152 179.399 -0.247 19168 969 1 3 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.124 0.038 19168 970 1 3 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.403 -0.109 19168 971 1 3 . 1 1 26 26 VAL N N 26 119.387 119.387 116.106 3.281 19168 972 1 3 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.971 -0.351 19168 973 1 3 . 1 1 26 26 VAL C C 26 177.017 177.017 177.561 -0.544 19168 974 1 3 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.203 1.458 19168 975 1 3 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.339 0.211 19168 976 1 3 . 1 1 27 27 LYS N N 27 120.420 120.420 120.901 -0.481 19168 977 1 3 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.880 0.066 19168 978 1 3 . 1 1 27 27 LYS C C 27 179.458 179.458 178.948 0.510 19168 979 1 3 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.699 0.179 19168 980 1 3 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.276 -0.428 19168 981 1 3 . 1 1 28 28 HIS N N 28 118.160 118.160 117.855 0.305 19168 982 1 3 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.613 -0.426 19168 983 1 3 . 1 1 28 28 HIS C C 28 177.085 177.085 177.401 -0.316 19168 984 1 3 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.569 -1.684 19168 985 1 3 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.957 -0.201 19168 986 1 3 . 1 1 29 29 ALA N N 29 120.579 120.579 122.728 -2.149 19168 987 1 3 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.313 -0.315 19168 988 1 3 . 1 1 29 29 ALA C C 29 179.299 179.299 179.664 -0.365 19168 989 1 3 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.310 0.257 19168 990 1 3 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.371 1.078 19168 991 1 3 . 1 1 30 30 LEU N N 30 117.262 117.262 117.436 -0.174 19168 992 1 3 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.936 0.139 19168 993 1 3 . 1 1 30 30 LEU C C 30 180.017 180.017 179.122 0.895 19168 994 1 3 . 1 1 30 30 LEU CA C 30 58.232 58.232 58.076 0.156 19168 995 1 3 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.571 -0.245 19168 996 1 3 . 1 1 31 31 GLU N N 31 120.625 120.625 119.450 1.175 19168 997 1 3 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.933 0.135 19168 998 1 3 . 1 1 31 31 GLU C C 31 179.572 179.572 179.249 0.323 19168 999 1 3 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.114 0.161 19168 1000 1 3 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.124 -0.149 19168 1001 1 3 . 1 1 32 32 PHE N N 32 118.245 118.245 118.614 -0.369 19168 1002 1 3 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.255 0.271 19168 1003 1 3 . 1 1 32 32 PHE C C 32 179.123 179.123 177.674 1.449 19168 1004 1 3 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.858 -3.161 19168 1005 1 3 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.847 -1.595 19168 1006 1 3 . 1 1 33 33 LEU N N 33 121.684 121.684 120.399 1.285 19168 1007 1 3 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.322 0.269 19168 1008 1 3 . 1 1 33 33 LEU C C 33 181.655 181.655 180.033 1.622 19168 1009 1 3 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.585 0.587 19168 1010 1 3 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.697 -0.005 19168 1011 1 3 . 1 1 34 34 GLU N N 34 122.046 122.046 117.913 4.133 19168 1012 1 3 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.102 0.050 19168 1013 1 3 . 1 1 34 34 GLU C C 34 178.237 178.237 178.192 0.045 19168 1014 1 3 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.860 0.286 19168 1015 1 3 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.050 0.184 19168 1016 1 3 . 1 1 35 35 GLN N N 35 115.697 115.697 115.323 0.374 19168 1017 1 3 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.397 -0.010 19168 1018 1 3 . 1 1 35 35 GLN C C 35 176.456 176.456 177.089 -0.633 19168 1019 1 3 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.199 0.487 19168 1020 1 3 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.146 0.050 19168 1021 1 3 . 1 1 36 36 GLY N N 36 108.291 108.291 107.966 0.325 19168 1022 1 3 . 1 1 36 36 GLY C C 36 174.673 174.673 174.207 0.466 19168 1023 1 3 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.513 0.014 19168 1024 1 3 . 1 1 37 37 LYS N N 37 120.464 120.464 119.271 1.193 19168 1025 1 3 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.833 -0.336 19168 1026 1 3 . 1 1 37 37 LYS C C 37 174.580 174.580 176.049 -1.469 19168 1027 1 3 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.897 0.192 19168 1028 1 3 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.830 -2.085 19168 1029 1 3 . 1 1 38 38 HIS N N 38 116.878 116.878 117.182 -0.304 19168 1030 1 3 . 1 1 38 38 HIS HA H 38 5.019 5.019 5.081 -0.062 19168 1031 1 3 . 1 1 38 38 HIS C C 38 175.268 175.268 174.530 0.738 19168 1032 1 3 . 1 1 38 38 HIS CA C 38 54.150 54.150 54.771 -0.621 19168 1033 1 3 . 1 1 38 38 HIS CB C 38 32.877 32.877 32.668 0.209 19168 1034 1 3 . 1 1 39 39 VAL N N 39 119.782 119.782 120.670 -0.888 19168 1035 1 3 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.370 0.426 19168 1036 1 3 . 1 1 39 39 VAL C C 39 173.320 173.320 174.135 -0.815 19168 1037 1 3 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.737 0.029 19168 1038 1 3 . 1 1 39 39 VAL CB C 39 35.433 35.433 33.883 1.550 19168 1039 1 3 . 1 1 40 40 ARG N N 40 128.358 128.358 127.584 0.774 19168 1040 1 3 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.829 0.286 19168 1041 1 3 . 1 1 40 40 ARG C C 40 175.659 175.659 174.922 0.737 19168 1042 1 3 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.451 -0.629 19168 1043 1 3 . 1 1 40 40 ARG CB C 40 33.007 33.007 31.871 1.136 19168 1044 1 3 . 1 1 41 41 PHE N N 41 126.396 126.396 127.623 -1.227 19168 1045 1 3 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.376 -0.198 19168 1046 1 3 . 1 1 41 41 PHE C C 41 176.107 176.107 175.360 0.747 19168 1047 1 3 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.908 -0.213 19168 1048 1 3 . 1 1 41 41 PHE CB C 41 42.046 42.046 40.153 1.893 19168 1049 1 3 . 1 1 42 42 ARG N N 42 120.641 120.641 122.940 -2.299 19168 1050 1 3 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.462 0.077 19168 1051 1 3 . 1 1 42 42 ARG C C 42 175.010 175.010 174.464 0.546 19168 1052 1 3 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.852 -0.157 19168 1053 1 3 . 1 1 42 42 ARG CB C 42 34.374 34.374 34.738 -0.364 19168 1054 1 3 . 1 1 43 43 VAL N N 43 125.565 125.565 122.688 2.877 19168 1055 1 3 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.147 -0.482 19168 1056 1 3 . 1 1 43 43 VAL C C 43 175.325 175.325 173.501 1.824 19168 1057 1 3 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.997 0.819 19168 1058 1 3 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.877 -2.894 19168 1059 1 3 . 1 1 44 44 PHE N N 44 128.291 128.291 129.607 -1.316 19168 1060 1 3 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.400 0.218 19168 1061 1 3 . 1 1 44 44 PHE C C 44 174.477 174.477 173.866 0.611 19168 1062 1 3 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.337 0.811 19168 1063 1 3 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.680 -1.739 19168 1064 1 3 . 1 1 45 45 LEU N N 45 128.360 128.360 128.647 -0.287 19168 1065 1 3 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.447 -0.056 19168 1066 1 3 . 1 1 45 45 LEU C C 45 174.342 174.342 176.863 -2.521 19168 1067 1 3 . 1 1 45 45 LEU CA C 45 53.586 53.586 54.092 -0.506 19168 1068 1 3 . 1 1 45 45 LEU CB C 45 41.113 41.113 40.925 0.188 19168 1069 1 3 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.057 0.035 19168 1070 1 3 . 1 1 46 46 LYS CA C 46 55.079 55.079 58.401 -3.322 19168 1071 1 3 . 1 1 46 46 LYS CB C 46 34.295 34.295 33.151 1.145 19168 1072 1 3 . 1 1 47 47 GLY CA C 47 46.813 46.813 44.841 1.972 19168 1073 1 3 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.000 0.200 19168 1074 1 3 . 1 1 48 48 ARG C C 48 178.069 178.069 176.190 1.879 19168 1075 1 3 . 1 1 48 48 ARG CA C 48 57.862 57.862 58.010 -0.148 19168 1076 1 3 . 1 1 48 48 ARG CB C 48 29.444 29.444 29.502 -0.058 19168 1077 1 3 . 1 1 49 49 GLU N N 49 119.779 119.779 118.221 1.558 19168 1078 1 3 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.274 -0.221 19168 1079 1 3 . 1 1 49 49 GLU C C 49 178.227 178.227 177.702 0.525 19168 1080 1 3 . 1 1 49 49 GLU CA C 49 57.436 57.436 57.993 -0.557 19168 1081 1 3 . 1 1 49 49 GLU CB C 49 29.745 29.745 29.803 -0.058 19168 1082 1 3 . 1 1 50 50 MET N N 50 116.370 116.370 118.734 -2.364 19168 1083 1 3 . 1 1 50 50 MET HA H 50 4.024 4.024 4.207 -0.183 19168 1084 1 3 . 1 1 50 50 MET C C 50 175.912 175.912 176.956 -1.044 19168 1085 1 3 . 1 1 50 50 MET CA C 50 56.664 56.664 57.234 -0.570 19168 1086 1 3 . 1 1 50 50 MET CB C 50 32.033 32.033 31.950 0.083 19168 1087 1 3 . 1 1 51 51 ALA N N 51 118.880 118.880 122.059 -3.179 19168 1088 1 3 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.169 0.175 19168 1089 1 3 . 1 1 51 51 ALA C C 51 177.746 177.746 177.719 0.027 19168 1090 1 3 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.608 -1.218 19168 1091 1 3 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.175 0.268 19168 1092 1 3 . 1 1 52 52 THR N N 52 108.299 108.299 110.125 -1.826 19168 1093 1 3 . 1 1 52 52 THR HA H 52 4.869 4.869 4.642 0.227 19168 1094 1 3 . 1 1 52 52 THR C C 52 173.933 173.933 172.370 1.563 19168 1095 1 3 . 1 1 52 52 THR CA C 52 57.554 57.554 58.172 -0.618 19168 1096 1 3 . 1 1 52 52 THR CB C 52 69.479 69.479 69.790 -0.311 19168 1097 1 3 . 1 1 53 53 PRO HA H 53 3.931 3.931 4.097 -0.166 19168 1098 1 3 . 1 1 53 53 PRO C C 53 178.185 178.185 177.996 0.189 19168 1099 1 3 . 1 1 53 53 PRO CA C 53 65.019 65.019 63.963 1.056 19168 1100 1 3 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.369 -0.853 19168 1101 1 3 . 1 1 54 54 GLU N N 54 120.653 120.653 118.649 2.004 19168 1102 1 3 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.013 0.003 19168 1103 1 3 . 1 1 54 54 GLU C C 54 178.608 178.608 177.958 0.650 19168 1104 1 3 . 1 1 54 54 GLU CA C 54 59.472 59.472 59.177 0.295 19168 1105 1 3 . 1 1 54 54 GLU CB C 54 27.419 27.419 29.177 -1.758 19168 1106 1 3 . 1 1 55 55 ALA N N 55 124.380 124.380 120.601 3.779 19168 1107 1 3 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.090 0.233 19168 1108 1 3 . 1 1 55 55 ALA C C 55 181.502 181.502 179.820 1.682 19168 1109 1 3 . 1 1 55 55 ALA CA C 55 54.780 54.780 54.913 -0.133 19168 1110 1 3 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.188 0.213 19168 1111 1 3 . 1 1 56 56 GLY N N 56 105.673 105.673 107.033 -1.360 19168 1112 1 3 . 1 1 56 56 GLY C C 56 174.278 174.278 176.326 -2.048 19168 1113 1 3 . 1 1 56 56 GLY CA C 56 46.879 46.879 47.162 -0.283 19168 1114 1 3 . 1 1 57 57 VAL N N 57 122.685 122.685 122.660 0.025 19168 1115 1 3 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.726 -0.404 19168 1116 1 3 . 1 1 57 57 VAL C C 57 177.134 177.134 177.741 -0.607 19168 1117 1 3 . 1 1 57 57 VAL CA C 57 67.396 67.396 65.221 2.175 19168 1118 1 3 . 1 1 57 57 VAL CB C 57 31.769 31.769 30.830 0.939 19168 1119 1 3 . 1 1 58 58 ALA N N 58 119.580 119.580 123.329 -3.749 19168 1120 1 3 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.028 0.066 19168 1121 1 3 . 1 1 58 58 ALA C C 58 180.788 180.788 179.648 1.140 19168 1122 1 3 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.393 -0.340 19168 1123 1 3 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.448 -0.594 19168 1124 1 3 . 1 1 59 59 LEU N N 59 119.723 119.723 120.314 -0.591 19168 1125 1 3 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.000 0.258 19168 1126 1 3 . 1 1 59 59 LEU C C 59 178.024 178.024 178.591 -0.567 19168 1127 1 3 . 1 1 59 59 LEU CA C 59 57.710 57.710 58.200 -0.490 19168 1128 1 3 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.069 -0.368 19168 1129 1 3 . 1 1 60 60 LEU N N 60 117.978 117.978 118.840 -0.862 19168 1130 1 3 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.817 0.040 19168 1131 1 3 . 1 1 60 60 LEU C C 60 178.851 178.851 179.228 -0.377 19168 1132 1 3 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.062 -0.418 19168 1133 1 3 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.234 -0.946 19168 1134 1 3 . 1 1 61 61 GLU N N 61 119.906 119.906 119.681 0.225 19168 1135 1 3 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.060 0.431 19168 1136 1 3 . 1 1 61 61 GLU C C 61 179.519 179.519 179.086 0.433 19168 1137 1 3 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.622 -0.880 19168 1138 1 3 . 1 1 61 61 GLU CB C 61 28.813 28.813 29.040 -0.227 19168 1139 1 3 . 1 1 62 62 LYS N N 62 122.015 122.015 120.590 1.425 19168 1140 1 3 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.107 0.021 19168 1141 1 3 . 1 1 62 62 LYS C C 62 179.843 179.843 179.501 0.342 19168 1142 1 3 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.303 0.034 19168 1143 1 3 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.388 -0.741 19168 1144 1 3 . 1 1 63 63 ILE N N 63 120.882 120.882 120.382 0.500 19168 1145 1 3 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.689 -0.194 19168 1146 1 3 . 1 1 63 63 ILE C C 63 177.761 177.761 177.350 0.411 19168 1147 1 3 . 1 1 63 63 ILE CA C 63 65.182 65.182 65.181 0.001 19168 1148 1 3 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.838 -0.452 19168 1149 1 3 . 1 1 64 64 TRP N N 64 120.279 120.279 121.812 -1.533 19168 1150 1 3 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.096 0.388 19168 1151 1 3 . 1 1 64 64 TRP C C 64 177.056 177.056 177.942 -0.886 19168 1152 1 3 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.212 -1.118 19168 1153 1 3 . 1 1 64 64 TRP CB C 64 29.635 29.635 30.115 -0.480 19168 1154 1 3 . 1 1 65 65 THR N N 65 109.483 109.483 109.529 -0.046 19168 1155 1 3 . 1 1 65 65 THR HA H 65 3.744 3.744 4.180 -0.436 19168 1156 1 3 . 1 1 65 65 THR C C 65 176.224 176.224 175.850 0.374 19168 1157 1 3 . 1 1 65 65 THR CA C 65 65.568 65.568 63.862 1.706 19168 1158 1 3 . 1 1 65 65 THR CB C 65 69.308 69.308 68.625 0.683 19168 1159 1 3 . 1 1 66 66 MET N N 66 117.791 117.791 119.715 -1.924 19168 1160 1 3 . 1 1 66 66 MET HA H 66 4.110 4.110 4.322 -0.212 19168 1161 1 3 . 1 1 66 66 MET C C 66 177.782 177.782 178.067 -0.285 19168 1162 1 3 . 1 1 66 66 MET CA C 66 58.304 58.304 58.475 -0.171 19168 1163 1 3 . 1 1 66 66 MET CB C 66 34.040 34.040 33.957 0.083 19168 1164 1 3 . 1 1 67 67 ILE N N 67 109.871 109.871 115.810 -5.939 19168 1165 1 3 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.038 0.604 19168 1166 1 3 . 1 1 67 67 ILE C C 67 176.713 176.713 176.693 0.020 19168 1167 1 3 . 1 1 67 67 ILE CA C 67 61.174 61.174 63.133 -1.959 19168 1168 1 3 . 1 1 67 67 ILE CB C 67 39.813 39.813 37.460 2.353 19168 1169 1 3 . 1 1 68 68 GLU N N 68 121.972 121.972 119.358 2.614 19168 1170 1 3 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.433 -0.685 19168 1171 1 3 . 1 1 68 68 GLU C C 68 175.855 175.855 176.769 -0.914 19168 1172 1 3 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.103 0.188 19168 1173 1 3 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.757 0.735 19168 1174 1 3 . 1 1 69 69 ASN N N 69 114.338 114.338 116.735 -2.397 19168 1175 1 3 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.469 0.111 19168 1176 1 3 . 1 1 69 69 ASN C C 69 175.904 175.904 176.865 -0.961 19168 1177 1 3 . 1 1 69 69 ASN CA C 69 54.597 54.597 55.280 -0.683 19168 1178 1 3 . 1 1 69 69 ASN CB C 69 38.323 38.323 38.453 -0.130 19168 1179 1 3 . 1 1 70 70 GLU N N 70 116.936 116.936 115.854 1.082 19168 1180 1 3 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.576 -0.028 19168 1181 1 3 . 1 1 70 70 GLU C C 70 174.941 174.941 174.592 0.349 19168 1182 1 3 . 1 1 70 70 GLU CA C 70 55.983 55.983 55.629 0.354 19168 1183 1 3 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.232 0.116 19168 1184 1 3 . 1 1 71 71 ALA N N 71 122.966 122.966 121.986 0.980 19168 1185 1 3 . 1 1 71 71 ALA HA H 71 5.246 5.246 5.118 0.128 19168 1186 1 3 . 1 1 71 71 ALA C C 71 173.907 173.907 175.557 -1.650 19168 1187 1 3 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.318 0.500 19168 1188 1 3 . 1 1 71 71 ALA CB C 71 24.060 24.060 21.894 2.166 19168 1189 1 3 . 1 1 72 72 ASN N N 72 115.820 115.820 119.992 -4.172 19168 1190 1 3 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.346 0.095 19168 1191 1 3 . 1 1 72 72 ASN C C 72 174.137 174.137 174.876 -0.739 19168 1192 1 3 . 1 1 72 72 ASN CA C 72 51.659 51.659 51.872 -0.213 19168 1193 1 3 . 1 1 72 72 ASN CB C 72 42.186 42.186 41.351 0.835 19168 1194 1 3 . 1 1 73 73 ARG N N 73 118.340 118.340 124.680 -6.340 19168 1195 1 3 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.819 0.959 19168 1196 1 3 . 1 1 73 73 ARG C C 73 174.674 174.674 175.180 -0.506 19168 1197 1 3 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.998 -2.129 19168 1198 1 3 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.303 2.822 19168 1199 1 3 . 1 1 74 74 ASP N N 74 124.007 124.007 126.793 -2.786 19168 1200 1 3 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.494 0.048 19168 1201 1 3 . 1 1 74 74 ASP C C 74 175.935 175.935 175.677 0.258 19168 1202 1 3 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.606 -1.209 19168 1203 1 3 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.564 0.656 19168 1204 1 3 . 1 1 75 75 LYS N N 75 116.482 116.482 118.514 -2.032 19168 1205 1 3 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.522 -0.077 19168 1206 1 3 . 1 1 75 75 LYS C C 75 175.135 175.135 175.053 0.082 19168 1207 1 3 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.103 -0.318 19168 1208 1 3 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.665 0.810 19168 1209 1 3 . 1 1 76 76 GLU N N 76 120.126 120.126 125.627 -5.501 19168 1210 1 3 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.233 -0.325 19168 1211 1 3 . 1 1 76 76 GLU C C 76 173.204 173.204 174.995 -1.791 19168 1212 1 3 . 1 1 76 76 GLU CA C 76 55.524 55.524 55.209 0.315 19168 1213 1 3 . 1 1 76 76 GLU CB C 76 27.511 27.511 28.825 -1.314 19168 1214 1 3 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.776 0.001 19168 1215 1 3 . 1 1 77 77 PRO C C 77 174.933 174.933 176.148 -1.215 19168 1216 1 3 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.920 0.502 19168 1217 1 3 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.283 0.108 19168 1218 1 3 . 1 1 78 78 ASN N N 78 119.292 119.292 121.211 -1.919 19168 1219 1 3 . 1 1 78 78 ASN HA H 78 5.093 5.093 4.991 0.102 19168 1220 1 3 . 1 1 78 78 ASN C C 78 172.876 172.876 173.657 -0.781 19168 1221 1 3 . 1 1 78 78 ASN CA C 78 51.928 51.928 52.196 -0.268 19168 1222 1 3 . 1 1 78 78 ASN CB C 78 42.017 42.017 42.319 -0.302 19168 1223 1 3 . 1 1 79 79 PHE N N 79 125.023 125.023 125.544 -0.521 19168 1224 1 3 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.316 0.107 19168 1225 1 3 . 1 1 79 79 PHE C C 79 174.552 174.552 174.635 -0.083 19168 1226 1 3 . 1 1 79 79 PHE CA C 79 55.210 55.210 56.550 -1.340 19168 1227 1 3 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.457 -0.348 19168 1228 1 3 . 1 1 80 80 GLU N N 80 128.920 128.920 126.978 1.942 19168 1229 1 3 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.531 -0.323 19168 1230 1 3 . 1 1 80 80 GLU C C 80 175.538 175.538 175.336 0.202 19168 1231 1 3 . 1 1 80 80 GLU CA C 80 55.724 55.724 55.064 0.660 19168 1232 1 3 . 1 1 80 80 GLU CB C 80 32.135 32.135 32.178 -0.044 19168 1233 1 3 . 1 1 81 81 GLY N N 81 116.695 116.695 114.316 2.379 19168 1234 1 3 . 1 1 81 81 GLY C C 81 173.950 173.950 174.307 -0.357 19168 1235 1 3 . 1 1 81 81 GLY CA C 81 46.967 46.967 46.791 0.176 19168 1236 1 3 . 1 1 82 82 ARG N N 82 124.481 124.481 123.422 1.059 19168 1237 1 3 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.657 -0.118 19168 1238 1 3 . 1 1 82 82 ARG C C 82 173.437 173.437 174.311 -0.874 19168 1239 1 3 . 1 1 82 82 ARG CA C 82 55.156 55.156 55.584 -0.428 19168 1240 1 3 . 1 1 82 82 ARG CB C 82 30.255 30.255 32.370 -2.115 19168 1241 1 3 . 1 1 83 83 TYR N N 83 114.539 114.539 118.356 -3.817 19168 1242 1 3 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.647 0.301 19168 1243 1 3 . 1 1 83 83 TYR C C 83 175.909 175.909 174.933 0.976 19168 1244 1 3 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.292 -0.235 19168 1245 1 3 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.360 0.639 19168 1246 1 3 . 1 1 84 84 VAL N N 84 118.812 118.812 123.001 -4.189 19168 1247 1 3 . 1 1 84 84 VAL HA H 84 4.867 4.867 5.012 -0.145 19168 1248 1 3 . 1 1 84 84 VAL C C 84 174.982 174.982 174.977 0.005 19168 1249 1 3 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.272 -0.037 19168 1250 1 3 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.961 -0.470 19168 1251 1 3 . 1 1 85 85 ASN N N 85 124.630 124.630 124.349 0.281 19168 1252 1 3 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.174 -0.170 19168 1253 1 3 . 1 1 85 85 ASN C C 85 175.392 175.392 173.528 1.864 19168 1254 1 3 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.231 1.365 19168 1255 1 3 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.610 1.596 19168 1256 1 3 . 1 1 86 86 MET N N 86 118.969 118.969 119.986 -1.017 19168 1257 1 3 . 1 1 86 86 MET HA H 86 4.640 4.640 4.857 -0.217 19168 1258 1 3 . 1 1 86 86 MET C C 86 172.378 172.378 173.605 -1.227 19168 1259 1 3 . 1 1 86 86 MET CA C 86 56.158 56.158 54.959 1.199 19168 1260 1 3 . 1 1 86 86 MET CB C 86 39.138 39.138 37.037 2.101 19168 1261 1 3 . 1 1 87 87 LEU N N 87 131.886 131.886 125.892 5.994 19168 1262 1 3 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.180 0.201 19168 1263 1 3 . 1 1 87 87 LEU C C 87 176.003 176.003 175.715 0.288 19168 1264 1 3 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.524 0.606 19168 1265 1 3 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.474 -0.001 19168 1266 1 3 . 1 1 88 88 VAL N N 88 121.165 121.165 119.178 1.987 19168 1267 1 3 . 1 1 88 88 VAL HA H 88 5.510 5.510 4.995 0.515 19168 1268 1 3 . 1 1 88 88 VAL C C 88 173.666 173.666 174.682 -1.016 19168 1269 1 3 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.374 -0.774 19168 1270 1 3 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.032 0.761 19168 1271 1 3 . 1 1 89 89 THR N N 89 111.786 111.786 121.070 -9.284 19168 1272 1 3 . 1 1 89 89 THR HA H 89 4.720 4.720 4.533 0.187 19168 1273 1 3 . 1 1 89 89 THR C C 89 171.898 171.898 172.154 -0.256 19168 1274 1 3 . 1 1 89 89 THR CA C 89 57.985 57.985 59.691 -1.706 19168 1275 1 3 . 1 1 89 89 THR CB C 89 69.113 69.113 69.751 -0.638 19168 1276 1 3 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.717 -0.134 19168 1277 1 3 . 1 1 90 90 PRO C C 90 177.403 177.403 177.539 -0.136 19168 1278 1 3 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.537 0.994 19168 1279 1 3 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.334 -0.291 19168 1280 1 3 . 1 1 91 91 LYS N N 91 123.696 123.696 122.993 0.703 19168 1281 1 3 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.251 -0.140 19168 1282 1 3 . 1 1 91 91 LYS C C 91 176.568 176.568 176.661 -0.093 19168 1283 1 3 . 1 1 91 91 LYS CA C 91 57.208 57.208 56.573 0.635 19168 1284 1 3 . 1 1 91 91 LYS CB C 91 33.183 33.183 30.372 2.811 19168 1285 1 3 . 1 1 92 92 LYS N N 92 122.054 122.054 122.090 -0.036 19168 1286 1 3 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.096 0.220 19168 1287 1 3 . 1 1 92 92 LYS C C 92 175.956 175.956 176.597 -0.641 19168 1288 1 3 . 1 1 92 92 LYS CA C 92 55.942 55.942 58.112 -2.170 19168 1289 1 3 . 1 1 92 92 LYS CB C 92 33.000 33.000 32.768 0.232 19168 1290 1 3 . 1 1 93 93 ALA N N 93 126.278 126.278 121.856 4.422 19168 1291 1 3 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.361 -0.020 19168 1292 1 3 . 1 1 93 93 ALA C C 93 177.592 177.592 176.657 0.935 19168 1293 1 3 . 1 1 93 93 ALA CA C 93 52.279 52.279 52.253 0.026 19168 1294 1 3 . 1 1 93 93 ALA CB C 93 19.332 19.332 18.544 0.788 19168 1295 1 3 . 1 1 94 94 GLU N N 94 120.522 120.522 125.771 -5.249 19168 1296 1 3 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.389 -0.105 19168 1297 1 3 . 1 1 94 94 GLU C C 94 177.041 177.041 175.609 1.432 19168 1298 1 3 . 1 1 94 94 GLU CA C 94 56.606 56.606 56.111 0.495 19168 1299 1 3 . 1 1 94 94 GLU CB C 94 30.353 30.353 31.553 -1.200 19168 1300 1 3 . 1 1 95 95 GLY N N 95 109.755 109.755 111.686 -1.931 19168 1301 1 3 . 1 1 95 95 GLY C C 95 173.939 173.939 174.610 -0.671 19168 1302 1 3 . 1 1 95 95 GLY CA C 95 45.168 45.168 44.520 0.647 19168 1303 1 4 . 1 1 5 5 VAL N N 5 123.289 123.289 121.179 2.110 19168 1304 1 4 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.147 -0.128 19168 1305 1 4 . 1 1 5 5 VAL C C 5 175.799 175.799 175.775 0.024 19168 1306 1 4 . 1 1 5 5 VAL CA C 5 62.120 62.120 62.980 -0.860 19168 1307 1 4 . 1 1 5 5 VAL CB C 5 32.757 32.757 32.265 0.492 19168 1308 1 4 . 1 1 6 6 ILE N N 6 126.794 126.794 121.410 5.384 19168 1309 1 4 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.221 -0.254 19168 1310 1 4 . 1 1 6 6 ILE C C 6 175.103 175.103 174.729 0.374 19168 1311 1 4 . 1 1 6 6 ILE CA C 6 60.227 60.227 60.415 -0.188 19168 1312 1 4 . 1 1 6 6 ILE CB C 6 38.565 38.565 39.517 -0.952 19168 1313 1 4 . 1 1 7 7 ASP N N 7 127.797 127.797 127.206 0.591 19168 1314 1 4 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.515 0.029 19168 1315 1 4 . 1 1 7 7 ASP C C 7 174.000 174.000 175.380 -1.380 19168 1316 1 4 . 1 1 7 7 ASP CA C 7 53.591 53.591 54.342 -0.751 19168 1317 1 4 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.124 1.028 19168 1318 1 4 . 1 1 8 8 ILE N N 8 122.764 122.764 125.339 -2.575 19168 1319 1 4 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.027 0.293 19168 1320 1 4 . 1 1 8 8 ILE C C 8 176.337 176.337 175.666 0.671 19168 1321 1 4 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.612 -0.436 19168 1322 1 4 . 1 1 8 8 ILE CB C 8 39.542 39.542 39.149 0.393 19168 1323 1 4 . 1 1 9 9 LYS N N 9 127.990 127.990 126.930 1.060 19168 1324 1 4 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.319 0.003 19168 1325 1 4 . 1 1 9 9 LYS C C 9 174.759 174.759 175.528 -0.769 19168 1326 1 4 . 1 1 9 9 LYS CA C 9 52.315 52.315 53.903 -1.588 19168 1327 1 4 . 1 1 9 9 LYS CB C 9 32.902 32.902 32.208 0.694 19168 1328 1 4 . 1 1 10 10 GLU N N 10 123.021 123.021 124.329 -1.308 19168 1329 1 4 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.798 0.337 19168 1330 1 4 . 1 1 10 10 GLU C C 10 176.215 176.215 175.714 0.501 19168 1331 1 4 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.411 -0.509 19168 1332 1 4 . 1 1 10 10 GLU CB C 10 32.037 32.037 30.654 1.383 19168 1333 1 4 . 1 1 11 11 ILE N N 11 126.526 126.526 127.288 -0.762 19168 1334 1 4 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.220 0.115 19168 1335 1 4 . 1 1 11 11 ILE C C 11 174.334 174.334 174.444 -0.110 19168 1336 1 4 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.180 0.130 19168 1337 1 4 . 1 1 11 11 ILE CB C 11 39.826 39.826 39.603 0.223 19168 1338 1 4 . 1 1 12 12 LYS N N 12 128.164 128.164 128.655 -0.491 19168 1339 1 4 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.303 0.042 19168 1340 1 4 . 1 1 12 12 LYS C C 12 176.378 176.378 175.338 1.040 19168 1341 1 4 . 1 1 12 12 LYS CA C 12 55.940 55.940 55.691 0.249 19168 1342 1 4 . 1 1 12 12 LYS CB C 12 34.056 34.056 34.320 -0.264 19168 1343 1 4 . 1 1 13 13 LEU N N 13 121.881 121.881 124.028 -2.147 19168 1344 1 4 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.962 -0.008 19168 1345 1 4 . 1 1 13 13 LEU C C 13 175.137 175.137 175.177 -0.040 19168 1346 1 4 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.275 0.699 19168 1347 1 4 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.221 0.063 19168 1348 1 4 . 1 1 14 14 SER N N 14 115.759 115.759 112.213 3.546 19168 1349 1 4 . 1 1 14 14 SER HA H 14 4.889 4.889 4.924 -0.035 19168 1350 1 4 . 1 1 14 14 SER C C 14 173.993 173.993 174.350 -0.357 19168 1351 1 4 . 1 1 14 14 SER CA C 14 56.052 56.052 56.739 -0.688 19168 1352 1 4 . 1 1 14 14 SER CB C 14 64.775 64.775 65.881 -1.106 19168 1353 1 4 . 1 1 15 15 VAL N N 15 120.993 120.993 119.611 1.382 19168 1354 1 4 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.874 -0.140 19168 1355 1 4 . 1 1 15 15 VAL C C 15 176.964 176.964 176.990 -0.026 19168 1356 1 4 . 1 1 15 15 VAL CA C 15 65.427 65.427 64.855 0.573 19168 1357 1 4 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.840 -0.055 19168 1358 1 4 . 1 1 16 16 LYS N N 16 118.897 118.897 120.247 -1.350 19168 1359 1 4 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.470 -0.069 19168 1360 1 4 . 1 1 16 16 LYS C C 16 175.489 175.489 175.333 0.156 19168 1361 1 4 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.378 -0.223 19168 1362 1 4 . 1 1 16 16 LYS CB C 16 30.929 30.929 31.361 -0.432 19168 1363 1 4 . 1 1 17 17 ILE N N 17 122.247 122.247 120.157 2.090 19168 1364 1 4 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.376 -0.191 19168 1365 1 4 . 1 1 17 17 ILE C C 17 173.426 173.426 174.617 -1.191 19168 1366 1 4 . 1 1 17 17 ILE CA C 17 61.276 61.276 59.537 1.739 19168 1367 1 4 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.949 -1.869 19168 1368 1 4 . 1 1 18 18 ALA N N 18 129.434 129.434 128.793 0.641 19168 1369 1 4 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.648 -0.169 19168 1370 1 4 . 1 1 18 18 ALA C C 18 179.130 179.130 177.139 1.991 19168 1371 1 4 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.022 0.415 19168 1372 1 4 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.300 -0.391 19168 1373 1 4 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.054 -0.257 19168 1374 1 4 . 1 1 19 19 GLN CA C 19 59.231 59.231 58.884 0.347 19168 1375 1 4 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.438 -0.263 19168 1376 1 4 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.498 -0.068 19168 1377 1 4 . 1 1 20 20 ASN C C 20 177.272 177.272 177.482 -0.210 19168 1378 1 4 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.681 -0.497 19168 1379 1 4 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.834 -0.381 19168 1380 1 4 . 1 1 21 21 ASP N N 21 119.132 119.132 119.930 -0.798 19168 1381 1 4 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.553 0.245 19168 1382 1 4 . 1 1 21 21 ASP C C 21 178.707 178.707 178.874 -0.167 19168 1383 1 4 . 1 1 21 21 ASP CA C 21 56.886 56.886 57.665 -0.779 19168 1384 1 4 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.822 -0.157 19168 1385 1 4 . 1 1 22 22 ILE N N 22 122.030 122.030 120.753 1.277 19168 1386 1 4 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.655 -0.236 19168 1387 1 4 . 1 1 22 22 ILE C C 22 177.454 177.454 177.791 -0.337 19168 1388 1 4 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.628 1.098 19168 1389 1 4 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.874 -0.308 19168 1390 1 4 . 1 1 23 23 ASN N N 23 116.728 116.728 118.087 -1.359 19168 1391 1 4 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.399 -0.186 19168 1392 1 4 . 1 1 23 23 ASN C C 23 178.260 178.260 177.550 0.710 19168 1393 1 4 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.437 -0.163 19168 1394 1 4 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.504 -1.296 19168 1395 1 4 . 1 1 24 24 TYR N N 24 119.864 119.864 120.839 -0.975 19168 1396 1 4 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.169 0.124 19168 1397 1 4 . 1 1 24 24 TYR C C 24 177.719 177.719 177.714 0.005 19168 1398 1 4 . 1 1 24 24 TYR CA C 24 61.048 61.048 61.877 -0.829 19168 1399 1 4 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.790 -0.507 19168 1400 1 4 . 1 1 25 25 LYS N N 25 119.730 119.730 119.598 0.132 19168 1401 1 4 . 1 1 25 25 LYS HA H 25 4.111 4.111 4.137 -0.026 19168 1402 1 4 . 1 1 25 25 LYS C C 25 179.152 179.152 179.181 -0.029 19168 1403 1 4 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.560 -0.398 19168 1404 1 4 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.774 -0.480 19168 1405 1 4 . 1 1 26 26 VAL N N 26 119.387 119.387 119.394 -0.007 19168 1406 1 4 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.851 -0.231 19168 1407 1 4 . 1 1 26 26 VAL C C 26 177.017 177.017 177.350 -0.333 19168 1408 1 4 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.734 0.927 19168 1409 1 4 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.334 0.216 19168 1410 1 4 . 1 1 27 27 LYS N N 27 120.420 120.420 120.145 0.275 19168 1411 1 4 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.859 0.087 19168 1412 1 4 . 1 1 27 27 LYS C C 27 179.458 179.458 178.177 1.281 19168 1413 1 4 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.631 0.247 19168 1414 1 4 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.271 -0.423 19168 1415 1 4 . 1 1 28 28 HIS N N 28 118.160 118.160 117.523 0.637 19168 1416 1 4 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.642 -0.455 19168 1417 1 4 . 1 1 28 28 HIS C C 28 177.085 177.085 177.436 -0.351 19168 1418 1 4 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.325 -1.440 19168 1419 1 4 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.685 0.071 19168 1420 1 4 . 1 1 29 29 ALA N N 29 120.579 120.579 122.707 -2.128 19168 1421 1 4 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.172 -0.174 19168 1422 1 4 . 1 1 29 29 ALA C C 29 179.299 179.299 179.593 -0.294 19168 1423 1 4 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.384 0.183 19168 1424 1 4 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.353 1.096 19168 1425 1 4 . 1 1 30 30 LEU N N 30 117.262 117.262 118.207 -0.945 19168 1426 1 4 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.923 0.152 19168 1427 1 4 . 1 1 30 30 LEU C C 30 180.017 180.017 179.177 0.840 19168 1428 1 4 . 1 1 30 30 LEU CA C 30 58.232 58.232 57.947 0.284 19168 1429 1 4 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.600 -0.274 19168 1430 1 4 . 1 1 31 31 GLU N N 31 120.625 120.625 119.898 0.727 19168 1431 1 4 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.881 0.187 19168 1432 1 4 . 1 1 31 31 GLU C C 31 179.572 179.572 179.340 0.232 19168 1433 1 4 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.389 -0.114 19168 1434 1 4 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.245 -0.271 19168 1435 1 4 . 1 1 32 32 PHE N N 32 118.245 118.245 118.443 -0.198 19168 1436 1 4 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.273 0.253 19168 1437 1 4 . 1 1 32 32 PHE C C 32 179.123 179.123 177.813 1.310 19168 1438 1 4 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.839 -3.142 19168 1439 1 4 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.845 -1.593 19168 1440 1 4 . 1 1 33 33 LEU N N 33 121.684 121.684 120.882 0.802 19168 1441 1 4 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.288 0.303 19168 1442 1 4 . 1 1 33 33 LEU C C 33 181.655 181.655 180.096 1.559 19168 1443 1 4 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.564 0.608 19168 1444 1 4 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.621 0.071 19168 1445 1 4 . 1 1 34 34 GLU N N 34 122.046 122.046 118.434 3.612 19168 1446 1 4 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.067 0.085 19168 1447 1 4 . 1 1 34 34 GLU C C 34 178.237 178.237 178.573 -0.336 19168 1448 1 4 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.920 0.226 19168 1449 1 4 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.086 0.148 19168 1450 1 4 . 1 1 35 35 GLN N N 35 115.697 115.697 116.008 -0.311 19168 1451 1 4 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.228 0.159 19168 1452 1 4 . 1 1 35 35 GLN C C 35 176.456 176.456 177.006 -0.550 19168 1453 1 4 . 1 1 35 35 GLN CA C 35 55.686 55.686 56.883 -1.196 19168 1454 1 4 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.425 -0.229 19168 1455 1 4 . 1 1 36 36 GLY N N 36 108.291 108.291 105.358 2.933 19168 1456 1 4 . 1 1 36 36 GLY C C 36 174.673 174.673 174.009 0.664 19168 1457 1 4 . 1 1 36 36 GLY CA C 36 45.527 45.527 44.957 0.570 19168 1458 1 4 . 1 1 37 37 LYS N N 37 120.464 120.464 119.162 1.302 19168 1459 1 4 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.745 -0.248 19168 1460 1 4 . 1 1 37 37 LYS C C 37 174.580 174.580 175.324 -0.744 19168 1461 1 4 . 1 1 37 37 LYS CA C 37 55.089 55.089 53.375 1.714 19168 1462 1 4 . 1 1 37 37 LYS CB C 37 32.745 32.745 35.647 -2.902 19168 1463 1 4 . 1 1 38 38 HIS N N 38 116.878 116.878 118.762 -1.884 19168 1464 1 4 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.862 0.157 19168 1465 1 4 . 1 1 38 38 HIS C C 38 175.268 175.268 174.802 0.466 19168 1466 1 4 . 1 1 38 38 HIS CA C 38 54.150 54.150 56.593 -2.443 19168 1467 1 4 . 1 1 38 38 HIS CB C 38 32.877 32.877 32.114 0.763 19168 1468 1 4 . 1 1 39 39 VAL N N 39 119.782 119.782 121.703 -1.921 19168 1469 1 4 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.812 -0.016 19168 1470 1 4 . 1 1 39 39 VAL C C 39 173.320 173.320 174.140 -0.820 19168 1471 1 4 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.589 0.177 19168 1472 1 4 . 1 1 39 39 VAL CB C 39 35.433 35.433 33.953 1.480 19168 1473 1 4 . 1 1 40 40 ARG N N 40 128.358 128.358 127.029 1.329 19168 1474 1 4 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.993 0.122 19168 1475 1 4 . 1 1 40 40 ARG C C 40 175.659 175.659 174.993 0.666 19168 1476 1 4 . 1 1 40 40 ARG CA C 40 53.822 53.822 53.970 -0.148 19168 1477 1 4 . 1 1 40 40 ARG CB C 40 33.007 33.007 32.378 0.629 19168 1478 1 4 . 1 1 41 41 PHE N N 41 126.396 126.396 127.278 -0.882 19168 1479 1 4 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.437 -0.259 19168 1480 1 4 . 1 1 41 41 PHE C C 41 176.107 176.107 175.606 0.501 19168 1481 1 4 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.869 -0.173 19168 1482 1 4 . 1 1 41 41 PHE CB C 41 42.046 42.046 40.004 2.042 19168 1483 1 4 . 1 1 42 42 ARG N N 42 120.641 120.641 123.680 -3.039 19168 1484 1 4 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.378 0.161 19168 1485 1 4 . 1 1 42 42 ARG C C 42 175.010 175.010 174.420 0.590 19168 1486 1 4 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.975 -0.280 19168 1487 1 4 . 1 1 42 42 ARG CB C 42 34.374 34.374 34.100 0.274 19168 1488 1 4 . 1 1 43 43 VAL N N 43 125.565 125.565 123.098 2.467 19168 1489 1 4 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.387 -0.722 19168 1490 1 4 . 1 1 43 43 VAL C C 43 175.325 175.325 173.571 1.754 19168 1491 1 4 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.312 1.504 19168 1492 1 4 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.820 -2.837 19168 1493 1 4 . 1 1 44 44 PHE N N 44 128.291 128.291 128.660 -0.369 19168 1494 1 4 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.887 -0.269 19168 1495 1 4 . 1 1 44 44 PHE C C 44 174.477 174.477 174.666 -0.189 19168 1496 1 4 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.210 0.938 19168 1497 1 4 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.723 -1.782 19168 1498 1 4 . 1 1 45 45 LEU N N 45 128.360 128.360 129.315 -0.955 19168 1499 1 4 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.183 0.208 19168 1500 1 4 . 1 1 45 45 LEU C C 45 174.342 174.342 175.209 -0.867 19168 1501 1 4 . 1 1 45 45 LEU CA C 45 53.586 53.586 53.920 -0.334 19168 1502 1 4 . 1 1 45 45 LEU CB C 45 41.113 41.113 40.330 0.783 19168 1503 1 4 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.268 -0.176 19168 1504 1 4 . 1 1 46 46 LYS CA C 46 55.079 55.079 56.216 -1.137 19168 1505 1 4 . 1 1 46 46 LYS CB C 46 34.295 34.295 33.586 0.709 19168 1506 1 4 . 1 1 47 47 GLY CA C 47 46.813 46.813 44.712 2.101 19168 1507 1 4 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.206 -0.006 19168 1508 1 4 . 1 1 48 48 ARG C C 48 178.069 178.069 177.665 0.404 19168 1509 1 4 . 1 1 48 48 ARG CA C 48 57.862 57.862 57.557 0.305 19168 1510 1 4 . 1 1 48 48 ARG CB C 48 29.444 29.444 30.077 -0.633 19168 1511 1 4 . 1 1 49 49 GLU N N 49 119.779 119.779 121.198 -1.419 19168 1512 1 4 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.044 0.009 19168 1513 1 4 . 1 1 49 49 GLU C C 49 178.227 178.227 178.511 -0.284 19168 1514 1 4 . 1 1 49 49 GLU CA C 49 57.436 57.436 58.960 -1.524 19168 1515 1 4 . 1 1 49 49 GLU CB C 49 29.745 29.745 28.597 1.148 19168 1516 1 4 . 1 1 50 50 MET N N 50 116.370 116.370 118.404 -2.034 19168 1517 1 4 . 1 1 50 50 MET HA H 50 4.024 4.024 4.146 -0.122 19168 1518 1 4 . 1 1 50 50 MET C C 50 175.912 175.912 177.353 -1.441 19168 1519 1 4 . 1 1 50 50 MET CA C 50 56.664 56.664 56.862 -0.198 19168 1520 1 4 . 1 1 50 50 MET CB C 50 32.033 32.033 31.512 0.520 19168 1521 1 4 . 1 1 51 51 ALA N N 51 118.880 118.880 119.789 -0.909 19168 1522 1 4 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.315 0.029 19168 1523 1 4 . 1 1 51 51 ALA C C 51 177.746 177.746 177.158 0.588 19168 1524 1 4 . 1 1 51 51 ALA CA C 51 52.391 52.391 52.943 -0.552 19168 1525 1 4 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.638 -0.195 19168 1526 1 4 . 1 1 52 52 THR N N 52 108.299 108.299 114.995 -6.696 19168 1527 1 4 . 1 1 52 52 THR HA H 52 4.869 4.869 4.578 0.291 19168 1528 1 4 . 1 1 52 52 THR C C 52 173.933 173.933 172.711 1.222 19168 1529 1 4 . 1 1 52 52 THR CA C 52 57.554 57.554 59.669 -2.115 19168 1530 1 4 . 1 1 52 52 THR CB C 52 69.479 69.479 69.701 -0.222 19168 1531 1 4 . 1 1 53 53 PRO HA H 53 3.931 3.931 3.963 -0.032 19168 1532 1 4 . 1 1 53 53 PRO C C 53 178.185 178.185 178.105 0.080 19168 1533 1 4 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.322 0.697 19168 1534 1 4 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.654 -1.138 19168 1535 1 4 . 1 1 54 54 GLU N N 54 120.653 120.653 118.567 2.086 19168 1536 1 4 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.063 -0.047 19168 1537 1 4 . 1 1 54 54 GLU C C 54 178.608 178.608 177.788 0.820 19168 1538 1 4 . 1 1 54 54 GLU CA C 54 59.472 59.472 58.554 0.918 19168 1539 1 4 . 1 1 54 54 GLU CB C 54 27.419 27.419 29.144 -1.725 19168 1540 1 4 . 1 1 55 55 ALA N N 55 124.380 124.380 121.296 3.084 19168 1541 1 4 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.080 0.243 19168 1542 1 4 . 1 1 55 55 ALA C C 55 181.502 181.502 179.694 1.808 19168 1543 1 4 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.215 -0.435 19168 1544 1 4 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.015 0.386 19168 1545 1 4 . 1 1 56 56 GLY N N 56 105.673 105.673 106.534 -0.861 19168 1546 1 4 . 1 1 56 56 GLY C C 56 174.278 174.278 176.167 -1.889 19168 1547 1 4 . 1 1 56 56 GLY CA C 56 46.879 46.879 46.953 -0.074 19168 1548 1 4 . 1 1 57 57 VAL N N 57 122.685 122.685 123.042 -0.357 19168 1549 1 4 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.607 -0.285 19168 1550 1 4 . 1 1 57 57 VAL C C 57 177.134 177.134 177.716 -0.582 19168 1551 1 4 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.279 1.117 19168 1552 1 4 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.579 0.190 19168 1553 1 4 . 1 1 58 58 ALA N N 58 119.580 119.580 122.454 -2.874 19168 1554 1 4 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.076 0.018 19168 1555 1 4 . 1 1 58 58 ALA C C 58 180.788 180.788 179.696 1.092 19168 1556 1 4 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.280 -0.227 19168 1557 1 4 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.303 -0.449 19168 1558 1 4 . 1 1 59 59 LEU N N 59 119.723 119.723 120.420 -0.697 19168 1559 1 4 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.035 0.223 19168 1560 1 4 . 1 1 59 59 LEU C C 59 178.024 178.024 178.711 -0.687 19168 1561 1 4 . 1 1 59 59 LEU CA C 59 57.710 57.710 57.993 -0.283 19168 1562 1 4 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.050 -0.349 19168 1563 1 4 . 1 1 60 60 LEU N N 60 117.978 117.978 118.186 -0.208 19168 1564 1 4 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.812 0.045 19168 1565 1 4 . 1 1 60 60 LEU C C 60 178.851 178.851 178.962 -0.111 19168 1566 1 4 . 1 1 60 60 LEU CA C 60 57.644 57.644 57.979 -0.335 19168 1567 1 4 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.509 -1.221 19168 1568 1 4 . 1 1 61 61 GLU N N 61 119.906 119.906 119.283 0.623 19168 1569 1 4 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.153 0.338 19168 1570 1 4 . 1 1 61 61 GLU C C 61 179.519 179.519 178.517 1.002 19168 1571 1 4 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.077 -0.335 19168 1572 1 4 . 1 1 61 61 GLU CB C 61 28.813 28.813 28.777 0.036 19168 1573 1 4 . 1 1 62 62 LYS N N 62 122.015 122.015 120.614 1.401 19168 1574 1 4 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.086 0.042 19168 1575 1 4 . 1 1 62 62 LYS C C 62 179.843 179.843 178.545 1.298 19168 1576 1 4 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.060 0.277 19168 1577 1 4 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.425 -0.778 19168 1578 1 4 . 1 1 63 63 ILE N N 63 120.882 120.882 119.165 1.717 19168 1579 1 4 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.637 -0.141 19168 1580 1 4 . 1 1 63 63 ILE C C 63 177.761 177.761 177.323 0.438 19168 1581 1 4 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.629 0.552 19168 1582 1 4 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.626 -0.240 19168 1583 1 4 . 1 1 64 64 TRP N N 64 120.279 120.279 122.251 -1.972 19168 1584 1 4 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.102 0.382 19168 1585 1 4 . 1 1 64 64 TRP C C 64 177.056 177.056 177.614 -0.558 19168 1586 1 4 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.082 -0.988 19168 1587 1 4 . 1 1 64 64 TRP CB C 64 29.635 29.635 30.067 -0.432 19168 1588 1 4 . 1 1 65 65 THR N N 65 109.483 109.483 110.468 -0.985 19168 1589 1 4 . 1 1 65 65 THR HA H 65 3.744 3.744 3.639 0.105 19168 1590 1 4 . 1 1 65 65 THR C C 65 176.224 176.224 175.808 0.416 19168 1591 1 4 . 1 1 65 65 THR CA C 65 65.568 65.568 64.621 0.947 19168 1592 1 4 . 1 1 65 65 THR CB C 65 69.308 69.308 68.367 0.941 19168 1593 1 4 . 1 1 66 66 MET N N 66 117.791 117.791 118.685 -0.894 19168 1594 1 4 . 1 1 66 66 MET HA H 66 4.110 4.110 4.447 -0.337 19168 1595 1 4 . 1 1 66 66 MET C C 66 177.782 177.782 177.458 0.324 19168 1596 1 4 . 1 1 66 66 MET CA C 66 58.304 58.304 56.097 2.207 19168 1597 1 4 . 1 1 66 66 MET CB C 66 34.040 34.040 33.243 0.797 19168 1598 1 4 . 1 1 67 67 ILE N N 67 109.871 109.871 111.966 -2.095 19168 1599 1 4 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.510 0.132 19168 1600 1 4 . 1 1 67 67 ILE C C 67 176.713 176.713 176.100 0.613 19168 1601 1 4 . 1 1 67 67 ILE CA C 67 61.174 61.174 60.893 0.281 19168 1602 1 4 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.381 1.432 19168 1603 1 4 . 1 1 68 68 GLU N N 68 121.972 121.972 121.514 0.458 19168 1604 1 4 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.750 -1.002 19168 1605 1 4 . 1 1 68 68 GLU C C 68 175.855 175.855 177.427 -1.572 19168 1606 1 4 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.223 0.068 19168 1607 1 4 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.311 1.181 19168 1608 1 4 . 1 1 69 69 ASN N N 69 114.338 114.338 117.242 -2.904 19168 1609 1 4 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.405 0.175 19168 1610 1 4 . 1 1 69 69 ASN C C 69 175.904 175.904 177.562 -1.658 19168 1611 1 4 . 1 1 69 69 ASN CA C 69 54.597 54.597 56.279 -1.683 19168 1612 1 4 . 1 1 69 69 ASN CB C 69 38.323 38.323 38.403 -0.080 19168 1613 1 4 . 1 1 70 70 GLU N N 70 116.936 116.936 118.168 -1.232 19168 1614 1 4 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.590 -0.042 19168 1615 1 4 . 1 1 70 70 GLU C C 70 174.941 174.941 174.763 0.178 19168 1616 1 4 . 1 1 70 70 GLU CA C 70 55.983 55.983 55.710 0.273 19168 1617 1 4 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.634 -0.286 19168 1618 1 4 . 1 1 71 71 ALA N N 71 122.966 122.966 122.080 0.886 19168 1619 1 4 . 1 1 71 71 ALA HA H 71 5.246 5.246 5.290 -0.044 19168 1620 1 4 . 1 1 71 71 ALA C C 71 173.907 173.907 175.479 -1.572 19168 1621 1 4 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.280 0.538 19168 1622 1 4 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.399 1.661 19168 1623 1 4 . 1 1 72 72 ASN N N 72 115.820 115.820 119.440 -3.620 19168 1624 1 4 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.368 0.073 19168 1625 1 4 . 1 1 72 72 ASN C C 72 174.137 174.137 174.737 -0.600 19168 1626 1 4 . 1 1 72 72 ASN CA C 72 51.659 51.659 51.881 -0.222 19168 1627 1 4 . 1 1 72 72 ASN CB C 72 42.186 42.186 41.181 1.005 19168 1628 1 4 . 1 1 73 73 ARG N N 73 118.340 118.340 124.039 -5.699 19168 1629 1 4 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.794 0.984 19168 1630 1 4 . 1 1 73 73 ARG C C 73 174.674 174.674 175.583 -0.909 19168 1631 1 4 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.447 -1.578 19168 1632 1 4 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.263 2.862 19168 1633 1 4 . 1 1 74 74 ASP N N 74 124.007 124.007 126.595 -2.588 19168 1634 1 4 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.483 0.059 19168 1635 1 4 . 1 1 74 74 ASP C C 74 175.935 175.935 176.614 -0.679 19168 1636 1 4 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.453 -1.056 19168 1637 1 4 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.748 0.472 19168 1638 1 4 . 1 1 75 75 LYS N N 75 116.482 116.482 116.862 -0.380 19168 1639 1 4 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.523 -0.078 19168 1640 1 4 . 1 1 75 75 LYS C C 75 175.135 175.135 174.385 0.750 19168 1641 1 4 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.363 -0.578 19168 1642 1 4 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.884 0.591 19168 1643 1 4 . 1 1 76 76 GLU N N 76 120.126 120.126 123.469 -3.343 19168 1644 1 4 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.190 -0.282 19168 1645 1 4 . 1 1 76 76 GLU C C 76 173.204 173.204 175.298 -2.094 19168 1646 1 4 . 1 1 76 76 GLU CA C 76 55.524 55.524 55.346 0.178 19168 1647 1 4 . 1 1 76 76 GLU CB C 76 27.511 27.511 28.892 -1.381 19168 1648 1 4 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.611 0.166 19168 1649 1 4 . 1 1 77 77 PRO C C 77 174.933 174.933 176.096 -1.163 19168 1650 1 4 . 1 1 77 77 PRO CA C 77 63.422 63.422 63.051 0.371 19168 1651 1 4 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.243 0.148 19168 1652 1 4 . 1 1 78 78 ASN N N 78 119.292 119.292 121.062 -1.770 19168 1653 1 4 . 1 1 78 78 ASN HA H 78 5.093 5.093 5.021 0.072 19168 1654 1 4 . 1 1 78 78 ASN C C 78 172.876 172.876 173.838 -0.962 19168 1655 1 4 . 1 1 78 78 ASN CA C 78 51.928 51.928 51.959 -0.031 19168 1656 1 4 . 1 1 78 78 ASN CB C 78 42.017 42.017 42.039 -0.022 19168 1657 1 4 . 1 1 79 79 PHE N N 79 125.023 125.023 126.965 -1.942 19168 1658 1 4 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.068 0.355 19168 1659 1 4 . 1 1 79 79 PHE C C 79 174.552 174.552 174.602 -0.050 19168 1660 1 4 . 1 1 79 79 PHE CA C 79 55.210 55.210 56.966 -1.756 19168 1661 1 4 . 1 1 79 79 PHE CB C 79 40.109 40.109 39.880 0.229 19168 1662 1 4 . 1 1 80 80 GLU N N 80 128.920 128.920 126.335 2.585 19168 1663 1 4 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.527 -0.319 19168 1664 1 4 . 1 1 80 80 GLU C C 80 175.538 175.538 176.024 -0.486 19168 1665 1 4 . 1 1 80 80 GLU CA C 80 55.724 55.724 54.850 0.874 19168 1666 1 4 . 1 1 80 80 GLU CB C 80 32.135 32.135 32.249 -0.114 19168 1667 1 4 . 1 1 81 81 GLY N N 81 116.695 116.695 113.509 3.186 19168 1668 1 4 . 1 1 81 81 GLY C C 81 173.950 173.950 174.574 -0.624 19168 1669 1 4 . 1 1 81 81 GLY CA C 81 46.967 46.967 46.930 0.037 19168 1670 1 4 . 1 1 82 82 ARG N N 82 124.481 124.481 122.911 1.570 19168 1671 1 4 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.423 0.116 19168 1672 1 4 . 1 1 82 82 ARG C C 82 173.437 173.437 174.590 -1.153 19168 1673 1 4 . 1 1 82 82 ARG CA C 82 55.156 55.156 55.363 -0.207 19168 1674 1 4 . 1 1 82 82 ARG CB C 82 30.255 30.255 32.318 -2.063 19168 1675 1 4 . 1 1 83 83 TYR N N 83 114.539 114.539 118.432 -3.893 19168 1676 1 4 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.539 0.409 19168 1677 1 4 . 1 1 83 83 TYR C C 83 175.909 175.909 174.397 1.512 19168 1678 1 4 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.465 -0.408 19168 1679 1 4 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.190 0.809 19168 1680 1 4 . 1 1 84 84 VAL N N 84 118.812 118.812 122.470 -3.658 19168 1681 1 4 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.853 0.014 19168 1682 1 4 . 1 1 84 84 VAL C C 84 174.982 174.982 175.397 -0.415 19168 1683 1 4 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.064 0.171 19168 1684 1 4 . 1 1 84 84 VAL CB C 84 32.491 32.491 31.866 0.625 19168 1685 1 4 . 1 1 85 85 ASN N N 85 124.630 124.630 126.426 -1.796 19168 1686 1 4 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.101 -0.097 19168 1687 1 4 . 1 1 85 85 ASN C C 85 175.392 175.392 173.764 1.628 19168 1688 1 4 . 1 1 85 85 ASN CA C 85 52.596 52.596 52.144 0.452 19168 1689 1 4 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.963 1.243 19168 1690 1 4 . 1 1 86 86 MET N N 86 118.969 118.969 121.915 -2.946 19168 1691 1 4 . 1 1 86 86 MET HA H 86 4.640 4.640 4.883 -0.243 19168 1692 1 4 . 1 1 86 86 MET C C 86 172.378 172.378 173.478 -1.100 19168 1693 1 4 . 1 1 86 86 MET CA C 86 56.158 56.158 55.166 0.992 19168 1694 1 4 . 1 1 86 86 MET CB C 86 39.138 39.138 36.644 2.494 19168 1695 1 4 . 1 1 87 87 LEU N N 87 131.886 131.886 127.335 4.551 19168 1696 1 4 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.325 0.056 19168 1697 1 4 . 1 1 87 87 LEU C C 87 176.003 176.003 175.604 0.399 19168 1698 1 4 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.608 0.522 19168 1699 1 4 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.312 0.161 19168 1700 1 4 . 1 1 88 88 VAL N N 88 121.165 121.165 119.323 1.842 19168 1701 1 4 . 1 1 88 88 VAL HA H 88 5.510 5.510 4.948 0.562 19168 1702 1 4 . 1 1 88 88 VAL C C 88 173.666 173.666 174.793 -1.127 19168 1703 1 4 . 1 1 88 88 VAL CA C 88 58.600 58.600 60.155 -1.555 19168 1704 1 4 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.463 0.330 19168 1705 1 4 . 1 1 89 89 THR N N 89 111.786 111.786 121.833 -10.047 19168 1706 1 4 . 1 1 89 89 THR HA H 89 4.720 4.720 4.694 0.026 19168 1707 1 4 . 1 1 89 89 THR C C 89 171.898 171.898 172.562 -0.664 19168 1708 1 4 . 1 1 89 89 THR CA C 89 57.985 57.985 59.690 -1.705 19168 1709 1 4 . 1 1 89 89 THR CB C 89 69.113 69.113 69.876 -0.763 19168 1710 1 4 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.629 -0.046 19168 1711 1 4 . 1 1 90 90 PRO C C 90 177.403 177.403 176.726 0.677 19168 1712 1 4 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.976 0.555 19168 1713 1 4 . 1 1 90 90 PRO CB C 90 32.043 32.043 31.968 0.075 19168 1714 1 4 . 1 1 91 91 LYS N N 91 123.696 123.696 124.633 -0.937 19168 1715 1 4 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.066 0.045 19168 1716 1 4 . 1 1 91 91 LYS C C 91 176.568 176.568 177.784 -1.216 19168 1717 1 4 . 1 1 91 91 LYS CA C 91 57.208 57.208 59.007 -1.798 19168 1718 1 4 . 1 1 91 91 LYS CB C 91 33.183 33.183 32.590 0.593 19168 1719 1 4 . 1 1 92 92 LYS N N 92 122.054 122.054 116.911 5.143 19168 1720 1 4 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.401 -0.085 19168 1721 1 4 . 1 1 92 92 LYS C C 92 175.956 175.956 176.749 -0.793 19168 1722 1 4 . 1 1 92 92 LYS CA C 92 55.942 55.942 56.795 -0.853 19168 1723 1 4 . 1 1 92 92 LYS CB C 92 33.000 33.000 33.629 -0.629 19168 1724 1 4 . 1 1 93 93 ALA N N 93 126.278 126.278 120.772 5.506 19168 1725 1 4 . 1 1 93 93 ALA HA H 93 4.341 4.341 3.976 0.365 19168 1726 1 4 . 1 1 93 93 ALA C C 93 177.592 177.592 176.872 0.720 19168 1727 1 4 . 1 1 93 93 ALA CA C 93 52.279 52.279 53.716 -1.437 19168 1728 1 4 . 1 1 93 93 ALA CB C 93 19.332 19.332 17.721 1.611 19168 1729 1 4 . 1 1 94 94 GLU N N 94 120.522 120.522 122.765 -2.243 19168 1730 1 4 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.624 -0.340 19168 1731 1 4 . 1 1 94 94 GLU C C 94 177.041 177.041 176.231 0.810 19168 1732 1 4 . 1 1 94 94 GLU CA C 94 56.606 56.606 55.351 1.255 19168 1733 1 4 . 1 1 94 94 GLU CB C 94 30.353 30.353 32.532 -2.179 19168 1734 1 4 . 1 1 95 95 GLY N N 95 109.755 109.755 112.122 -2.367 19168 1735 1 4 . 1 1 95 95 GLY C C 95 173.939 173.939 174.872 -0.933 19168 1736 1 4 . 1 1 95 95 GLY CA C 95 45.168 45.168 45.606 -0.438 19168 1737 1 5 . 1 1 5 5 VAL N N 5 123.289 123.289 121.002 2.287 19168 1738 1 5 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.297 -0.278 19168 1739 1 5 . 1 1 5 5 VAL C C 5 175.799 175.799 174.868 0.931 19168 1740 1 5 . 1 1 5 5 VAL CA C 5 62.120 62.120 62.341 -0.221 19168 1741 1 5 . 1 1 5 5 VAL CB C 5 32.757 32.757 32.589 0.168 19168 1742 1 5 . 1 1 6 6 ILE N N 6 126.794 126.794 123.491 3.303 19168 1743 1 5 . 1 1 6 6 ILE HA H 6 3.967 3.967 3.996 -0.029 19168 1744 1 5 . 1 1 6 6 ILE C C 6 175.103 175.103 174.418 0.685 19168 1745 1 5 . 1 1 6 6 ILE CA C 6 60.227 60.227 61.222 -0.995 19168 1746 1 5 . 1 1 6 6 ILE CB C 6 38.565 38.565 37.299 1.266 19168 1747 1 5 . 1 1 7 7 ASP N N 7 127.797 127.797 129.684 -1.887 19168 1748 1 5 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.666 -0.122 19168 1749 1 5 . 1 1 7 7 ASP C C 7 174.000 174.000 175.275 -1.275 19168 1750 1 5 . 1 1 7 7 ASP CA C 7 53.591 53.591 54.635 -1.044 19168 1751 1 5 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.184 0.968 19168 1752 1 5 . 1 1 8 8 ILE N N 8 122.764 122.764 124.750 -1.986 19168 1753 1 5 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.202 0.118 19168 1754 1 5 . 1 1 8 8 ILE C C 8 176.337 176.337 175.670 0.667 19168 1755 1 5 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.873 -0.697 19168 1756 1 5 . 1 1 8 8 ILE CB C 8 39.542 39.542 38.363 1.179 19168 1757 1 5 . 1 1 9 9 LYS N N 9 127.990 127.990 128.464 -0.474 19168 1758 1 5 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.307 0.015 19168 1759 1 5 . 1 1 9 9 LYS C C 9 174.759 174.759 175.367 -0.608 19168 1760 1 5 . 1 1 9 9 LYS CA C 9 52.315 52.315 53.992 -1.677 19168 1761 1 5 . 1 1 9 9 LYS CB C 9 32.902 32.902 32.313 0.589 19168 1762 1 5 . 1 1 10 10 GLU N N 10 123.021 123.021 124.779 -1.758 19168 1763 1 5 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.870 0.265 19168 1764 1 5 . 1 1 10 10 GLU C C 10 176.215 176.215 175.880 0.335 19168 1765 1 5 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.239 -0.337 19168 1766 1 5 . 1 1 10 10 GLU CB C 10 32.037 32.037 30.558 1.479 19168 1767 1 5 . 1 1 11 11 ILE N N 11 126.526 126.526 127.552 -1.026 19168 1768 1 5 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.153 0.182 19168 1769 1 5 . 1 1 11 11 ILE C C 11 174.334 174.334 174.647 -0.313 19168 1770 1 5 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.589 -0.279 19168 1771 1 5 . 1 1 11 11 ILE CB C 11 39.826 39.826 38.751 1.075 19168 1772 1 5 . 1 1 12 12 LYS N N 12 128.164 128.164 129.925 -1.761 19168 1773 1 5 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.509 -0.164 19168 1774 1 5 . 1 1 12 12 LYS C C 12 176.378 176.378 175.579 0.799 19168 1775 1 5 . 1 1 12 12 LYS CA C 12 55.940 55.940 55.658 0.282 19168 1776 1 5 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.711 0.345 19168 1777 1 5 . 1 1 13 13 LEU N N 13 121.881 121.881 126.309 -4.428 19168 1778 1 5 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.882 0.072 19168 1779 1 5 . 1 1 13 13 LEU C C 13 175.137 175.137 174.921 0.216 19168 1780 1 5 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.540 0.434 19168 1781 1 5 . 1 1 13 13 LEU CB C 13 46.284 46.284 45.968 0.317 19168 1782 1 5 . 1 1 14 14 SER N N 14 115.759 115.759 112.396 3.363 19168 1783 1 5 . 1 1 14 14 SER HA H 14 4.889 4.889 5.137 -0.248 19168 1784 1 5 . 1 1 14 14 SER C C 14 173.993 173.993 174.882 -0.889 19168 1785 1 5 . 1 1 14 14 SER CA C 14 56.052 56.052 56.924 -0.872 19168 1786 1 5 . 1 1 14 14 SER CB C 14 64.775 64.775 65.840 -1.065 19168 1787 1 5 . 1 1 15 15 VAL N N 15 120.993 120.993 122.282 -1.289 19168 1788 1 5 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.807 -0.073 19168 1789 1 5 . 1 1 15 15 VAL C C 15 176.964 176.964 177.327 -0.363 19168 1790 1 5 . 1 1 15 15 VAL CA C 15 65.427 65.427 66.250 -0.823 19168 1791 1 5 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.868 -0.083 19168 1792 1 5 . 1 1 16 16 LYS N N 16 118.897 118.897 119.131 -0.234 19168 1793 1 5 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.240 0.161 19168 1794 1 5 . 1 1 16 16 LYS C C 16 175.489 175.489 175.396 0.093 19168 1795 1 5 . 1 1 16 16 LYS CA C 16 55.155 55.155 56.164 -1.009 19168 1796 1 5 . 1 1 16 16 LYS CB C 16 30.929 30.929 30.174 0.755 19168 1797 1 5 . 1 1 17 17 ILE N N 17 122.247 122.247 119.338 2.909 19168 1798 1 5 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.290 -0.104 19168 1799 1 5 . 1 1 17 17 ILE C C 17 173.426 173.426 174.991 -1.565 19168 1800 1 5 . 1 1 17 17 ILE CA C 17 61.276 61.276 59.879 1.397 19168 1801 1 5 . 1 1 17 17 ILE CB C 17 39.080 39.080 39.868 -0.788 19168 1802 1 5 . 1 1 18 18 ALA N N 18 129.434 129.434 126.617 2.817 19168 1803 1 5 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.547 -0.068 19168 1804 1 5 . 1 1 18 18 ALA C C 18 179.130 179.130 177.773 1.357 19168 1805 1 5 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.384 0.053 19168 1806 1 5 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.119 -0.210 19168 1807 1 5 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.003 -0.206 19168 1808 1 5 . 1 1 19 19 GLN CA C 19 59.231 59.231 58.869 0.362 19168 1809 1 5 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.589 -0.414 19168 1810 1 5 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.485 -0.055 19168 1811 1 5 . 1 1 20 20 ASN C C 20 177.272 177.272 177.506 -0.234 19168 1812 1 5 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.030 0.154 19168 1813 1 5 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.291 0.161 19168 1814 1 5 . 1 1 21 21 ASP N N 21 119.132 119.132 120.285 -1.153 19168 1815 1 5 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.515 0.283 19168 1816 1 5 . 1 1 21 21 ASP C C 21 178.707 178.707 178.286 0.421 19168 1817 1 5 . 1 1 21 21 ASP CA C 21 56.886 56.886 56.847 0.039 19168 1818 1 5 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.908 -0.243 19168 1819 1 5 . 1 1 22 22 ILE N N 22 122.030 122.030 119.738 2.292 19168 1820 1 5 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.623 -0.205 19168 1821 1 5 . 1 1 22 22 ILE C C 22 177.454 177.454 177.811 -0.357 19168 1822 1 5 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.421 1.305 19168 1823 1 5 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.609 -0.043 19168 1824 1 5 . 1 1 23 23 ASN N N 23 116.728 116.728 118.749 -2.021 19168 1825 1 5 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.432 -0.219 19168 1826 1 5 . 1 1 23 23 ASN C C 23 178.260 178.260 177.872 0.388 19168 1827 1 5 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.984 -0.710 19168 1828 1 5 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.666 -1.458 19168 1829 1 5 . 1 1 24 24 TYR N N 24 119.864 119.864 121.943 -2.079 19168 1830 1 5 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.215 0.078 19168 1831 1 5 . 1 1 24 24 TYR C C 24 177.719 177.719 177.309 0.410 19168 1832 1 5 . 1 1 24 24 TYR CA C 24 61.048 61.048 62.066 -1.018 19168 1833 1 5 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.579 -0.296 19168 1834 1 5 . 1 1 25 25 LYS N N 25 119.730 119.730 118.609 1.121 19168 1835 1 5 . 1 1 25 25 LYS HA H 25 4.111 4.111 3.955 0.156 19168 1836 1 5 . 1 1 25 25 LYS C C 25 179.152 179.152 179.350 -0.198 19168 1837 1 5 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.070 0.092 19168 1838 1 5 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.097 0.197 19168 1839 1 5 . 1 1 26 26 VAL N N 26 119.387 119.387 116.731 2.656 19168 1840 1 5 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.955 -0.335 19168 1841 1 5 . 1 1 26 26 VAL C C 26 177.017 177.017 177.801 -0.784 19168 1842 1 5 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.192 1.469 19168 1843 1 5 . 1 1 26 26 VAL CB C 26 31.550 31.550 30.697 0.853 19168 1844 1 5 . 1 1 27 27 LYS N N 27 120.420 120.420 120.591 -0.171 19168 1845 1 5 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.916 0.030 19168 1846 1 5 . 1 1 27 27 LYS C C 27 179.458 179.458 178.916 0.542 19168 1847 1 5 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.586 0.292 19168 1848 1 5 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.432 -0.584 19168 1849 1 5 . 1 1 28 28 HIS N N 28 118.160 118.160 117.461 0.699 19168 1850 1 5 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.236 -0.049 19168 1851 1 5 . 1 1 28 28 HIS C C 28 177.085 177.085 176.816 0.269 19168 1852 1 5 . 1 1 28 28 HIS CA C 28 57.885 57.885 58.824 -0.939 19168 1853 1 5 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.936 -0.180 19168 1854 1 5 . 1 1 29 29 ALA N N 29 120.579 120.579 122.496 -1.917 19168 1855 1 5 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.437 -0.439 19168 1856 1 5 . 1 1 29 29 ALA C C 29 179.299 179.299 179.590 -0.291 19168 1857 1 5 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.106 0.461 19168 1858 1 5 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.408 1.041 19168 1859 1 5 . 1 1 30 30 LEU N N 30 117.262 117.262 117.812 -0.550 19168 1860 1 5 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.996 0.079 19168 1861 1 5 . 1 1 30 30 LEU C C 30 180.017 180.017 178.892 1.125 19168 1862 1 5 . 1 1 30 30 LEU CA C 30 58.232 58.232 57.656 0.576 19168 1863 1 5 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.370 -0.044 19168 1864 1 5 . 1 1 31 31 GLU N N 31 120.625 120.625 119.029 1.596 19168 1865 1 5 . 1 1 31 31 GLU HA H 31 4.068 4.068 4.181 -0.113 19168 1866 1 5 . 1 1 31 31 GLU C C 31 179.572 179.572 179.242 0.330 19168 1867 1 5 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.017 0.258 19168 1868 1 5 . 1 1 31 31 GLU CB C 31 28.975 28.975 28.614 0.361 19168 1869 1 5 . 1 1 32 32 PHE N N 32 118.245 118.245 118.201 0.044 19168 1870 1 5 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.265 0.261 19168 1871 1 5 . 1 1 32 32 PHE C C 32 179.123 179.123 177.900 1.223 19168 1872 1 5 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.110 -2.413 19168 1873 1 5 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.523 -1.271 19168 1874 1 5 . 1 1 33 33 LEU N N 33 121.684 121.684 121.157 0.527 19168 1875 1 5 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.338 0.253 19168 1876 1 5 . 1 1 33 33 LEU C C 33 181.655 181.655 179.858 1.797 19168 1877 1 5 . 1 1 33 33 LEU CA C 33 58.172 58.172 58.054 0.117 19168 1878 1 5 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.530 0.162 19168 1879 1 5 . 1 1 34 34 GLU N N 34 122.046 122.046 118.704 3.342 19168 1880 1 5 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.100 0.052 19168 1881 1 5 . 1 1 34 34 GLU C C 34 178.237 178.237 178.483 -0.246 19168 1882 1 5 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.861 0.285 19168 1883 1 5 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.304 -0.070 19168 1884 1 5 . 1 1 35 35 GLN N N 35 115.697 115.697 115.773 -0.076 19168 1885 1 5 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.340 0.047 19168 1886 1 5 . 1 1 35 35 GLN C C 35 176.456 176.456 176.640 -0.184 19168 1887 1 5 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.764 -0.078 19168 1888 1 5 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.305 -0.109 19168 1889 1 5 . 1 1 36 36 GLY N N 36 108.291 108.291 106.837 1.454 19168 1890 1 5 . 1 1 36 36 GLY C C 36 174.673 174.673 174.575 0.098 19168 1891 1 5 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.280 0.247 19168 1892 1 5 . 1 1 37 37 LYS N N 37 120.464 120.464 119.609 0.855 19168 1893 1 5 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.748 -0.251 19168 1894 1 5 . 1 1 37 37 LYS C C 37 174.580 174.580 176.212 -1.632 19168 1895 1 5 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.527 0.562 19168 1896 1 5 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.274 -1.529 19168 1897 1 5 . 1 1 38 38 HIS N N 38 116.878 116.878 117.512 -0.634 19168 1898 1 5 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.890 0.129 19168 1899 1 5 . 1 1 38 38 HIS C C 38 175.268 175.268 174.047 1.221 19168 1900 1 5 . 1 1 38 38 HIS CA C 38 54.150 54.150 54.861 -0.711 19168 1901 1 5 . 1 1 38 38 HIS CB C 38 32.877 32.877 33.061 -0.184 19168 1902 1 5 . 1 1 39 39 VAL N N 39 119.782 119.782 120.552 -0.770 19168 1903 1 5 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.862 -0.066 19168 1904 1 5 . 1 1 39 39 VAL C C 39 173.320 173.320 174.170 -0.850 19168 1905 1 5 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.396 0.370 19168 1906 1 5 . 1 1 39 39 VAL CB C 39 35.433 35.433 33.967 1.466 19168 1907 1 5 . 1 1 40 40 ARG N N 40 128.358 128.358 127.419 0.939 19168 1908 1 5 . 1 1 40 40 ARG HA H 40 5.115 5.115 5.004 0.111 19168 1909 1 5 . 1 1 40 40 ARG C C 40 175.659 175.659 174.979 0.680 19168 1910 1 5 . 1 1 40 40 ARG CA C 40 53.822 53.822 53.891 -0.069 19168 1911 1 5 . 1 1 40 40 ARG CB C 40 33.007 33.007 32.306 0.702 19168 1912 1 5 . 1 1 41 41 PHE N N 41 126.396 126.396 127.542 -1.146 19168 1913 1 5 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.158 0.020 19168 1914 1 5 . 1 1 41 41 PHE C C 41 176.107 176.107 175.282 0.825 19168 1915 1 5 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.970 -0.274 19168 1916 1 5 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.744 2.302 19168 1917 1 5 . 1 1 42 42 ARG N N 42 120.641 120.641 123.409 -2.768 19168 1918 1 5 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.525 0.014 19168 1919 1 5 . 1 1 42 42 ARG C C 42 175.010 175.010 174.616 0.394 19168 1920 1 5 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.883 -0.188 19168 1921 1 5 . 1 1 42 42 ARG CB C 42 34.374 34.374 33.964 0.410 19168 1922 1 5 . 1 1 43 43 VAL N N 43 125.565 125.565 123.472 2.093 19168 1923 1 5 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.315 -0.650 19168 1924 1 5 . 1 1 43 43 VAL C C 43 175.325 175.325 173.651 1.674 19168 1925 1 5 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.945 0.871 19168 1926 1 5 . 1 1 43 43 VAL CB C 43 32.983 32.983 36.148 -3.165 19168 1927 1 5 . 1 1 44 44 PHE N N 44 128.291 128.291 129.809 -1.518 19168 1928 1 5 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.661 -0.043 19168 1929 1 5 . 1 1 44 44 PHE C C 44 174.477 174.477 174.018 0.459 19168 1930 1 5 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.444 0.704 19168 1931 1 5 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.776 -1.835 19168 1932 1 5 . 1 1 45 45 LEU N N 45 128.360 128.360 128.733 -0.373 19168 1933 1 5 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.207 0.184 19168 1934 1 5 . 1 1 45 45 LEU C C 45 174.342 174.342 175.708 -1.366 19168 1935 1 5 . 1 1 45 45 LEU CA C 45 53.586 53.586 54.304 -0.718 19168 1936 1 5 . 1 1 45 45 LEU CB C 45 41.113 41.113 41.455 -0.342 19168 1937 1 5 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.319 -0.227 19168 1938 1 5 . 1 1 46 46 LYS CA C 46 55.079 55.079 55.769 -0.690 19168 1939 1 5 . 1 1 46 46 LYS CB C 46 34.295 34.295 33.627 0.668 19168 1940 1 5 . 1 1 47 47 GLY CA C 47 46.813 46.813 45.361 1.452 19168 1941 1 5 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.141 0.059 19168 1942 1 5 . 1 1 48 48 ARG C C 48 178.069 178.069 177.702 0.367 19168 1943 1 5 . 1 1 48 48 ARG CA C 48 57.862 57.862 57.999 -0.137 19168 1944 1 5 . 1 1 48 48 ARG CB C 48 29.444 29.444 29.732 -0.288 19168 1945 1 5 . 1 1 49 49 GLU N N 49 119.779 119.779 120.387 -0.608 19168 1946 1 5 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.027 0.026 19168 1947 1 5 . 1 1 49 49 GLU C C 49 178.227 178.227 178.044 0.183 19168 1948 1 5 . 1 1 49 49 GLU CA C 49 57.436 57.436 58.410 -0.974 19168 1949 1 5 . 1 1 49 49 GLU CB C 49 29.745 29.745 29.045 0.700 19168 1950 1 5 . 1 1 50 50 MET N N 50 116.370 116.370 117.256 -0.886 19168 1951 1 5 . 1 1 50 50 MET HA H 50 4.024 4.024 4.076 -0.052 19168 1952 1 5 . 1 1 50 50 MET C C 50 175.912 175.912 177.517 -1.605 19168 1953 1 5 . 1 1 50 50 MET CA C 50 56.664 56.664 57.952 -1.288 19168 1954 1 5 . 1 1 50 50 MET CB C 50 32.033 32.033 32.519 -0.486 19168 1955 1 5 . 1 1 51 51 ALA N N 51 118.880 118.880 119.457 -0.577 19168 1956 1 5 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.225 0.119 19168 1957 1 5 . 1 1 51 51 ALA C C 51 177.746 177.746 177.420 0.326 19168 1958 1 5 . 1 1 51 51 ALA CA C 51 52.391 52.391 52.989 -0.598 19168 1959 1 5 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.402 0.041 19168 1960 1 5 . 1 1 52 52 THR N N 52 108.299 108.299 109.679 -1.380 19168 1961 1 5 . 1 1 52 52 THR HA H 52 4.869 4.869 4.695 0.174 19168 1962 1 5 . 1 1 52 52 THR C C 52 173.933 173.933 172.676 1.257 19168 1963 1 5 . 1 1 52 52 THR CA C 52 57.554 57.554 58.295 -0.741 19168 1964 1 5 . 1 1 52 52 THR CB C 52 69.479 69.479 70.005 -0.527 19168 1965 1 5 . 1 1 53 53 PRO HA H 53 3.931 3.931 3.843 0.088 19168 1966 1 5 . 1 1 53 53 PRO C C 53 178.185 178.185 178.253 -0.068 19168 1967 1 5 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.168 0.851 19168 1968 1 5 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.427 -0.911 19168 1969 1 5 . 1 1 54 54 GLU N N 54 120.653 120.653 118.070 2.583 19168 1970 1 5 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.010 0.006 19168 1971 1 5 . 1 1 54 54 GLU C C 54 178.608 178.608 178.276 0.332 19168 1972 1 5 . 1 1 54 54 GLU CA C 54 59.472 59.472 59.194 0.279 19168 1973 1 5 . 1 1 54 54 GLU CB C 54 27.419 27.419 28.980 -1.561 19168 1974 1 5 . 1 1 55 55 ALA N N 55 124.380 124.380 121.686 2.694 19168 1975 1 5 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.095 0.228 19168 1976 1 5 . 1 1 55 55 ALA C C 55 181.502 181.502 179.703 1.799 19168 1977 1 5 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.153 -0.373 19168 1978 1 5 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.093 0.308 19168 1979 1 5 . 1 1 56 56 GLY N N 56 105.673 105.673 106.698 -1.025 19168 1980 1 5 . 1 1 56 56 GLY C C 56 174.278 174.278 176.281 -2.003 19168 1981 1 5 . 1 1 56 56 GLY CA C 56 46.879 46.879 47.013 -0.134 19168 1982 1 5 . 1 1 57 57 VAL N N 57 122.685 122.685 123.124 -0.439 19168 1983 1 5 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.673 -0.351 19168 1984 1 5 . 1 1 57 57 VAL C C 57 177.134 177.134 177.466 -0.332 19168 1985 1 5 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.423 0.973 19168 1986 1 5 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.403 0.366 19168 1987 1 5 . 1 1 58 58 ALA N N 58 119.580 119.580 122.308 -2.728 19168 1988 1 5 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.060 0.034 19168 1989 1 5 . 1 1 58 58 ALA C C 58 180.788 180.788 179.714 1.074 19168 1990 1 5 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.295 -0.242 19168 1991 1 5 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.175 -0.321 19168 1992 1 5 . 1 1 59 59 LEU N N 59 119.723 119.723 120.280 -0.557 19168 1993 1 5 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.006 0.252 19168 1994 1 5 . 1 1 59 59 LEU C C 59 178.024 178.024 178.594 -0.570 19168 1995 1 5 . 1 1 59 59 LEU CA C 59 57.710 57.710 58.113 -0.403 19168 1996 1 5 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.089 -0.388 19168 1997 1 5 . 1 1 60 60 LEU N N 60 117.978 117.978 118.846 -0.868 19168 1998 1 5 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.827 0.030 19168 1999 1 5 . 1 1 60 60 LEU C C 60 178.851 178.851 179.200 -0.349 19168 2000 1 5 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.079 -0.435 19168 2001 1 5 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.250 -0.962 19168 2002 1 5 . 1 1 61 61 GLU N N 61 119.906 119.906 119.392 0.514 19168 2003 1 5 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.069 0.422 19168 2004 1 5 . 1 1 61 61 GLU C C 61 179.519 179.519 179.077 0.442 19168 2005 1 5 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.644 -0.902 19168 2006 1 5 . 1 1 61 61 GLU CB C 61 28.813 28.813 28.980 -0.168 19168 2007 1 5 . 1 1 62 62 LYS N N 62 122.015 122.015 120.405 1.610 19168 2008 1 5 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.078 0.050 19168 2009 1 5 . 1 1 62 62 LYS C C 62 179.843 179.843 179.111 0.732 19168 2010 1 5 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.528 -0.191 19168 2011 1 5 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.306 -0.659 19168 2012 1 5 . 1 1 63 63 ILE N N 63 120.882 120.882 119.671 1.211 19168 2013 1 5 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.659 -0.163 19168 2014 1 5 . 1 1 63 63 ILE C C 63 177.761 177.761 177.481 0.280 19168 2015 1 5 . 1 1 63 63 ILE CA C 63 65.182 65.182 65.049 0.133 19168 2016 1 5 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.812 -0.426 19168 2017 1 5 . 1 1 64 64 TRP N N 64 120.279 120.279 121.418 -1.139 19168 2018 1 5 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.122 0.362 19168 2019 1 5 . 1 1 64 64 TRP C C 64 177.056 177.056 177.840 -0.784 19168 2020 1 5 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.328 -1.234 19168 2021 1 5 . 1 1 64 64 TRP CB C 64 29.635 29.635 30.104 -0.469 19168 2022 1 5 . 1 1 65 65 THR N N 65 109.483 109.483 113.703 -4.220 19168 2023 1 5 . 1 1 65 65 THR HA H 65 3.744 3.744 3.601 0.143 19168 2024 1 5 . 1 1 65 65 THR C C 65 176.224 176.224 175.993 0.231 19168 2025 1 5 . 1 1 65 65 THR CA C 65 65.568 65.568 65.522 0.047 19168 2026 1 5 . 1 1 65 65 THR CB C 65 69.308 69.308 68.446 0.862 19168 2027 1 5 . 1 1 66 66 MET N N 66 117.791 117.791 117.634 0.157 19168 2028 1 5 . 1 1 66 66 MET HA H 66 4.110 4.110 4.249 -0.139 19168 2029 1 5 . 1 1 66 66 MET C C 66 177.782 177.782 177.811 -0.029 19168 2030 1 5 . 1 1 66 66 MET CA C 66 58.304 58.304 58.406 -0.101 19168 2031 1 5 . 1 1 66 66 MET CB C 66 34.040 34.040 33.172 0.868 19168 2032 1 5 . 1 1 67 67 ILE N N 67 109.871 109.871 111.806 -1.935 19168 2033 1 5 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.444 0.198 19168 2034 1 5 . 1 1 67 67 ILE C C 67 176.713 176.713 176.135 0.578 19168 2035 1 5 . 1 1 67 67 ILE CA C 67 61.174 61.174 60.968 0.206 19168 2036 1 5 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.402 1.411 19168 2037 1 5 . 1 1 68 68 GLU N N 68 121.972 121.972 121.652 0.320 19168 2038 1 5 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.261 -0.513 19168 2039 1 5 . 1 1 68 68 GLU C C 68 175.855 175.855 177.443 -1.588 19168 2040 1 5 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.495 -0.203 19168 2041 1 5 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.286 1.206 19168 2042 1 5 . 1 1 69 69 ASN N N 69 114.338 114.338 115.388 -1.050 19168 2043 1 5 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.417 0.163 19168 2044 1 5 . 1 1 69 69 ASN C C 69 175.904 175.904 176.875 -0.971 19168 2045 1 5 . 1 1 69 69 ASN CA C 69 54.597 54.597 55.451 -0.854 19168 2046 1 5 . 1 1 69 69 ASN CB C 69 38.323 38.323 38.030 0.293 19168 2047 1 5 . 1 1 70 70 GLU N N 70 116.936 116.936 117.091 -0.155 19168 2048 1 5 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.497 0.051 19168 2049 1 5 . 1 1 70 70 GLU C C 70 174.941 174.941 174.823 0.118 19168 2050 1 5 . 1 1 70 70 GLU CA C 70 55.983 55.983 55.946 0.037 19168 2051 1 5 . 1 1 70 70 GLU CB C 70 31.348 31.348 30.648 0.701 19168 2052 1 5 . 1 1 71 71 ALA N N 71 122.966 122.966 121.381 1.585 19168 2053 1 5 . 1 1 71 71 ALA HA H 71 5.246 5.246 5.080 0.166 19168 2054 1 5 . 1 1 71 71 ALA C C 71 173.907 173.907 175.753 -1.846 19168 2055 1 5 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.240 0.578 19168 2056 1 5 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.226 1.834 19168 2057 1 5 . 1 1 72 72 ASN N N 72 115.820 115.820 119.168 -3.348 19168 2058 1 5 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.327 0.114 19168 2059 1 5 . 1 1 72 72 ASN C C 72 174.137 174.137 174.628 -0.491 19168 2060 1 5 . 1 1 72 72 ASN CA C 72 51.659 51.659 52.052 -0.393 19168 2061 1 5 . 1 1 72 72 ASN CB C 72 42.186 42.186 41.219 0.967 19168 2062 1 5 . 1 1 73 73 ARG N N 73 118.340 118.340 124.503 -6.163 19168 2063 1 5 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.979 0.799 19168 2064 1 5 . 1 1 73 73 ARG C C 73 174.674 174.674 175.583 -0.909 19168 2065 1 5 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.244 -1.375 19168 2066 1 5 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.420 2.705 19168 2067 1 5 . 1 1 74 74 ASP N N 74 124.007 124.007 127.072 -3.065 19168 2068 1 5 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.415 0.127 19168 2069 1 5 . 1 1 74 74 ASP C C 74 175.935 175.935 176.334 -0.399 19168 2070 1 5 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.575 -1.178 19168 2071 1 5 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.558 0.662 19168 2072 1 5 . 1 1 75 75 LYS N N 75 116.482 116.482 117.995 -1.513 19168 2073 1 5 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.507 -0.062 19168 2074 1 5 . 1 1 75 75 LYS C C 75 175.135 175.135 174.880 0.255 19168 2075 1 5 . 1 1 75 75 LYS CA C 75 54.785 54.785 54.659 0.126 19168 2076 1 5 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.571 0.904 19168 2077 1 5 . 1 1 76 76 GLU N N 76 120.126 120.126 124.317 -4.191 19168 2078 1 5 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.189 -0.281 19168 2079 1 5 . 1 1 76 76 GLU C C 76 173.204 173.204 174.908 -1.704 19168 2080 1 5 . 1 1 76 76 GLU CA C 76 55.524 55.524 54.945 0.579 19168 2081 1 5 . 1 1 76 76 GLU CB C 76 27.511 27.511 28.684 -1.173 19168 2082 1 5 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.547 0.230 19168 2083 1 5 . 1 1 77 77 PRO C C 77 174.933 174.933 175.968 -1.035 19168 2084 1 5 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.913 0.509 19168 2085 1 5 . 1 1 77 77 PRO CB C 77 32.391 32.391 31.799 0.592 19168 2086 1 5 . 1 1 78 78 ASN N N 78 119.292 119.292 123.247 -3.955 19168 2087 1 5 . 1 1 78 78 ASN HA H 78 5.093 5.093 5.013 0.080 19168 2088 1 5 . 1 1 78 78 ASN C C 78 172.876 172.876 173.804 -0.928 19168 2089 1 5 . 1 1 78 78 ASN CA C 78 51.928 51.928 52.395 -0.467 19168 2090 1 5 . 1 1 78 78 ASN CB C 78 42.017 42.017 42.541 -0.524 19168 2091 1 5 . 1 1 79 79 PHE N N 79 125.023 125.023 125.982 -0.959 19168 2092 1 5 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.162 0.261 19168 2093 1 5 . 1 1 79 79 PHE C C 79 174.552 174.552 174.759 -0.207 19168 2094 1 5 . 1 1 79 79 PHE CA C 79 55.210 55.210 57.006 -1.796 19168 2095 1 5 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.218 -0.109 19168 2096 1 5 . 1 1 80 80 GLU N N 80 128.920 128.920 126.128 2.792 19168 2097 1 5 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.488 -0.280 19168 2098 1 5 . 1 1 80 80 GLU C C 80 175.538 175.538 175.818 -0.280 19168 2099 1 5 . 1 1 80 80 GLU CA C 80 55.724 55.724 54.986 0.738 19168 2100 1 5 . 1 1 80 80 GLU CB C 80 32.135 32.135 32.696 -0.561 19168 2101 1 5 . 1 1 81 81 GLY N N 81 116.695 116.695 112.665 4.030 19168 2102 1 5 . 1 1 81 81 GLY C C 81 173.950 173.950 174.439 -0.489 19168 2103 1 5 . 1 1 81 81 GLY CA C 81 46.967 46.967 47.113 -0.146 19168 2104 1 5 . 1 1 82 82 ARG N N 82 124.481 124.481 119.635 4.846 19168 2105 1 5 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.326 0.213 19168 2106 1 5 . 1 1 82 82 ARG C C 82 173.437 173.437 174.290 -0.853 19168 2107 1 5 . 1 1 82 82 ARG CA C 82 55.156 55.156 55.511 -0.356 19168 2108 1 5 . 1 1 82 82 ARG CB C 82 30.255 30.255 31.606 -1.351 19168 2109 1 5 . 1 1 83 83 TYR N N 83 114.539 114.539 119.062 -4.523 19168 2110 1 5 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.436 0.512 19168 2111 1 5 . 1 1 83 83 TYR C C 83 175.909 175.909 174.209 1.700 19168 2112 1 5 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.898 -0.841 19168 2113 1 5 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.623 0.376 19168 2114 1 5 . 1 1 84 84 VAL N N 84 118.812 118.812 123.101 -4.289 19168 2115 1 5 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.821 0.046 19168 2116 1 5 . 1 1 84 84 VAL C C 84 174.982 174.982 175.040 -0.058 19168 2117 1 5 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.707 -0.472 19168 2118 1 5 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.569 -0.078 19168 2119 1 5 . 1 1 85 85 ASN N N 85 124.630 124.630 123.857 0.773 19168 2120 1 5 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.235 -0.231 19168 2121 1 5 . 1 1 85 85 ASN C C 85 175.392 175.392 173.539 1.853 19168 2122 1 5 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.322 1.274 19168 2123 1 5 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.898 1.308 19168 2124 1 5 . 1 1 86 86 MET N N 86 118.969 118.969 120.034 -1.065 19168 2125 1 5 . 1 1 86 86 MET HA H 86 4.640 4.640 4.848 -0.208 19168 2126 1 5 . 1 1 86 86 MET C C 86 172.378 172.378 173.602 -1.224 19168 2127 1 5 . 1 1 86 86 MET CA C 86 56.158 56.158 55.184 0.974 19168 2128 1 5 . 1 1 86 86 MET CB C 86 39.138 39.138 36.892 2.246 19168 2129 1 5 . 1 1 87 87 LEU N N 87 131.886 131.886 126.994 4.892 19168 2130 1 5 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.190 0.191 19168 2131 1 5 . 1 1 87 87 LEU C C 87 176.003 176.003 175.839 0.164 19168 2132 1 5 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.608 0.522 19168 2133 1 5 . 1 1 87 87 LEU CB C 87 44.473 44.473 43.779 0.694 19168 2134 1 5 . 1 1 88 88 VAL N N 88 121.165 121.165 119.449 1.716 19168 2135 1 5 . 1 1 88 88 VAL HA H 88 5.510 5.510 4.952 0.558 19168 2136 1 5 . 1 1 88 88 VAL C C 88 173.666 173.666 174.697 -1.031 19168 2137 1 5 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.241 -0.641 19168 2138 1 5 . 1 1 88 88 VAL CB C 88 34.793 34.793 33.862 0.930 19168 2139 1 5 . 1 1 89 89 THR N N 89 111.786 111.786 121.121 -9.335 19168 2140 1 5 . 1 1 89 89 THR HA H 89 4.720 4.720 4.503 0.217 19168 2141 1 5 . 1 1 89 89 THR C C 89 171.898 171.898 172.161 -0.263 19168 2142 1 5 . 1 1 89 89 THR CA C 89 57.985 57.985 59.593 -1.608 19168 2143 1 5 . 1 1 89 89 THR CB C 89 69.113 69.113 69.503 -0.390 19168 2144 1 5 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.430 0.153 19168 2145 1 5 . 1 1 90 90 PRO C C 90 177.403 177.403 176.650 0.753 19168 2146 1 5 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.610 0.921 19168 2147 1 5 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.509 -0.466 19168 2148 1 5 . 1 1 91 91 LYS N N 91 123.696 123.696 122.724 0.972 19168 2149 1 5 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.131 -0.020 19168 2150 1 5 . 1 1 91 91 LYS C C 91 176.568 176.568 177.896 -1.328 19168 2151 1 5 . 1 1 91 91 LYS CA C 91 57.208 57.208 57.128 0.080 19168 2152 1 5 . 1 1 91 91 LYS CB C 91 33.183 33.183 32.609 0.574 19168 2153 1 5 . 1 1 92 92 LYS N N 92 122.054 122.054 126.013 -3.959 19168 2154 1 5 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.153 0.163 19168 2155 1 5 . 1 1 92 92 LYS C C 92 175.956 175.956 177.979 -2.023 19168 2156 1 5 . 1 1 92 92 LYS CA C 92 55.942 55.942 57.679 -1.737 19168 2157 1 5 . 1 1 92 92 LYS CB C 92 33.000 33.000 32.365 0.635 19168 2158 1 5 . 1 1 93 93 ALA N N 93 126.278 126.278 122.045 4.233 19168 2159 1 5 . 1 1 93 93 ALA HA H 93 4.341 4.341 3.980 0.361 19168 2160 1 5 . 1 1 93 93 ALA C C 93 177.592 177.592 178.381 -0.789 19168 2161 1 5 . 1 1 93 93 ALA CA C 93 52.279 52.279 54.487 -2.208 19168 2162 1 5 . 1 1 93 93 ALA CB C 93 19.332 19.332 17.293 2.039 19168 2163 1 5 . 1 1 94 94 GLU N N 94 120.522 120.522 120.732 -0.210 19168 2164 1 5 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.444 -0.160 19168 2165 1 5 . 1 1 94 94 GLU C C 94 177.041 177.041 176.692 0.349 19168 2166 1 5 . 1 1 94 94 GLU CA C 94 56.606 56.606 55.123 1.483 19168 2167 1 5 . 1 1 94 94 GLU CB C 94 30.353 30.353 31.144 -0.791 19168 2168 1 5 . 1 1 95 95 GLY N N 95 109.755 109.755 110.424 -0.669 19168 2169 1 5 . 1 1 95 95 GLY C C 95 173.939 173.939 174.065 -0.126 19168 2170 1 5 . 1 1 95 95 GLY CA C 95 45.168 45.168 46.183 -1.015 19168 2171 1 6 . 1 1 5 5 VAL N N 5 123.289 123.289 124.484 -1.195 19168 2172 1 6 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.250 -0.231 19168 2173 1 6 . 1 1 5 5 VAL C C 5 175.799 175.799 175.971 -0.172 19168 2174 1 6 . 1 1 5 5 VAL CA C 5 62.120 62.120 61.764 0.356 19168 2175 1 6 . 1 1 5 5 VAL CB C 5 32.757 32.757 32.540 0.217 19168 2176 1 6 . 1 1 6 6 ILE N N 6 126.794 126.794 125.852 0.942 19168 2177 1 6 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.055 -0.088 19168 2178 1 6 . 1 1 6 6 ILE C C 6 175.103 175.103 175.927 -0.824 19168 2179 1 6 . 1 1 6 6 ILE CA C 6 60.227 60.227 61.336 -1.109 19168 2180 1 6 . 1 1 6 6 ILE CB C 6 38.565 38.565 38.648 -0.083 19168 2181 1 6 . 1 1 7 7 ASP N N 7 127.797 127.797 128.545 -0.748 19168 2182 1 6 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.649 -0.105 19168 2183 1 6 . 1 1 7 7 ASP C C 7 174.000 174.000 174.945 -0.945 19168 2184 1 6 . 1 1 7 7 ASP CA C 7 53.591 53.591 53.963 -0.372 19168 2185 1 6 . 1 1 7 7 ASP CB C 7 42.152 42.152 40.965 1.187 19168 2186 1 6 . 1 1 8 8 ILE N N 8 122.764 122.764 125.538 -2.774 19168 2187 1 6 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.326 -0.006 19168 2188 1 6 . 1 1 8 8 ILE C C 8 176.337 176.337 175.259 1.078 19168 2189 1 6 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.155 0.021 19168 2190 1 6 . 1 1 8 8 ILE CB C 8 39.542 39.542 40.423 -0.881 19168 2191 1 6 . 1 1 9 9 LYS N N 9 127.990 127.990 127.502 0.488 19168 2192 1 6 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.251 0.071 19168 2193 1 6 . 1 1 9 9 LYS C C 9 174.759 174.759 175.309 -0.550 19168 2194 1 6 . 1 1 9 9 LYS CA C 9 52.315 52.315 54.725 -2.410 19168 2195 1 6 . 1 1 9 9 LYS CB C 9 32.902 32.902 32.894 0.008 19168 2196 1 6 . 1 1 10 10 GLU N N 10 123.021 123.021 122.827 0.194 19168 2197 1 6 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.882 0.253 19168 2198 1 6 . 1 1 10 10 GLU C C 10 176.215 176.215 175.825 0.390 19168 2199 1 6 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.309 -0.406 19168 2200 1 6 . 1 1 10 10 GLU CB C 10 32.037 32.037 31.488 0.549 19168 2201 1 6 . 1 1 11 11 ILE N N 11 126.526 126.526 127.141 -0.615 19168 2202 1 6 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.256 0.079 19168 2203 1 6 . 1 1 11 11 ILE C C 11 174.334 174.334 174.562 -0.228 19168 2204 1 6 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.142 0.168 19168 2205 1 6 . 1 1 11 11 ILE CB C 11 39.826 39.826 39.687 0.139 19168 2206 1 6 . 1 1 12 12 LYS N N 12 128.164 128.164 129.061 -0.897 19168 2207 1 6 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.061 0.284 19168 2208 1 6 . 1 1 12 12 LYS C C 12 176.378 176.378 175.407 0.971 19168 2209 1 6 . 1 1 12 12 LYS CA C 12 55.940 55.940 56.007 -0.067 19168 2210 1 6 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.652 0.404 19168 2211 1 6 . 1 1 13 13 LEU N N 13 121.881 121.881 125.811 -3.930 19168 2212 1 6 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.794 0.160 19168 2213 1 6 . 1 1 13 13 LEU C C 13 175.137 175.137 175.162 -0.025 19168 2214 1 6 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.436 0.538 19168 2215 1 6 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.775 -0.491 19168 2216 1 6 . 1 1 14 14 SER N N 14 115.759 115.759 113.335 2.424 19168 2217 1 6 . 1 1 14 14 SER HA H 14 4.889 4.889 5.285 -0.396 19168 2218 1 6 . 1 1 14 14 SER C C 14 173.993 173.993 175.102 -1.109 19168 2219 1 6 . 1 1 14 14 SER CA C 14 56.052 56.052 57.015 -0.963 19168 2220 1 6 . 1 1 14 14 SER CB C 14 64.775 64.775 65.678 -0.903 19168 2221 1 6 . 1 1 15 15 VAL N N 15 120.993 120.993 123.476 -2.483 19168 2222 1 6 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.780 -0.046 19168 2223 1 6 . 1 1 15 15 VAL C C 15 176.964 176.964 177.129 -0.165 19168 2224 1 6 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.767 -0.340 19168 2225 1 6 . 1 1 15 15 VAL CB C 15 31.785 31.785 32.043 -0.258 19168 2226 1 6 . 1 1 16 16 LYS N N 16 118.897 118.897 119.568 -0.671 19168 2227 1 6 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.372 0.029 19168 2228 1 6 . 1 1 16 16 LYS C C 16 175.489 175.489 175.143 0.346 19168 2229 1 6 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.382 -0.227 19168 2230 1 6 . 1 1 16 16 LYS CB C 16 30.929 30.929 30.784 0.145 19168 2231 1 6 . 1 1 17 17 ILE N N 17 122.247 122.247 120.237 2.010 19168 2232 1 6 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.290 -0.105 19168 2233 1 6 . 1 1 17 17 ILE C C 17 173.426 173.426 174.925 -1.499 19168 2234 1 6 . 1 1 17 17 ILE CA C 17 61.276 61.276 59.728 1.548 19168 2235 1 6 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.559 -1.479 19168 2236 1 6 . 1 1 18 18 ALA N N 18 129.434 129.434 128.540 0.894 19168 2237 1 6 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.401 0.078 19168 2238 1 6 . 1 1 18 18 ALA C C 18 179.130 179.130 177.943 1.187 19168 2239 1 6 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.996 -0.559 19168 2240 1 6 . 1 1 18 18 ALA CB C 18 19.909 19.909 19.748 0.161 19168 2241 1 6 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.029 -0.232 19168 2242 1 6 . 1 1 19 19 GLN CA C 19 59.231 59.231 59.291 -0.060 19168 2243 1 6 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.813 -0.638 19168 2244 1 6 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.564 -0.134 19168 2245 1 6 . 1 1 20 20 ASN C C 20 177.272 177.272 177.000 0.272 19168 2246 1 6 . 1 1 20 20 ASN CA C 20 56.184 56.184 55.199 0.985 19168 2247 1 6 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.518 -0.065 19168 2248 1 6 . 1 1 21 21 ASP N N 21 119.132 119.132 121.289 -2.157 19168 2249 1 6 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.493 0.305 19168 2250 1 6 . 1 1 21 21 ASP C C 21 178.707 178.707 177.975 0.732 19168 2251 1 6 . 1 1 21 21 ASP CA C 21 56.886 56.886 56.995 -0.109 19168 2252 1 6 . 1 1 21 21 ASP CB C 21 40.665 40.665 41.156 -0.491 19168 2253 1 6 . 1 1 22 22 ILE N N 22 122.030 122.030 119.775 2.255 19168 2254 1 6 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.704 -0.286 19168 2255 1 6 . 1 1 22 22 ILE C C 22 177.454 177.454 177.854 -0.400 19168 2256 1 6 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.078 1.648 19168 2257 1 6 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.709 -0.143 19168 2258 1 6 . 1 1 23 23 ASN N N 23 116.728 116.728 118.291 -1.563 19168 2259 1 6 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.473 -0.260 19168 2260 1 6 . 1 1 23 23 ASN C C 23 178.260 178.260 177.798 0.462 19168 2261 1 6 . 1 1 23 23 ASN CA C 23 56.274 56.274 55.946 0.328 19168 2262 1 6 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.156 -0.948 19168 2263 1 6 . 1 1 24 24 TYR N N 24 119.864 119.864 121.596 -1.732 19168 2264 1 6 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.180 0.113 19168 2265 1 6 . 1 1 24 24 TYR C C 24 177.719 177.719 177.432 0.287 19168 2266 1 6 . 1 1 24 24 TYR CA C 24 61.048 61.048 61.786 -0.738 19168 2267 1 6 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.787 -0.504 19168 2268 1 6 . 1 1 25 25 LYS N N 25 119.730 119.730 119.242 0.488 19168 2269 1 6 . 1 1 25 25 LYS HA H 25 4.111 4.111 4.100 0.011 19168 2270 1 6 . 1 1 25 25 LYS C C 25 179.152 179.152 179.059 0.093 19168 2271 1 6 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.543 -0.381 19168 2272 1 6 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.956 -0.662 19168 2273 1 6 . 1 1 26 26 VAL N N 26 119.387 119.387 116.216 3.171 19168 2274 1 6 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.800 -0.180 19168 2275 1 6 . 1 1 26 26 VAL C C 26 177.017 177.017 177.433 -0.416 19168 2276 1 6 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.406 1.255 19168 2277 1 6 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.278 0.272 19168 2278 1 6 . 1 1 27 27 LYS N N 27 120.420 120.420 120.666 -0.246 19168 2279 1 6 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.902 0.044 19168 2280 1 6 . 1 1 27 27 LYS C C 27 179.458 179.458 178.334 1.124 19168 2281 1 6 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.606 0.272 19168 2282 1 6 . 1 1 27 27 LYS CB C 27 31.848 31.848 31.878 -0.030 19168 2283 1 6 . 1 1 28 28 HIS N N 28 118.160 118.160 117.378 0.782 19168 2284 1 6 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.429 -0.242 19168 2285 1 6 . 1 1 28 28 HIS C C 28 177.085 177.085 177.562 -0.477 19168 2286 1 6 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.727 -1.841 19168 2287 1 6 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.523 0.233 19168 2288 1 6 . 1 1 29 29 ALA N N 29 120.579 120.579 122.518 -1.939 19168 2289 1 6 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.171 -0.173 19168 2290 1 6 . 1 1 29 29 ALA C C 29 179.299 179.299 179.648 -0.349 19168 2291 1 6 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.397 0.170 19168 2292 1 6 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.332 1.117 19168 2293 1 6 . 1 1 30 30 LEU N N 30 117.262 117.262 118.409 -1.147 19168 2294 1 6 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.892 0.183 19168 2295 1 6 . 1 1 30 30 LEU C C 30 180.017 180.017 179.255 0.762 19168 2296 1 6 . 1 1 30 30 LEU CA C 30 58.232 58.232 57.955 0.277 19168 2297 1 6 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.623 -0.297 19168 2298 1 6 . 1 1 31 31 GLU N N 31 120.625 120.625 119.714 0.911 19168 2299 1 6 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.881 0.187 19168 2300 1 6 . 1 1 31 31 GLU C C 31 179.572 179.572 179.377 0.195 19168 2301 1 6 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.351 -0.076 19168 2302 1 6 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.308 -0.333 19168 2303 1 6 . 1 1 32 32 PHE N N 32 118.245 118.245 118.359 -0.114 19168 2304 1 6 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.281 0.245 19168 2305 1 6 . 1 1 32 32 PHE C C 32 179.123 179.123 177.667 1.456 19168 2306 1 6 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.733 -3.035 19168 2307 1 6 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.882 -1.630 19168 2308 1 6 . 1 1 33 33 LEU N N 33 121.684 121.684 120.761 0.923 19168 2309 1 6 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.270 0.321 19168 2310 1 6 . 1 1 33 33 LEU C C 33 181.655 181.655 179.954 1.701 19168 2311 1 6 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.615 0.557 19168 2312 1 6 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.588 0.104 19168 2313 1 6 . 1 1 34 34 GLU N N 34 122.046 122.046 119.112 2.934 19168 2314 1 6 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.064 0.088 19168 2315 1 6 . 1 1 34 34 GLU C C 34 178.237 178.237 178.280 -0.043 19168 2316 1 6 . 1 1 34 34 GLU CA C 34 59.146 59.146 59.005 0.141 19168 2317 1 6 . 1 1 34 34 GLU CB C 34 29.234 29.234 28.857 0.377 19168 2318 1 6 . 1 1 35 35 GLN N N 35 115.697 115.697 116.586 -0.889 19168 2319 1 6 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.277 0.110 19168 2320 1 6 . 1 1 35 35 GLN C C 35 176.456 176.456 176.625 -0.169 19168 2321 1 6 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.805 -0.119 19168 2322 1 6 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.030 0.166 19168 2323 1 6 . 1 1 36 36 GLY N N 36 108.291 108.291 106.319 1.972 19168 2324 1 6 . 1 1 36 36 GLY C C 36 174.673 174.673 174.331 0.342 19168 2325 1 6 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.235 0.292 19168 2326 1 6 . 1 1 37 37 LYS N N 37 120.464 120.464 120.060 0.404 19168 2327 1 6 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.723 -0.226 19168 2328 1 6 . 1 1 37 37 LYS C C 37 174.580 174.580 175.400 -0.820 19168 2329 1 6 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.070 1.019 19168 2330 1 6 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.854 -2.109 19168 2331 1 6 . 1 1 38 38 HIS N N 38 116.878 116.878 119.795 -2.917 19168 2332 1 6 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.847 0.172 19168 2333 1 6 . 1 1 38 38 HIS C C 38 175.268 175.268 173.799 1.469 19168 2334 1 6 . 1 1 38 38 HIS CA C 38 54.150 54.150 56.052 -1.902 19168 2335 1 6 . 1 1 38 38 HIS CB C 38 32.877 32.877 32.305 0.572 19168 2336 1 6 . 1 1 39 39 VAL N N 39 119.782 119.782 122.631 -2.849 19168 2337 1 6 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.921 -0.125 19168 2338 1 6 . 1 1 39 39 VAL C C 39 173.320 173.320 174.189 -0.869 19168 2339 1 6 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.425 0.341 19168 2340 1 6 . 1 1 39 39 VAL CB C 39 35.433 35.433 34.231 1.202 19168 2341 1 6 . 1 1 40 40 ARG N N 40 128.358 128.358 126.997 1.361 19168 2342 1 6 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.975 0.140 19168 2343 1 6 . 1 1 40 40 ARG C C 40 175.659 175.659 174.461 1.198 19168 2344 1 6 . 1 1 40 40 ARG CA C 40 53.822 53.822 53.979 -0.157 19168 2345 1 6 . 1 1 40 40 ARG CB C 40 33.007 33.007 33.173 -0.167 19168 2346 1 6 . 1 1 41 41 PHE N N 41 126.396 126.396 126.244 0.152 19168 2347 1 6 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.415 -0.237 19168 2348 1 6 . 1 1 41 41 PHE C C 41 176.107 176.107 175.186 0.921 19168 2349 1 6 . 1 1 41 41 PHE CA C 41 57.696 57.696 56.946 0.750 19168 2350 1 6 . 1 1 41 41 PHE CB C 41 42.046 42.046 40.452 1.594 19168 2351 1 6 . 1 1 42 42 ARG N N 42 120.641 120.641 124.204 -3.563 19168 2352 1 6 . 1 1 42 42 ARG HA H 42 5.539 5.539 4.978 0.561 19168 2353 1 6 . 1 1 42 42 ARG C C 42 175.010 175.010 174.726 0.284 19168 2354 1 6 . 1 1 42 42 ARG CA C 42 54.695 54.695 55.252 -0.556 19168 2355 1 6 . 1 1 42 42 ARG CB C 42 34.374 34.374 32.311 2.063 19168 2356 1 6 . 1 1 43 43 VAL N N 43 125.565 125.565 125.578 -0.013 19168 2357 1 6 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.027 -0.362 19168 2358 1 6 . 1 1 43 43 VAL C C 43 175.325 175.325 173.945 1.380 19168 2359 1 6 . 1 1 43 43 VAL CA C 43 60.816 60.816 60.372 0.444 19168 2360 1 6 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.013 -2.030 19168 2361 1 6 . 1 1 44 44 PHE N N 44 128.291 128.291 130.071 -1.780 19168 2362 1 6 . 1 1 44 44 PHE HA H 44 4.618 4.618 5.012 -0.394 19168 2363 1 6 . 1 1 44 44 PHE C C 44 174.477 174.477 174.818 -0.341 19168 2364 1 6 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.238 0.910 19168 2365 1 6 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.938 -1.997 19168 2366 1 6 . 1 1 45 45 LEU N N 45 128.360 128.360 129.348 -0.988 19168 2367 1 6 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.169 0.222 19168 2368 1 6 . 1 1 45 45 LEU C C 45 174.342 174.342 175.616 -1.274 19168 2369 1 6 . 1 1 45 45 LEU CA C 45 53.586 53.586 53.769 -0.183 19168 2370 1 6 . 1 1 45 45 LEU CB C 45 41.113 41.113 40.368 0.745 19168 2371 1 6 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.387 -0.295 19168 2372 1 6 . 1 1 46 46 LYS CA C 46 55.079 55.079 57.047 -1.968 19168 2373 1 6 . 1 1 46 46 LYS CB C 46 34.295 34.295 33.488 0.807 19168 2374 1 6 . 1 1 47 47 GLY CA C 47 46.813 46.813 45.690 1.123 19168 2375 1 6 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.424 -0.224 19168 2376 1 6 . 1 1 48 48 ARG C C 48 178.069 178.069 176.774 1.295 19168 2377 1 6 . 1 1 48 48 ARG CA C 48 57.862 57.862 55.885 1.977 19168 2378 1 6 . 1 1 48 48 ARG CB C 48 29.444 29.444 30.000 -0.556 19168 2379 1 6 . 1 1 49 49 GLU N N 49 119.779 119.779 121.043 -1.264 19168 2380 1 6 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.122 -0.069 19168 2381 1 6 . 1 1 49 49 GLU C C 49 178.227 178.227 177.073 1.154 19168 2382 1 6 . 1 1 49 49 GLU CA C 49 57.436 57.436 57.371 0.065 19168 2383 1 6 . 1 1 49 49 GLU CB C 49 29.745 29.745 28.753 0.992 19168 2384 1 6 . 1 1 50 50 MET N N 50 116.370 116.370 118.012 -1.642 19168 2385 1 6 . 1 1 50 50 MET HA H 50 4.024 4.024 4.142 -0.118 19168 2386 1 6 . 1 1 50 50 MET C C 50 175.912 175.912 177.048 -1.136 19168 2387 1 6 . 1 1 50 50 MET CA C 50 56.664 56.664 57.220 -0.556 19168 2388 1 6 . 1 1 50 50 MET CB C 50 32.033 32.033 31.715 0.318 19168 2389 1 6 . 1 1 51 51 ALA N N 51 118.880 118.880 122.003 -3.123 19168 2390 1 6 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.154 0.190 19168 2391 1 6 . 1 1 51 51 ALA C C 51 177.746 177.746 177.779 -0.033 19168 2392 1 6 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.786 -1.395 19168 2393 1 6 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.372 0.071 19168 2394 1 6 . 1 1 52 52 THR N N 52 108.299 108.299 109.825 -1.526 19168 2395 1 6 . 1 1 52 52 THR HA H 52 4.869 4.869 4.676 0.193 19168 2396 1 6 . 1 1 52 52 THR C C 52 173.933 173.933 172.860 1.073 19168 2397 1 6 . 1 1 52 52 THR CA C 52 57.554 57.554 58.548 -0.994 19168 2398 1 6 . 1 1 52 52 THR CB C 52 69.479 69.479 70.121 -0.642 19168 2399 1 6 . 1 1 53 53 PRO HA H 53 3.931 3.931 3.916 0.015 19168 2400 1 6 . 1 1 53 53 PRO C C 53 178.185 178.185 178.360 -0.175 19168 2401 1 6 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.181 0.838 19168 2402 1 6 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.356 -0.840 19168 2403 1 6 . 1 1 54 54 GLU N N 54 120.653 120.653 118.488 2.165 19168 2404 1 6 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.036 -0.020 19168 2405 1 6 . 1 1 54 54 GLU C C 54 178.608 178.608 177.632 0.976 19168 2406 1 6 . 1 1 54 54 GLU CA C 54 59.472 59.472 58.587 0.885 19168 2407 1 6 . 1 1 54 54 GLU CB C 54 27.419 27.419 29.136 -1.717 19168 2408 1 6 . 1 1 55 55 ALA N N 55 124.380 124.380 121.155 3.225 19168 2409 1 6 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.087 0.236 19168 2410 1 6 . 1 1 55 55 ALA C C 55 181.502 181.502 179.719 1.783 19168 2411 1 6 . 1 1 55 55 ALA CA C 55 54.780 54.780 54.994 -0.214 19168 2412 1 6 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.084 0.317 19168 2413 1 6 . 1 1 56 56 GLY N N 56 105.673 105.673 106.646 -0.973 19168 2414 1 6 . 1 1 56 56 GLY C C 56 174.278 174.278 176.226 -1.948 19168 2415 1 6 . 1 1 56 56 GLY CA C 56 46.879 46.879 47.099 -0.220 19168 2416 1 6 . 1 1 57 57 VAL N N 57 122.685 122.685 122.796 -0.111 19168 2417 1 6 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.696 -0.374 19168 2418 1 6 . 1 1 57 57 VAL C C 57 177.134 177.134 177.699 -0.565 19168 2419 1 6 . 1 1 57 57 VAL CA C 57 67.396 67.396 65.514 1.882 19168 2420 1 6 . 1 1 57 57 VAL CB C 57 31.769 31.769 30.870 0.899 19168 2421 1 6 . 1 1 58 58 ALA N N 58 119.580 119.580 122.753 -3.173 19168 2422 1 6 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.039 0.055 19168 2423 1 6 . 1 1 58 58 ALA C C 58 180.788 180.788 179.763 1.025 19168 2424 1 6 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.350 -0.297 19168 2425 1 6 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.204 -0.350 19168 2426 1 6 . 1 1 59 59 LEU N N 59 119.723 119.723 120.249 -0.526 19168 2427 1 6 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.017 0.241 19168 2428 1 6 . 1 1 59 59 LEU C C 59 178.024 178.024 178.685 -0.661 19168 2429 1 6 . 1 1 59 59 LEU CA C 59 57.710 57.710 57.993 -0.283 19168 2430 1 6 . 1 1 59 59 LEU CB C 59 41.701 41.701 41.998 -0.297 19168 2431 1 6 . 1 1 60 60 LEU N N 60 117.978 117.978 119.000 -1.022 19168 2432 1 6 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.775 0.082 19168 2433 1 6 . 1 1 60 60 LEU C C 60 178.851 178.851 179.165 -0.314 19168 2434 1 6 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.104 -0.460 19168 2435 1 6 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.234 -0.946 19168 2436 1 6 . 1 1 61 61 GLU N N 61 119.906 119.906 119.129 0.777 19168 2437 1 6 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.018 0.473 19168 2438 1 6 . 1 1 61 61 GLU C C 61 179.519 179.519 179.076 0.443 19168 2439 1 6 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.540 -0.798 19168 2440 1 6 . 1 1 61 61 GLU CB C 61 28.813 28.813 28.994 -0.180 19168 2441 1 6 . 1 1 62 62 LYS N N 62 122.015 122.015 120.411 1.604 19168 2442 1 6 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.106 0.022 19168 2443 1 6 . 1 1 62 62 LYS C C 62 179.843 179.843 179.276 0.567 19168 2444 1 6 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.265 0.072 19168 2445 1 6 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.378 -0.731 19168 2446 1 6 . 1 1 63 63 ILE N N 63 120.882 120.882 119.957 0.925 19168 2447 1 6 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.716 -0.220 19168 2448 1 6 . 1 1 63 63 ILE C C 63 177.761 177.761 177.534 0.227 19168 2449 1 6 . 1 1 63 63 ILE CA C 63 65.182 65.182 65.126 0.056 19168 2450 1 6 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.934 -0.548 19168 2451 1 6 . 1 1 64 64 TRP N N 64 120.279 120.279 122.085 -1.806 19168 2452 1 6 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.138 0.346 19168 2453 1 6 . 1 1 64 64 TRP C C 64 177.056 177.056 177.693 -0.637 19168 2454 1 6 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.211 -1.117 19168 2455 1 6 . 1 1 64 64 TRP CB C 64 29.635 29.635 30.161 -0.526 19168 2456 1 6 . 1 1 65 65 THR N N 65 109.483 109.483 110.005 -0.522 19168 2457 1 6 . 1 1 65 65 THR HA H 65 3.744 3.744 4.117 -0.373 19168 2458 1 6 . 1 1 65 65 THR C C 65 176.224 176.224 175.675 0.549 19168 2459 1 6 . 1 1 65 65 THR CA C 65 65.568 65.568 64.231 1.337 19168 2460 1 6 . 1 1 65 65 THR CB C 65 69.308 69.308 68.210 1.097 19168 2461 1 6 . 1 1 66 66 MET N N 66 117.791 117.791 118.619 -0.828 19168 2462 1 6 . 1 1 66 66 MET HA H 66 4.110 4.110 4.335 -0.225 19168 2463 1 6 . 1 1 66 66 MET C C 66 177.782 177.782 177.182 0.600 19168 2464 1 6 . 1 1 66 66 MET CA C 66 58.304 58.304 58.263 0.041 19168 2465 1 6 . 1 1 66 66 MET CB C 66 34.040 34.040 33.705 0.335 19168 2466 1 6 . 1 1 67 67 ILE N N 67 109.871 109.871 112.744 -2.873 19168 2467 1 6 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.427 0.215 19168 2468 1 6 . 1 1 67 67 ILE C C 67 176.713 176.713 176.905 -0.192 19168 2469 1 6 . 1 1 67 67 ILE CA C 67 61.174 61.174 61.173 0.001 19168 2470 1 6 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.559 1.254 19168 2471 1 6 . 1 1 68 68 GLU N N 68 121.972 121.972 121.648 0.324 19168 2472 1 6 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.061 -0.313 19168 2473 1 6 . 1 1 68 68 GLU C C 68 175.855 175.855 177.171 -1.316 19168 2474 1 6 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.643 -0.352 19168 2475 1 6 . 1 1 68 68 GLU CB C 68 28.492 28.492 28.096 0.396 19168 2476 1 6 . 1 1 69 69 ASN N N 69 114.338 114.338 115.562 -1.224 19168 2477 1 6 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.418 0.163 19168 2478 1 6 . 1 1 69 69 ASN C C 69 175.904 175.904 176.434 -0.530 19168 2479 1 6 . 1 1 69 69 ASN CA C 69 54.597 54.597 54.893 -0.296 19168 2480 1 6 . 1 1 69 69 ASN CB C 69 38.323 38.323 37.865 0.458 19168 2481 1 6 . 1 1 70 70 GLU N N 70 116.936 116.936 116.943 -0.007 19168 2482 1 6 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.452 0.096 19168 2483 1 6 . 1 1 70 70 GLU C C 70 174.941 174.941 174.509 0.432 19168 2484 1 6 . 1 1 70 70 GLU CA C 70 55.983 55.983 55.979 0.004 19168 2485 1 6 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.316 0.032 19168 2486 1 6 . 1 1 71 71 ALA N N 71 122.966 122.966 121.101 1.865 19168 2487 1 6 . 1 1 71 71 ALA HA H 71 5.246 5.246 4.929 0.317 19168 2488 1 6 . 1 1 71 71 ALA C C 71 173.907 173.907 175.384 -1.477 19168 2489 1 6 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.620 0.198 19168 2490 1 6 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.389 1.671 19168 2491 1 6 . 1 1 72 72 ASN N N 72 115.820 115.820 118.563 -2.743 19168 2492 1 6 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.422 0.019 19168 2493 1 6 . 1 1 72 72 ASN C C 72 174.137 174.137 174.243 -0.106 19168 2494 1 6 . 1 1 72 72 ASN CA C 72 51.659 51.659 52.104 -0.445 19168 2495 1 6 . 1 1 72 72 ASN CB C 72 42.186 42.186 42.458 -0.272 19168 2496 1 6 . 1 1 73 73 ARG N N 73 118.340 118.340 120.915 -2.575 19168 2497 1 6 . 1 1 73 73 ARG HA H 73 4.778 4.778 4.465 0.313 19168 2498 1 6 . 1 1 73 73 ARG C C 73 174.674 174.674 175.338 -0.664 19168 2499 1 6 . 1 1 73 73 ARG CA C 73 54.869 54.869 55.740 -0.871 19168 2500 1 6 . 1 1 73 73 ARG CB C 73 32.125 32.125 30.456 1.669 19168 2501 1 6 . 1 1 74 74 ASP N N 74 124.007 124.007 124.745 -0.738 19168 2502 1 6 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.653 -0.111 19168 2503 1 6 . 1 1 74 74 ASP C C 74 175.935 175.935 175.348 0.587 19168 2504 1 6 . 1 1 74 74 ASP CA C 74 55.397 55.397 55.152 0.245 19168 2505 1 6 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.771 0.449 19168 2506 1 6 . 1 1 75 75 LYS N N 75 116.482 116.482 117.446 -0.964 19168 2507 1 6 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.365 0.080 19168 2508 1 6 . 1 1 75 75 LYS C C 75 175.135 175.135 174.464 0.671 19168 2509 1 6 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.837 -1.052 19168 2510 1 6 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.582 0.893 19168 2511 1 6 . 1 1 76 76 GLU N N 76 120.126 120.126 121.515 -1.389 19168 2512 1 6 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.504 -0.596 19168 2513 1 6 . 1 1 76 76 GLU C C 76 173.204 173.204 175.182 -1.978 19168 2514 1 6 . 1 1 76 76 GLU CA C 76 55.524 55.524 53.917 1.607 19168 2515 1 6 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.205 -1.694 19168 2516 1 6 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.757 0.020 19168 2517 1 6 . 1 1 77 77 PRO C C 77 174.933 174.933 175.965 -1.032 19168 2518 1 6 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.741 0.681 19168 2519 1 6 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.109 0.282 19168 2520 1 6 . 1 1 78 78 ASN N N 78 119.292 119.292 121.902 -2.610 19168 2521 1 6 . 1 1 78 78 ASN HA H 78 5.093 5.093 4.987 0.106 19168 2522 1 6 . 1 1 78 78 ASN C C 78 172.876 172.876 173.830 -0.954 19168 2523 1 6 . 1 1 78 78 ASN CA C 78 51.928 51.928 52.897 -0.969 19168 2524 1 6 . 1 1 78 78 ASN CB C 78 42.017 42.017 42.364 -0.347 19168 2525 1 6 . 1 1 79 79 PHE N N 79 125.023 125.023 126.134 -1.111 19168 2526 1 6 . 1 1 79 79 PHE HA H 79 5.423 5.423 4.945 0.478 19168 2527 1 6 . 1 1 79 79 PHE C C 79 174.552 174.552 174.688 -0.136 19168 2528 1 6 . 1 1 79 79 PHE CA C 79 55.210 55.210 58.087 -2.877 19168 2529 1 6 . 1 1 79 79 PHE CB C 79 40.109 40.109 39.817 0.292 19168 2530 1 6 . 1 1 80 80 GLU N N 80 128.920 128.920 128.824 0.096 19168 2531 1 6 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.442 -0.234 19168 2532 1 6 . 1 1 80 80 GLU C C 80 175.538 175.538 175.997 -0.459 19168 2533 1 6 . 1 1 80 80 GLU CA C 80 55.724 55.724 54.921 0.803 19168 2534 1 6 . 1 1 80 80 GLU CB C 80 32.135 32.135 32.041 0.094 19168 2535 1 6 . 1 1 81 81 GLY N N 81 116.695 116.695 115.531 1.164 19168 2536 1 6 . 1 1 81 81 GLY C C 81 173.950 173.950 174.644 -0.694 19168 2537 1 6 . 1 1 81 81 GLY CA C 81 46.967 46.967 46.805 0.162 19168 2538 1 6 . 1 1 82 82 ARG N N 82 124.481 124.481 122.392 2.089 19168 2539 1 6 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.607 -0.068 19168 2540 1 6 . 1 1 82 82 ARG C C 82 173.437 173.437 174.367 -0.930 19168 2541 1 6 . 1 1 82 82 ARG CA C 82 55.156 55.156 55.319 -0.164 19168 2542 1 6 . 1 1 82 82 ARG CB C 82 30.255 30.255 33.104 -2.849 19168 2543 1 6 . 1 1 83 83 TYR N N 83 114.539 114.539 118.164 -3.625 19168 2544 1 6 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.678 0.270 19168 2545 1 6 . 1 1 83 83 TYR C C 83 175.909 175.909 174.693 1.216 19168 2546 1 6 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.409 -0.352 19168 2547 1 6 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.180 0.819 19168 2548 1 6 . 1 1 84 84 VAL N N 84 118.812 118.812 123.128 -4.316 19168 2549 1 6 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.608 0.259 19168 2550 1 6 . 1 1 84 84 VAL C C 84 174.982 174.982 175.329 -0.347 19168 2551 1 6 . 1 1 84 84 VAL CA C 84 61.235 61.235 62.135 -0.900 19168 2552 1 6 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.285 0.207 19168 2553 1 6 . 1 1 85 85 ASN N N 85 124.630 124.630 126.400 -1.770 19168 2554 1 6 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.188 -0.184 19168 2555 1 6 . 1 1 85 85 ASN C C 85 175.392 175.392 173.876 1.516 19168 2556 1 6 . 1 1 85 85 ASN CA C 85 52.596 52.596 52.038 0.557 19168 2557 1 6 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.531 1.675 19168 2558 1 6 . 1 1 86 86 MET N N 86 118.969 118.969 121.523 -2.554 19168 2559 1 6 . 1 1 86 86 MET HA H 86 4.640 4.640 4.888 -0.248 19168 2560 1 6 . 1 1 86 86 MET C C 86 172.378 172.378 173.445 -1.067 19168 2561 1 6 . 1 1 86 86 MET CA C 86 56.158 56.158 55.237 0.921 19168 2562 1 6 . 1 1 86 86 MET CB C 86 39.138 39.138 36.713 2.425 19168 2563 1 6 . 1 1 87 87 LEU N N 87 131.886 131.886 126.466 5.420 19168 2564 1 6 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.409 -0.028 19168 2565 1 6 . 1 1 87 87 LEU C C 87 176.003 176.003 176.042 -0.039 19168 2566 1 6 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.496 0.634 19168 2567 1 6 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.447 0.026 19168 2568 1 6 . 1 1 88 88 VAL N N 88 121.165 121.165 120.175 0.990 19168 2569 1 6 . 1 1 88 88 VAL HA H 88 5.510 5.510 5.111 0.399 19168 2570 1 6 . 1 1 88 88 VAL C C 88 173.666 173.666 174.516 -0.850 19168 2571 1 6 . 1 1 88 88 VAL CA C 88 58.600 58.600 60.006 -1.406 19168 2572 1 6 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.453 0.340 19168 2573 1 6 . 1 1 89 89 THR N N 89 111.786 111.786 121.685 -9.899 19168 2574 1 6 . 1 1 89 89 THR HA H 89 4.720 4.720 4.329 0.391 19168 2575 1 6 . 1 1 89 89 THR C C 89 171.898 171.898 172.307 -0.409 19168 2576 1 6 . 1 1 89 89 THR CA C 89 57.985 57.985 59.288 -1.303 19168 2577 1 6 . 1 1 89 89 THR CB C 89 69.113 69.113 69.886 -0.773 19168 2578 1 6 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.503 0.080 19168 2579 1 6 . 1 1 90 90 PRO C C 90 177.403 177.403 176.785 0.618 19168 2580 1 6 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.332 1.199 19168 2581 1 6 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.436 -0.393 19168 2582 1 6 . 1 1 91 91 LYS N N 91 123.696 123.696 122.342 1.354 19168 2583 1 6 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.191 -0.080 19168 2584 1 6 . 1 1 91 91 LYS C C 91 176.568 176.568 176.631 -0.063 19168 2585 1 6 . 1 1 91 91 LYS CA C 91 57.208 57.208 56.789 0.419 19168 2586 1 6 . 1 1 91 91 LYS CB C 91 33.183 33.183 32.098 1.085 19168 2587 1 6 . 1 1 92 92 LYS N N 92 122.054 122.054 125.998 -3.944 19168 2588 1 6 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.284 0.032 19168 2589 1 6 . 1 1 92 92 LYS C C 92 175.956 175.956 176.260 -0.304 19168 2590 1 6 . 1 1 92 92 LYS CA C 92 55.942 55.942 56.491 -0.549 19168 2591 1 6 . 1 1 92 92 LYS CB C 92 33.000 33.000 31.444 1.556 19168 2592 1 6 . 1 1 93 93 ALA N N 93 126.278 126.278 126.253 0.025 19168 2593 1 6 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.086 0.255 19168 2594 1 6 . 1 1 93 93 ALA C C 93 177.592 177.592 176.041 1.551 19168 2595 1 6 . 1 1 93 93 ALA CA C 93 52.279 52.279 52.633 -0.354 19168 2596 1 6 . 1 1 93 93 ALA CB C 93 19.332 19.332 18.882 0.450 19168 2597 1 6 . 1 1 94 94 GLU N N 94 120.522 120.522 121.057 -0.535 19168 2598 1 6 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.490 -0.206 19168 2599 1 6 . 1 1 94 94 GLU C C 94 177.041 177.041 176.303 0.738 19168 2600 1 6 . 1 1 94 94 GLU CA C 94 56.606 56.606 56.232 0.374 19168 2601 1 6 . 1 1 94 94 GLU CB C 94 30.353 30.353 30.250 0.103 19168 2602 1 6 . 1 1 95 95 GLY N N 95 109.755 109.755 113.422 -3.667 19168 2603 1 6 . 1 1 95 95 GLY C C 95 173.939 173.939 172.884 1.055 19168 2604 1 6 . 1 1 95 95 GLY CA C 95 45.168 45.168 44.190 0.978 19168 2605 1 7 . 1 1 5 5 VAL N N 5 123.289 123.289 123.097 0.192 19168 2606 1 7 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.227 -0.208 19168 2607 1 7 . 1 1 5 5 VAL C C 5 175.799 175.799 175.400 0.399 19168 2608 1 7 . 1 1 5 5 VAL CA C 5 62.120 62.120 61.356 0.764 19168 2609 1 7 . 1 1 5 5 VAL CB C 5 32.757 32.757 33.361 -0.604 19168 2610 1 7 . 1 1 6 6 ILE N N 6 126.794 126.794 126.272 0.522 19168 2611 1 7 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.052 -0.085 19168 2612 1 7 . 1 1 6 6 ILE C C 6 175.103 175.103 175.157 -0.054 19168 2613 1 7 . 1 1 6 6 ILE CA C 6 60.227 60.227 59.848 0.379 19168 2614 1 7 . 1 1 6 6 ILE CB C 6 38.565 38.565 37.699 0.866 19168 2615 1 7 . 1 1 7 7 ASP N N 7 127.797 127.797 128.888 -1.091 19168 2616 1 7 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.599 -0.055 19168 2617 1 7 . 1 1 7 7 ASP C C 7 174.000 174.000 174.999 -0.999 19168 2618 1 7 . 1 1 7 7 ASP CA C 7 53.591 53.591 54.546 -0.955 19168 2619 1 7 . 1 1 7 7 ASP CB C 7 42.152 42.152 40.917 1.235 19168 2620 1 7 . 1 1 8 8 ILE N N 8 122.764 122.764 124.166 -1.402 19168 2621 1 7 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.379 -0.059 19168 2622 1 7 . 1 1 8 8 ILE C C 8 176.337 176.337 175.367 0.970 19168 2623 1 7 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.102 0.073 19168 2624 1 7 . 1 1 8 8 ILE CB C 8 39.542 39.542 39.497 0.045 19168 2625 1 7 . 1 1 9 9 LYS N N 9 127.990 127.990 127.529 0.461 19168 2626 1 7 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.336 -0.014 19168 2627 1 7 . 1 1 9 9 LYS C C 9 174.759 174.759 175.321 -0.562 19168 2628 1 7 . 1 1 9 9 LYS CA C 9 52.315 52.315 53.731 -1.416 19168 2629 1 7 . 1 1 9 9 LYS CB C 9 32.902 32.902 32.774 0.128 19168 2630 1 7 . 1 1 10 10 GLU N N 10 123.021 123.021 124.253 -1.232 19168 2631 1 7 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.869 0.266 19168 2632 1 7 . 1 1 10 10 GLU C C 10 176.215 176.215 175.846 0.369 19168 2633 1 7 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.347 -0.445 19168 2634 1 7 . 1 1 10 10 GLU CB C 10 32.037 32.037 30.118 1.919 19168 2635 1 7 . 1 1 11 11 ILE N N 11 126.526 126.526 127.006 -0.480 19168 2636 1 7 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.087 0.248 19168 2637 1 7 . 1 1 11 11 ILE C C 11 174.334 174.334 174.938 -0.604 19168 2638 1 7 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.587 -0.277 19168 2639 1 7 . 1 1 11 11 ILE CB C 11 39.826 39.826 38.719 1.107 19168 2640 1 7 . 1 1 12 12 LYS N N 12 128.164 128.164 129.123 -0.959 19168 2641 1 7 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.431 -0.086 19168 2642 1 7 . 1 1 12 12 LYS C C 12 176.378 176.378 175.690 0.688 19168 2643 1 7 . 1 1 12 12 LYS CA C 12 55.940 55.940 56.003 -0.063 19168 2644 1 7 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.987 0.069 19168 2645 1 7 . 1 1 13 13 LEU N N 13 121.881 121.881 125.413 -3.532 19168 2646 1 7 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.900 0.054 19168 2647 1 7 . 1 1 13 13 LEU C C 13 175.137 175.137 174.884 0.253 19168 2648 1 7 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.696 0.278 19168 2649 1 7 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.147 0.137 19168 2650 1 7 . 1 1 14 14 SER N N 14 115.759 115.759 112.273 3.486 19168 2651 1 7 . 1 1 14 14 SER HA H 14 4.889 4.889 4.866 0.023 19168 2652 1 7 . 1 1 14 14 SER C C 14 173.993 173.993 174.235 -0.242 19168 2653 1 7 . 1 1 14 14 SER CA C 14 56.052 56.052 56.897 -0.845 19168 2654 1 7 . 1 1 14 14 SER CB C 14 64.775 64.775 66.162 -1.387 19168 2655 1 7 . 1 1 15 15 VAL N N 15 120.993 120.993 120.920 0.073 19168 2656 1 7 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.825 -0.091 19168 2657 1 7 . 1 1 15 15 VAL C C 15 176.964 176.964 177.534 -0.570 19168 2658 1 7 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.498 -0.071 19168 2659 1 7 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.961 -0.176 19168 2660 1 7 . 1 1 16 16 LYS N N 16 118.897 118.897 118.680 0.217 19168 2661 1 7 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.302 0.099 19168 2662 1 7 . 1 1 16 16 LYS C C 16 175.489 175.489 175.388 0.101 19168 2663 1 7 . 1 1 16 16 LYS CA C 16 55.155 55.155 56.106 -0.952 19168 2664 1 7 . 1 1 16 16 LYS CB C 16 30.929 30.929 30.123 0.806 19168 2665 1 7 . 1 1 17 17 ILE N N 17 122.247 122.247 120.426 1.821 19168 2666 1 7 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.274 -0.089 19168 2667 1 7 . 1 1 17 17 ILE C C 17 173.426 173.426 174.915 -1.489 19168 2668 1 7 . 1 1 17 17 ILE CA C 17 61.276 61.276 59.940 1.336 19168 2669 1 7 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.345 -1.265 19168 2670 1 7 . 1 1 18 18 ALA N N 18 129.434 129.434 127.807 1.627 19168 2671 1 7 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.608 -0.129 19168 2672 1 7 . 1 1 18 18 ALA C C 18 179.130 179.130 177.703 1.427 19168 2673 1 7 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.053 0.384 19168 2674 1 7 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.407 -0.498 19168 2675 1 7 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.030 -0.233 19168 2676 1 7 . 1 1 19 19 GLN CA C 19 59.231 59.231 59.005 0.226 19168 2677 1 7 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.354 -0.179 19168 2678 1 7 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.537 -0.107 19168 2679 1 7 . 1 1 20 20 ASN C C 20 177.272 177.272 177.411 -0.139 19168 2680 1 7 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.133 0.051 19168 2681 1 7 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.184 0.269 19168 2682 1 7 . 1 1 21 21 ASP N N 21 119.132 119.132 119.754 -0.622 19168 2683 1 7 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.528 0.270 19168 2684 1 7 . 1 1 21 21 ASP C C 21 178.707 178.707 178.529 0.178 19168 2685 1 7 . 1 1 21 21 ASP CA C 21 56.886 56.886 56.892 -0.006 19168 2686 1 7 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.683 -0.018 19168 2687 1 7 . 1 1 22 22 ILE N N 22 122.030 122.030 120.182 1.848 19168 2688 1 7 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.626 -0.208 19168 2689 1 7 . 1 1 22 22 ILE C C 22 177.454 177.454 177.948 -0.494 19168 2690 1 7 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.618 1.108 19168 2691 1 7 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.788 -0.222 19168 2692 1 7 . 1 1 23 23 ASN N N 23 116.728 116.728 118.689 -1.961 19168 2693 1 7 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.453 -0.240 19168 2694 1 7 . 1 1 23 23 ASN C C 23 178.260 178.260 177.934 0.326 19168 2695 1 7 . 1 1 23 23 ASN CA C 23 56.274 56.274 57.154 -0.880 19168 2696 1 7 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.751 -1.543 19168 2697 1 7 . 1 1 24 24 TYR N N 24 119.864 119.864 121.725 -1.861 19168 2698 1 7 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.178 0.115 19168 2699 1 7 . 1 1 24 24 TYR C C 24 177.719 177.719 177.499 0.220 19168 2700 1 7 . 1 1 24 24 TYR CA C 24 61.048 61.048 62.263 -1.215 19168 2701 1 7 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.692 -0.409 19168 2702 1 7 . 1 1 25 25 LYS N N 25 119.730 119.730 119.795 -0.065 19168 2703 1 7 . 1 1 25 25 LYS HA H 25 4.111 4.111 4.005 0.106 19168 2704 1 7 . 1 1 25 25 LYS C C 25 179.152 179.152 179.099 0.053 19168 2705 1 7 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.830 -0.668 19168 2706 1 7 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.689 -0.395 19168 2707 1 7 . 1 1 26 26 VAL N N 26 119.387 119.387 119.751 -0.364 19168 2708 1 7 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.773 -0.153 19168 2709 1 7 . 1 1 26 26 VAL C C 26 177.017 177.017 177.617 -0.600 19168 2710 1 7 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.606 1.055 19168 2711 1 7 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.535 0.015 19168 2712 1 7 . 1 1 27 27 LYS N N 27 120.420 120.420 119.310 1.110 19168 2713 1 7 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.927 0.019 19168 2714 1 7 . 1 1 27 27 LYS C C 27 179.458 179.458 178.974 0.484 19168 2715 1 7 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.400 0.478 19168 2716 1 7 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.247 -0.399 19168 2717 1 7 . 1 1 28 28 HIS N N 28 118.160 118.160 119.615 -1.455 19168 2718 1 7 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.687 -0.500 19168 2719 1 7 . 1 1 28 28 HIS C C 28 177.085 177.085 176.929 0.156 19168 2720 1 7 . 1 1 28 28 HIS CA C 28 57.885 57.885 58.211 -0.326 19168 2721 1 7 . 1 1 28 28 HIS CB C 28 29.756 29.756 30.127 -0.371 19168 2722 1 7 . 1 1 29 29 ALA N N 29 120.579 120.579 121.417 -0.838 19168 2723 1 7 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.160 -0.162 19168 2724 1 7 . 1 1 29 29 ALA C C 29 179.299 179.299 179.384 -0.085 19168 2725 1 7 . 1 1 29 29 ALA CA C 29 55.567 55.567 54.955 0.612 19168 2726 1 7 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.317 1.132 19168 2727 1 7 . 1 1 30 30 LEU N N 30 117.262 117.262 117.706 -0.444 19168 2728 1 7 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.949 0.126 19168 2729 1 7 . 1 1 30 30 LEU C C 30 180.017 180.017 178.987 1.030 19168 2730 1 7 . 1 1 30 30 LEU CA C 30 58.232 58.232 57.708 0.524 19168 2731 1 7 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.534 -0.208 19168 2732 1 7 . 1 1 31 31 GLU N N 31 120.625 120.625 119.705 0.920 19168 2733 1 7 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.939 0.129 19168 2734 1 7 . 1 1 31 31 GLU C C 31 179.572 179.572 178.843 0.729 19168 2735 1 7 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.899 -0.624 19168 2736 1 7 . 1 1 31 31 GLU CB C 31 28.975 28.975 28.791 0.184 19168 2737 1 7 . 1 1 32 32 PHE N N 32 118.245 118.245 117.386 0.859 19168 2738 1 7 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.271 0.255 19168 2739 1 7 . 1 1 32 32 PHE C C 32 179.123 179.123 177.642 1.481 19168 2740 1 7 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.258 -2.562 19168 2741 1 7 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.688 -1.436 19168 2742 1 7 . 1 1 33 33 LEU N N 33 121.684 121.684 120.881 0.803 19168 2743 1 7 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.327 0.264 19168 2744 1 7 . 1 1 33 33 LEU C C 33 181.655 181.655 180.100 1.555 19168 2745 1 7 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.609 0.563 19168 2746 1 7 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.681 0.012 19168 2747 1 7 . 1 1 34 34 GLU N N 34 122.046 122.046 117.869 4.177 19168 2748 1 7 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.016 0.136 19168 2749 1 7 . 1 1 34 34 GLU C C 34 178.237 178.237 178.045 0.192 19168 2750 1 7 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.859 0.287 19168 2751 1 7 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.128 0.106 19168 2752 1 7 . 1 1 35 35 GLN N N 35 115.697 115.697 114.719 0.978 19168 2753 1 7 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.132 0.255 19168 2754 1 7 . 1 1 35 35 GLN C C 35 176.456 176.456 176.568 -0.112 19168 2755 1 7 . 1 1 35 35 GLN CA C 35 55.686 55.686 56.706 -1.020 19168 2756 1 7 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.438 -0.242 19168 2757 1 7 . 1 1 36 36 GLY N N 36 108.291 108.291 106.363 1.928 19168 2758 1 7 . 1 1 36 36 GLY C C 36 174.673 174.673 174.155 0.518 19168 2759 1 7 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.135 0.392 19168 2760 1 7 . 1 1 37 37 LYS N N 37 120.464 120.464 119.220 1.244 19168 2761 1 7 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.873 -0.376 19168 2762 1 7 . 1 1 37 37 LYS C C 37 174.580 174.580 176.232 -1.652 19168 2763 1 7 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.911 0.178 19168 2764 1 7 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.676 -1.931 19168 2765 1 7 . 1 1 38 38 HIS N N 38 116.878 116.878 117.139 -0.261 19168 2766 1 7 . 1 1 38 38 HIS HA H 38 5.019 5.019 5.082 -0.063 19168 2767 1 7 . 1 1 38 38 HIS C C 38 175.268 175.268 174.103 1.165 19168 2768 1 7 . 1 1 38 38 HIS CA C 38 54.150 54.150 54.588 -0.438 19168 2769 1 7 . 1 1 38 38 HIS CB C 38 32.877 32.877 32.834 0.043 19168 2770 1 7 . 1 1 39 39 VAL N N 39 119.782 119.782 120.095 -0.313 19168 2771 1 7 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.733 0.063 19168 2772 1 7 . 1 1 39 39 VAL C C 39 173.320 173.320 174.310 -0.990 19168 2773 1 7 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.411 0.355 19168 2774 1 7 . 1 1 39 39 VAL CB C 39 35.433 35.433 33.728 1.705 19168 2775 1 7 . 1 1 40 40 ARG N N 40 128.358 128.358 126.882 1.476 19168 2776 1 7 . 1 1 40 40 ARG HA H 40 5.115 5.115 5.078 0.037 19168 2777 1 7 . 1 1 40 40 ARG C C 40 175.659 175.659 175.272 0.387 19168 2778 1 7 . 1 1 40 40 ARG CA C 40 53.822 53.822 53.860 -0.038 19168 2779 1 7 . 1 1 40 40 ARG CB C 40 33.007 33.007 32.168 0.839 19168 2780 1 7 . 1 1 41 41 PHE N N 41 126.396 126.396 127.241 -0.845 19168 2781 1 7 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.124 0.054 19168 2782 1 7 . 1 1 41 41 PHE C C 41 176.107 176.107 175.385 0.722 19168 2783 1 7 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.880 -0.184 19168 2784 1 7 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.525 2.521 19168 2785 1 7 . 1 1 42 42 ARG N N 42 120.641 120.641 123.205 -2.564 19168 2786 1 7 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.447 0.092 19168 2787 1 7 . 1 1 42 42 ARG C C 42 175.010 175.010 174.721 0.289 19168 2788 1 7 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.777 -0.082 19168 2789 1 7 . 1 1 42 42 ARG CB C 42 34.374 34.374 33.732 0.642 19168 2790 1 7 . 1 1 43 43 VAL N N 43 125.565 125.565 123.519 2.046 19168 2791 1 7 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.022 -0.357 19168 2792 1 7 . 1 1 43 43 VAL C C 43 175.325 175.325 173.536 1.789 19168 2793 1 7 . 1 1 43 43 VAL CA C 43 60.816 60.816 60.157 0.659 19168 2794 1 7 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.963 -2.980 19168 2795 1 7 . 1 1 44 44 PHE N N 44 128.291 128.291 129.878 -1.587 19168 2796 1 7 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.590 0.028 19168 2797 1 7 . 1 1 44 44 PHE C C 44 174.477 174.477 174.405 0.072 19168 2798 1 7 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.287 0.861 19168 2799 1 7 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.274 -1.333 19168 2800 1 7 . 1 1 45 45 LEU N N 45 128.360 128.360 128.774 -0.414 19168 2801 1 7 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.335 0.056 19168 2802 1 7 . 1 1 45 45 LEU C C 45 174.342 174.342 175.879 -1.537 19168 2803 1 7 . 1 1 45 45 LEU CA C 45 53.586 53.586 53.667 -0.081 19168 2804 1 7 . 1 1 45 45 LEU CB C 45 41.113 41.113 41.663 -0.550 19168 2805 1 7 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.166 -0.074 19168 2806 1 7 . 1 1 46 46 LYS CA C 46 55.079 55.079 55.969 -0.890 19168 2807 1 7 . 1 1 46 46 LYS CB C 46 34.295 34.295 31.673 2.622 19168 2808 1 7 . 1 1 47 47 GLY CA C 47 46.813 46.813 44.746 2.067 19168 2809 1 7 . 1 1 48 48 ARG HA H 48 4.200 4.200 3.679 0.521 19168 2810 1 7 . 1 1 48 48 ARG C C 48 178.069 178.069 177.885 0.184 19168 2811 1 7 . 1 1 48 48 ARG CA C 48 57.862 57.862 59.323 -1.461 19168 2812 1 7 . 1 1 48 48 ARG CB C 48 29.444 29.444 29.007 0.437 19168 2813 1 7 . 1 1 49 49 GLU N N 49 119.779 119.779 119.903 -0.124 19168 2814 1 7 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.074 -0.021 19168 2815 1 7 . 1 1 49 49 GLU C C 49 178.227 178.227 178.818 -0.591 19168 2816 1 7 . 1 1 49 49 GLU CA C 49 57.436 57.436 58.565 -1.129 19168 2817 1 7 . 1 1 49 49 GLU CB C 49 29.745 29.745 29.378 0.367 19168 2818 1 7 . 1 1 50 50 MET N N 50 116.370 116.370 117.136 -0.766 19168 2819 1 7 . 1 1 50 50 MET HA H 50 4.024 4.024 4.088 -0.064 19168 2820 1 7 . 1 1 50 50 MET C C 50 175.912 175.912 177.360 -1.448 19168 2821 1 7 . 1 1 50 50 MET CA C 50 56.664 56.664 57.648 -0.983 19168 2822 1 7 . 1 1 50 50 MET CB C 50 32.033 32.033 32.059 -0.026 19168 2823 1 7 . 1 1 51 51 ALA N N 51 118.880 118.880 119.334 -0.454 19168 2824 1 7 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.196 0.148 19168 2825 1 7 . 1 1 51 51 ALA C C 51 177.746 177.746 177.865 -0.119 19168 2826 1 7 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.160 -0.769 19168 2827 1 7 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.433 0.010 19168 2828 1 7 . 1 1 52 52 THR N N 52 108.299 108.299 115.136 -6.837 19168 2829 1 7 . 1 1 52 52 THR HA H 52 4.869 4.869 4.591 0.278 19168 2830 1 7 . 1 1 52 52 THR C C 52 173.933 173.933 172.474 1.459 19168 2831 1 7 . 1 1 52 52 THR CA C 52 57.554 57.554 59.427 -1.873 19168 2832 1 7 . 1 1 52 52 THR CB C 52 69.479 69.479 69.241 0.238 19168 2833 1 7 . 1 1 53 53 PRO HA H 53 3.931 3.931 3.928 0.003 19168 2834 1 7 . 1 1 53 53 PRO C C 53 178.185 178.185 178.234 -0.049 19168 2835 1 7 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.490 0.529 19168 2836 1 7 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.715 -1.199 19168 2837 1 7 . 1 1 54 54 GLU N N 54 120.653 120.653 118.029 2.624 19168 2838 1 7 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.023 -0.007 19168 2839 1 7 . 1 1 54 54 GLU C C 54 178.608 178.608 177.897 0.711 19168 2840 1 7 . 1 1 54 54 GLU CA C 54 59.472 59.472 58.962 0.510 19168 2841 1 7 . 1 1 54 54 GLU CB C 54 27.419 27.419 29.258 -1.839 19168 2842 1 7 . 1 1 55 55 ALA N N 55 124.380 124.380 121.289 3.091 19168 2843 1 7 . 1 1 55 55 ALA HA H 55 4.323 4.323 3.998 0.325 19168 2844 1 7 . 1 1 55 55 ALA C C 55 181.502 181.502 179.324 2.178 19168 2845 1 7 . 1 1 55 55 ALA CA C 55 54.780 54.780 54.964 -0.184 19168 2846 1 7 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.243 0.158 19168 2847 1 7 . 1 1 56 56 GLY N N 56 105.673 105.673 106.688 -1.015 19168 2848 1 7 . 1 1 56 56 GLY C C 56 174.278 174.278 176.191 -1.913 19168 2849 1 7 . 1 1 56 56 GLY CA C 56 46.879 46.879 46.857 0.022 19168 2850 1 7 . 1 1 57 57 VAL N N 57 122.685 122.685 123.005 -0.320 19168 2851 1 7 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.583 -0.261 19168 2852 1 7 . 1 1 57 57 VAL C C 57 177.134 177.134 177.642 -0.508 19168 2853 1 7 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.246 1.150 19168 2854 1 7 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.589 0.180 19168 2855 1 7 . 1 1 58 58 ALA N N 58 119.580 119.580 122.342 -2.762 19168 2856 1 7 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.228 -0.134 19168 2857 1 7 . 1 1 58 58 ALA C C 58 180.788 180.788 179.655 1.133 19168 2858 1 7 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.171 -0.118 19168 2859 1 7 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.314 -0.460 19168 2860 1 7 . 1 1 59 59 LEU N N 59 119.723 119.723 120.296 -0.573 19168 2861 1 7 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.021 0.237 19168 2862 1 7 . 1 1 59 59 LEU C C 59 178.024 178.024 178.647 -0.623 19168 2863 1 7 . 1 1 59 59 LEU CA C 59 57.710 57.710 57.903 -0.193 19168 2864 1 7 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.015 -0.314 19168 2865 1 7 . 1 1 60 60 LEU N N 60 117.978 117.978 118.184 -0.206 19168 2866 1 7 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.807 0.050 19168 2867 1 7 . 1 1 60 60 LEU C C 60 178.851 178.851 178.910 -0.059 19168 2868 1 7 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.094 -0.450 19168 2869 1 7 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.518 -1.230 19168 2870 1 7 . 1 1 61 61 GLU N N 61 119.906 119.906 119.073 0.833 19168 2871 1 7 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.071 0.420 19168 2872 1 7 . 1 1 61 61 GLU C C 61 179.519 179.519 178.535 0.984 19168 2873 1 7 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.212 -0.470 19168 2874 1 7 . 1 1 61 61 GLU CB C 61 28.813 28.813 28.934 -0.121 19168 2875 1 7 . 1 1 62 62 LYS N N 62 122.015 122.015 121.123 0.892 19168 2876 1 7 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.076 0.052 19168 2877 1 7 . 1 1 62 62 LYS C C 62 179.843 179.843 178.994 0.849 19168 2878 1 7 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.363 -0.026 19168 2879 1 7 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.383 -0.736 19168 2880 1 7 . 1 1 63 63 ILE N N 63 120.882 120.882 119.338 1.544 19168 2881 1 7 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.715 -0.219 19168 2882 1 7 . 1 1 63 63 ILE C C 63 177.761 177.761 177.447 0.314 19168 2883 1 7 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.733 0.449 19168 2884 1 7 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.979 -0.593 19168 2885 1 7 . 1 1 64 64 TRP N N 64 120.279 120.279 121.774 -1.495 19168 2886 1 7 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.026 0.458 19168 2887 1 7 . 1 1 64 64 TRP C C 64 177.056 177.056 177.800 -0.744 19168 2888 1 7 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.432 -1.338 19168 2889 1 7 . 1 1 64 64 TRP CB C 64 29.635 29.635 29.787 -0.152 19168 2890 1 7 . 1 1 65 65 THR N N 65 109.483 109.483 113.805 -4.322 19168 2891 1 7 . 1 1 65 65 THR HA H 65 3.744 3.744 3.638 0.106 19168 2892 1 7 . 1 1 65 65 THR C C 65 176.224 176.224 175.714 0.510 19168 2893 1 7 . 1 1 65 65 THR CA C 65 65.568 65.568 64.792 0.776 19168 2894 1 7 . 1 1 65 65 THR CB C 65 69.308 69.308 68.611 0.697 19168 2895 1 7 . 1 1 66 66 MET N N 66 117.791 117.791 118.744 -0.953 19168 2896 1 7 . 1 1 66 66 MET HA H 66 4.110 4.110 4.311 -0.201 19168 2897 1 7 . 1 1 66 66 MET C C 66 177.782 177.782 177.850 -0.068 19168 2898 1 7 . 1 1 66 66 MET CA C 66 58.304 58.304 58.812 -0.508 19168 2899 1 7 . 1 1 66 66 MET CB C 66 34.040 34.040 33.812 0.228 19168 2900 1 7 . 1 1 67 67 ILE N N 67 109.871 109.871 114.720 -4.849 19168 2901 1 7 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.240 0.402 19168 2902 1 7 . 1 1 67 67 ILE C C 67 176.713 176.713 176.159 0.554 19168 2903 1 7 . 1 1 67 67 ILE CA C 67 61.174 61.174 62.149 -0.975 19168 2904 1 7 . 1 1 67 67 ILE CB C 67 39.813 39.813 37.581 2.232 19168 2905 1 7 . 1 1 68 68 GLU N N 68 121.972 121.972 120.368 1.604 19168 2906 1 7 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.787 -1.039 19168 2907 1 7 . 1 1 68 68 GLU C C 68 175.855 175.855 177.221 -1.366 19168 2908 1 7 . 1 1 68 68 GLU CA C 68 58.291 58.291 57.229 1.062 19168 2909 1 7 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.363 1.129 19168 2910 1 7 . 1 1 69 69 ASN N N 69 114.338 114.338 117.620 -3.282 19168 2911 1 7 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.408 0.172 19168 2912 1 7 . 1 1 69 69 ASN C C 69 175.904 175.904 177.029 -1.125 19168 2913 1 7 . 1 1 69 69 ASN CA C 69 54.597 54.597 56.078 -1.481 19168 2914 1 7 . 1 1 69 69 ASN CB C 69 38.323 38.323 38.575 -0.252 19168 2915 1 7 . 1 1 70 70 GLU N N 70 116.936 116.936 116.648 0.288 19168 2916 1 7 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.590 -0.042 19168 2917 1 7 . 1 1 70 70 GLU C C 70 174.941 174.941 174.989 -0.048 19168 2918 1 7 . 1 1 70 70 GLU CA C 70 55.983 55.983 55.630 0.353 19168 2919 1 7 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.441 -0.093 19168 2920 1 7 . 1 1 71 71 ALA N N 71 122.966 122.966 122.492 0.474 19168 2921 1 7 . 1 1 71 71 ALA HA H 71 5.246 5.246 5.229 0.017 19168 2922 1 7 . 1 1 71 71 ALA C C 71 173.907 173.907 175.494 -1.587 19168 2923 1 7 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.305 0.513 19168 2924 1 7 . 1 1 71 71 ALA CB C 71 24.060 24.060 21.937 2.123 19168 2925 1 7 . 1 1 72 72 ASN N N 72 115.820 115.820 120.252 -4.432 19168 2926 1 7 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.350 0.091 19168 2927 1 7 . 1 1 72 72 ASN C C 72 174.137 174.137 174.782 -0.645 19168 2928 1 7 . 1 1 72 72 ASN CA C 72 51.659 51.659 51.830 -0.171 19168 2929 1 7 . 1 1 72 72 ASN CB C 72 42.186 42.186 41.312 0.874 19168 2930 1 7 . 1 1 73 73 ARG N N 73 118.340 118.340 125.177 -6.837 19168 2931 1 7 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.779 0.999 19168 2932 1 7 . 1 1 73 73 ARG C C 73 174.674 174.674 175.049 -0.375 19168 2933 1 7 . 1 1 73 73 ARG CA C 73 54.869 54.869 57.049 -2.180 19168 2934 1 7 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.409 2.716 19168 2935 1 7 . 1 1 74 74 ASP N N 74 124.007 124.007 126.868 -2.861 19168 2936 1 7 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.528 0.014 19168 2937 1 7 . 1 1 74 74 ASP C C 74 175.935 175.935 175.539 0.396 19168 2938 1 7 . 1 1 74 74 ASP CA C 74 55.397 55.397 55.952 -0.555 19168 2939 1 7 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.805 0.415 19168 2940 1 7 . 1 1 75 75 LYS N N 75 116.482 116.482 119.231 -2.749 19168 2941 1 7 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.536 -0.091 19168 2942 1 7 . 1 1 75 75 LYS C C 75 175.135 175.135 175.384 -0.249 19168 2943 1 7 . 1 1 75 75 LYS CA C 75 54.785 54.785 54.801 -0.016 19168 2944 1 7 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.504 0.971 19168 2945 1 7 . 1 1 76 76 GLU N N 76 120.126 120.126 126.086 -5.960 19168 2946 1 7 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.354 -0.446 19168 2947 1 7 . 1 1 76 76 GLU C C 76 173.204 173.204 174.981 -1.777 19168 2948 1 7 . 1 1 76 76 GLU CA C 76 55.524 55.524 54.147 1.377 19168 2949 1 7 . 1 1 76 76 GLU CB C 76 27.511 27.511 28.820 -1.309 19168 2950 1 7 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.789 -0.012 19168 2951 1 7 . 1 1 77 77 PRO C C 77 174.933 174.933 176.153 -1.220 19168 2952 1 7 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.837 0.585 19168 2953 1 7 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.255 0.136 19168 2954 1 7 . 1 1 78 78 ASN N N 78 119.292 119.292 121.431 -2.139 19168 2955 1 7 . 1 1 78 78 ASN HA H 78 5.093 5.093 4.965 0.128 19168 2956 1 7 . 1 1 78 78 ASN C C 78 172.876 172.876 173.713 -0.837 19168 2957 1 7 . 1 1 78 78 ASN CA C 78 51.928 51.928 52.275 -0.347 19168 2958 1 7 . 1 1 78 78 ASN CB C 78 42.017 42.017 42.244 -0.227 19168 2959 1 7 . 1 1 79 79 PHE N N 79 125.023 125.023 125.287 -0.264 19168 2960 1 7 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.227 0.196 19168 2961 1 7 . 1 1 79 79 PHE C C 79 174.552 174.552 174.865 -0.313 19168 2962 1 7 . 1 1 79 79 PHE CA C 79 55.210 55.210 57.373 -2.163 19168 2963 1 7 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.070 0.039 19168 2964 1 7 . 1 1 80 80 GLU N N 80 128.920 128.920 128.266 0.654 19168 2965 1 7 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.265 -0.057 19168 2966 1 7 . 1 1 80 80 GLU C C 80 175.538 175.538 175.785 -0.247 19168 2967 1 7 . 1 1 80 80 GLU CA C 80 55.724 55.724 55.981 -0.257 19168 2968 1 7 . 1 1 80 80 GLU CB C 80 32.135 32.135 31.495 0.640 19168 2969 1 7 . 1 1 81 81 GLY N N 81 116.695 116.695 115.626 1.069 19168 2970 1 7 . 1 1 81 81 GLY C C 81 173.950 173.950 174.165 -0.215 19168 2971 1 7 . 1 1 81 81 GLY CA C 81 46.967 46.967 45.422 1.545 19168 2972 1 7 . 1 1 82 82 ARG N N 82 124.481 124.481 112.096 12.385 19168 2973 1 7 . 1 1 82 82 ARG HA H 82 4.539 4.539 3.514 1.025 19168 2974 1 7 . 1 1 82 82 ARG C C 82 173.437 173.437 173.828 -0.391 19168 2975 1 7 . 1 1 82 82 ARG CA C 82 55.156 55.156 57.494 -2.338 19168 2976 1 7 . 1 1 82 82 ARG CB C 82 30.255 30.255 29.050 1.205 19168 2977 1 7 . 1 1 83 83 TYR N N 83 114.539 114.539 115.623 -1.084 19168 2978 1 7 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.477 0.471 19168 2979 1 7 . 1 1 83 83 TYR C C 83 175.909 175.909 174.929 0.980 19168 2980 1 7 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.505 -0.449 19168 2981 1 7 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.299 0.700 19168 2982 1 7 . 1 1 84 84 VAL N N 84 118.812 118.812 123.016 -4.204 19168 2983 1 7 . 1 1 84 84 VAL HA H 84 4.867 4.867 5.063 -0.196 19168 2984 1 7 . 1 1 84 84 VAL C C 84 174.982 174.982 175.260 -0.278 19168 2985 1 7 . 1 1 84 84 VAL CA C 84 61.235 61.235 60.587 0.648 19168 2986 1 7 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.091 0.400 19168 2987 1 7 . 1 1 85 85 ASN N N 85 124.630 124.630 124.137 0.493 19168 2988 1 7 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.224 -0.220 19168 2989 1 7 . 1 1 85 85 ASN C C 85 175.392 175.392 173.551 1.841 19168 2990 1 7 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.364 1.232 19168 2991 1 7 . 1 1 85 85 ASN CB C 85 44.206 44.206 43.050 1.156 19168 2992 1 7 . 1 1 86 86 MET N N 86 118.969 118.969 119.518 -0.549 19168 2993 1 7 . 1 1 86 86 MET HA H 86 4.640 4.640 4.834 -0.194 19168 2994 1 7 . 1 1 86 86 MET C C 86 172.378 172.378 173.634 -1.256 19168 2995 1 7 . 1 1 86 86 MET CA C 86 56.158 56.158 55.087 1.071 19168 2996 1 7 . 1 1 86 86 MET CB C 86 39.138 39.138 36.880 2.258 19168 2997 1 7 . 1 1 87 87 LEU N N 87 131.886 131.886 126.642 5.244 19168 2998 1 7 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.143 0.238 19168 2999 1 7 . 1 1 87 87 LEU C C 87 176.003 176.003 175.621 0.382 19168 3000 1 7 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.532 0.598 19168 3001 1 7 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.520 -0.047 19168 3002 1 7 . 1 1 88 88 VAL N N 88 121.165 121.165 119.048 2.117 19168 3003 1 7 . 1 1 88 88 VAL HA H 88 5.510 5.510 4.941 0.569 19168 3004 1 7 . 1 1 88 88 VAL C C 88 173.666 173.666 174.708 -1.042 19168 3005 1 7 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.232 -0.632 19168 3006 1 7 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.230 0.563 19168 3007 1 7 . 1 1 89 89 THR N N 89 111.786 111.786 120.667 -8.881 19168 3008 1 7 . 1 1 89 89 THR HA H 89 4.720 4.720 4.298 0.422 19168 3009 1 7 . 1 1 89 89 THR C C 89 171.898 171.898 172.252 -0.354 19168 3010 1 7 . 1 1 89 89 THR CA C 89 57.985 57.985 59.645 -1.660 19168 3011 1 7 . 1 1 89 89 THR CB C 89 69.113 69.113 69.303 -0.190 19168 3012 1 7 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.860 -0.277 19168 3013 1 7 . 1 1 90 90 PRO C C 90 177.403 177.403 176.905 0.498 19168 3014 1 7 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.538 0.993 19168 3015 1 7 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.520 -0.477 19168 3016 1 7 . 1 1 91 91 LYS N N 91 123.696 123.696 121.837 1.859 19168 3017 1 7 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.273 -0.162 19168 3018 1 7 . 1 1 91 91 LYS C C 91 176.568 176.568 177.017 -0.449 19168 3019 1 7 . 1 1 91 91 LYS CA C 91 57.208 57.208 57.194 0.014 19168 3020 1 7 . 1 1 91 91 LYS CB C 91 33.183 33.183 32.128 1.055 19168 3021 1 7 . 1 1 92 92 LYS N N 92 122.054 122.054 117.808 4.246 19168 3022 1 7 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.568 -0.252 19168 3023 1 7 . 1 1 92 92 LYS C C 92 175.956 175.956 176.483 -0.527 19168 3024 1 7 . 1 1 92 92 LYS CA C 92 55.942 55.942 54.822 1.120 19168 3025 1 7 . 1 1 92 92 LYS CB C 92 33.000 33.000 31.181 1.819 19168 3026 1 7 . 1 1 93 93 ALA N N 93 126.278 126.278 122.437 3.841 19168 3027 1 7 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.163 0.178 19168 3028 1 7 . 1 1 93 93 ALA C C 93 177.592 177.592 178.139 -0.547 19168 3029 1 7 . 1 1 93 93 ALA CA C 93 52.279 52.279 52.995 -0.716 19168 3030 1 7 . 1 1 93 93 ALA CB C 93 19.332 19.332 18.132 1.200 19168 3031 1 7 . 1 1 94 94 GLU N N 94 120.522 120.522 118.671 1.851 19168 3032 1 7 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.175 0.109 19168 3033 1 7 . 1 1 94 94 GLU C C 94 177.041 177.041 177.151 -0.110 19168 3034 1 7 . 1 1 94 94 GLU CA C 94 56.606 56.606 57.531 -0.925 19168 3035 1 7 . 1 1 94 94 GLU CB C 94 30.353 30.353 29.948 0.405 19168 3036 1 7 . 1 1 95 95 GLY N N 95 109.755 109.755 106.835 2.920 19168 3037 1 7 . 1 1 95 95 GLY C C 95 173.939 173.939 173.298 0.641 19168 3038 1 7 . 1 1 95 95 GLY CA C 95 45.168 45.168 44.910 0.258 19168 3039 1 8 . 1 1 5 5 VAL N N 5 123.289 123.289 122.863 0.426 19168 3040 1 8 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.184 -0.165 19168 3041 1 8 . 1 1 5 5 VAL C C 5 175.799 175.799 175.901 -0.102 19168 3042 1 8 . 1 1 5 5 VAL CA C 5 62.120 62.120 61.784 0.336 19168 3043 1 8 . 1 1 5 5 VAL CB C 5 32.757 32.757 32.807 -0.050 19168 3044 1 8 . 1 1 6 6 ILE N N 6 126.794 126.794 125.923 0.871 19168 3045 1 8 . 1 1 6 6 ILE HA H 6 3.967 3.967 3.939 0.028 19168 3046 1 8 . 1 1 6 6 ILE C C 6 175.103 175.103 175.092 0.011 19168 3047 1 8 . 1 1 6 6 ILE CA C 6 60.227 60.227 61.190 -0.963 19168 3048 1 8 . 1 1 6 6 ILE CB C 6 38.565 38.565 37.978 0.587 19168 3049 1 8 . 1 1 7 7 ASP N N 7 127.797 127.797 128.741 -0.944 19168 3050 1 8 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.635 -0.091 19168 3051 1 8 . 1 1 7 7 ASP C C 7 174.000 174.000 174.768 -0.768 19168 3052 1 8 . 1 1 7 7 ASP CA C 7 53.591 53.591 53.895 -0.304 19168 3053 1 8 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.750 0.402 19168 3054 1 8 . 1 1 8 8 ILE N N 8 122.764 122.764 124.164 -1.400 19168 3055 1 8 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.173 0.147 19168 3056 1 8 . 1 1 8 8 ILE C C 8 176.337 176.337 175.094 1.243 19168 3057 1 8 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.044 0.132 19168 3058 1 8 . 1 1 8 8 ILE CB C 8 39.542 39.542 40.784 -1.242 19168 3059 1 8 . 1 1 9 9 LYS N N 9 127.990 127.990 125.808 2.182 19168 3060 1 8 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.394 -0.072 19168 3061 1 8 . 1 1 9 9 LYS C C 9 174.759 174.759 175.198 -0.439 19168 3062 1 8 . 1 1 9 9 LYS CA C 9 52.315 52.315 53.870 -1.555 19168 3063 1 8 . 1 1 9 9 LYS CB C 9 32.902 32.902 33.418 -0.516 19168 3064 1 8 . 1 1 10 10 GLU N N 10 123.021 123.021 123.680 -0.659 19168 3065 1 8 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.759 0.376 19168 3066 1 8 . 1 1 10 10 GLU C C 10 176.215 176.215 175.628 0.587 19168 3067 1 8 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.164 -0.262 19168 3068 1 8 . 1 1 10 10 GLU CB C 10 32.037 32.037 30.736 1.301 19168 3069 1 8 . 1 1 11 11 ILE N N 11 126.526 126.526 126.878 -0.352 19168 3070 1 8 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.086 0.249 19168 3071 1 8 . 1 1 11 11 ILE C C 11 174.334 174.334 174.774 -0.440 19168 3072 1 8 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.593 -0.282 19168 3073 1 8 . 1 1 11 11 ILE CB C 11 39.826 39.826 38.317 1.509 19168 3074 1 8 . 1 1 12 12 LYS N N 12 128.164 128.164 129.675 -1.511 19168 3075 1 8 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.167 0.178 19168 3076 1 8 . 1 1 12 12 LYS C C 12 176.378 176.378 175.782 0.596 19168 3077 1 8 . 1 1 12 12 LYS CA C 12 55.940 55.940 56.074 -0.134 19168 3078 1 8 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.525 0.531 19168 3079 1 8 . 1 1 13 13 LEU N N 13 121.881 121.881 126.316 -4.435 19168 3080 1 8 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.872 0.082 19168 3081 1 8 . 1 1 13 13 LEU C C 13 175.137 175.137 175.015 0.122 19168 3082 1 8 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.616 0.358 19168 3083 1 8 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.422 -0.138 19168 3084 1 8 . 1 1 14 14 SER N N 14 115.759 115.759 112.663 3.096 19168 3085 1 8 . 1 1 14 14 SER HA H 14 4.889 4.889 5.145 -0.256 19168 3086 1 8 . 1 1 14 14 SER C C 14 173.993 173.993 175.491 -1.498 19168 3087 1 8 . 1 1 14 14 SER CA C 14 56.052 56.052 56.692 -0.640 19168 3088 1 8 . 1 1 14 14 SER CB C 14 64.775 64.775 66.444 -1.669 19168 3089 1 8 . 1 1 15 15 VAL N N 15 120.993 120.993 121.448 -0.455 19168 3090 1 8 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.801 -0.067 19168 3091 1 8 . 1 1 15 15 VAL C C 15 176.964 176.964 176.494 0.470 19168 3092 1 8 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.345 0.082 19168 3093 1 8 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.838 -0.053 19168 3094 1 8 . 1 1 16 16 LYS N N 16 118.897 118.897 116.259 2.638 19168 3095 1 8 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.275 0.126 19168 3096 1 8 . 1 1 16 16 LYS C C 16 175.489 175.489 176.465 -0.976 19168 3097 1 8 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.409 -0.254 19168 3098 1 8 . 1 1 16 16 LYS CB C 16 30.929 30.929 31.829 -0.900 19168 3099 1 8 . 1 1 17 17 ILE N N 17 122.247 122.247 121.993 0.254 19168 3100 1 8 . 1 1 17 17 ILE HA H 17 4.185 4.185 3.962 0.223 19168 3101 1 8 . 1 1 17 17 ILE C C 17 173.426 173.426 175.295 -1.869 19168 3102 1 8 . 1 1 17 17 ILE CA C 17 61.276 61.276 61.116 0.160 19168 3103 1 8 . 1 1 17 17 ILE CB C 17 39.080 39.080 38.888 0.192 19168 3104 1 8 . 1 1 18 18 ALA N N 18 129.434 129.434 128.732 0.702 19168 3105 1 8 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.505 -0.026 19168 3106 1 8 . 1 1 18 18 ALA C C 18 179.130 179.130 177.903 1.227 19168 3107 1 8 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.271 0.166 19168 3108 1 8 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.812 -0.903 19168 3109 1 8 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.033 -0.236 19168 3110 1 8 . 1 1 19 19 GLN CA C 19 59.231 59.231 58.892 0.339 19168 3111 1 8 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.291 -0.116 19168 3112 1 8 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.466 -0.036 19168 3113 1 8 . 1 1 20 20 ASN C C 20 177.272 177.272 177.409 -0.137 19168 3114 1 8 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.192 -0.008 19168 3115 1 8 . 1 1 20 20 ASN CB C 20 37.453 37.453 36.981 0.472 19168 3116 1 8 . 1 1 21 21 ASP N N 21 119.132 119.132 121.096 -1.964 19168 3117 1 8 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.501 0.297 19168 3118 1 8 . 1 1 21 21 ASP C C 21 178.707 178.707 178.453 0.254 19168 3119 1 8 . 1 1 21 21 ASP CA C 21 56.886 56.886 57.044 -0.158 19168 3120 1 8 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.859 -0.194 19168 3121 1 8 . 1 1 22 22 ILE N N 22 122.030 122.030 120.365 1.665 19168 3122 1 8 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.641 -0.223 19168 3123 1 8 . 1 1 22 22 ILE C C 22 177.454 177.454 177.971 -0.517 19168 3124 1 8 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.188 1.538 19168 3125 1 8 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.667 -0.101 19168 3126 1 8 . 1 1 23 23 ASN N N 23 116.728 116.728 118.516 -1.788 19168 3127 1 8 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.440 -0.227 19168 3128 1 8 . 1 1 23 23 ASN C C 23 178.260 178.260 177.873 0.387 19168 3129 1 8 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.941 -0.667 19168 3130 1 8 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.737 -1.529 19168 3131 1 8 . 1 1 24 24 TYR N N 24 119.864 119.864 121.750 -1.886 19168 3132 1 8 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.206 0.087 19168 3133 1 8 . 1 1 24 24 TYR C C 24 177.719 177.719 177.331 0.388 19168 3134 1 8 . 1 1 24 24 TYR CA C 24 61.048 61.048 61.715 -0.667 19168 3135 1 8 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.650 -0.367 19168 3136 1 8 . 1 1 25 25 LYS N N 25 119.730 119.730 118.634 1.096 19168 3137 1 8 . 1 1 25 25 LYS HA H 25 4.111 4.111 3.946 0.165 19168 3138 1 8 . 1 1 25 25 LYS C C 25 179.152 179.152 179.130 0.022 19168 3139 1 8 . 1 1 25 25 LYS CA C 25 59.162 59.162 58.767 0.395 19168 3140 1 8 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.270 0.024 19168 3141 1 8 . 1 1 26 26 VAL N N 26 119.387 119.387 116.442 2.945 19168 3142 1 8 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.967 -0.347 19168 3143 1 8 . 1 1 26 26 VAL C C 26 177.017 177.017 177.790 -0.773 19168 3144 1 8 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.324 1.337 19168 3145 1 8 . 1 1 26 26 VAL CB C 26 31.550 31.550 30.514 1.036 19168 3146 1 8 . 1 1 27 27 LYS N N 27 120.420 120.420 120.509 -0.089 19168 3147 1 8 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.961 -0.015 19168 3148 1 8 . 1 1 27 27 LYS C C 27 179.458 179.458 179.149 0.309 19168 3149 1 8 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.865 0.013 19168 3150 1 8 . 1 1 27 27 LYS CB C 27 31.848 31.848 31.943 -0.095 19168 3151 1 8 . 1 1 28 28 HIS N N 28 118.160 118.160 118.794 -0.634 19168 3152 1 8 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.602 -0.415 19168 3153 1 8 . 1 1 28 28 HIS C C 28 177.085 177.085 177.591 -0.506 19168 3154 1 8 . 1 1 28 28 HIS CA C 28 57.885 57.885 58.406 -0.521 19168 3155 1 8 . 1 1 28 28 HIS CB C 28 29.756 29.756 30.287 -0.531 19168 3156 1 8 . 1 1 29 29 ALA N N 29 120.579 120.579 122.241 -1.662 19168 3157 1 8 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.244 -0.246 19168 3158 1 8 . 1 1 29 29 ALA C C 29 179.299 179.299 179.685 -0.386 19168 3159 1 8 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.294 0.273 19168 3160 1 8 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.393 1.056 19168 3161 1 8 . 1 1 30 30 LEU N N 30 117.262 117.262 118.717 -1.455 19168 3162 1 8 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.897 0.178 19168 3163 1 8 . 1 1 30 30 LEU C C 30 180.017 180.017 179.151 0.866 19168 3164 1 8 . 1 1 30 30 LEU CA C 30 58.232 58.232 58.066 0.165 19168 3165 1 8 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.422 -0.096 19168 3166 1 8 . 1 1 31 31 GLU N N 31 120.625 120.625 119.706 0.919 19168 3167 1 8 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.841 0.227 19168 3168 1 8 . 1 1 31 31 GLU C C 31 179.572 179.572 179.319 0.253 19168 3169 1 8 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.296 -0.021 19168 3170 1 8 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.106 -0.131 19168 3171 1 8 . 1 1 32 32 PHE N N 32 118.245 118.245 118.129 0.116 19168 3172 1 8 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.299 0.227 19168 3173 1 8 . 1 1 32 32 PHE C C 32 179.123 179.123 177.636 1.487 19168 3174 1 8 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.488 -2.791 19168 3175 1 8 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.793 -1.541 19168 3176 1 8 . 1 1 33 33 LEU N N 33 121.684 121.684 121.122 0.562 19168 3177 1 8 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.317 0.274 19168 3178 1 8 . 1 1 33 33 LEU C C 33 181.655 181.655 180.107 1.548 19168 3179 1 8 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.688 0.484 19168 3180 1 8 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.624 0.068 19168 3181 1 8 . 1 1 34 34 GLU N N 34 122.046 122.046 118.581 3.465 19168 3182 1 8 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.132 0.020 19168 3183 1 8 . 1 1 34 34 GLU C C 34 178.237 178.237 178.522 -0.285 19168 3184 1 8 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.714 0.432 19168 3185 1 8 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.056 0.178 19168 3186 1 8 . 1 1 35 35 GLN N N 35 115.697 115.697 116.503 -0.806 19168 3187 1 8 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.283 0.104 19168 3188 1 8 . 1 1 35 35 GLN C C 35 176.456 176.456 176.742 -0.286 19168 3189 1 8 . 1 1 35 35 GLN CA C 35 55.686 55.686 56.027 -0.341 19168 3190 1 8 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.146 0.050 19168 3191 1 8 . 1 1 36 36 GLY N N 36 108.291 108.291 106.488 1.803 19168 3192 1 8 . 1 1 36 36 GLY C C 36 174.673 174.673 174.245 0.428 19168 3193 1 8 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.149 0.378 19168 3194 1 8 . 1 1 37 37 LYS N N 37 120.464 120.464 119.544 0.920 19168 3195 1 8 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.591 -0.094 19168 3196 1 8 . 1 1 37 37 LYS C C 37 174.580 174.580 175.902 -1.322 19168 3197 1 8 . 1 1 37 37 LYS CA C 37 55.089 55.089 55.410 -0.321 19168 3198 1 8 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.247 -1.502 19168 3199 1 8 . 1 1 38 38 HIS N N 38 116.878 116.878 116.577 0.301 19168 3200 1 8 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.977 0.042 19168 3201 1 8 . 1 1 38 38 HIS C C 38 175.268 175.268 174.013 1.255 19168 3202 1 8 . 1 1 38 38 HIS CA C 38 54.150 54.150 54.601 -0.451 19168 3203 1 8 . 1 1 38 38 HIS CB C 38 32.877 32.877 33.194 -0.317 19168 3204 1 8 . 1 1 39 39 VAL N N 39 119.782 119.782 120.327 -0.545 19168 3205 1 8 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.934 -0.138 19168 3206 1 8 . 1 1 39 39 VAL C C 39 173.320 173.320 174.358 -1.038 19168 3207 1 8 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.450 0.316 19168 3208 1 8 . 1 1 39 39 VAL CB C 39 35.433 35.433 33.907 1.526 19168 3209 1 8 . 1 1 40 40 ARG N N 40 128.358 128.358 127.468 0.890 19168 3210 1 8 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.969 0.146 19168 3211 1 8 . 1 1 40 40 ARG C C 40 175.659 175.659 174.939 0.720 19168 3212 1 8 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.066 -0.244 19168 3213 1 8 . 1 1 40 40 ARG CB C 40 33.007 33.007 32.295 0.712 19168 3214 1 8 . 1 1 41 41 PHE N N 41 126.396 126.396 127.438 -1.042 19168 3215 1 8 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.199 -0.021 19168 3216 1 8 . 1 1 41 41 PHE C C 41 176.107 176.107 175.431 0.676 19168 3217 1 8 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.639 0.057 19168 3218 1 8 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.688 2.358 19168 3219 1 8 . 1 1 42 42 ARG N N 42 120.641 120.641 124.726 -4.085 19168 3220 1 8 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.321 0.218 19168 3221 1 8 . 1 1 42 42 ARG C C 42 175.010 175.010 174.522 0.488 19168 3222 1 8 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.759 -0.064 19168 3223 1 8 . 1 1 42 42 ARG CB C 42 34.374 34.374 33.876 0.498 19168 3224 1 8 . 1 1 43 43 VAL N N 43 125.565 125.565 123.139 2.426 19168 3225 1 8 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.274 -0.609 19168 3226 1 8 . 1 1 43 43 VAL C C 43 175.325 175.325 173.861 1.464 19168 3227 1 8 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.520 1.296 19168 3228 1 8 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.138 -2.155 19168 3229 1 8 . 1 1 44 44 PHE N N 44 128.291 128.291 129.682 -1.391 19168 3230 1 8 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.529 0.089 19168 3231 1 8 . 1 1 44 44 PHE C C 44 174.477 174.477 173.780 0.697 19168 3232 1 8 . 1 1 44 44 PHE CA C 44 56.148 56.148 56.339 -0.191 19168 3233 1 8 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.269 -1.328 19168 3234 1 8 . 1 1 45 45 LEU N N 45 128.360 128.360 127.664 0.696 19168 3235 1 8 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.371 0.020 19168 3236 1 8 . 1 1 45 45 LEU C C 45 174.342 174.342 176.235 -1.893 19168 3237 1 8 . 1 1 45 45 LEU CA C 45 53.586 53.586 53.791 -0.205 19168 3238 1 8 . 1 1 45 45 LEU CB C 45 41.113 41.113 42.193 -1.080 19168 3239 1 8 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.012 0.080 19168 3240 1 8 . 1 1 46 46 LYS CA C 46 55.079 55.079 58.259 -3.180 19168 3241 1 8 . 1 1 46 46 LYS CB C 46 34.295 34.295 32.930 1.365 19168 3242 1 8 . 1 1 47 47 GLY CA C 47 46.813 46.813 45.511 1.302 19168 3243 1 8 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.472 -0.272 19168 3244 1 8 . 1 1 48 48 ARG C C 48 178.069 178.069 176.805 1.264 19168 3245 1 8 . 1 1 48 48 ARG CA C 48 57.862 57.862 56.822 1.040 19168 3246 1 8 . 1 1 48 48 ARG CB C 48 29.444 29.444 30.416 -0.973 19168 3247 1 8 . 1 1 49 49 GLU N N 49 119.779 119.779 117.475 2.304 19168 3248 1 8 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.222 -0.169 19168 3249 1 8 . 1 1 49 49 GLU C C 49 178.227 178.227 176.046 2.181 19168 3250 1 8 . 1 1 49 49 GLU CA C 49 57.436 57.436 57.164 0.272 19168 3251 1 8 . 1 1 49 49 GLU CB C 49 29.745 29.745 29.017 0.728 19168 3252 1 8 . 1 1 50 50 MET N N 50 116.370 116.370 118.429 -2.059 19168 3253 1 8 . 1 1 50 50 MET HA H 50 4.024 4.024 4.272 -0.248 19168 3254 1 8 . 1 1 50 50 MET C C 50 175.912 175.912 177.880 -1.968 19168 3255 1 8 . 1 1 50 50 MET CA C 50 56.664 56.664 56.743 -0.079 19168 3256 1 8 . 1 1 50 50 MET CB C 50 32.033 32.033 33.362 -1.329 19168 3257 1 8 . 1 1 51 51 ALA N N 51 118.880 118.880 119.530 -0.650 19168 3258 1 8 . 1 1 51 51 ALA HA H 51 4.344 4.344 3.910 0.434 19168 3259 1 8 . 1 1 51 51 ALA C C 51 177.746 177.746 177.688 0.058 19168 3260 1 8 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.959 -1.568 19168 3261 1 8 . 1 1 51 51 ALA CB C 51 19.443 19.443 17.619 1.824 19168 3262 1 8 . 1 1 52 52 THR N N 52 108.299 108.299 113.408 -5.109 19168 3263 1 8 . 1 1 52 52 THR HA H 52 4.869 4.869 4.584 0.285 19168 3264 1 8 . 1 1 52 52 THR C C 52 173.933 173.933 173.018 0.915 19168 3265 1 8 . 1 1 52 52 THR CA C 52 57.554 57.554 58.931 -1.377 19168 3266 1 8 . 1 1 52 52 THR CB C 52 69.479 69.479 70.123 -0.644 19168 3267 1 8 . 1 1 53 53 PRO HA H 53 3.931 3.931 4.363 -0.432 19168 3268 1 8 . 1 1 53 53 PRO C C 53 178.185 178.185 177.871 0.314 19168 3269 1 8 . 1 1 53 53 PRO CA C 53 65.019 65.019 63.838 1.181 19168 3270 1 8 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.666 -1.151 19168 3271 1 8 . 1 1 54 54 GLU N N 54 120.653 120.653 119.267 1.386 19168 3272 1 8 . 1 1 54 54 GLU HA H 54 4.016 4.016 3.994 0.022 19168 3273 1 8 . 1 1 54 54 GLU C C 54 178.608 178.608 178.043 0.565 19168 3274 1 8 . 1 1 54 54 GLU CA C 54 59.472 59.472 59.176 0.296 19168 3275 1 8 . 1 1 54 54 GLU CB C 54 27.419 27.419 28.314 -0.895 19168 3276 1 8 . 1 1 55 55 ALA N N 55 124.380 124.380 121.812 2.568 19168 3277 1 8 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.116 0.207 19168 3278 1 8 . 1 1 55 55 ALA C C 55 181.502 181.502 179.829 1.673 19168 3279 1 8 . 1 1 55 55 ALA CA C 55 54.780 54.780 54.919 -0.139 19168 3280 1 8 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.021 0.380 19168 3281 1 8 . 1 1 56 56 GLY N N 56 105.673 105.673 107.128 -1.455 19168 3282 1 8 . 1 1 56 56 GLY C C 56 174.278 174.278 176.331 -2.053 19168 3283 1 8 . 1 1 56 56 GLY CA C 56 46.879 46.879 46.983 -0.104 19168 3284 1 8 . 1 1 57 57 VAL N N 57 122.685 122.685 123.002 -0.317 19168 3285 1 8 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.675 -0.353 19168 3286 1 8 . 1 1 57 57 VAL C C 57 177.134 177.134 177.557 -0.423 19168 3287 1 8 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.198 1.198 19168 3288 1 8 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.340 0.428 19168 3289 1 8 . 1 1 58 58 ALA N N 58 119.580 119.580 122.474 -2.894 19168 3290 1 8 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.040 0.054 19168 3291 1 8 . 1 1 58 58 ALA C C 58 180.788 180.788 179.697 1.091 19168 3292 1 8 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.318 -0.265 19168 3293 1 8 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.143 -0.289 19168 3294 1 8 . 1 1 59 59 LEU N N 59 119.723 119.723 119.995 -0.272 19168 3295 1 8 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.000 0.258 19168 3296 1 8 . 1 1 59 59 LEU C C 59 178.024 178.024 178.566 -0.542 19168 3297 1 8 . 1 1 59 59 LEU CA C 59 57.710 57.710 58.026 -0.316 19168 3298 1 8 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.052 -0.351 19168 3299 1 8 . 1 1 60 60 LEU N N 60 117.978 117.978 118.994 -1.016 19168 3300 1 8 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.818 0.039 19168 3301 1 8 . 1 1 60 60 LEU C C 60 178.851 178.851 179.204 -0.353 19168 3302 1 8 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.121 -0.477 19168 3303 1 8 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.257 -0.969 19168 3304 1 8 . 1 1 61 61 GLU N N 61 119.906 119.906 119.056 0.850 19168 3305 1 8 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.093 0.398 19168 3306 1 8 . 1 1 61 61 GLU C C 61 179.519 179.519 179.196 0.323 19168 3307 1 8 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.372 -0.630 19168 3308 1 8 . 1 1 61 61 GLU CB C 61 28.813 28.813 28.902 -0.089 19168 3309 1 8 . 1 1 62 62 LYS N N 62 122.015 122.015 120.375 1.640 19168 3310 1 8 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.095 0.033 19168 3311 1 8 . 1 1 62 62 LYS C C 62 179.843 179.843 179.143 0.700 19168 3312 1 8 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.229 0.108 19168 3313 1 8 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.394 -0.747 19168 3314 1 8 . 1 1 63 63 ILE N N 63 120.882 120.882 119.236 1.646 19168 3315 1 8 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.730 -0.234 19168 3316 1 8 . 1 1 63 63 ILE C C 63 177.761 177.761 178.137 -0.376 19168 3317 1 8 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.546 0.636 19168 3318 1 8 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.996 -0.610 19168 3319 1 8 . 1 1 64 64 TRP N N 64 120.279 120.279 122.766 -2.487 19168 3320 1 8 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.124 0.360 19168 3321 1 8 . 1 1 64 64 TRP C C 64 177.056 177.056 177.713 -0.657 19168 3322 1 8 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.463 -1.369 19168 3323 1 8 . 1 1 64 64 TRP CB C 64 29.635 29.635 30.165 -0.530 19168 3324 1 8 . 1 1 65 65 THR N N 65 109.483 109.483 109.636 -0.153 19168 3325 1 8 . 1 1 65 65 THR HA H 65 3.744 3.744 3.900 -0.156 19168 3326 1 8 . 1 1 65 65 THR C C 65 176.224 176.224 175.902 0.322 19168 3327 1 8 . 1 1 65 65 THR CA C 65 65.568 65.568 64.202 1.366 19168 3328 1 8 . 1 1 65 65 THR CB C 65 69.308 69.308 68.449 0.859 19168 3329 1 8 . 1 1 66 66 MET N N 66 117.791 117.791 118.718 -0.927 19168 3330 1 8 . 1 1 66 66 MET HA H 66 4.110 4.110 4.295 -0.185 19168 3331 1 8 . 1 1 66 66 MET C C 66 177.782 177.782 177.650 0.132 19168 3332 1 8 . 1 1 66 66 MET CA C 66 58.304 58.304 57.947 0.357 19168 3333 1 8 . 1 1 66 66 MET CB C 66 34.040 34.040 33.504 0.536 19168 3334 1 8 . 1 1 67 67 ILE N N 67 109.871 109.871 111.685 -1.814 19168 3335 1 8 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.410 0.232 19168 3336 1 8 . 1 1 67 67 ILE C C 67 176.713 176.713 176.357 0.356 19168 3337 1 8 . 1 1 67 67 ILE CA C 67 61.174 61.174 60.841 0.333 19168 3338 1 8 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.887 0.926 19168 3339 1 8 . 1 1 68 68 GLU N N 68 121.972 121.972 121.195 0.777 19168 3340 1 8 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.013 -0.265 19168 3341 1 8 . 1 1 68 68 GLU C C 68 175.855 175.855 177.329 -1.474 19168 3342 1 8 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.581 -0.290 19168 3343 1 8 . 1 1 68 68 GLU CB C 68 28.492 28.492 28.029 0.463 19168 3344 1 8 . 1 1 69 69 ASN N N 69 114.338 114.338 116.242 -1.904 19168 3345 1 8 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.325 0.255 19168 3346 1 8 . 1 1 69 69 ASN C C 69 175.904 175.904 177.282 -1.378 19168 3347 1 8 . 1 1 69 69 ASN CA C 69 54.597 54.597 55.393 -0.796 19168 3348 1 8 . 1 1 69 69 ASN CB C 69 38.323 38.323 38.165 0.158 19168 3349 1 8 . 1 1 70 70 GLU N N 70 116.936 116.936 116.555 0.381 19168 3350 1 8 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.591 -0.043 19168 3351 1 8 . 1 1 70 70 GLU C C 70 174.941 174.941 175.189 -0.248 19168 3352 1 8 . 1 1 70 70 GLU CA C 70 55.983 55.983 55.266 0.717 19168 3353 1 8 . 1 1 70 70 GLU CB C 70 31.348 31.348 30.557 0.791 19168 3354 1 8 . 1 1 71 71 ALA N N 71 122.966 122.966 122.581 0.385 19168 3355 1 8 . 1 1 71 71 ALA HA H 71 5.246 5.246 5.188 0.058 19168 3356 1 8 . 1 1 71 71 ALA C C 71 173.907 173.907 175.512 -1.605 19168 3357 1 8 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.500 0.318 19168 3358 1 8 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.493 1.567 19168 3359 1 8 . 1 1 72 72 ASN N N 72 115.820 115.820 119.853 -4.033 19168 3360 1 8 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.379 0.062 19168 3361 1 8 . 1 1 72 72 ASN C C 72 174.137 174.137 174.739 -0.602 19168 3362 1 8 . 1 1 72 72 ASN CA C 72 51.659 51.659 51.858 -0.200 19168 3363 1 8 . 1 1 72 72 ASN CB C 72 42.186 42.186 41.628 0.558 19168 3364 1 8 . 1 1 73 73 ARG N N 73 118.340 118.340 122.979 -4.639 19168 3365 1 8 . 1 1 73 73 ARG HA H 73 4.778 4.778 4.049 0.729 19168 3366 1 8 . 1 1 73 73 ARG C C 73 174.674 174.674 175.244 -0.570 19168 3367 1 8 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.520 -1.651 19168 3368 1 8 . 1 1 73 73 ARG CB C 73 32.125 32.125 30.053 2.072 19168 3369 1 8 . 1 1 74 74 ASP N N 74 124.007 124.007 126.059 -2.052 19168 3370 1 8 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.487 0.055 19168 3371 1 8 . 1 1 74 74 ASP C C 74 175.935 175.935 176.007 -0.072 19168 3372 1 8 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.056 -0.659 19168 3373 1 8 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.733 0.487 19168 3374 1 8 . 1 1 75 75 LYS N N 75 116.482 116.482 116.276 0.206 19168 3375 1 8 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.438 0.007 19168 3376 1 8 . 1 1 75 75 LYS C C 75 175.135 175.135 174.525 0.610 19168 3377 1 8 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.246 -0.461 19168 3378 1 8 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.248 1.226 19168 3379 1 8 . 1 1 76 76 GLU N N 76 120.126 120.126 120.083 0.043 19168 3380 1 8 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.369 -0.461 19168 3381 1 8 . 1 1 76 76 GLU C C 76 173.204 173.204 175.180 -1.976 19168 3382 1 8 . 1 1 76 76 GLU CA C 76 55.524 55.524 54.505 1.019 19168 3383 1 8 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.015 -1.504 19168 3384 1 8 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.776 0.001 19168 3385 1 8 . 1 1 77 77 PRO C C 77 174.933 174.933 176.061 -1.128 19168 3386 1 8 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.964 0.458 19168 3387 1 8 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.213 0.178 19168 3388 1 8 . 1 1 78 78 ASN N N 78 119.292 119.292 120.428 -1.136 19168 3389 1 8 . 1 1 78 78 ASN HA H 78 5.093 5.093 4.883 0.209 19168 3390 1 8 . 1 1 78 78 ASN C C 78 172.876 172.876 173.088 -0.212 19168 3391 1 8 . 1 1 78 78 ASN CA C 78 51.928 51.928 51.932 -0.004 19168 3392 1 8 . 1 1 78 78 ASN CB C 78 42.017 42.017 40.896 1.121 19168 3393 1 8 . 1 1 79 79 PHE N N 79 125.023 125.023 120.982 4.041 19168 3394 1 8 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.158 0.265 19168 3395 1 8 . 1 1 79 79 PHE C C 79 174.552 174.552 174.867 -0.315 19168 3396 1 8 . 1 1 79 79 PHE CA C 79 55.210 55.210 57.233 -2.023 19168 3397 1 8 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.541 -0.432 19168 3398 1 8 . 1 1 80 80 GLU N N 80 128.920 128.920 128.885 0.035 19168 3399 1 8 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.543 -0.335 19168 3400 1 8 . 1 1 80 80 GLU C C 80 175.538 175.538 176.441 -0.903 19168 3401 1 8 . 1 1 80 80 GLU CA C 80 55.724 55.724 54.576 1.148 19168 3402 1 8 . 1 1 80 80 GLU CB C 80 32.135 32.135 31.553 0.582 19168 3403 1 8 . 1 1 81 81 GLY N N 81 116.695 116.695 116.213 0.482 19168 3404 1 8 . 1 1 81 81 GLY C C 81 173.950 173.950 174.657 -0.707 19168 3405 1 8 . 1 1 81 81 GLY CA C 81 46.967 46.967 47.004 -0.037 19168 3406 1 8 . 1 1 82 82 ARG N N 82 124.481 124.481 122.237 2.244 19168 3407 1 8 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.420 0.119 19168 3408 1 8 . 1 1 82 82 ARG C C 82 173.437 173.437 174.347 -0.910 19168 3409 1 8 . 1 1 82 82 ARG CA C 82 55.156 55.156 55.117 0.039 19168 3410 1 8 . 1 1 82 82 ARG CB C 82 30.255 30.255 32.843 -2.588 19168 3411 1 8 . 1 1 83 83 TYR N N 83 114.539 114.539 118.430 -3.891 19168 3412 1 8 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.342 0.606 19168 3413 1 8 . 1 1 83 83 TYR C C 83 175.909 175.909 174.793 1.116 19168 3414 1 8 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.374 -0.318 19168 3415 1 8 . 1 1 83 83 TYR CB C 83 42.999 42.999 41.815 1.184 19168 3416 1 8 . 1 1 84 84 VAL N N 84 118.812 118.812 123.265 -4.453 19168 3417 1 8 . 1 1 84 84 VAL HA H 84 4.867 4.867 5.095 -0.228 19168 3418 1 8 . 1 1 84 84 VAL C C 84 174.982 174.982 175.036 -0.054 19168 3419 1 8 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.378 -0.143 19168 3420 1 8 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.961 -0.470 19168 3421 1 8 . 1 1 85 85 ASN N N 85 124.630 124.630 124.222 0.408 19168 3422 1 8 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.204 -0.200 19168 3423 1 8 . 1 1 85 85 ASN C C 85 175.392 175.392 173.289 2.103 19168 3424 1 8 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.361 1.235 19168 3425 1 8 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.865 1.341 19168 3426 1 8 . 1 1 86 86 MET N N 86 118.969 118.969 119.268 -0.299 19168 3427 1 8 . 1 1 86 86 MET HA H 86 4.640 4.640 4.829 -0.189 19168 3428 1 8 . 1 1 86 86 MET C C 86 172.378 172.378 173.346 -0.968 19168 3429 1 8 . 1 1 86 86 MET CA C 86 56.158 56.158 54.818 1.340 19168 3430 1 8 . 1 1 86 86 MET CB C 86 39.138 39.138 37.278 1.861 19168 3431 1 8 . 1 1 87 87 LEU N N 87 131.886 131.886 127.180 4.706 19168 3432 1 8 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.198 0.183 19168 3433 1 8 . 1 1 87 87 LEU C C 87 176.003 176.003 174.829 1.174 19168 3434 1 8 . 1 1 87 87 LEU CA C 87 54.130 54.130 52.968 1.162 19168 3435 1 8 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.347 0.126 19168 3436 1 8 . 1 1 88 88 VAL N N 88 121.165 121.165 122.127 -0.962 19168 3437 1 8 . 1 1 88 88 VAL HA H 88 5.510 5.510 4.986 0.524 19168 3438 1 8 . 1 1 88 88 VAL C C 88 173.666 173.666 174.822 -1.156 19168 3439 1 8 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.967 -1.367 19168 3440 1 8 . 1 1 88 88 VAL CB C 88 34.793 34.793 33.993 0.800 19168 3441 1 8 . 1 1 89 89 THR N N 89 111.786 111.786 121.295 -9.509 19168 3442 1 8 . 1 1 89 89 THR HA H 89 4.720 4.720 4.408 0.312 19168 3443 1 8 . 1 1 89 89 THR C C 89 171.898 171.898 172.319 -0.421 19168 3444 1 8 . 1 1 89 89 THR CA C 89 57.985 57.985 59.296 -1.311 19168 3445 1 8 . 1 1 89 89 THR CB C 89 69.113 69.113 69.732 -0.619 19168 3446 1 8 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.464 0.119 19168 3447 1 8 . 1 1 90 90 PRO C C 90 177.403 177.403 176.466 0.937 19168 3448 1 8 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.612 0.918 19168 3449 1 8 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.277 -0.234 19168 3450 1 8 . 1 1 91 91 LYS N N 91 123.696 123.696 123.194 0.502 19168 3451 1 8 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.339 -0.228 19168 3452 1 8 . 1 1 91 91 LYS C C 91 176.568 176.568 176.643 -0.075 19168 3453 1 8 . 1 1 91 91 LYS CA C 91 57.208 57.208 56.245 0.963 19168 3454 1 8 . 1 1 91 91 LYS CB C 91 33.183 33.183 33.179 0.004 19168 3455 1 8 . 1 1 92 92 LYS N N 92 122.054 122.054 122.950 -0.896 19168 3456 1 8 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.426 -0.110 19168 3457 1 8 . 1 1 92 92 LYS C C 92 175.956 175.956 176.903 -0.947 19168 3458 1 8 . 1 1 92 92 LYS CA C 92 55.942 55.942 56.187 -0.245 19168 3459 1 8 . 1 1 92 92 LYS CB C 92 33.000 33.000 32.838 0.162 19168 3460 1 8 . 1 1 93 93 ALA N N 93 126.278 126.278 127.909 -1.631 19168 3461 1 8 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.190 0.151 19168 3462 1 8 . 1 1 93 93 ALA C C 93 177.592 177.592 178.595 -1.003 19168 3463 1 8 . 1 1 93 93 ALA CA C 93 52.279 52.279 53.974 -1.696 19168 3464 1 8 . 1 1 93 93 ALA CB C 93 19.332 19.332 18.870 0.462 19168 3465 1 8 . 1 1 94 94 GLU N N 94 120.522 120.522 115.512 5.010 19168 3466 1 8 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.351 -0.067 19168 3467 1 8 . 1 1 94 94 GLU C C 94 177.041 177.041 175.475 1.566 19168 3468 1 8 . 1 1 94 94 GLU CA C 94 56.606 56.606 56.503 0.103 19168 3469 1 8 . 1 1 94 94 GLU CB C 94 30.353 30.353 30.567 -0.214 19168 3470 1 8 . 1 1 95 95 GLY N N 95 109.755 109.755 109.418 0.337 19168 3471 1 8 . 1 1 95 95 GLY C C 95 173.939 173.939 173.282 0.657 19168 3472 1 8 . 1 1 95 95 GLY CA C 95 45.168 45.168 44.759 0.409 19168 3473 1 9 . 1 1 5 5 VAL N N 5 123.289 123.289 121.322 1.967 19168 3474 1 9 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.228 -0.209 19168 3475 1 9 . 1 1 5 5 VAL C C 5 175.799 175.799 175.743 0.056 19168 3476 1 9 . 1 1 5 5 VAL CA C 5 62.120 62.120 61.685 0.434 19168 3477 1 9 . 1 1 5 5 VAL CB C 5 32.757 32.757 32.912 -0.155 19168 3478 1 9 . 1 1 6 6 ILE N N 6 126.794 126.794 125.984 0.810 19168 3479 1 9 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.082 -0.115 19168 3480 1 9 . 1 1 6 6 ILE C C 6 175.103 175.103 175.743 -0.640 19168 3481 1 9 . 1 1 6 6 ILE CA C 6 60.227 60.227 60.857 -0.630 19168 3482 1 9 . 1 1 6 6 ILE CB C 6 38.565 38.565 37.701 0.864 19168 3483 1 9 . 1 1 7 7 ASP N N 7 127.797 127.797 127.971 -0.174 19168 3484 1 9 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.780 -0.236 19168 3485 1 9 . 1 1 7 7 ASP C C 7 174.000 174.000 174.952 -0.952 19168 3486 1 9 . 1 1 7 7 ASP CA C 7 53.591 53.591 54.089 -0.498 19168 3487 1 9 . 1 1 7 7 ASP CB C 7 42.152 42.152 42.187 -0.035 19168 3488 1 9 . 1 1 8 8 ILE N N 8 122.764 122.764 121.524 1.240 19168 3489 1 9 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.346 -0.026 19168 3490 1 9 . 1 1 8 8 ILE C C 8 176.337 176.337 175.043 1.294 19168 3491 1 9 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.190 -0.014 19168 3492 1 9 . 1 1 8 8 ILE CB C 8 39.542 39.542 40.812 -1.270 19168 3493 1 9 . 1 1 9 9 LYS N N 9 127.990 127.990 126.550 1.440 19168 3494 1 9 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.487 -0.165 19168 3495 1 9 . 1 1 9 9 LYS C C 9 174.759 174.759 175.147 -0.388 19168 3496 1 9 . 1 1 9 9 LYS CA C 9 52.315 52.315 53.593 -1.278 19168 3497 1 9 . 1 1 9 9 LYS CB C 9 32.902 32.902 33.381 -0.479 19168 3498 1 9 . 1 1 10 10 GLU N N 10 123.021 123.021 123.847 -0.826 19168 3499 1 9 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.865 0.270 19168 3500 1 9 . 1 1 10 10 GLU C C 10 176.215 176.215 175.788 0.427 19168 3501 1 9 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.287 -0.385 19168 3502 1 9 . 1 1 10 10 GLU CB C 10 32.037 32.037 30.638 1.399 19168 3503 1 9 . 1 1 11 11 ILE N N 11 126.526 126.526 127.344 -0.818 19168 3504 1 9 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.161 0.174 19168 3505 1 9 . 1 1 11 11 ILE C C 11 174.334 174.334 174.660 -0.326 19168 3506 1 9 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.441 -0.131 19168 3507 1 9 . 1 1 11 11 ILE CB C 11 39.826 39.826 38.905 0.921 19168 3508 1 9 . 1 1 12 12 LYS N N 12 128.164 128.164 129.370 -1.206 19168 3509 1 9 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.421 -0.076 19168 3510 1 9 . 1 1 12 12 LYS C C 12 176.378 176.378 175.465 0.913 19168 3511 1 9 . 1 1 12 12 LYS CA C 12 55.940 55.940 55.690 0.250 19168 3512 1 9 . 1 1 12 12 LYS CB C 12 34.056 34.056 34.171 -0.115 19168 3513 1 9 . 1 1 13 13 LEU N N 13 121.881 121.881 124.427 -2.546 19168 3514 1 9 . 1 1 13 13 LEU HA H 13 4.954 4.954 5.027 -0.073 19168 3515 1 9 . 1 1 13 13 LEU C C 13 175.137 175.137 175.105 0.032 19168 3516 1 9 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.256 0.718 19168 3517 1 9 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.608 -0.324 19168 3518 1 9 . 1 1 14 14 SER N N 14 115.759 115.759 112.607 3.152 19168 3519 1 9 . 1 1 14 14 SER HA H 14 4.889 4.889 5.255 -0.366 19168 3520 1 9 . 1 1 14 14 SER C C 14 173.993 173.993 175.513 -1.520 19168 3521 1 9 . 1 1 14 14 SER CA C 14 56.052 56.052 56.430 -0.378 19168 3522 1 9 . 1 1 14 14 SER CB C 14 64.775 64.775 66.397 -1.623 19168 3523 1 9 . 1 1 15 15 VAL N N 15 120.993 120.993 120.453 0.540 19168 3524 1 9 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.861 -0.127 19168 3525 1 9 . 1 1 15 15 VAL C C 15 176.964 176.964 176.288 0.676 19168 3526 1 9 . 1 1 15 15 VAL CA C 15 65.427 65.427 64.592 0.835 19168 3527 1 9 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.631 0.154 19168 3528 1 9 . 1 1 16 16 LYS N N 16 118.897 118.897 117.081 1.816 19168 3529 1 9 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.412 -0.011 19168 3530 1 9 . 1 1 16 16 LYS C C 16 175.489 175.489 176.034 -0.545 19168 3531 1 9 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.104 0.051 19168 3532 1 9 . 1 1 16 16 LYS CB C 16 30.929 30.929 32.156 -1.227 19168 3533 1 9 . 1 1 17 17 ILE N N 17 122.247 122.247 121.528 0.719 19168 3534 1 9 . 1 1 17 17 ILE HA H 17 4.185 4.185 3.997 0.188 19168 3535 1 9 . 1 1 17 17 ILE C C 17 173.426 173.426 175.642 -2.216 19168 3536 1 9 . 1 1 17 17 ILE CA C 17 61.276 61.276 61.173 0.103 19168 3537 1 9 . 1 1 17 17 ILE CB C 17 39.080 39.080 38.982 0.098 19168 3538 1 9 . 1 1 18 18 ALA N N 18 129.434 129.434 129.812 -0.378 19168 3539 1 9 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.466 0.013 19168 3540 1 9 . 1 1 18 18 ALA C C 18 179.130 179.130 177.865 1.265 19168 3541 1 9 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.369 0.068 19168 3542 1 9 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.058 -0.149 19168 3543 1 9 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.002 -0.205 19168 3544 1 9 . 1 1 19 19 GLN CA C 19 59.231 59.231 59.731 -0.500 19168 3545 1 9 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.328 -0.153 19168 3546 1 9 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.537 -0.107 19168 3547 1 9 . 1 1 20 20 ASN C C 20 177.272 177.272 177.342 -0.070 19168 3548 1 9 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.288 -0.104 19168 3549 1 9 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.504 -0.051 19168 3550 1 9 . 1 1 21 21 ASP N N 21 119.132 119.132 119.392 -0.260 19168 3551 1 9 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.473 0.325 19168 3552 1 9 . 1 1 21 21 ASP C C 21 178.707 178.707 178.881 -0.174 19168 3553 1 9 . 1 1 21 21 ASP CA C 21 56.886 56.886 57.478 -0.592 19168 3554 1 9 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.567 0.098 19168 3555 1 9 . 1 1 22 22 ILE N N 22 122.030 122.030 121.072 0.958 19168 3556 1 9 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.666 -0.248 19168 3557 1 9 . 1 1 22 22 ILE C C 22 177.454 177.454 177.999 -0.545 19168 3558 1 9 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.443 1.283 19168 3559 1 9 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.761 -0.195 19168 3560 1 9 . 1 1 23 23 ASN N N 23 116.728 116.728 118.455 -1.727 19168 3561 1 9 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.452 -0.239 19168 3562 1 9 . 1 1 23 23 ASN C C 23 178.260 178.260 177.845 0.415 19168 3563 1 9 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.210 0.064 19168 3564 1 9 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.139 -0.931 19168 3565 1 9 . 1 1 24 24 TYR N N 24 119.864 119.864 122.136 -2.272 19168 3566 1 9 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.220 0.073 19168 3567 1 9 . 1 1 24 24 TYR C C 24 177.719 177.719 177.464 0.255 19168 3568 1 9 . 1 1 24 24 TYR CA C 24 61.048 61.048 62.201 -1.153 19168 3569 1 9 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.754 -0.471 19168 3570 1 9 . 1 1 25 25 LYS N N 25 119.730 119.730 118.404 1.326 19168 3571 1 9 . 1 1 25 25 LYS HA H 25 4.111 4.111 4.095 0.016 19168 3572 1 9 . 1 1 25 25 LYS C C 25 179.152 179.152 179.383 -0.231 19168 3573 1 9 . 1 1 25 25 LYS CA C 25 59.162 59.162 58.787 0.375 19168 3574 1 9 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.189 0.105 19168 3575 1 9 . 1 1 26 26 VAL N N 26 119.387 119.387 116.918 2.469 19168 3576 1 9 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.924 -0.303 19168 3577 1 9 . 1 1 26 26 VAL C C 26 177.017 177.017 177.615 -0.598 19168 3578 1 9 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.019 1.642 19168 3579 1 9 . 1 1 26 26 VAL CB C 26 31.550 31.550 30.953 0.597 19168 3580 1 9 . 1 1 27 27 LYS N N 27 120.420 120.420 120.780 -0.360 19168 3581 1 9 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.878 0.068 19168 3582 1 9 . 1 1 27 27 LYS C C 27 179.458 179.458 178.784 0.674 19168 3583 1 9 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.778 0.100 19168 3584 1 9 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.270 -0.422 19168 3585 1 9 . 1 1 28 28 HIS N N 28 118.160 118.160 118.013 0.147 19168 3586 1 9 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.596 -0.409 19168 3587 1 9 . 1 1 28 28 HIS C C 28 177.085 177.085 177.384 -0.299 19168 3588 1 9 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.600 -1.715 19168 3589 1 9 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.836 -0.080 19168 3590 1 9 . 1 1 29 29 ALA N N 29 120.579 120.579 122.934 -2.355 19168 3591 1 9 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.180 -0.182 19168 3592 1 9 . 1 1 29 29 ALA C C 29 179.299 179.299 179.620 -0.321 19168 3593 1 9 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.439 0.128 19168 3594 1 9 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.339 1.110 19168 3595 1 9 . 1 1 30 30 LEU N N 30 117.262 117.262 118.358 -1.096 19168 3596 1 9 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.890 0.185 19168 3597 1 9 . 1 1 30 30 LEU C C 30 180.017 180.017 179.130 0.887 19168 3598 1 9 . 1 1 30 30 LEU CA C 30 58.232 58.232 58.008 0.223 19168 3599 1 9 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.548 -0.222 19168 3600 1 9 . 1 1 31 31 GLU N N 31 120.625 120.625 119.918 0.707 19168 3601 1 9 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.829 0.239 19168 3602 1 9 . 1 1 31 31 GLU C C 31 179.572 179.572 179.349 0.223 19168 3603 1 9 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.395 -0.120 19168 3604 1 9 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.194 -0.219 19168 3605 1 9 . 1 1 32 32 PHE N N 32 118.245 118.245 118.255 -0.010 19168 3606 1 9 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.273 0.253 19168 3607 1 9 . 1 1 32 32 PHE C C 32 179.123 179.123 177.794 1.329 19168 3608 1 9 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.802 -3.105 19168 3609 1 9 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.879 -1.627 19168 3610 1 9 . 1 1 33 33 LEU N N 33 121.684 121.684 120.991 0.693 19168 3611 1 9 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.278 0.313 19168 3612 1 9 . 1 1 33 33 LEU C C 33 181.655 181.655 180.057 1.598 19168 3613 1 9 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.596 0.576 19168 3614 1 9 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.656 0.036 19168 3615 1 9 . 1 1 34 34 GLU N N 34 122.046 122.046 118.870 3.176 19168 3616 1 9 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.066 0.086 19168 3617 1 9 . 1 1 34 34 GLU C C 34 178.237 178.237 178.577 -0.340 19168 3618 1 9 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.932 0.214 19168 3619 1 9 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.081 0.153 19168 3620 1 9 . 1 1 35 35 GLN N N 35 115.697 115.697 115.803 -0.106 19168 3621 1 9 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.288 0.099 19168 3622 1 9 . 1 1 35 35 GLN C C 35 176.456 176.456 176.784 -0.328 19168 3623 1 9 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.934 -0.248 19168 3624 1 9 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.362 -0.166 19168 3625 1 9 . 1 1 36 36 GLY N N 36 108.291 108.291 106.204 2.087 19168 3626 1 9 . 1 1 36 36 GLY C C 36 174.673 174.673 174.254 0.419 19168 3627 1 9 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.114 0.413 19168 3628 1 9 . 1 1 37 37 LYS N N 37 120.464 120.464 119.699 0.765 19168 3629 1 9 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.572 -0.075 19168 3630 1 9 . 1 1 37 37 LYS C C 37 174.580 174.580 175.346 -0.766 19168 3631 1 9 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.629 0.460 19168 3632 1 9 . 1 1 37 37 LYS CB C 37 32.745 32.745 35.531 -2.786 19168 3633 1 9 . 1 1 38 38 HIS N N 38 116.878 116.878 118.384 -1.506 19168 3634 1 9 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.907 0.112 19168 3635 1 9 . 1 1 38 38 HIS C C 38 175.268 175.268 174.511 0.757 19168 3636 1 9 . 1 1 38 38 HIS CA C 38 54.150 54.150 55.885 -1.735 19168 3637 1 9 . 1 1 38 38 HIS CB C 38 32.877 32.877 32.533 0.344 19168 3638 1 9 . 1 1 39 39 VAL N N 39 119.782 119.782 121.950 -2.168 19168 3639 1 9 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.850 -0.054 19168 3640 1 9 . 1 1 39 39 VAL C C 39 173.320 173.320 174.115 -0.795 19168 3641 1 9 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.536 0.230 19168 3642 1 9 . 1 1 39 39 VAL CB C 39 35.433 35.433 34.071 1.362 19168 3643 1 9 . 1 1 40 40 ARG N N 40 128.358 128.358 127.291 1.067 19168 3644 1 9 . 1 1 40 40 ARG HA H 40 5.115 5.115 5.038 0.077 19168 3645 1 9 . 1 1 40 40 ARG C C 40 175.659 175.659 174.919 0.740 19168 3646 1 9 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.012 -0.190 19168 3647 1 9 . 1 1 40 40 ARG CB C 40 33.007 33.007 32.449 0.558 19168 3648 1 9 . 1 1 41 41 PHE N N 41 126.396 126.396 127.414 -1.018 19168 3649 1 9 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.394 -0.216 19168 3650 1 9 . 1 1 41 41 PHE C C 41 176.107 176.107 175.425 0.682 19168 3651 1 9 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.617 0.079 19168 3652 1 9 . 1 1 41 41 PHE CB C 41 42.046 42.046 40.108 1.938 19168 3653 1 9 . 1 1 42 42 ARG N N 42 120.641 120.641 123.173 -2.532 19168 3654 1 9 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.403 0.136 19168 3655 1 9 . 1 1 42 42 ARG C C 42 175.010 175.010 174.429 0.581 19168 3656 1 9 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.820 -0.125 19168 3657 1 9 . 1 1 42 42 ARG CB C 42 34.374 34.374 34.350 0.024 19168 3658 1 9 . 1 1 43 43 VAL N N 43 125.565 125.565 123.226 2.339 19168 3659 1 9 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.288 -0.623 19168 3660 1 9 . 1 1 43 43 VAL C C 43 175.325 175.325 173.816 1.509 19168 3661 1 9 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.579 1.237 19168 3662 1 9 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.472 -2.490 19168 3663 1 9 . 1 1 44 44 PHE N N 44 128.291 128.291 129.973 -1.682 19168 3664 1 9 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.627 -0.009 19168 3665 1 9 . 1 1 44 44 PHE C C 44 174.477 174.477 173.822 0.655 19168 3666 1 9 . 1 1 44 44 PHE CA C 44 56.148 56.148 56.427 -0.279 19168 3667 1 9 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.374 -1.433 19168 3668 1 9 . 1 1 45 45 LEU N N 45 128.360 128.360 128.883 -0.523 19168 3669 1 9 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.475 -0.084 19168 3670 1 9 . 1 1 45 45 LEU C C 45 174.342 174.342 175.664 -1.322 19168 3671 1 9 . 1 1 45 45 LEU CA C 45 53.586 53.586 53.809 -0.223 19168 3672 1 9 . 1 1 45 45 LEU CB C 45 41.113 41.113 41.791 -0.678 19168 3673 1 9 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.277 -0.185 19168 3674 1 9 . 1 1 46 46 LYS CA C 46 55.079 55.079 55.957 -0.878 19168 3675 1 9 . 1 1 46 46 LYS CB C 46 34.295 34.295 33.515 0.780 19168 3676 1 9 . 1 1 47 47 GLY CA C 47 46.813 46.813 45.211 1.602 19168 3677 1 9 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.364 -0.164 19168 3678 1 9 . 1 1 48 48 ARG C C 48 178.069 178.069 177.514 0.555 19168 3679 1 9 . 1 1 48 48 ARG CA C 48 57.862 57.862 56.203 1.659 19168 3680 1 9 . 1 1 48 48 ARG CB C 48 29.444 29.444 29.766 -0.322 19168 3681 1 9 . 1 1 49 49 GLU N N 49 119.779 119.779 121.320 -1.541 19168 3682 1 9 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.018 0.035 19168 3683 1 9 . 1 1 49 49 GLU C C 49 178.227 178.227 177.978 0.249 19168 3684 1 9 . 1 1 49 49 GLU CA C 49 57.436 57.436 58.698 -1.262 19168 3685 1 9 . 1 1 49 49 GLU CB C 49 29.745 29.745 29.089 0.656 19168 3686 1 9 . 1 1 50 50 MET N N 50 116.370 116.370 116.956 -0.586 19168 3687 1 9 . 1 1 50 50 MET HA H 50 4.024 4.024 4.199 -0.175 19168 3688 1 9 . 1 1 50 50 MET C C 50 175.912 175.912 177.359 -1.447 19168 3689 1 9 . 1 1 50 50 MET CA C 50 56.664 56.664 57.155 -0.491 19168 3690 1 9 . 1 1 50 50 MET CB C 50 32.033 32.033 32.360 -0.327 19168 3691 1 9 . 1 1 51 51 ALA N N 51 118.880 118.880 120.602 -1.722 19168 3692 1 9 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.198 0.146 19168 3693 1 9 . 1 1 51 51 ALA C C 51 177.746 177.746 177.745 0.001 19168 3694 1 9 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.468 -1.077 19168 3695 1 9 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.505 -0.062 19168 3696 1 9 . 1 1 52 52 THR N N 52 108.299 108.299 114.434 -6.135 19168 3697 1 9 . 1 1 52 52 THR HA H 52 4.869 4.869 4.594 0.275 19168 3698 1 9 . 1 1 52 52 THR C C 52 173.933 173.933 172.429 1.504 19168 3699 1 9 . 1 1 52 52 THR CA C 52 57.554 57.554 58.855 -1.301 19168 3700 1 9 . 1 1 52 52 THR CB C 52 69.479 69.479 69.613 -0.134 19168 3701 1 9 . 1 1 53 53 PRO HA H 53 3.931 3.931 4.197 -0.266 19168 3702 1 9 . 1 1 53 53 PRO C C 53 178.185 178.185 178.073 0.112 19168 3703 1 9 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.715 0.304 19168 3704 1 9 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.629 -1.113 19168 3705 1 9 . 1 1 54 54 GLU N N 54 120.653 120.653 117.874 2.779 19168 3706 1 9 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.065 -0.049 19168 3707 1 9 . 1 1 54 54 GLU C C 54 178.608 178.608 177.887 0.721 19168 3708 1 9 . 1 1 54 54 GLU CA C 54 59.472 59.472 58.708 0.764 19168 3709 1 9 . 1 1 54 54 GLU CB C 54 27.419 27.419 29.229 -1.810 19168 3710 1 9 . 1 1 55 55 ALA N N 55 124.380 124.380 121.084 3.296 19168 3711 1 9 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.126 0.197 19168 3712 1 9 . 1 1 55 55 ALA C C 55 181.502 181.502 179.719 1.783 19168 3713 1 9 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.077 -0.297 19168 3714 1 9 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.086 0.315 19168 3715 1 9 . 1 1 56 56 GLY N N 56 105.673 105.673 106.882 -1.209 19168 3716 1 9 . 1 1 56 56 GLY C C 56 174.278 174.278 176.312 -2.034 19168 3717 1 9 . 1 1 56 56 GLY CA C 56 46.879 46.879 47.074 -0.195 19168 3718 1 9 . 1 1 57 57 VAL N N 57 122.685 122.685 122.891 -0.206 19168 3719 1 9 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.698 -0.376 19168 3720 1 9 . 1 1 57 57 VAL C C 57 177.134 177.134 177.721 -0.587 19168 3721 1 9 . 1 1 57 57 VAL CA C 57 67.396 67.396 65.615 1.781 19168 3722 1 9 . 1 1 57 57 VAL CB C 57 31.769 31.769 30.889 0.880 19168 3723 1 9 . 1 1 58 58 ALA N N 58 119.580 119.580 122.720 -3.140 19168 3724 1 9 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.051 0.043 19168 3725 1 9 . 1 1 58 58 ALA C C 58 180.788 180.788 179.867 0.921 19168 3726 1 9 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.340 -0.287 19168 3727 1 9 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.208 -0.354 19168 3728 1 9 . 1 1 59 59 LEU N N 59 119.723 119.723 120.193 -0.470 19168 3729 1 9 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.038 0.220 19168 3730 1 9 . 1 1 59 59 LEU C C 59 178.024 178.024 178.659 -0.635 19168 3731 1 9 . 1 1 59 59 LEU CA C 59 57.710 57.710 57.920 -0.210 19168 3732 1 9 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.011 -0.310 19168 3733 1 9 . 1 1 60 60 LEU N N 60 117.978 117.978 119.119 -1.141 19168 3734 1 9 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.826 0.031 19168 3735 1 9 . 1 1 60 60 LEU C C 60 178.851 178.851 179.261 -0.410 19168 3736 1 9 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.123 -0.479 19168 3737 1 9 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.303 -1.015 19168 3738 1 9 . 1 1 61 61 GLU N N 61 119.906 119.906 118.290 1.616 19168 3739 1 9 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.083 0.408 19168 3740 1 9 . 1 1 61 61 GLU C C 61 179.519 179.519 179.003 0.516 19168 3741 1 9 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.019 -0.277 19168 3742 1 9 . 1 1 61 61 GLU CB C 61 28.813 28.813 28.825 -0.012 19168 3743 1 9 . 1 1 62 62 LYS N N 62 122.015 122.015 120.810 1.205 19168 3744 1 9 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.099 0.029 19168 3745 1 9 . 1 1 62 62 LYS C C 62 179.843 179.843 179.061 0.782 19168 3746 1 9 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.240 0.097 19168 3747 1 9 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.304 -0.657 19168 3748 1 9 . 1 1 63 63 ILE N N 63 120.882 120.882 119.588 1.294 19168 3749 1 9 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.641 -0.145 19168 3750 1 9 . 1 1 63 63 ILE C C 63 177.761 177.761 177.498 0.263 19168 3751 1 9 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.810 0.372 19168 3752 1 9 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.681 -0.295 19168 3753 1 9 . 1 1 64 64 TRP N N 64 120.279 120.279 121.571 -1.292 19168 3754 1 9 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.134 0.350 19168 3755 1 9 . 1 1 64 64 TRP C C 64 177.056 177.056 177.835 -0.779 19168 3756 1 9 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.012 -0.918 19168 3757 1 9 . 1 1 64 64 TRP CB C 64 29.635 29.635 30.035 -0.400 19168 3758 1 9 . 1 1 65 65 THR N N 65 109.483 109.483 112.475 -2.992 19168 3759 1 9 . 1 1 65 65 THR HA H 65 3.744 3.744 3.845 -0.101 19168 3760 1 9 . 1 1 65 65 THR C C 65 176.224 176.224 175.928 0.296 19168 3761 1 9 . 1 1 65 65 THR CA C 65 65.568 65.568 65.744 -0.176 19168 3762 1 9 . 1 1 65 65 THR CB C 65 69.308 69.308 68.285 1.023 19168 3763 1 9 . 1 1 66 66 MET N N 66 117.791 117.791 116.804 0.987 19168 3764 1 9 . 1 1 66 66 MET HA H 66 4.110 4.110 4.366 -0.256 19168 3765 1 9 . 1 1 66 66 MET C C 66 177.782 177.782 177.419 0.363 19168 3766 1 9 . 1 1 66 66 MET CA C 66 58.304 58.304 56.247 2.057 19168 3767 1 9 . 1 1 66 66 MET CB C 66 34.040 34.040 33.237 0.803 19168 3768 1 9 . 1 1 67 67 ILE N N 67 109.871 109.871 111.682 -1.811 19168 3769 1 9 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.520 0.122 19168 3770 1 9 . 1 1 67 67 ILE C C 67 176.713 176.713 175.676 1.037 19168 3771 1 9 . 1 1 67 67 ILE CA C 67 61.174 61.174 59.666 1.508 19168 3772 1 9 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.550 1.263 19168 3773 1 9 . 1 1 68 68 GLU N N 68 121.972 121.972 120.539 1.433 19168 3774 1 9 . 1 1 68 68 GLU HA H 68 2.748 2.748 2.455 0.293 19168 3775 1 9 . 1 1 68 68 GLU C C 68 175.855 175.855 175.520 0.335 19168 3776 1 9 . 1 1 68 68 GLU CA C 68 58.291 58.291 57.714 0.577 19168 3777 1 9 . 1 1 68 68 GLU CB C 68 28.492 28.492 28.650 -0.158 19168 3778 1 9 . 1 1 69 69 ASN N N 69 114.338 114.338 116.880 -2.542 19168 3779 1 9 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.592 -0.012 19168 3780 1 9 . 1 1 69 69 ASN C C 69 175.904 175.904 175.068 0.836 19168 3781 1 9 . 1 1 69 69 ASN CA C 69 54.597 54.597 52.637 1.960 19168 3782 1 9 . 1 1 69 69 ASN CB C 69 38.323 38.323 40.025 -1.702 19168 3783 1 9 . 1 1 70 70 GLU N N 70 116.936 116.936 115.280 1.656 19168 3784 1 9 . 1 1 70 70 GLU HA H 70 4.548 4.548 3.822 0.726 19168 3785 1 9 . 1 1 70 70 GLU C C 70 174.941 174.941 174.458 0.483 19168 3786 1 9 . 1 1 70 70 GLU CA C 70 55.983 55.983 58.543 -2.560 19168 3787 1 9 . 1 1 70 70 GLU CB C 70 31.348 31.348 29.088 2.260 19168 3788 1 9 . 1 1 71 71 ALA N N 71 122.966 122.966 119.316 3.650 19168 3789 1 9 . 1 1 71 71 ALA HA H 71 5.246 5.246 5.109 0.137 19168 3790 1 9 . 1 1 71 71 ALA C C 71 173.907 173.907 175.686 -1.779 19168 3791 1 9 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.627 0.191 19168 3792 1 9 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.734 1.326 19168 3793 1 9 . 1 1 72 72 ASN N N 72 115.820 115.820 119.140 -3.320 19168 3794 1 9 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.403 0.038 19168 3795 1 9 . 1 1 72 72 ASN C C 72 174.137 174.137 174.724 -0.587 19168 3796 1 9 . 1 1 72 72 ASN CA C 72 51.659 51.659 52.046 -0.387 19168 3797 1 9 . 1 1 72 72 ASN CB C 72 42.186 42.186 42.907 -0.721 19168 3798 1 9 . 1 1 73 73 ARG N N 73 118.340 118.340 123.445 -5.105 19168 3799 1 9 . 1 1 73 73 ARG HA H 73 4.778 4.778 4.088 0.690 19168 3800 1 9 . 1 1 73 73 ARG C C 73 174.674 174.674 175.319 -0.645 19168 3801 1 9 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.313 -1.444 19168 3802 1 9 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.404 2.721 19168 3803 1 9 . 1 1 74 74 ASP N N 74 124.007 124.007 127.379 -3.372 19168 3804 1 9 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.564 -0.022 19168 3805 1 9 . 1 1 74 74 ASP C C 74 175.935 175.935 175.490 0.445 19168 3806 1 9 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.473 -1.076 19168 3807 1 9 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.659 0.561 19168 3808 1 9 . 1 1 75 75 LYS N N 75 116.482 116.482 119.417 -2.935 19168 3809 1 9 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.507 -0.062 19168 3810 1 9 . 1 1 75 75 LYS C C 75 175.135 175.135 175.033 0.102 19168 3811 1 9 . 1 1 75 75 LYS CA C 75 54.785 54.785 54.306 0.478 19168 3812 1 9 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.593 0.882 19168 3813 1 9 . 1 1 76 76 GLU N N 76 120.126 120.126 125.903 -5.777 19168 3814 1 9 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.380 -0.472 19168 3815 1 9 . 1 1 76 76 GLU C C 76 173.204 173.204 174.929 -1.725 19168 3816 1 9 . 1 1 76 76 GLU CA C 76 55.524 55.524 53.615 1.909 19168 3817 1 9 . 1 1 76 76 GLU CB C 76 27.511 27.511 28.255 -0.744 19168 3818 1 9 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.790 -0.013 19168 3819 1 9 . 1 1 77 77 PRO C C 77 174.933 174.933 176.082 -1.149 19168 3820 1 9 . 1 1 77 77 PRO CA C 77 63.422 63.422 63.294 0.128 19168 3821 1 9 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.035 0.356 19168 3822 1 9 . 1 1 78 78 ASN N N 78 119.292 119.292 120.241 -0.949 19168 3823 1 9 . 1 1 78 78 ASN HA H 78 5.093 5.093 4.878 0.215 19168 3824 1 9 . 1 1 78 78 ASN C C 78 172.876 172.876 172.881 -0.005 19168 3825 1 9 . 1 1 78 78 ASN CA C 78 51.928 51.928 52.025 -0.097 19168 3826 1 9 . 1 1 78 78 ASN CB C 78 42.017 42.017 41.221 0.796 19168 3827 1 9 . 1 1 79 79 PHE N N 79 125.023 125.023 121.485 3.538 19168 3828 1 9 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.134 0.289 19168 3829 1 9 . 1 1 79 79 PHE C C 79 174.552 174.552 175.086 -0.534 19168 3830 1 9 . 1 1 79 79 PHE CA C 79 55.210 55.210 57.887 -2.677 19168 3831 1 9 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.006 0.103 19168 3832 1 9 . 1 1 80 80 GLU N N 80 128.920 128.920 126.868 2.052 19168 3833 1 9 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.430 -0.222 19168 3834 1 9 . 1 1 80 80 GLU C C 80 175.538 175.538 175.974 -0.436 19168 3835 1 9 . 1 1 80 80 GLU CA C 80 55.724 55.724 55.691 0.032 19168 3836 1 9 . 1 1 80 80 GLU CB C 80 32.135 32.135 32.439 -0.304 19168 3837 1 9 . 1 1 81 81 GLY N N 81 116.695 116.695 113.522 3.173 19168 3838 1 9 . 1 1 81 81 GLY C C 81 173.950 173.950 174.360 -0.410 19168 3839 1 9 . 1 1 81 81 GLY CA C 81 46.967 46.967 45.752 1.215 19168 3840 1 9 . 1 1 82 82 ARG N N 82 124.481 124.481 110.860 13.621 19168 3841 1 9 . 1 1 82 82 ARG HA H 82 4.539 4.539 3.834 0.705 19168 3842 1 9 . 1 1 82 82 ARG C C 82 173.437 173.437 174.024 -0.587 19168 3843 1 9 . 1 1 82 82 ARG CA C 82 55.156 55.156 57.545 -2.389 19168 3844 1 9 . 1 1 82 82 ARG CB C 82 30.255 30.255 29.015 1.240 19168 3845 1 9 . 1 1 83 83 TYR N N 83 114.539 114.539 115.595 -1.056 19168 3846 1 9 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.130 0.818 19168 3847 1 9 . 1 1 83 83 TYR C C 83 175.909 175.909 175.109 0.800 19168 3848 1 9 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.621 -0.564 19168 3849 1 9 . 1 1 83 83 TYR CB C 83 42.999 42.999 41.552 1.447 19168 3850 1 9 . 1 1 84 84 VAL N N 84 118.812 118.812 122.089 -3.277 19168 3851 1 9 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.987 -0.120 19168 3852 1 9 . 1 1 84 84 VAL C C 84 174.982 174.982 175.016 -0.034 19168 3853 1 9 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.561 -0.326 19168 3854 1 9 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.910 -0.419 19168 3855 1 9 . 1 1 85 85 ASN N N 85 124.630 124.630 123.886 0.744 19168 3856 1 9 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.107 -0.103 19168 3857 1 9 . 1 1 85 85 ASN C C 85 175.392 175.392 173.501 1.891 19168 3858 1 9 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.332 1.264 19168 3859 1 9 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.842 1.365 19168 3860 1 9 . 1 1 86 86 MET N N 86 118.969 118.969 118.717 0.252 19168 3861 1 9 . 1 1 86 86 MET HA H 86 4.640 4.640 4.842 -0.202 19168 3862 1 9 . 1 1 86 86 MET C C 86 172.378 172.378 173.540 -1.162 19168 3863 1 9 . 1 1 86 86 MET CA C 86 56.158 56.158 55.014 1.145 19168 3864 1 9 . 1 1 86 86 MET CB C 86 39.138 39.138 37.402 1.736 19168 3865 1 9 . 1 1 87 87 LEU N N 87 131.886 131.886 124.635 7.251 19168 3866 1 9 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.256 0.125 19168 3867 1 9 . 1 1 87 87 LEU C C 87 176.003 176.003 175.782 0.221 19168 3868 1 9 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.341 0.789 19168 3869 1 9 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.773 -0.300 19168 3870 1 9 . 1 1 88 88 VAL N N 88 121.165 121.165 119.345 1.820 19168 3871 1 9 . 1 1 88 88 VAL HA H 88 5.510 5.510 5.329 0.181 19168 3872 1 9 . 1 1 88 88 VAL C C 88 173.666 173.666 175.190 -1.524 19168 3873 1 9 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.532 -0.932 19168 3874 1 9 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.587 0.206 19168 3875 1 9 . 1 1 89 89 THR N N 89 111.786 111.786 121.715 -9.929 19168 3876 1 9 . 1 1 89 89 THR HA H 89 4.720 4.720 4.897 -0.177 19168 3877 1 9 . 1 1 89 89 THR C C 89 171.898 171.898 172.720 -0.822 19168 3878 1 9 . 1 1 89 89 THR CA C 89 57.985 57.985 59.675 -1.690 19168 3879 1 9 . 1 1 89 89 THR CB C 89 69.113 69.113 69.793 -0.681 19168 3880 1 9 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.338 0.245 19168 3881 1 9 . 1 1 90 90 PRO C C 90 177.403 177.403 176.686 0.717 19168 3882 1 9 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.721 0.810 19168 3883 1 9 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.412 -0.369 19168 3884 1 9 . 1 1 91 91 LYS N N 91 123.696 123.696 125.251 -1.555 19168 3885 1 9 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.138 -0.027 19168 3886 1 9 . 1 1 91 91 LYS C C 91 176.568 176.568 177.059 -0.491 19168 3887 1 9 . 1 1 91 91 LYS CA C 91 57.208 57.208 56.855 0.353 19168 3888 1 9 . 1 1 91 91 LYS CB C 91 33.183 33.183 33.049 0.134 19168 3889 1 9 . 1 1 92 92 LYS N N 92 122.054 122.054 124.260 -2.206 19168 3890 1 9 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.286 0.030 19168 3891 1 9 . 1 1 92 92 LYS C C 92 175.956 175.956 175.989 -0.033 19168 3892 1 9 . 1 1 92 92 LYS CA C 92 55.942 55.942 56.044 -0.102 19168 3893 1 9 . 1 1 92 92 LYS CB C 92 33.000 33.000 32.925 0.075 19168 3894 1 9 . 1 1 93 93 ALA N N 93 126.278 126.278 123.233 3.045 19168 3895 1 9 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.302 0.039 19168 3896 1 9 . 1 1 93 93 ALA C C 93 177.592 177.592 177.537 0.055 19168 3897 1 9 . 1 1 93 93 ALA CA C 93 52.279 52.279 51.874 0.405 19168 3898 1 9 . 1 1 93 93 ALA CB C 93 19.332 19.332 19.108 0.224 19168 3899 1 9 . 1 1 94 94 GLU N N 94 120.522 120.522 121.411 -0.889 19168 3900 1 9 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.246 0.038 19168 3901 1 9 . 1 1 94 94 GLU C C 94 177.041 177.041 177.683 -0.642 19168 3902 1 9 . 1 1 94 94 GLU CA C 94 56.606 56.606 56.259 0.347 19168 3903 1 9 . 1 1 94 94 GLU CB C 94 30.353 30.353 30.421 -0.068 19168 3904 1 9 . 1 1 95 95 GLY N N 95 109.755 109.755 109.987 -0.232 19168 3905 1 9 . 1 1 95 95 GLY C C 95 173.939 173.939 175.051 -1.112 19168 3906 1 9 . 1 1 95 95 GLY CA C 95 45.168 45.168 45.807 -0.639 19168 3907 1 10 . 1 1 5 5 VAL N N 5 123.289 123.289 123.447 -0.158 19168 3908 1 10 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.413 -0.394 19168 3909 1 10 . 1 1 5 5 VAL C C 5 175.799 175.799 175.764 0.035 19168 3910 1 10 . 1 1 5 5 VAL CA C 5 62.120 62.120 61.526 0.594 19168 3911 1 10 . 1 1 5 5 VAL CB C 5 32.757 32.757 33.647 -0.890 19168 3912 1 10 . 1 1 6 6 ILE N N 6 126.794 126.794 126.314 0.480 19168 3913 1 10 . 1 1 6 6 ILE HA H 6 3.967 3.967 3.987 -0.020 19168 3914 1 10 . 1 1 6 6 ILE C C 6 175.103 175.103 175.310 -0.207 19168 3915 1 10 . 1 1 6 6 ILE CA C 6 60.227 60.227 61.262 -1.035 19168 3916 1 10 . 1 1 6 6 ILE CB C 6 38.565 38.565 37.742 0.823 19168 3917 1 10 . 1 1 7 7 ASP N N 7 127.797 127.797 128.542 -0.745 19168 3918 1 10 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.659 -0.115 19168 3919 1 10 . 1 1 7 7 ASP C C 7 174.000 174.000 175.079 -1.079 19168 3920 1 10 . 1 1 7 7 ASP CA C 7 53.591 53.591 54.053 -0.462 19168 3921 1 10 . 1 1 7 7 ASP CB C 7 42.152 42.152 42.119 0.033 19168 3922 1 10 . 1 1 8 8 ILE N N 8 122.764 122.764 124.341 -1.577 19168 3923 1 10 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.188 0.132 19168 3924 1 10 . 1 1 8 8 ILE C C 8 176.337 176.337 175.462 0.875 19168 3925 1 10 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.214 -0.038 19168 3926 1 10 . 1 1 8 8 ILE CB C 8 39.542 39.542 40.050 -0.508 19168 3927 1 10 . 1 1 9 9 LYS N N 9 127.990 127.990 126.632 1.358 19168 3928 1 10 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.392 -0.070 19168 3929 1 10 . 1 1 9 9 LYS C C 9 174.759 174.759 175.231 -0.472 19168 3930 1 10 . 1 1 9 9 LYS CA C 9 52.315 52.315 54.169 -1.854 19168 3931 1 10 . 1 1 9 9 LYS CB C 9 32.902 32.902 33.499 -0.597 19168 3932 1 10 . 1 1 10 10 GLU N N 10 123.021 123.021 120.439 2.582 19168 3933 1 10 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.794 0.341 19168 3934 1 10 . 1 1 10 10 GLU C C 10 176.215 176.215 175.609 0.606 19168 3935 1 10 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.245 -0.343 19168 3936 1 10 . 1 1 10 10 GLU CB C 10 32.037 32.037 31.712 0.325 19168 3937 1 10 . 1 1 11 11 ILE N N 11 126.526 126.526 126.927 -0.401 19168 3938 1 10 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.184 0.151 19168 3939 1 10 . 1 1 11 11 ILE C C 11 174.334 174.334 174.801 -0.467 19168 3940 1 10 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.300 0.010 19168 3941 1 10 . 1 1 11 11 ILE CB C 11 39.826 39.826 38.964 0.862 19168 3942 1 10 . 1 1 12 12 LYS N N 12 128.164 128.164 128.880 -0.716 19168 3943 1 10 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.156 0.189 19168 3944 1 10 . 1 1 12 12 LYS C C 12 176.378 176.378 175.519 0.859 19168 3945 1 10 . 1 1 12 12 LYS CA C 12 55.940 55.940 55.847 0.093 19168 3946 1 10 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.907 0.149 19168 3947 1 10 . 1 1 13 13 LEU N N 13 121.881 121.881 125.393 -3.512 19168 3948 1 10 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.799 0.155 19168 3949 1 10 . 1 1 13 13 LEU C C 13 175.137 175.137 175.022 0.115 19168 3950 1 10 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.532 0.442 19168 3951 1 10 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.838 -0.554 19168 3952 1 10 . 1 1 14 14 SER N N 14 115.759 115.759 113.589 2.170 19168 3953 1 10 . 1 1 14 14 SER HA H 14 4.889 4.889 5.332 -0.443 19168 3954 1 10 . 1 1 14 14 SER C C 14 173.993 173.993 175.152 -1.159 19168 3955 1 10 . 1 1 14 14 SER CA C 14 56.052 56.052 56.748 -0.697 19168 3956 1 10 . 1 1 14 14 SER CB C 14 64.775 64.775 65.918 -1.143 19168 3957 1 10 . 1 1 15 15 VAL N N 15 120.993 120.993 122.424 -1.431 19168 3958 1 10 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.788 -0.054 19168 3959 1 10 . 1 1 15 15 VAL C C 15 176.964 176.964 177.045 -0.081 19168 3960 1 10 . 1 1 15 15 VAL CA C 15 65.427 65.427 66.391 -0.964 19168 3961 1 10 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.963 -0.178 19168 3962 1 10 . 1 1 16 16 LYS N N 16 118.897 118.897 119.140 -0.243 19168 3963 1 10 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.375 0.026 19168 3964 1 10 . 1 1 16 16 LYS C C 16 175.489 175.489 175.225 0.264 19168 3965 1 10 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.824 -0.669 19168 3966 1 10 . 1 1 16 16 LYS CB C 16 30.929 30.929 30.502 0.427 19168 3967 1 10 . 1 1 17 17 ILE N N 17 122.247 122.247 120.657 1.590 19168 3968 1 10 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.319 -0.134 19168 3969 1 10 . 1 1 17 17 ILE C C 17 173.426 173.426 174.881 -1.455 19168 3970 1 10 . 1 1 17 17 ILE CA C 17 61.276 61.276 60.265 1.011 19168 3971 1 10 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.348 -1.268 19168 3972 1 10 . 1 1 18 18 ALA N N 18 129.434 129.434 128.708 0.726 19168 3973 1 10 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.458 0.021 19168 3974 1 10 . 1 1 18 18 ALA C C 18 179.130 179.130 178.133 0.997 19168 3975 1 10 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.952 -0.515 19168 3976 1 10 . 1 1 18 18 ALA CB C 18 19.909 19.909 19.867 0.042 19168 3977 1 10 . 1 1 19 19 GLN HA H 19 3.797 3.797 3.973 -0.176 19168 3978 1 10 . 1 1 19 19 GLN CA C 19 59.231 59.231 59.294 -0.063 19168 3979 1 10 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.522 -0.347 19168 3980 1 10 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.487 -0.057 19168 3981 1 10 . 1 1 20 20 ASN C C 20 177.272 177.272 177.377 -0.105 19168 3982 1 10 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.233 -0.049 19168 3983 1 10 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.844 -0.392 19168 3984 1 10 . 1 1 21 21 ASP N N 21 119.132 119.132 119.749 -0.617 19168 3985 1 10 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.503 0.295 19168 3986 1 10 . 1 1 21 21 ASP C C 21 178.707 178.707 178.585 0.122 19168 3987 1 10 . 1 1 21 21 ASP CA C 21 56.886 56.886 56.680 0.206 19168 3988 1 10 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.633 0.032 19168 3989 1 10 . 1 1 22 22 ILE N N 22 122.030 122.030 120.078 1.952 19168 3990 1 10 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.666 -0.248 19168 3991 1 10 . 1 1 22 22 ILE C C 22 177.454 177.454 177.934 -0.480 19168 3992 1 10 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.351 1.375 19168 3993 1 10 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.892 -0.326 19168 3994 1 10 . 1 1 23 23 ASN N N 23 116.728 116.728 117.875 -1.147 19168 3995 1 10 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.497 -0.284 19168 3996 1 10 . 1 1 23 23 ASN C C 23 178.260 178.260 177.547 0.713 19168 3997 1 10 . 1 1 23 23 ASN CA C 23 56.274 56.274 55.446 0.828 19168 3998 1 10 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.648 -1.440 19168 3999 1 10 . 1 1 24 24 TYR N N 24 119.864 119.864 120.810 -0.946 19168 4000 1 10 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.375 -0.082 19168 4001 1 10 . 1 1 24 24 TYR C C 24 177.719 177.719 177.468 0.251 19168 4002 1 10 . 1 1 24 24 TYR CA C 24 61.048 61.048 61.595 -0.547 19168 4003 1 10 . 1 1 24 24 TYR CB C 24 38.283 38.283 39.110 -0.827 19168 4004 1 10 . 1 1 25 25 LYS N N 25 119.730 119.730 119.452 0.278 19168 4005 1 10 . 1 1 25 25 LYS HA H 25 4.111 4.111 4.153 -0.042 19168 4006 1 10 . 1 1 25 25 LYS C C 25 179.152 179.152 178.968 0.184 19168 4007 1 10 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.705 -0.543 19168 4008 1 10 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.797 -0.504 19168 4009 1 10 . 1 1 26 26 VAL N N 26 119.387 119.387 116.598 2.789 19168 4010 1 10 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.833 -0.213 19168 4011 1 10 . 1 1 26 26 VAL C C 26 177.017 177.017 177.376 -0.359 19168 4012 1 10 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.506 1.155 19168 4013 1 10 . 1 1 26 26 VAL CB C 26 31.550 31.550 30.987 0.563 19168 4014 1 10 . 1 1 27 27 LYS N N 27 120.420 120.420 119.918 0.502 19168 4015 1 10 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.902 0.044 19168 4016 1 10 . 1 1 27 27 LYS C C 27 179.458 179.458 178.451 1.007 19168 4017 1 10 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.550 0.328 19168 4018 1 10 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.026 -0.178 19168 4019 1 10 . 1 1 28 28 HIS N N 28 118.160 118.160 117.427 0.733 19168 4020 1 10 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.549 -0.362 19168 4021 1 10 . 1 1 28 28 HIS C C 28 177.085 177.085 177.395 -0.310 19168 4022 1 10 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.566 -1.681 19168 4023 1 10 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.598 0.158 19168 4024 1 10 . 1 1 29 29 ALA N N 29 120.579 120.579 122.237 -1.658 19168 4025 1 10 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.369 -0.371 19168 4026 1 10 . 1 1 29 29 ALA C C 29 179.299 179.299 179.748 -0.449 19168 4027 1 10 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.294 0.273 19168 4028 1 10 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.501 0.948 19168 4029 1 10 . 1 1 30 30 LEU N N 30 117.262 117.262 117.394 -0.132 19168 4030 1 10 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.963 0.112 19168 4031 1 10 . 1 1 30 30 LEU C C 30 180.017 180.017 179.001 1.016 19168 4032 1 10 . 1 1 30 30 LEU CA C 30 58.232 58.232 57.725 0.507 19168 4033 1 10 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.505 -0.179 19168 4034 1 10 . 1 1 31 31 GLU N N 31 120.625 120.625 118.997 1.628 19168 4035 1 10 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.846 0.222 19168 4036 1 10 . 1 1 31 31 GLU C C 31 179.572 179.572 179.035 0.537 19168 4037 1 10 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.138 0.137 19168 4038 1 10 . 1 1 31 31 GLU CB C 31 28.975 28.975 28.877 0.098 19168 4039 1 10 . 1 1 32 32 PHE N N 32 118.245 118.245 117.492 0.753 19168 4040 1 10 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.267 0.259 19168 4041 1 10 . 1 1 32 32 PHE C C 32 179.123 179.123 177.751 1.372 19168 4042 1 10 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.052 -2.355 19168 4043 1 10 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.653 -1.401 19168 4044 1 10 . 1 1 33 33 LEU N N 33 121.684 121.684 121.094 0.590 19168 4045 1 10 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.321 0.270 19168 4046 1 10 . 1 1 33 33 LEU C C 33 181.655 181.655 179.885 1.770 19168 4047 1 10 . 1 1 33 33 LEU CA C 33 58.172 58.172 58.085 0.087 19168 4048 1 10 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.503 0.189 19168 4049 1 10 . 1 1 34 34 GLU N N 34 122.046 122.046 116.892 5.154 19168 4050 1 10 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.066 0.086 19168 4051 1 10 . 1 1 34 34 GLU C C 34 178.237 178.237 177.691 0.546 19168 4052 1 10 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.611 0.535 19168 4053 1 10 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.051 0.183 19168 4054 1 10 . 1 1 35 35 GLN N N 35 115.697 115.697 115.228 0.469 19168 4055 1 10 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.376 0.011 19168 4056 1 10 . 1 1 35 35 GLN C C 35 176.456 176.456 176.501 -0.045 19168 4057 1 10 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.522 0.164 19168 4058 1 10 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.617 -0.421 19168 4059 1 10 . 1 1 36 36 GLY N N 36 108.291 108.291 106.592 1.699 19168 4060 1 10 . 1 1 36 36 GLY C C 36 174.673 174.673 174.132 0.541 19168 4061 1 10 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.222 0.305 19168 4062 1 10 . 1 1 37 37 LYS N N 37 120.464 120.464 118.780 1.684 19168 4063 1 10 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.717 -0.220 19168 4064 1 10 . 1 1 37 37 LYS C C 37 174.580 174.580 175.011 -0.431 19168 4065 1 10 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.024 1.065 19168 4066 1 10 . 1 1 37 37 LYS CB C 37 32.745 32.745 35.889 -3.144 19168 4067 1 10 . 1 1 38 38 HIS N N 38 116.878 116.878 117.938 -1.060 19168 4068 1 10 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.952 0.067 19168 4069 1 10 . 1 1 38 38 HIS C C 38 175.268 175.268 174.422 0.846 19168 4070 1 10 . 1 1 38 38 HIS CA C 38 54.150 54.150 55.965 -1.815 19168 4071 1 10 . 1 1 38 38 HIS CB C 38 32.877 32.877 32.835 0.042 19168 4072 1 10 . 1 1 39 39 VAL N N 39 119.782 119.782 121.180 -1.398 19168 4073 1 10 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.470 0.326 19168 4074 1 10 . 1 1 39 39 VAL C C 39 173.320 173.320 174.100 -0.780 19168 4075 1 10 . 1 1 39 39 VAL CA C 39 60.766 60.766 61.239 -0.473 19168 4076 1 10 . 1 1 39 39 VAL CB C 39 35.433 35.433 33.630 1.803 19168 4077 1 10 . 1 1 40 40 ARG N N 40 128.358 128.358 127.116 1.242 19168 4078 1 10 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.649 0.466 19168 4079 1 10 . 1 1 40 40 ARG C C 40 175.659 175.659 174.963 0.696 19168 4080 1 10 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.598 -0.776 19168 4081 1 10 . 1 1 40 40 ARG CB C 40 33.007 33.007 31.522 1.485 19168 4082 1 10 . 1 1 41 41 PHE N N 41 126.396 126.396 127.660 -1.264 19168 4083 1 10 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.156 0.022 19168 4084 1 10 . 1 1 41 41 PHE C C 41 176.107 176.107 175.347 0.760 19168 4085 1 10 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.756 -0.060 19168 4086 1 10 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.961 2.085 19168 4087 1 10 . 1 1 42 42 ARG N N 42 120.641 120.641 124.254 -3.613 19168 4088 1 10 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.309 0.230 19168 4089 1 10 . 1 1 42 42 ARG C C 42 175.010 175.010 174.565 0.445 19168 4090 1 10 . 1 1 42 42 ARG CA C 42 54.695 54.695 55.070 -0.375 19168 4091 1 10 . 1 1 42 42 ARG CB C 42 34.374 34.374 33.563 0.811 19168 4092 1 10 . 1 1 43 43 VAL N N 43 125.565 125.565 124.688 0.877 19168 4093 1 10 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.107 -0.442 19168 4094 1 10 . 1 1 43 43 VAL C C 43 175.325 175.325 173.775 1.550 19168 4095 1 10 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.769 1.047 19168 4096 1 10 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.179 -2.196 19168 4097 1 10 . 1 1 44 44 PHE N N 44 128.291 128.291 130.213 -1.922 19168 4098 1 10 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.619 -0.001 19168 4099 1 10 . 1 1 44 44 PHE C C 44 174.477 174.477 174.044 0.433 19168 4100 1 10 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.837 0.311 19168 4101 1 10 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.610 -1.669 19168 4102 1 10 . 1 1 45 45 LEU N N 45 128.360 128.360 128.347 0.013 19168 4103 1 10 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.315 0.076 19168 4104 1 10 . 1 1 45 45 LEU C C 45 174.342 174.342 175.554 -1.212 19168 4105 1 10 . 1 1 45 45 LEU CA C 45 53.586 53.586 54.124 -0.539 19168 4106 1 10 . 1 1 45 45 LEU CB C 45 41.113 41.113 41.914 -0.801 19168 4107 1 10 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.385 -0.293 19168 4108 1 10 . 1 1 46 46 LYS CA C 46 55.079 55.079 55.593 -0.513 19168 4109 1 10 . 1 1 46 46 LYS CB C 46 34.295 34.295 33.715 0.580 19168 4110 1 10 . 1 1 47 47 GLY CA C 47 46.813 46.813 45.098 1.715 19168 4111 1 10 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.271 -0.071 19168 4112 1 10 . 1 1 48 48 ARG C C 48 178.069 178.069 177.664 0.405 19168 4113 1 10 . 1 1 48 48 ARG CA C 48 57.862 57.862 56.831 1.030 19168 4114 1 10 . 1 1 48 48 ARG CB C 48 29.444 29.444 29.822 -0.378 19168 4115 1 10 . 1 1 49 49 GLU N N 49 119.779 119.779 120.771 -0.992 19168 4116 1 10 . 1 1 49 49 GLU HA H 49 4.053 4.053 3.983 0.070 19168 4117 1 10 . 1 1 49 49 GLU C C 49 178.227 178.227 177.932 0.295 19168 4118 1 10 . 1 1 49 49 GLU CA C 49 57.436 57.436 58.608 -1.173 19168 4119 1 10 . 1 1 49 49 GLU CB C 49 29.745 29.745 29.169 0.576 19168 4120 1 10 . 1 1 50 50 MET N N 50 116.370 116.370 118.514 -2.144 19168 4121 1 10 . 1 1 50 50 MET HA H 50 4.024 4.024 4.048 -0.024 19168 4122 1 10 . 1 1 50 50 MET C C 50 175.912 175.912 177.067 -1.155 19168 4123 1 10 . 1 1 50 50 MET CA C 50 56.664 56.664 57.826 -1.162 19168 4124 1 10 . 1 1 50 50 MET CB C 50 32.033 32.033 32.541 -0.508 19168 4125 1 10 . 1 1 51 51 ALA N N 51 118.880 118.880 120.280 -1.400 19168 4126 1 10 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.189 0.155 19168 4127 1 10 . 1 1 51 51 ALA C C 51 177.746 177.746 177.760 -0.014 19168 4128 1 10 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.501 -1.110 19168 4129 1 10 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.372 0.071 19168 4130 1 10 . 1 1 52 52 THR N N 52 108.299 108.299 110.690 -2.391 19168 4131 1 10 . 1 1 52 52 THR HA H 52 4.869 4.869 4.609 0.260 19168 4132 1 10 . 1 1 52 52 THR C C 52 173.933 173.933 172.683 1.250 19168 4133 1 10 . 1 1 52 52 THR CA C 52 57.554 57.554 58.741 -1.187 19168 4134 1 10 . 1 1 52 52 THR CB C 52 69.479 69.479 69.966 -0.487 19168 4135 1 10 . 1 1 53 53 PRO HA H 53 3.931 3.931 4.090 -0.159 19168 4136 1 10 . 1 1 53 53 PRO C C 53 178.185 178.185 178.309 -0.124 19168 4137 1 10 . 1 1 53 53 PRO CA C 53 65.019 65.019 63.995 1.024 19168 4138 1 10 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.588 -1.072 19168 4139 1 10 . 1 1 54 54 GLU N N 54 120.653 120.653 119.004 1.649 19168 4140 1 10 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.053 -0.037 19168 4141 1 10 . 1 1 54 54 GLU C C 54 178.608 178.608 177.783 0.825 19168 4142 1 10 . 1 1 54 54 GLU CA C 54 59.472 59.472 58.905 0.567 19168 4143 1 10 . 1 1 54 54 GLU CB C 54 27.419 27.419 29.155 -1.736 19168 4144 1 10 . 1 1 55 55 ALA N N 55 124.380 124.380 120.887 3.493 19168 4145 1 10 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.107 0.216 19168 4146 1 10 . 1 1 55 55 ALA C C 55 181.502 181.502 179.727 1.775 19168 4147 1 10 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.000 -0.220 19168 4148 1 10 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.078 0.323 19168 4149 1 10 . 1 1 56 56 GLY N N 56 105.673 105.673 106.845 -1.172 19168 4150 1 10 . 1 1 56 56 GLY C C 56 174.278 174.278 176.219 -1.941 19168 4151 1 10 . 1 1 56 56 GLY CA C 56 46.879 46.879 47.014 -0.135 19168 4152 1 10 . 1 1 57 57 VAL N N 57 122.685 122.685 123.234 -0.549 19168 4153 1 10 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.664 -0.342 19168 4154 1 10 . 1 1 57 57 VAL C C 57 177.134 177.134 177.678 -0.544 19168 4155 1 10 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.179 1.217 19168 4156 1 10 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.377 0.392 19168 4157 1 10 . 1 1 58 58 ALA N N 58 119.580 119.580 122.680 -3.100 19168 4158 1 10 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.283 -0.189 19168 4159 1 10 . 1 1 58 58 ALA C C 58 180.788 180.788 179.840 0.948 19168 4160 1 10 . 1 1 58 58 ALA CA C 58 55.053 55.053 54.995 0.058 19168 4161 1 10 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.490 -0.636 19168 4162 1 10 . 1 1 59 59 LEU N N 59 119.723 119.723 120.241 -0.518 19168 4163 1 10 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.029 0.229 19168 4164 1 10 . 1 1 59 59 LEU C C 59 178.024 178.024 178.664 -0.640 19168 4165 1 10 . 1 1 59 59 LEU CA C 59 57.710 57.710 58.007 -0.297 19168 4166 1 10 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.010 -0.309 19168 4167 1 10 . 1 1 60 60 LEU N N 60 117.978 117.978 118.897 -0.919 19168 4168 1 10 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.786 0.071 19168 4169 1 10 . 1 1 60 60 LEU C C 60 178.851 178.851 179.125 -0.274 19168 4170 1 10 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.214 -0.570 19168 4171 1 10 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.427 -1.139 19168 4172 1 10 . 1 1 61 61 GLU N N 61 119.906 119.906 119.075 0.831 19168 4173 1 10 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.040 0.452 19168 4174 1 10 . 1 1 61 61 GLU C C 61 179.519 179.519 178.968 0.551 19168 4175 1 10 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.836 -1.094 19168 4176 1 10 . 1 1 61 61 GLU CB C 61 28.813 28.813 29.231 -0.418 19168 4177 1 10 . 1 1 62 62 LYS N N 62 122.015 122.015 120.531 1.484 19168 4178 1 10 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.074 0.054 19168 4179 1 10 . 1 1 62 62 LYS C C 62 179.843 179.843 179.085 0.758 19168 4180 1 10 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.311 0.026 19168 4181 1 10 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.455 -0.808 19168 4182 1 10 . 1 1 63 63 ILE N N 63 120.882 120.882 119.566 1.316 19168 4183 1 10 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.751 -0.255 19168 4184 1 10 . 1 1 63 63 ILE C C 63 177.761 177.761 177.539 0.222 19168 4185 1 10 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.711 0.471 19168 4186 1 10 . 1 1 63 63 ILE CB C 63 37.386 37.386 38.125 -0.739 19168 4187 1 10 . 1 1 64 64 TRP N N 64 120.279 120.279 122.534 -2.255 19168 4188 1 10 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.147 0.337 19168 4189 1 10 . 1 1 64 64 TRP C C 64 177.056 177.056 177.607 -0.551 19168 4190 1 10 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.227 -1.133 19168 4191 1 10 . 1 1 64 64 TRP CB C 64 29.635 29.635 30.145 -0.510 19168 4192 1 10 . 1 1 65 65 THR N N 65 109.483 109.483 110.732 -1.249 19168 4193 1 10 . 1 1 65 65 THR HA H 65 3.744 3.744 3.855 -0.111 19168 4194 1 10 . 1 1 65 65 THR C C 65 176.224 176.224 175.968 0.256 19168 4195 1 10 . 1 1 65 65 THR CA C 65 65.568 65.568 64.491 1.077 19168 4196 1 10 . 1 1 65 65 THR CB C 65 69.308 69.308 68.252 1.056 19168 4197 1 10 . 1 1 66 66 MET N N 66 117.791 117.791 118.643 -0.852 19168 4198 1 10 . 1 1 66 66 MET HA H 66 4.110 4.110 4.206 -0.096 19168 4199 1 10 . 1 1 66 66 MET C C 66 177.782 177.782 177.324 0.458 19168 4200 1 10 . 1 1 66 66 MET CA C 66 58.304 58.304 58.425 -0.121 19168 4201 1 10 . 1 1 66 66 MET CB C 66 34.040 34.040 33.010 1.030 19168 4202 1 10 . 1 1 67 67 ILE N N 67 109.871 109.871 111.897 -2.026 19168 4203 1 10 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.380 0.262 19168 4204 1 10 . 1 1 67 67 ILE C C 67 176.713 176.713 176.304 0.409 19168 4205 1 10 . 1 1 67 67 ILE CA C 67 61.174 61.174 60.695 0.479 19168 4206 1 10 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.306 1.507 19168 4207 1 10 . 1 1 68 68 GLU N N 68 121.972 121.972 121.559 0.413 19168 4208 1 10 . 1 1 68 68 GLU HA H 68 2.748 2.748 2.698 0.050 19168 4209 1 10 . 1 1 68 68 GLU C C 68 175.855 175.855 177.353 -1.498 19168 4210 1 10 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.776 -0.485 19168 4211 1 10 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.989 0.503 19168 4212 1 10 . 1 1 69 69 ASN N N 69 114.338 114.338 114.584 -0.246 19168 4213 1 10 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.504 0.076 19168 4214 1 10 . 1 1 69 69 ASN C C 69 175.904 175.904 175.861 0.043 19168 4215 1 10 . 1 1 69 69 ASN CA C 69 54.597 54.597 54.593 0.004 19168 4216 1 10 . 1 1 69 69 ASN CB C 69 38.323 38.323 38.075 0.248 19168 4217 1 10 . 1 1 70 70 GLU N N 70 116.936 116.936 118.006 -1.070 19168 4218 1 10 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.515 0.033 19168 4219 1 10 . 1 1 70 70 GLU C C 70 174.941 174.941 174.701 0.240 19168 4220 1 10 . 1 1 70 70 GLU CA C 70 55.983 55.983 56.493 -0.510 19168 4221 1 10 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.688 -0.340 19168 4222 1 10 . 1 1 71 71 ALA N N 71 122.966 122.966 121.171 1.795 19168 4223 1 10 . 1 1 71 71 ALA HA H 71 5.246 5.246 4.728 0.518 19168 4224 1 10 . 1 1 71 71 ALA C C 71 173.907 173.907 175.434 -1.527 19168 4225 1 10 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.489 0.329 19168 4226 1 10 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.163 1.897 19168 4227 1 10 . 1 1 72 72 ASN N N 72 115.820 115.820 118.692 -2.872 19168 4228 1 10 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.328 0.113 19168 4229 1 10 . 1 1 72 72 ASN C C 72 174.137 174.137 174.729 -0.592 19168 4230 1 10 . 1 1 72 72 ASN CA C 72 51.659 51.659 52.041 -0.382 19168 4231 1 10 . 1 1 72 72 ASN CB C 72 42.186 42.186 42.321 -0.135 19168 4232 1 10 . 1 1 73 73 ARG N N 73 118.340 118.340 123.590 -5.250 19168 4233 1 10 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.997 0.781 19168 4234 1 10 . 1 1 73 73 ARG C C 73 174.674 174.674 175.836 -1.162 19168 4235 1 10 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.127 -1.258 19168 4236 1 10 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.777 2.348 19168 4237 1 10 . 1 1 74 74 ASP N N 74 124.007 124.007 128.039 -4.032 19168 4238 1 10 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.525 0.017 19168 4239 1 10 . 1 1 74 74 ASP C C 74 175.935 175.935 176.085 -0.150 19168 4240 1 10 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.253 -0.856 19168 4241 1 10 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.939 0.281 19168 4242 1 10 . 1 1 75 75 LYS N N 75 116.482 116.482 116.475 0.007 19168 4243 1 10 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.452 -0.007 19168 4244 1 10 . 1 1 75 75 LYS C C 75 175.135 175.135 174.229 0.906 19168 4245 1 10 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.579 -0.794 19168 4246 1 10 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.359 1.116 19168 4247 1 10 . 1 1 76 76 GLU N N 76 120.126 120.126 121.689 -1.563 19168 4248 1 10 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.312 -0.404 19168 4249 1 10 . 1 1 76 76 GLU C C 76 173.204 173.204 175.239 -2.035 19168 4250 1 10 . 1 1 76 76 GLU CA C 76 55.524 55.524 54.758 0.766 19168 4251 1 10 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.154 -1.643 19168 4252 1 10 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.679 0.098 19168 4253 1 10 . 1 1 77 77 PRO C C 77 174.933 174.933 176.248 -1.315 19168 4254 1 10 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.884 0.538 19168 4255 1 10 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.245 0.146 19168 4256 1 10 . 1 1 78 78 ASN N N 78 119.292 119.292 121.195 -1.903 19168 4257 1 10 . 1 1 78 78 ASN HA H 78 5.093 5.093 4.925 0.168 19168 4258 1 10 . 1 1 78 78 ASN C C 78 172.876 172.876 173.278 -0.402 19168 4259 1 10 . 1 1 78 78 ASN CA C 78 51.928 51.928 52.147 -0.219 19168 4260 1 10 . 1 1 78 78 ASN CB C 78 42.017 42.017 41.781 0.236 19168 4261 1 10 . 1 1 79 79 PHE N N 79 125.023 125.023 124.731 0.292 19168 4262 1 10 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.117 0.306 19168 4263 1 10 . 1 1 79 79 PHE C C 79 174.552 174.552 174.728 -0.176 19168 4264 1 10 . 1 1 79 79 PHE CA C 79 55.210 55.210 57.520 -2.310 19168 4265 1 10 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.026 0.083 19168 4266 1 10 . 1 1 80 80 GLU N N 80 128.920 128.920 128.847 0.073 19168 4267 1 10 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.493 -0.285 19168 4268 1 10 . 1 1 80 80 GLU C C 80 175.538 175.538 176.291 -0.753 19168 4269 1 10 . 1 1 80 80 GLU CA C 80 55.724 55.724 54.733 0.991 19168 4270 1 10 . 1 1 80 80 GLU CB C 80 32.135 32.135 31.651 0.483 19168 4271 1 10 . 1 1 81 81 GLY N N 81 116.695 116.695 115.602 1.093 19168 4272 1 10 . 1 1 81 81 GLY C C 81 173.950 173.950 174.503 -0.553 19168 4273 1 10 . 1 1 81 81 GLY CA C 81 46.967 46.967 46.697 0.270 19168 4274 1 10 . 1 1 82 82 ARG N N 82 124.481 124.481 122.460 2.021 19168 4275 1 10 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.359 0.180 19168 4276 1 10 . 1 1 82 82 ARG C C 82 173.437 173.437 174.399 -0.962 19168 4277 1 10 . 1 1 82 82 ARG CA C 82 55.156 55.156 55.142 0.013 19168 4278 1 10 . 1 1 82 82 ARG CB C 82 30.255 30.255 32.077 -1.821 19168 4279 1 10 . 1 1 83 83 TYR N N 83 114.539 114.539 118.227 -3.688 19168 4280 1 10 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.368 0.580 19168 4281 1 10 . 1 1 83 83 TYR C C 83 175.909 175.909 174.461 1.448 19168 4282 1 10 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.532 -0.475 19168 4283 1 10 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.014 0.985 19168 4284 1 10 . 1 1 84 84 VAL N N 84 118.812 118.812 122.601 -3.789 19168 4285 1 10 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.691 0.176 19168 4286 1 10 . 1 1 84 84 VAL C C 84 174.982 174.982 175.447 -0.465 19168 4287 1 10 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.329 -0.094 19168 4288 1 10 . 1 1 84 84 VAL CB C 84 32.491 32.491 31.497 0.994 19168 4289 1 10 . 1 1 85 85 ASN N N 85 124.630 124.630 127.181 -2.551 19168 4290 1 10 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.026 -0.022 19168 4291 1 10 . 1 1 85 85 ASN C C 85 175.392 175.392 173.853 1.539 19168 4292 1 10 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.943 0.653 19168 4293 1 10 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.225 1.981 19168 4294 1 10 . 1 1 86 86 MET N N 86 118.969 118.969 121.352 -2.383 19168 4295 1 10 . 1 1 86 86 MET HA H 86 4.640 4.640 4.897 -0.257 19168 4296 1 10 . 1 1 86 86 MET C C 86 172.378 172.378 173.243 -0.865 19168 4297 1 10 . 1 1 86 86 MET CA C 86 56.158 56.158 54.554 1.604 19168 4298 1 10 . 1 1 86 86 MET CB C 86 39.138 39.138 36.940 2.198 19168 4299 1 10 . 1 1 87 87 LEU N N 87 131.886 131.886 125.528 6.358 19168 4300 1 10 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.156 0.225 19168 4301 1 10 . 1 1 87 87 LEU C C 87 176.003 176.003 175.750 0.253 19168 4302 1 10 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.494 0.636 19168 4303 1 10 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.768 -0.295 19168 4304 1 10 . 1 1 88 88 VAL N N 88 121.165 121.165 119.652 1.513 19168 4305 1 10 . 1 1 88 88 VAL HA H 88 5.510 5.510 5.195 0.315 19168 4306 1 10 . 1 1 88 88 VAL C C 88 173.666 173.666 175.363 -1.697 19168 4307 1 10 . 1 1 88 88 VAL CA C 88 58.600 58.600 60.123 -1.523 19168 4308 1 10 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.101 0.692 19168 4309 1 10 . 1 1 89 89 THR N N 89 111.786 111.786 122.074 -10.288 19168 4310 1 10 . 1 1 89 89 THR HA H 89 4.720 4.720 4.788 -0.068 19168 4311 1 10 . 1 1 89 89 THR C C 89 171.898 171.898 172.660 -0.762 19168 4312 1 10 . 1 1 89 89 THR CA C 89 57.985 57.985 59.526 -1.541 19168 4313 1 10 . 1 1 89 89 THR CB C 89 69.113 69.113 69.674 -0.561 19168 4314 1 10 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.445 0.138 19168 4315 1 10 . 1 1 90 90 PRO C C 90 177.403 177.403 176.751 0.652 19168 4316 1 10 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.666 0.865 19168 4317 1 10 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.295 -0.252 19168 4318 1 10 . 1 1 91 91 LYS N N 91 123.696 123.696 123.610 0.086 19168 4319 1 10 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.191 -0.080 19168 4320 1 10 . 1 1 91 91 LYS C C 91 176.568 176.568 175.960 0.608 19168 4321 1 10 . 1 1 91 91 LYS CA C 91 57.208 57.208 57.323 -0.115 19168 4322 1 10 . 1 1 91 91 LYS CB C 91 33.183 33.183 31.861 1.322 19168 4323 1 10 . 1 1 92 92 LYS N N 92 122.054 122.054 123.517 -1.463 19168 4324 1 10 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.528 -0.212 19168 4325 1 10 . 1 1 92 92 LYS C C 92 175.956 175.956 175.747 0.209 19168 4326 1 10 . 1 1 92 92 LYS CA C 92 55.942 55.942 55.062 0.880 19168 4327 1 10 . 1 1 92 92 LYS CB C 92 33.000 33.000 35.512 -2.512 19168 4328 1 10 . 1 1 93 93 ALA N N 93 126.278 126.278 126.731 -0.453 19168 4329 1 10 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.482 -0.141 19168 4330 1 10 . 1 1 93 93 ALA C C 93 177.592 177.592 177.294 0.298 19168 4331 1 10 . 1 1 93 93 ALA CA C 93 52.279 52.279 51.365 0.914 19168 4332 1 10 . 1 1 93 93 ALA CB C 93 19.332 19.332 19.266 0.066 19168 4333 1 10 . 1 1 94 94 GLU N N 94 120.522 120.522 124.309 -3.787 19168 4334 1 10 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.040 0.244 19168 4335 1 10 . 1 1 94 94 GLU C C 94 177.041 177.041 176.390 0.651 19168 4336 1 10 . 1 1 94 94 GLU CA C 94 56.606 56.606 56.089 0.517 19168 4337 1 10 . 1 1 94 94 GLU CB C 94 30.353 30.353 28.642 1.711 19168 4338 1 10 . 1 1 95 95 GLY N N 95 109.755 109.755 112.743 -2.988 19168 4339 1 10 . 1 1 95 95 GLY C C 95 173.939 173.939 174.250 -0.311 19168 4340 1 10 . 1 1 95 95 GLY CA C 95 45.168 45.168 44.910 0.258 19168 4341 1 11 . 1 1 5 5 VAL N N 5 123.289 123.289 124.202 -0.913 19168 4342 1 11 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.184 -0.165 19168 4343 1 11 . 1 1 5 5 VAL C C 5 175.799 175.799 175.641 0.158 19168 4344 1 11 . 1 1 5 5 VAL CA C 5 62.120 62.120 61.632 0.488 19168 4345 1 11 . 1 1 5 5 VAL CB C 5 32.757 32.757 32.833 -0.076 19168 4346 1 11 . 1 1 6 6 ILE N N 6 126.794 126.794 126.894 -0.100 19168 4347 1 11 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.032 -0.065 19168 4348 1 11 . 1 1 6 6 ILE C C 6 175.103 175.103 175.050 0.053 19168 4349 1 11 . 1 1 6 6 ILE CA C 6 60.227 60.227 61.322 -1.095 19168 4350 1 11 . 1 1 6 6 ILE CB C 6 38.565 38.565 38.388 0.177 19168 4351 1 11 . 1 1 7 7 ASP N N 7 127.797 127.797 128.831 -1.034 19168 4352 1 11 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.654 -0.110 19168 4353 1 11 . 1 1 7 7 ASP C C 7 174.000 174.000 175.379 -1.379 19168 4354 1 11 . 1 1 7 7 ASP CA C 7 53.591 53.591 53.647 -0.056 19168 4355 1 11 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.324 0.828 19168 4356 1 11 . 1 1 8 8 ILE N N 8 122.764 122.764 126.405 -3.641 19168 4357 1 11 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.015 0.305 19168 4358 1 11 . 1 1 8 8 ILE C C 8 176.337 176.337 175.709 0.628 19168 4359 1 11 . 1 1 8 8 ILE CA C 8 60.176 60.176 61.225 -1.049 19168 4360 1 11 . 1 1 8 8 ILE CB C 8 39.542 39.542 38.739 0.803 19168 4361 1 11 . 1 1 9 9 LYS N N 9 127.990 127.990 127.896 0.094 19168 4362 1 11 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.359 -0.037 19168 4363 1 11 . 1 1 9 9 LYS C C 9 174.759 174.759 175.132 -0.373 19168 4364 1 11 . 1 1 9 9 LYS CA C 9 52.315 52.315 54.336 -2.021 19168 4365 1 11 . 1 1 9 9 LYS CB C 9 32.902 32.902 33.348 -0.446 19168 4366 1 11 . 1 1 10 10 GLU N N 10 123.021 123.021 121.319 1.702 19168 4367 1 11 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.787 0.348 19168 4368 1 11 . 1 1 10 10 GLU C C 10 176.215 176.215 175.943 0.272 19168 4369 1 11 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.205 -0.303 19168 4370 1 11 . 1 1 10 10 GLU CB C 10 32.037 32.037 32.322 -0.285 19168 4371 1 11 . 1 1 11 11 ILE N N 11 126.526 126.526 127.506 -0.980 19168 4372 1 11 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.282 0.053 19168 4373 1 11 . 1 1 11 11 ILE C C 11 174.334 174.334 174.694 -0.360 19168 4374 1 11 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.369 -0.059 19168 4375 1 11 . 1 1 11 11 ILE CB C 11 39.826 39.826 39.709 0.117 19168 4376 1 11 . 1 1 12 12 LYS N N 12 128.164 128.164 127.839 0.325 19168 4377 1 11 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.676 -0.331 19168 4378 1 11 . 1 1 12 12 LYS C C 12 176.378 176.378 175.872 0.506 19168 4379 1 11 . 1 1 12 12 LYS CA C 12 55.940 55.940 55.558 0.382 19168 4380 1 11 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.865 0.191 19168 4381 1 11 . 1 1 13 13 LEU N N 13 121.881 121.881 121.782 0.099 19168 4382 1 11 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.798 0.156 19168 4383 1 11 . 1 1 13 13 LEU C C 13 175.137 175.137 175.192 -0.055 19168 4384 1 11 . 1 1 13 13 LEU CA C 13 53.974 53.974 54.051 -0.077 19168 4385 1 11 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.315 -0.030 19168 4386 1 11 . 1 1 14 14 SER N N 14 115.759 115.759 113.037 2.722 19168 4387 1 11 . 1 1 14 14 SER HA H 14 4.889 4.889 5.230 -0.341 19168 4388 1 11 . 1 1 14 14 SER C C 14 173.993 173.993 175.171 -1.178 19168 4389 1 11 . 1 1 14 14 SER CA C 14 56.052 56.052 56.718 -0.666 19168 4390 1 11 . 1 1 14 14 SER CB C 14 64.775 64.775 65.772 -0.997 19168 4391 1 11 . 1 1 15 15 VAL N N 15 120.993 120.993 121.729 -0.736 19168 4392 1 11 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.788 -0.054 19168 4393 1 11 . 1 1 15 15 VAL C C 15 176.964 176.964 176.651 0.313 19168 4394 1 11 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.904 -0.478 19168 4395 1 11 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.868 -0.083 19168 4396 1 11 . 1 1 16 16 LYS N N 16 118.897 118.897 119.535 -0.638 19168 4397 1 11 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.437 -0.036 19168 4398 1 11 . 1 1 16 16 LYS C C 16 175.489 175.489 175.232 0.257 19168 4399 1 11 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.376 -0.221 19168 4400 1 11 . 1 1 16 16 LYS CB C 16 30.929 30.929 31.140 -0.211 19168 4401 1 11 . 1 1 17 17 ILE N N 17 122.247 122.247 120.333 1.914 19168 4402 1 11 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.395 -0.210 19168 4403 1 11 . 1 1 17 17 ILE C C 17 173.426 173.426 174.860 -1.434 19168 4404 1 11 . 1 1 17 17 ILE CA C 17 61.276 61.276 59.912 1.364 19168 4405 1 11 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.940 -1.859 19168 4406 1 11 . 1 1 18 18 ALA N N 18 129.434 129.434 127.603 1.831 19168 4407 1 11 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.563 -0.084 19168 4408 1 11 . 1 1 18 18 ALA C C 18 179.130 179.130 178.236 0.894 19168 4409 1 11 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.848 -0.411 19168 4410 1 11 . 1 1 18 18 ALA CB C 18 19.909 19.909 19.928 -0.019 19168 4411 1 11 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.033 -0.236 19168 4412 1 11 . 1 1 19 19 GLN CA C 19 59.231 59.231 59.420 -0.189 19168 4413 1 11 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.614 -0.439 19168 4414 1 11 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.503 -0.073 19168 4415 1 11 . 1 1 20 20 ASN C C 20 177.272 177.272 177.739 -0.467 19168 4416 1 11 . 1 1 20 20 ASN CA C 20 56.184 56.184 55.892 0.292 19168 4417 1 11 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.600 -0.147 19168 4418 1 11 . 1 1 21 21 ASP N N 21 119.132 119.132 120.211 -1.079 19168 4419 1 11 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.541 0.257 19168 4420 1 11 . 1 1 21 21 ASP C C 21 178.707 178.707 178.596 0.111 19168 4421 1 11 . 1 1 21 21 ASP CA C 21 56.886 56.886 57.028 -0.142 19168 4422 1 11 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.790 -0.125 19168 4423 1 11 . 1 1 22 22 ILE N N 22 122.030 122.030 120.094 1.936 19168 4424 1 11 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.618 -0.200 19168 4425 1 11 . 1 1 22 22 ILE C C 22 177.454 177.454 177.907 -0.453 19168 4426 1 11 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.649 1.077 19168 4427 1 11 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.703 -0.137 19168 4428 1 11 . 1 1 23 23 ASN N N 23 116.728 116.728 118.856 -2.128 19168 4429 1 11 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.438 -0.225 19168 4430 1 11 . 1 1 23 23 ASN C C 23 178.260 178.260 177.862 0.398 19168 4431 1 11 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.998 -0.724 19168 4432 1 11 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.651 -1.444 19168 4433 1 11 . 1 1 24 24 TYR N N 24 119.864 119.864 121.677 -1.813 19168 4434 1 11 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.085 0.208 19168 4435 1 11 . 1 1 24 24 TYR C C 24 177.719 177.719 177.467 0.252 19168 4436 1 11 . 1 1 24 24 TYR CA C 24 61.048 61.048 62.037 -0.989 19168 4437 1 11 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.629 -0.346 19168 4438 1 11 . 1 1 25 25 LYS N N 25 119.730 119.730 119.287 0.443 19168 4439 1 11 . 1 1 25 25 LYS HA H 25 4.111 4.111 4.185 -0.074 19168 4440 1 11 . 1 1 25 25 LYS C C 25 179.152 179.152 179.151 0.001 19168 4441 1 11 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.499 -0.338 19168 4442 1 11 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.736 -0.442 19168 4443 1 11 . 1 1 26 26 VAL N N 26 119.387 119.387 119.692 -0.305 19168 4444 1 11 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.899 -0.279 19168 4445 1 11 . 1 1 26 26 VAL C C 26 177.017 177.017 177.712 -0.695 19168 4446 1 11 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.248 1.413 19168 4447 1 11 . 1 1 26 26 VAL CB C 26 31.550 31.550 30.969 0.581 19168 4448 1 11 . 1 1 27 27 LYS N N 27 120.420 120.420 120.016 0.404 19168 4449 1 11 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.894 0.052 19168 4450 1 11 . 1 1 27 27 LYS C C 27 179.458 179.458 178.461 0.997 19168 4451 1 11 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.904 -0.026 19168 4452 1 11 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.205 -0.357 19168 4453 1 11 . 1 1 28 28 HIS N N 28 118.160 118.160 117.264 0.896 19168 4454 1 11 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.242 -0.055 19168 4455 1 11 . 1 1 28 28 HIS C C 28 177.085 177.085 177.311 -0.226 19168 4456 1 11 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.075 -1.190 19168 4457 1 11 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.618 0.138 19168 4458 1 11 . 1 1 29 29 ALA N N 29 120.579 120.579 122.362 -1.783 19168 4459 1 11 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.265 -0.267 19168 4460 1 11 . 1 1 29 29 ALA C C 29 179.299 179.299 179.574 -0.275 19168 4461 1 11 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.266 0.301 19168 4462 1 11 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.389 1.060 19168 4463 1 11 . 1 1 30 30 LEU N N 30 117.262 117.262 118.366 -1.104 19168 4464 1 11 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.918 0.157 19168 4465 1 11 . 1 1 30 30 LEU C C 30 180.017 180.017 179.189 0.828 19168 4466 1 11 . 1 1 30 30 LEU CA C 30 58.232 58.232 57.963 0.269 19168 4467 1 11 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.396 -0.070 19168 4468 1 11 . 1 1 31 31 GLU N N 31 120.625 120.625 119.520 1.105 19168 4469 1 11 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.923 0.145 19168 4470 1 11 . 1 1 31 31 GLU C C 31 179.572 179.572 179.392 0.180 19168 4471 1 11 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.336 -0.061 19168 4472 1 11 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.105 -0.130 19168 4473 1 11 . 1 1 32 32 PHE N N 32 118.245 118.245 118.602 -0.357 19168 4474 1 11 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.264 0.262 19168 4475 1 11 . 1 1 32 32 PHE C C 32 179.123 179.123 178.011 1.112 19168 4476 1 11 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.715 -3.018 19168 4477 1 11 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.642 -1.390 19168 4478 1 11 . 1 1 33 33 LEU N N 33 121.684 121.684 120.686 0.998 19168 4479 1 11 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.278 0.313 19168 4480 1 11 . 1 1 33 33 LEU C C 33 181.655 181.655 180.042 1.613 19168 4481 1 11 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.651 0.521 19168 4482 1 11 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.644 0.048 19168 4483 1 11 . 1 1 34 34 GLU N N 34 122.046 122.046 118.433 3.613 19168 4484 1 11 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.153 -0.001 19168 4485 1 11 . 1 1 34 34 GLU C C 34 178.237 178.237 178.420 -0.183 19168 4486 1 11 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.515 0.631 19168 4487 1 11 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.106 0.128 19168 4488 1 11 . 1 1 35 35 GLN N N 35 115.697 115.697 116.662 -0.965 19168 4489 1 11 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.305 0.082 19168 4490 1 11 . 1 1 35 35 GLN C C 35 176.456 176.456 176.566 -0.110 19168 4491 1 11 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.908 -0.222 19168 4492 1 11 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.082 0.114 19168 4493 1 11 . 1 1 36 36 GLY N N 36 108.291 108.291 107.045 1.246 19168 4494 1 11 . 1 1 36 36 GLY C C 36 174.673 174.673 174.188 0.485 19168 4495 1 11 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.120 0.407 19168 4496 1 11 . 1 1 37 37 LYS N N 37 120.464 120.464 120.482 -0.018 19168 4497 1 11 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.659 -0.162 19168 4498 1 11 . 1 1 37 37 LYS C C 37 174.580 174.580 175.726 -1.146 19168 4499 1 11 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.195 0.894 19168 4500 1 11 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.656 -1.911 19168 4501 1 11 . 1 1 38 38 HIS N N 38 116.878 116.878 118.929 -2.051 19168 4502 1 11 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.705 0.314 19168 4503 1 11 . 1 1 38 38 HIS C C 38 175.268 175.268 174.575 0.693 19168 4504 1 11 . 1 1 38 38 HIS CA C 38 54.150 54.150 56.693 -2.543 19168 4505 1 11 . 1 1 38 38 HIS CB C 38 32.877 32.877 31.561 1.317 19168 4506 1 11 . 1 1 39 39 VAL N N 39 119.782 119.782 122.579 -2.797 19168 4507 1 11 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.693 0.103 19168 4508 1 11 . 1 1 39 39 VAL C C 39 173.320 173.320 174.368 -1.048 19168 4509 1 11 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.681 0.085 19168 4510 1 11 . 1 1 39 39 VAL CB C 39 35.433 35.433 33.072 2.361 19168 4511 1 11 . 1 1 40 40 ARG N N 40 128.358 128.358 127.152 1.206 19168 4512 1 11 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.848 0.267 19168 4513 1 11 . 1 1 40 40 ARG C C 40 175.659 175.659 174.970 0.689 19168 4514 1 11 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.150 -0.328 19168 4515 1 11 . 1 1 40 40 ARG CB C 40 33.007 33.007 32.182 0.825 19168 4516 1 11 . 1 1 41 41 PHE N N 41 126.396 126.396 127.582 -1.186 19168 4517 1 11 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.239 -0.061 19168 4518 1 11 . 1 1 41 41 PHE C C 41 176.107 176.107 175.306 0.801 19168 4519 1 11 . 1 1 41 41 PHE CA C 41 57.696 57.696 58.045 -0.349 19168 4520 1 11 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.648 2.397 19168 4521 1 11 . 1 1 42 42 ARG N N 42 120.641 120.641 124.092 -3.451 19168 4522 1 11 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.625 -0.086 19168 4523 1 11 . 1 1 42 42 ARG C C 42 175.010 175.010 174.606 0.404 19168 4524 1 11 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.533 0.162 19168 4525 1 11 . 1 1 42 42 ARG CB C 42 34.374 34.374 34.468 -0.094 19168 4526 1 11 . 1 1 43 43 VAL N N 43 125.565 125.565 122.297 3.268 19168 4527 1 11 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.305 -0.640 19168 4528 1 11 . 1 1 43 43 VAL C C 43 175.325 175.325 173.659 1.666 19168 4529 1 11 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.513 1.303 19168 4530 1 11 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.538 -2.555 19168 4531 1 11 . 1 1 44 44 PHE N N 44 128.291 128.291 129.131 -0.840 19168 4532 1 11 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.674 -0.056 19168 4533 1 11 . 1 1 44 44 PHE C C 44 174.477 174.477 173.839 0.638 19168 4534 1 11 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.660 0.488 19168 4535 1 11 . 1 1 44 44 PHE CB C 44 39.941 39.941 42.038 -2.097 19168 4536 1 11 . 1 1 45 45 LEU N N 45 128.360 128.360 128.041 0.319 19168 4537 1 11 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.399 -0.008 19168 4538 1 11 . 1 1 45 45 LEU C C 45 174.342 174.342 175.288 -0.946 19168 4539 1 11 . 1 1 45 45 LEU CA C 45 53.586 53.586 53.704 -0.118 19168 4540 1 11 . 1 1 45 45 LEU CB C 45 41.113 41.113 41.548 -0.435 19168 4541 1 11 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.313 -0.221 19168 4542 1 11 . 1 1 46 46 LYS CA C 46 55.079 55.079 55.852 -0.773 19168 4543 1 11 . 1 1 46 46 LYS CB C 46 34.295 34.295 33.765 0.530 19168 4544 1 11 . 1 1 47 47 GLY CA C 47 46.813 46.813 44.704 2.109 19168 4545 1 11 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.317 -0.117 19168 4546 1 11 . 1 1 48 48 ARG C C 48 178.069 178.069 176.848 1.221 19168 4547 1 11 . 1 1 48 48 ARG CA C 48 57.862 57.862 56.387 1.475 19168 4548 1 11 . 1 1 48 48 ARG CB C 48 29.444 29.444 30.093 -0.649 19168 4549 1 11 . 1 1 49 49 GLU N N 49 119.779 119.779 119.388 0.391 19168 4550 1 11 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.168 -0.115 19168 4551 1 11 . 1 1 49 49 GLU C C 49 178.227 178.227 177.780 0.447 19168 4552 1 11 . 1 1 49 49 GLU CA C 49 57.436 57.436 57.823 -0.387 19168 4553 1 11 . 1 1 49 49 GLU CB C 49 29.745 29.745 28.825 0.920 19168 4554 1 11 . 1 1 50 50 MET N N 50 116.370 116.370 118.467 -2.097 19168 4555 1 11 . 1 1 50 50 MET HA H 50 4.024 4.024 4.193 -0.169 19168 4556 1 11 . 1 1 50 50 MET C C 50 175.912 175.912 177.780 -1.868 19168 4557 1 11 . 1 1 50 50 MET CA C 50 56.664 56.664 56.740 -0.076 19168 4558 1 11 . 1 1 50 50 MET CB C 50 32.033 32.033 31.076 0.957 19168 4559 1 11 . 1 1 51 51 ALA N N 51 118.880 118.880 119.899 -1.019 19168 4560 1 11 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.162 0.182 19168 4561 1 11 . 1 1 51 51 ALA C C 51 177.746 177.746 177.876 -0.130 19168 4562 1 11 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.299 -0.908 19168 4563 1 11 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.195 0.248 19168 4564 1 11 . 1 1 52 52 THR N N 52 108.299 108.299 110.322 -2.023 19168 4565 1 11 . 1 1 52 52 THR HA H 52 4.869 4.869 4.679 0.190 19168 4566 1 11 . 1 1 52 52 THR C C 52 173.933 173.933 173.023 0.910 19168 4567 1 11 . 1 1 52 52 THR CA C 52 57.554 57.554 58.688 -1.134 19168 4568 1 11 . 1 1 52 52 THR CB C 52 69.479 69.479 69.735 -0.256 19168 4569 1 11 . 1 1 53 53 PRO HA H 53 3.931 3.931 3.840 0.091 19168 4570 1 11 . 1 1 53 53 PRO C C 53 178.185 178.185 177.984 0.201 19168 4571 1 11 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.207 0.812 19168 4572 1 11 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.208 -0.692 19168 4573 1 11 . 1 1 54 54 GLU N N 54 120.653 120.653 117.584 3.069 19168 4574 1 11 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.031 -0.015 19168 4575 1 11 . 1 1 54 54 GLU C C 54 178.608 178.608 177.880 0.728 19168 4576 1 11 . 1 1 54 54 GLU CA C 54 59.472 59.472 58.511 0.961 19168 4577 1 11 . 1 1 54 54 GLU CB C 54 27.419 27.419 28.299 -0.880 19168 4578 1 11 . 1 1 55 55 ALA N N 55 124.380 124.380 122.216 2.164 19168 4579 1 11 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.089 0.234 19168 4580 1 11 . 1 1 55 55 ALA C C 55 181.502 181.502 179.797 1.705 19168 4581 1 11 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.050 -0.271 19168 4582 1 11 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.040 0.361 19168 4583 1 11 . 1 1 56 56 GLY N N 56 105.673 105.673 106.602 -0.929 19168 4584 1 11 . 1 1 56 56 GLY C C 56 174.278 174.278 176.197 -1.919 19168 4585 1 11 . 1 1 56 56 GLY CA C 56 46.879 46.879 47.020 -0.141 19168 4586 1 11 . 1 1 57 57 VAL N N 57 122.685 122.685 123.205 -0.520 19168 4587 1 11 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.688 -0.366 19168 4588 1 11 . 1 1 57 57 VAL C C 57 177.134 177.134 177.727 -0.593 19168 4589 1 11 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.077 1.319 19168 4590 1 11 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.363 0.406 19168 4591 1 11 . 1 1 58 58 ALA N N 58 119.580 119.580 122.702 -3.122 19168 4592 1 11 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.439 -0.345 19168 4593 1 11 . 1 1 58 58 ALA C C 58 180.788 180.788 179.892 0.896 19168 4594 1 11 . 1 1 58 58 ALA CA C 58 55.053 55.053 54.934 0.119 19168 4595 1 11 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.516 -0.662 19168 4596 1 11 . 1 1 59 59 LEU N N 59 119.723 119.723 119.730 -0.007 19168 4597 1 11 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.077 0.181 19168 4598 1 11 . 1 1 59 59 LEU C C 59 178.024 178.024 178.640 -0.616 19168 4599 1 11 . 1 1 59 59 LEU CA C 59 57.710 57.710 57.809 -0.099 19168 4600 1 11 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.053 -0.353 19168 4601 1 11 . 1 1 60 60 LEU N N 60 117.978 117.978 118.706 -0.728 19168 4602 1 11 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.828 0.029 19168 4603 1 11 . 1 1 60 60 LEU C C 60 178.851 178.851 179.032 -0.181 19168 4604 1 11 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.072 -0.428 19168 4605 1 11 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.331 -1.043 19168 4606 1 11 . 1 1 61 61 GLU N N 61 119.906 119.906 119.718 0.188 19168 4607 1 11 . 1 1 61 61 GLU HA H 61 4.491 4.491 3.969 0.522 19168 4608 1 11 . 1 1 61 61 GLU C C 61 179.519 179.519 178.933 0.586 19168 4609 1 11 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.902 -1.160 19168 4610 1 11 . 1 1 61 61 GLU CB C 61 28.813 28.813 29.254 -0.441 19168 4611 1 11 . 1 1 62 62 LYS N N 62 122.015 122.015 119.944 2.071 19168 4612 1 11 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.071 0.057 19168 4613 1 11 . 1 1 62 62 LYS C C 62 179.843 179.843 179.025 0.818 19168 4614 1 11 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.317 0.020 19168 4615 1 11 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.373 -0.726 19168 4616 1 11 . 1 1 63 63 ILE N N 63 120.882 120.882 119.502 1.380 19168 4617 1 11 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.639 -0.143 19168 4618 1 11 . 1 1 63 63 ILE C C 63 177.761 177.761 177.353 0.408 19168 4619 1 11 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.972 0.210 19168 4620 1 11 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.641 -0.255 19168 4621 1 11 . 1 1 64 64 TRP N N 64 120.279 120.279 122.046 -1.767 19168 4622 1 11 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.086 0.398 19168 4623 1 11 . 1 1 64 64 TRP C C 64 177.056 177.056 177.849 -0.793 19168 4624 1 11 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.584 -1.490 19168 4625 1 11 . 1 1 64 64 TRP CB C 64 29.635 29.635 29.768 -0.133 19168 4626 1 11 . 1 1 65 65 THR N N 65 109.483 109.483 114.215 -4.732 19168 4627 1 11 . 1 1 65 65 THR HA H 65 3.744 3.744 4.086 -0.342 19168 4628 1 11 . 1 1 65 65 THR C C 65 176.224 176.224 175.703 0.521 19168 4629 1 11 . 1 1 65 65 THR CA C 65 65.568 65.568 65.041 0.527 19168 4630 1 11 . 1 1 65 65 THR CB C 65 69.308 69.308 68.561 0.747 19168 4631 1 11 . 1 1 66 66 MET N N 66 117.791 117.791 118.690 -0.899 19168 4632 1 11 . 1 1 66 66 MET HA H 66 4.110 4.110 4.302 -0.192 19168 4633 1 11 . 1 1 66 66 MET C C 66 177.782 177.782 177.987 -0.205 19168 4634 1 11 . 1 1 66 66 MET CA C 66 58.304 58.304 58.602 -0.298 19168 4635 1 11 . 1 1 66 66 MET CB C 66 34.040 34.040 33.657 0.383 19168 4636 1 11 . 1 1 67 67 ILE N N 67 109.871 109.871 116.690 -6.819 19168 4637 1 11 . 1 1 67 67 ILE HA H 67 4.642 4.642 3.979 0.663 19168 4638 1 11 . 1 1 67 67 ILE C C 67 176.713 176.713 176.699 0.014 19168 4639 1 11 . 1 1 67 67 ILE CA C 67 61.174 61.174 63.753 -2.579 19168 4640 1 11 . 1 1 67 67 ILE CB C 67 39.813 39.813 37.435 2.377 19168 4641 1 11 . 1 1 68 68 GLU N N 68 121.972 121.972 120.063 1.909 19168 4642 1 11 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.652 -0.904 19168 4643 1 11 . 1 1 68 68 GLU C C 68 175.855 175.855 177.876 -2.021 19168 4644 1 11 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.361 -0.070 19168 4645 1 11 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.708 0.784 19168 4646 1 11 . 1 1 69 69 ASN N N 69 114.338 114.338 118.168 -3.830 19168 4647 1 11 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.447 0.133 19168 4648 1 11 . 1 1 69 69 ASN C C 69 175.904 175.904 176.977 -1.073 19168 4649 1 11 . 1 1 69 69 ASN CA C 69 54.597 54.597 55.616 -1.019 19168 4650 1 11 . 1 1 69 69 ASN CB C 69 38.323 38.323 38.278 0.045 19168 4651 1 11 . 1 1 70 70 GLU N N 70 116.936 116.936 116.623 0.313 19168 4652 1 11 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.550 -0.002 19168 4653 1 11 . 1 1 70 70 GLU C C 70 174.941 174.941 174.765 0.176 19168 4654 1 11 . 1 1 70 70 GLU CA C 70 55.983 55.983 56.227 -0.244 19168 4655 1 11 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.563 -0.215 19168 4656 1 11 . 1 1 71 71 ALA N N 71 122.966 122.966 121.778 1.188 19168 4657 1 11 . 1 1 71 71 ALA HA H 71 5.246 5.246 4.807 0.439 19168 4658 1 11 . 1 1 71 71 ALA C C 71 173.907 173.907 175.747 -1.840 19168 4659 1 11 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.590 0.228 19168 4660 1 11 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.108 1.952 19168 4661 1 11 . 1 1 72 72 ASN N N 72 115.820 115.820 118.035 -2.215 19168 4662 1 11 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.393 0.048 19168 4663 1 11 . 1 1 72 72 ASN C C 72 174.137 174.137 174.210 -0.073 19168 4664 1 11 . 1 1 72 72 ASN CA C 72 51.659 51.659 52.141 -0.482 19168 4665 1 11 . 1 1 72 72 ASN CB C 72 42.186 42.186 42.110 0.076 19168 4666 1 11 . 1 1 73 73 ARG N N 73 118.340 118.340 122.018 -3.678 19168 4667 1 11 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.905 0.873 19168 4668 1 11 . 1 1 73 73 ARG C C 73 174.674 174.674 175.619 -0.945 19168 4669 1 11 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.706 -1.837 19168 4670 1 11 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.667 2.458 19168 4671 1 11 . 1 1 74 74 ASP N N 74 124.007 124.007 127.364 -3.357 19168 4672 1 11 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.589 -0.047 19168 4673 1 11 . 1 1 74 74 ASP C C 74 175.935 175.935 175.730 0.205 19168 4674 1 11 . 1 1 74 74 ASP CA C 74 55.397 55.397 55.975 -0.578 19168 4675 1 11 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.827 0.394 19168 4676 1 11 . 1 1 75 75 LYS N N 75 116.482 116.482 117.464 -0.982 19168 4677 1 11 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.414 0.031 19168 4678 1 11 . 1 1 75 75 LYS C C 75 175.135 175.135 174.259 0.876 19168 4679 1 11 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.412 -0.627 19168 4680 1 11 . 1 1 75 75 LYS CB C 75 35.475 35.475 35.459 0.016 19168 4681 1 11 . 1 1 76 76 GLU N N 76 120.126 120.126 121.757 -1.631 19168 4682 1 11 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.475 -0.567 19168 4683 1 11 . 1 1 76 76 GLU C C 76 173.204 173.204 175.120 -1.916 19168 4684 1 11 . 1 1 76 76 GLU CA C 76 55.524 55.524 53.989 1.535 19168 4685 1 11 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.192 -1.681 19168 4686 1 11 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.499 0.278 19168 4687 1 11 . 1 1 77 77 PRO C C 77 174.933 174.933 175.838 -0.905 19168 4688 1 11 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.907 0.515 19168 4689 1 11 . 1 1 77 77 PRO CB C 77 32.391 32.391 31.860 0.531 19168 4690 1 11 . 1 1 78 78 ASN N N 78 119.292 119.292 121.769 -2.477 19168 4691 1 11 . 1 1 78 78 ASN HA H 78 5.093 5.093 5.016 0.077 19168 4692 1 11 . 1 1 78 78 ASN C C 78 172.876 172.876 174.078 -1.202 19168 4693 1 11 . 1 1 78 78 ASN CA C 78 51.928 51.928 51.352 0.576 19168 4694 1 11 . 1 1 78 78 ASN CB C 78 42.017 42.017 42.228 -0.211 19168 4695 1 11 . 1 1 79 79 PHE N N 79 125.023 125.023 126.594 -1.571 19168 4696 1 11 . 1 1 79 79 PHE HA H 79 5.423 5.423 4.909 0.514 19168 4697 1 11 . 1 1 79 79 PHE C C 79 174.552 174.552 174.880 -0.328 19168 4698 1 11 . 1 1 79 79 PHE CA C 79 55.210 55.210 58.183 -2.973 19168 4699 1 11 . 1 1 79 79 PHE CB C 79 40.109 40.109 39.639 0.471 19168 4700 1 11 . 1 1 80 80 GLU N N 80 128.920 128.920 127.972 0.948 19168 4701 1 11 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.471 -0.263 19168 4702 1 11 . 1 1 80 80 GLU C C 80 175.538 175.538 176.065 -0.527 19168 4703 1 11 . 1 1 80 80 GLU CA C 80 55.724 55.724 55.000 0.724 19168 4704 1 11 . 1 1 80 80 GLU CB C 80 32.135 32.135 31.899 0.236 19168 4705 1 11 . 1 1 81 81 GLY N N 81 116.695 116.695 114.170 2.525 19168 4706 1 11 . 1 1 81 81 GLY C C 81 173.950 173.950 174.459 -0.509 19168 4707 1 11 . 1 1 81 81 GLY CA C 81 46.967 46.967 46.891 0.076 19168 4708 1 11 . 1 1 82 82 ARG N N 82 124.481 124.481 122.997 1.484 19168 4709 1 11 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.480 0.059 19168 4710 1 11 . 1 1 82 82 ARG C C 82 173.437 173.437 174.588 -1.151 19168 4711 1 11 . 1 1 82 82 ARG CA C 82 55.156 55.156 55.364 -0.208 19168 4712 1 11 . 1 1 82 82 ARG CB C 82 30.255 30.255 32.243 -1.988 19168 4713 1 11 . 1 1 83 83 TYR N N 83 114.539 114.539 117.991 -3.452 19168 4714 1 11 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.562 0.386 19168 4715 1 11 . 1 1 83 83 TYR C C 83 175.909 175.909 174.641 1.268 19168 4716 1 11 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.367 -0.311 19168 4717 1 11 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.463 0.536 19168 4718 1 11 . 1 1 84 84 VAL N N 84 118.812 118.812 121.923 -3.111 19168 4719 1 11 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.792 0.075 19168 4720 1 11 . 1 1 84 84 VAL C C 84 174.982 174.982 174.949 0.033 19168 4721 1 11 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.277 -0.042 19168 4722 1 11 . 1 1 84 84 VAL CB C 84 32.491 32.491 33.252 -0.761 19168 4723 1 11 . 1 1 85 85 ASN N N 85 124.630 124.630 125.967 -1.337 19168 4724 1 11 . 1 1 85 85 ASN HA H 85 6.004 6.004 5.945 0.059 19168 4725 1 11 . 1 1 85 85 ASN C C 85 175.392 175.392 173.660 1.732 19168 4726 1 11 . 1 1 85 85 ASN CA C 85 52.596 52.596 52.002 0.594 19168 4727 1 11 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.760 1.446 19168 4728 1 11 . 1 1 86 86 MET N N 86 118.969 118.969 122.864 -3.895 19168 4729 1 11 . 1 1 86 86 MET HA H 86 4.640 4.640 4.904 -0.264 19168 4730 1 11 . 1 1 86 86 MET C C 86 172.378 172.378 173.447 -1.069 19168 4731 1 11 . 1 1 86 86 MET CA C 86 56.158 56.158 54.608 1.550 19168 4732 1 11 . 1 1 86 86 MET CB C 86 39.138 39.138 36.645 2.493 19168 4733 1 11 . 1 1 87 87 LEU N N 87 131.886 131.886 127.551 4.335 19168 4734 1 11 . 1 1 87 87 LEU HA H 87 5.381 5.381 4.969 0.412 19168 4735 1 11 . 1 1 87 87 LEU C C 87 176.003 176.003 174.849 1.154 19168 4736 1 11 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.175 0.955 19168 4737 1 11 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.273 0.200 19168 4738 1 11 . 1 1 88 88 VAL N N 88 121.165 121.165 121.396 -0.231 19168 4739 1 11 . 1 1 88 88 VAL HA H 88 5.510 5.510 5.004 0.506 19168 4740 1 11 . 1 1 88 88 VAL C C 88 173.666 173.666 174.793 -1.127 19168 4741 1 11 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.799 -1.199 19168 4742 1 11 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.861 -0.068 19168 4743 1 11 . 1 1 89 89 THR N N 89 111.786 111.786 120.282 -8.496 19168 4744 1 11 . 1 1 89 89 THR HA H 89 4.720 4.720 4.885 -0.165 19168 4745 1 11 . 1 1 89 89 THR C C 89 171.898 171.898 172.530 -0.632 19168 4746 1 11 . 1 1 89 89 THR CA C 89 57.985 57.985 59.513 -1.528 19168 4747 1 11 . 1 1 89 89 THR CB C 89 69.113 69.113 70.440 -1.327 19168 4748 1 11 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.564 0.019 19168 4749 1 11 . 1 1 90 90 PRO C C 90 177.403 177.403 176.934 0.469 19168 4750 1 11 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.506 1.025 19168 4751 1 11 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.254 -0.211 19168 4752 1 11 . 1 1 91 91 LYS N N 91 123.696 123.696 122.535 1.161 19168 4753 1 11 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.111 0.000 19168 4754 1 11 . 1 1 91 91 LYS C C 91 176.568 176.568 177.001 -0.433 19168 4755 1 11 . 1 1 91 91 LYS CA C 91 57.208 57.208 57.356 -0.148 19168 4756 1 11 . 1 1 91 91 LYS CB C 91 33.183 33.183 31.128 2.055 19168 4757 1 11 . 1 1 92 92 LYS N N 92 122.054 122.054 125.486 -3.432 19168 4758 1 11 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.103 0.213 19168 4759 1 11 . 1 1 92 92 LYS C C 92 175.956 175.956 175.769 0.187 19168 4760 1 11 . 1 1 92 92 LYS CA C 92 55.942 55.942 56.877 -0.935 19168 4761 1 11 . 1 1 92 92 LYS CB C 92 33.000 33.000 32.644 0.356 19168 4762 1 11 . 1 1 93 93 ALA N N 93 126.278 126.278 120.530 5.748 19168 4763 1 11 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.256 0.085 19168 4764 1 11 . 1 1 93 93 ALA C C 93 177.592 177.592 177.077 0.515 19168 4765 1 11 . 1 1 93 93 ALA CA C 93 52.279 52.279 52.316 -0.037 19168 4766 1 11 . 1 1 93 93 ALA CB C 93 19.332 19.332 18.436 0.896 19168 4767 1 11 . 1 1 94 94 GLU N N 94 120.522 120.522 121.893 -1.371 19168 4768 1 11 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.203 0.081 19168 4769 1 11 . 1 1 94 94 GLU C C 94 177.041 177.041 176.617 0.424 19168 4770 1 11 . 1 1 94 94 GLU CA C 94 56.606 56.606 56.645 -0.039 19168 4771 1 11 . 1 1 94 94 GLU CB C 94 30.353 30.353 29.994 0.359 19168 4772 1 11 . 1 1 95 95 GLY N N 95 109.755 109.755 109.363 0.392 19168 4773 1 11 . 1 1 95 95 GLY C C 95 173.939 173.939 173.886 0.053 19168 4774 1 11 . 1 1 95 95 GLY CA C 95 45.168 45.168 44.892 0.276 19168 4775 1 12 . 1 1 5 5 VAL N N 5 123.289 123.289 120.906 2.383 19168 4776 1 12 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.059 -0.040 19168 4777 1 12 . 1 1 5 5 VAL C C 5 175.799 175.799 176.031 -0.232 19168 4778 1 12 . 1 1 5 5 VAL CA C 5 62.120 62.120 62.887 -0.767 19168 4779 1 12 . 1 1 5 5 VAL CB C 5 32.757 32.757 31.959 0.798 19168 4780 1 12 . 1 1 6 6 ILE N N 6 126.794 126.794 121.256 5.538 19168 4781 1 12 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.130 -0.163 19168 4782 1 12 . 1 1 6 6 ILE C C 6 175.103 175.103 176.203 -1.100 19168 4783 1 12 . 1 1 6 6 ILE CA C 6 60.227 60.227 60.451 -0.224 19168 4784 1 12 . 1 1 6 6 ILE CB C 6 38.565 38.565 38.042 0.523 19168 4785 1 12 . 1 1 7 7 ASP N N 7 127.797 127.797 125.099 2.698 19168 4786 1 12 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.498 0.046 19168 4787 1 12 . 1 1 7 7 ASP C C 7 174.000 174.000 175.234 -1.234 19168 4788 1 12 . 1 1 7 7 ASP CA C 7 53.591 53.591 54.283 -0.692 19168 4789 1 12 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.097 1.055 19168 4790 1 12 . 1 1 8 8 ILE N N 8 122.764 122.764 124.684 -1.920 19168 4791 1 12 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.040 0.280 19168 4792 1 12 . 1 1 8 8 ILE C C 8 176.337 176.337 175.494 0.843 19168 4793 1 12 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.504 -0.328 19168 4794 1 12 . 1 1 8 8 ILE CB C 8 39.542 39.542 39.711 -0.169 19168 4795 1 12 . 1 1 9 9 LYS N N 9 127.990 127.990 126.665 1.325 19168 4796 1 12 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.537 -0.215 19168 4797 1 12 . 1 1 9 9 LYS C C 9 174.759 174.759 175.594 -0.835 19168 4798 1 12 . 1 1 9 9 LYS CA C 9 52.315 52.315 53.244 -0.929 19168 4799 1 12 . 1 1 9 9 LYS CB C 9 32.902 32.902 33.241 -0.339 19168 4800 1 12 . 1 1 10 10 GLU N N 10 123.021 123.021 120.015 3.006 19168 4801 1 12 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.946 0.189 19168 4802 1 12 . 1 1 10 10 GLU C C 10 176.215 176.215 175.297 0.918 19168 4803 1 12 . 1 1 10 10 GLU CA C 10 54.902 54.902 54.588 0.314 19168 4804 1 12 . 1 1 10 10 GLU CB C 10 32.037 32.037 32.239 -0.202 19168 4805 1 12 . 1 1 11 11 ILE N N 11 126.526 126.526 124.657 1.869 19168 4806 1 12 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.307 0.028 19168 4807 1 12 . 1 1 11 11 ILE C C 11 174.334 174.334 174.930 -0.596 19168 4808 1 12 . 1 1 11 11 ILE CA C 11 60.310 60.310 59.200 1.110 19168 4809 1 12 . 1 1 11 11 ILE CB C 11 39.826 39.826 38.921 0.905 19168 4810 1 12 . 1 1 12 12 LYS N N 12 128.164 128.164 128.773 -0.609 19168 4811 1 12 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.321 0.024 19168 4812 1 12 . 1 1 12 12 LYS C C 12 176.378 176.378 175.459 0.919 19168 4813 1 12 . 1 1 12 12 LYS CA C 12 55.940 55.940 55.614 0.326 19168 4814 1 12 . 1 1 12 12 LYS CB C 12 34.056 34.056 34.070 -0.014 19168 4815 1 12 . 1 1 13 13 LEU N N 13 121.881 121.881 125.550 -3.669 19168 4816 1 12 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.883 0.071 19168 4817 1 12 . 1 1 13 13 LEU C C 13 175.137 175.137 174.885 0.252 19168 4818 1 12 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.586 0.388 19168 4819 1 12 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.568 -0.284 19168 4820 1 12 . 1 1 14 14 SER N N 14 115.759 115.759 112.794 2.965 19168 4821 1 12 . 1 1 14 14 SER HA H 14 4.889 4.889 5.179 -0.290 19168 4822 1 12 . 1 1 14 14 SER C C 14 173.993 173.993 174.466 -0.473 19168 4823 1 12 . 1 1 14 14 SER CA C 14 56.052 56.052 56.952 -0.900 19168 4824 1 12 . 1 1 14 14 SER CB C 14 64.775 64.775 66.553 -1.778 19168 4825 1 12 . 1 1 15 15 VAL N N 15 120.993 120.993 120.073 0.920 19168 4826 1 12 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.807 -0.073 19168 4827 1 12 . 1 1 15 15 VAL C C 15 176.964 176.964 176.854 0.110 19168 4828 1 12 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.938 -0.511 19168 4829 1 12 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.956 -0.171 19168 4830 1 12 . 1 1 16 16 LYS N N 16 118.897 118.897 119.910 -1.013 19168 4831 1 12 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.399 0.002 19168 4832 1 12 . 1 1 16 16 LYS C C 16 175.489 175.489 175.247 0.242 19168 4833 1 12 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.549 -0.394 19168 4834 1 12 . 1 1 16 16 LYS CB C 16 30.929 30.929 31.098 -0.169 19168 4835 1 12 . 1 1 17 17 ILE N N 17 122.247 122.247 120.550 1.697 19168 4836 1 12 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.362 -0.177 19168 4837 1 12 . 1 1 17 17 ILE C C 17 173.426 173.426 174.443 -1.017 19168 4838 1 12 . 1 1 17 17 ILE CA C 17 61.276 61.276 60.037 1.239 19168 4839 1 12 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.894 -1.814 19168 4840 1 12 . 1 1 18 18 ALA N N 18 129.434 129.434 129.719 -0.285 19168 4841 1 12 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.401 0.078 19168 4842 1 12 . 1 1 18 18 ALA C C 18 179.130 179.130 177.840 1.290 19168 4843 1 12 . 1 1 18 18 ALA CA C 18 51.437 51.437 52.022 -0.584 19168 4844 1 12 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.085 -0.176 19168 4845 1 12 . 1 1 19 19 GLN HA H 19 3.797 3.797 3.992 -0.195 19168 4846 1 12 . 1 1 19 19 GLN CA C 19 59.231 59.231 59.054 0.177 19168 4847 1 12 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.594 -0.419 19168 4848 1 12 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.520 -0.090 19168 4849 1 12 . 1 1 20 20 ASN C C 20 177.272 177.272 177.404 -0.132 19168 4850 1 12 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.433 -0.249 19168 4851 1 12 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.757 -0.304 19168 4852 1 12 . 1 1 21 21 ASP N N 21 119.132 119.132 119.961 -0.829 19168 4853 1 12 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.539 0.259 19168 4854 1 12 . 1 1 21 21 ASP C C 21 178.707 178.707 178.278 0.429 19168 4855 1 12 . 1 1 21 21 ASP CA C 21 56.886 56.886 56.938 -0.052 19168 4856 1 12 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.678 -0.013 19168 4857 1 12 . 1 1 22 22 ILE N N 22 122.030 122.030 120.106 1.924 19168 4858 1 12 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.615 -0.197 19168 4859 1 12 . 1 1 22 22 ILE C C 22 177.454 177.454 177.929 -0.475 19168 4860 1 12 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.439 1.287 19168 4861 1 12 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.825 -0.259 19168 4862 1 12 . 1 1 23 23 ASN N N 23 116.728 116.728 118.407 -1.679 19168 4863 1 12 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.446 -0.233 19168 4864 1 12 . 1 1 23 23 ASN C C 23 178.260 178.260 177.711 0.549 19168 4865 1 12 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.244 0.030 19168 4866 1 12 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.108 -0.899 19168 4867 1 12 . 1 1 24 24 TYR N N 24 119.864 119.864 121.600 -1.736 19168 4868 1 12 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.232 0.061 19168 4869 1 12 . 1 1 24 24 TYR C C 24 177.719 177.719 177.314 0.405 19168 4870 1 12 . 1 1 24 24 TYR CA C 24 61.048 61.048 61.643 -0.595 19168 4871 1 12 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.813 -0.530 19168 4872 1 12 . 1 1 25 25 LYS N N 25 119.730 119.730 119.218 0.512 19168 4873 1 12 . 1 1 25 25 LYS HA H 25 4.111 4.111 3.936 0.175 19168 4874 1 12 . 1 1 25 25 LYS C C 25 179.152 179.152 179.169 -0.017 19168 4875 1 12 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.005 0.157 19168 4876 1 12 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.243 0.051 19168 4877 1 12 . 1 1 26 26 VAL N N 26 119.387 119.387 115.968 3.419 19168 4878 1 12 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.795 -0.175 19168 4879 1 12 . 1 1 26 26 VAL C C 26 177.017 177.017 177.588 -0.571 19168 4880 1 12 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.521 1.140 19168 4881 1 12 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.214 0.336 19168 4882 1 12 . 1 1 27 27 LYS N N 27 120.420 120.420 119.186 1.234 19168 4883 1 12 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.876 0.070 19168 4884 1 12 . 1 1 27 27 LYS C C 27 179.458 179.458 178.529 0.929 19168 4885 1 12 . 1 1 27 27 LYS CA C 27 59.878 59.878 60.160 -0.282 19168 4886 1 12 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.037 -0.189 19168 4887 1 12 . 1 1 28 28 HIS N N 28 118.160 118.160 119.620 -1.460 19168 4888 1 12 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.587 -0.400 19168 4889 1 12 . 1 1 28 28 HIS C C 28 177.085 177.085 177.359 -0.274 19168 4890 1 12 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.142 -1.257 19168 4891 1 12 . 1 1 28 28 HIS CB C 28 29.756 29.756 30.356 -0.600 19168 4892 1 12 . 1 1 29 29 ALA N N 29 120.579 120.579 121.988 -1.409 19168 4893 1 12 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.153 -0.155 19168 4894 1 12 . 1 1 29 29 ALA C C 29 179.299 179.299 179.773 -0.474 19168 4895 1 12 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.102 0.465 19168 4896 1 12 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.466 0.983 19168 4897 1 12 . 1 1 30 30 LEU N N 30 117.262 117.262 119.042 -1.780 19168 4898 1 12 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.855 0.220 19168 4899 1 12 . 1 1 30 30 LEU C C 30 180.017 180.017 179.105 0.912 19168 4900 1 12 . 1 1 30 30 LEU CA C 30 58.232 58.232 58.087 0.145 19168 4901 1 12 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.557 -0.231 19168 4902 1 12 . 1 1 31 31 GLU N N 31 120.625 120.625 119.600 1.025 19168 4903 1 12 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.864 0.204 19168 4904 1 12 . 1 1 31 31 GLU C C 31 179.572 179.572 179.092 0.480 19168 4905 1 12 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.539 -0.264 19168 4906 1 12 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.073 -0.098 19168 4907 1 12 . 1 1 32 32 PHE N N 32 118.245 118.245 117.226 1.019 19168 4908 1 12 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.242 0.284 19168 4909 1 12 . 1 1 32 32 PHE C C 32 179.123 179.123 177.624 1.499 19168 4910 1 12 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.278 -2.581 19168 4911 1 12 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.793 -1.541 19168 4912 1 12 . 1 1 33 33 LEU N N 33 121.684 121.684 120.457 1.227 19168 4913 1 12 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.290 0.301 19168 4914 1 12 . 1 1 33 33 LEU C C 33 181.655 181.655 179.946 1.709 19168 4915 1 12 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.350 0.822 19168 4916 1 12 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.917 -0.225 19168 4917 1 12 . 1 1 34 34 GLU N N 34 122.046 122.046 118.254 3.792 19168 4918 1 12 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.053 0.099 19168 4919 1 12 . 1 1 34 34 GLU C C 34 178.237 178.237 178.072 0.165 19168 4920 1 12 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.719 0.427 19168 4921 1 12 . 1 1 34 34 GLU CB C 34 29.234 29.234 28.593 0.641 19168 4922 1 12 . 1 1 35 35 GLN N N 35 115.697 115.697 117.531 -1.834 19168 4923 1 12 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.164 0.223 19168 4924 1 12 . 1 1 35 35 GLN C C 35 176.456 176.456 177.347 -0.891 19168 4925 1 12 . 1 1 35 35 GLN CA C 35 55.686 55.686 57.181 -1.495 19168 4926 1 12 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.298 -0.102 19168 4927 1 12 . 1 1 36 36 GLY N N 36 108.291 108.291 104.974 3.317 19168 4928 1 12 . 1 1 36 36 GLY C C 36 174.673 174.673 174.214 0.459 19168 4929 1 12 . 1 1 36 36 GLY CA C 36 45.527 45.527 44.588 0.939 19168 4930 1 12 . 1 1 37 37 LYS N N 37 120.464 120.464 120.007 0.457 19168 4931 1 12 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.644 -0.147 19168 4932 1 12 . 1 1 37 37 LYS C C 37 174.580 174.580 175.776 -1.196 19168 4933 1 12 . 1 1 37 37 LYS CA C 37 55.089 55.089 55.308 -0.219 19168 4934 1 12 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.175 -1.431 19168 4935 1 12 . 1 1 38 38 HIS N N 38 116.878 116.878 118.848 -1.970 19168 4936 1 12 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.902 0.117 19168 4937 1 12 . 1 1 38 38 HIS C C 38 175.268 175.268 174.419 0.849 19168 4938 1 12 . 1 1 38 38 HIS CA C 38 54.150 54.150 56.259 -2.109 19168 4939 1 12 . 1 1 38 38 HIS CB C 38 32.877 32.877 32.430 0.447 19168 4940 1 12 . 1 1 39 39 VAL N N 39 119.782 119.782 121.667 -1.885 19168 4941 1 12 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.752 0.044 19168 4942 1 12 . 1 1 39 39 VAL C C 39 173.320 173.320 174.077 -0.757 19168 4943 1 12 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.929 -0.163 19168 4944 1 12 . 1 1 39 39 VAL CB C 39 35.433 35.433 34.254 1.179 19168 4945 1 12 . 1 1 40 40 ARG N N 40 128.358 128.358 126.861 1.497 19168 4946 1 12 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.822 0.293 19168 4947 1 12 . 1 1 40 40 ARG C C 40 175.659 175.659 174.775 0.884 19168 4948 1 12 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.456 -0.634 19168 4949 1 12 . 1 1 40 40 ARG CB C 40 33.007 33.007 31.822 1.185 19168 4950 1 12 . 1 1 41 41 PHE N N 41 126.396 126.396 127.618 -1.222 19168 4951 1 12 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.333 -0.155 19168 4952 1 12 . 1 1 41 41 PHE C C 41 176.107 176.107 175.126 0.981 19168 4953 1 12 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.483 0.213 19168 4954 1 12 . 1 1 41 41 PHE CB C 41 42.046 42.046 40.027 2.019 19168 4955 1 12 . 1 1 42 42 ARG N N 42 120.641 120.641 124.174 -3.533 19168 4956 1 12 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.074 0.465 19168 4957 1 12 . 1 1 42 42 ARG C C 42 175.010 175.010 174.340 0.670 19168 4958 1 12 . 1 1 42 42 ARG CA C 42 54.695 54.695 55.097 -0.402 19168 4959 1 12 . 1 1 42 42 ARG CB C 42 34.374 34.374 33.135 1.239 19168 4960 1 12 . 1 1 43 43 VAL N N 43 125.565 125.565 124.881 0.684 19168 4961 1 12 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.112 -0.447 19168 4962 1 12 . 1 1 43 43 VAL C C 43 175.325 175.325 173.851 1.474 19168 4963 1 12 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.695 1.121 19168 4964 1 12 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.194 -2.211 19168 4965 1 12 . 1 1 44 44 PHE N N 44 128.291 128.291 130.619 -2.328 19168 4966 1 12 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.651 -0.033 19168 4967 1 12 . 1 1 44 44 PHE C C 44 174.477 174.477 174.144 0.333 19168 4968 1 12 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.946 0.202 19168 4969 1 12 . 1 1 44 44 PHE CB C 44 39.941 39.941 40.866 -0.925 19168 4970 1 12 . 1 1 45 45 LEU N N 45 128.360 128.360 128.380 -0.020 19168 4971 1 12 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.268 0.123 19168 4972 1 12 . 1 1 45 45 LEU C C 45 174.342 174.342 175.163 -0.821 19168 4973 1 12 . 1 1 45 45 LEU CA C 45 53.586 53.586 54.485 -0.899 19168 4974 1 12 . 1 1 45 45 LEU CB C 45 41.113 41.113 42.248 -1.135 19168 4975 1 12 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.303 -0.211 19168 4976 1 12 . 1 1 46 46 LYS CA C 46 55.079 55.079 55.357 -0.278 19168 4977 1 12 . 1 1 46 46 LYS CB C 46 34.295 34.295 34.921 -0.626 19168 4978 1 12 . 1 1 47 47 GLY CA C 47 46.813 46.813 45.434 1.379 19168 4979 1 12 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.063 0.137 19168 4980 1 12 . 1 1 48 48 ARG C C 48 178.069 178.069 178.111 -0.042 19168 4981 1 12 . 1 1 48 48 ARG CA C 48 57.862 57.862 58.450 -0.588 19168 4982 1 12 . 1 1 48 48 ARG CB C 48 29.444 29.444 29.712 -0.268 19168 4983 1 12 . 1 1 49 49 GLU N N 49 119.779 119.779 119.241 0.538 19168 4984 1 12 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.051 0.002 19168 4985 1 12 . 1 1 49 49 GLU C C 49 178.227 178.227 178.789 -0.562 19168 4986 1 12 . 1 1 49 49 GLU CA C 49 57.436 57.436 58.795 -1.359 19168 4987 1 12 . 1 1 49 49 GLU CB C 49 29.745 29.745 28.605 1.140 19168 4988 1 12 . 1 1 50 50 MET N N 50 116.370 116.370 117.889 -1.519 19168 4989 1 12 . 1 1 50 50 MET HA H 50 4.024 4.024 3.985 0.039 19168 4990 1 12 . 1 1 50 50 MET C C 50 175.912 175.912 177.562 -1.650 19168 4991 1 12 . 1 1 50 50 MET CA C 50 56.664 56.664 58.436 -1.772 19168 4992 1 12 . 1 1 50 50 MET CB C 50 32.033 32.033 32.530 -0.497 19168 4993 1 12 . 1 1 51 51 ALA N N 51 118.880 118.880 119.591 -0.711 19168 4994 1 12 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.170 0.174 19168 4995 1 12 . 1 1 51 51 ALA C C 51 177.746 177.746 177.410 0.336 19168 4996 1 12 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.523 -1.132 19168 4997 1 12 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.312 0.131 19168 4998 1 12 . 1 1 52 52 THR N N 52 108.299 108.299 110.334 -2.035 19168 4999 1 12 . 1 1 52 52 THR HA H 52 4.869 4.869 4.631 0.238 19168 5000 1 12 . 1 1 52 52 THR C C 52 173.933 173.933 172.421 1.512 19168 5001 1 12 . 1 1 52 52 THR CA C 52 57.554 57.554 57.972 -0.418 19168 5002 1 12 . 1 1 52 52 THR CB C 52 69.479 69.479 69.866 -0.387 19168 5003 1 12 . 1 1 53 53 PRO HA H 53 3.931 3.931 3.845 0.086 19168 5004 1 12 . 1 1 53 53 PRO C C 53 178.185 178.185 178.142 0.043 19168 5005 1 12 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.295 0.724 19168 5006 1 12 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.377 -0.861 19168 5007 1 12 . 1 1 54 54 GLU N N 54 120.653 120.653 118.057 2.596 19168 5008 1 12 . 1 1 54 54 GLU HA H 54 4.016 4.016 3.967 0.049 19168 5009 1 12 . 1 1 54 54 GLU C C 54 178.608 178.608 178.028 0.580 19168 5010 1 12 . 1 1 54 54 GLU CA C 54 59.472 59.472 59.116 0.356 19168 5011 1 12 . 1 1 54 54 GLU CB C 54 27.419 27.419 28.507 -1.088 19168 5012 1 12 . 1 1 55 55 ALA N N 55 124.380 124.380 121.714 2.666 19168 5013 1 12 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.091 0.232 19168 5014 1 12 . 1 1 55 55 ALA C C 55 181.502 181.502 179.869 1.633 19168 5015 1 12 . 1 1 55 55 ALA CA C 55 54.780 54.780 54.930 -0.150 19168 5016 1 12 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.008 0.393 19168 5017 1 12 . 1 1 56 56 GLY N N 56 105.673 105.673 107.132 -1.459 19168 5018 1 12 . 1 1 56 56 GLY C C 56 174.278 174.278 176.211 -1.933 19168 5019 1 12 . 1 1 56 56 GLY CA C 56 46.879 46.879 46.882 -0.003 19168 5020 1 12 . 1 1 57 57 VAL N N 57 122.685 122.685 123.036 -0.351 19168 5021 1 12 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.582 -0.260 19168 5022 1 12 . 1 1 57 57 VAL C C 57 177.134 177.134 177.690 -0.556 19168 5023 1 12 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.361 1.035 19168 5024 1 12 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.619 0.150 19168 5025 1 12 . 1 1 58 58 ALA N N 58 119.580 119.580 122.516 -2.936 19168 5026 1 12 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.280 -0.186 19168 5027 1 12 . 1 1 58 58 ALA C C 58 180.788 180.788 179.762 1.026 19168 5028 1 12 . 1 1 58 58 ALA CA C 58 55.053 55.053 54.923 0.130 19168 5029 1 12 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.585 -0.732 19168 5030 1 12 . 1 1 59 59 LEU N N 59 119.723 119.723 120.272 -0.549 19168 5031 1 12 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.006 0.252 19168 5032 1 12 . 1 1 59 59 LEU C C 59 178.024 178.024 178.579 -0.555 19168 5033 1 12 . 1 1 59 59 LEU CA C 59 57.710 57.710 58.042 -0.332 19168 5034 1 12 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.080 -0.379 19168 5035 1 12 . 1 1 60 60 LEU N N 60 117.978 117.978 118.773 -0.795 19168 5036 1 12 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.745 0.112 19168 5037 1 12 . 1 1 60 60 LEU C C 60 178.851 178.851 179.065 -0.214 19168 5038 1 12 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.150 -0.506 19168 5039 1 12 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.421 -1.133 19168 5040 1 12 . 1 1 61 61 GLU N N 61 119.906 119.906 119.350 0.556 19168 5041 1 12 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.038 0.453 19168 5042 1 12 . 1 1 61 61 GLU C C 61 179.519 179.519 178.952 0.567 19168 5043 1 12 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.753 -1.011 19168 5044 1 12 . 1 1 61 61 GLU CB C 61 28.813 28.813 29.290 -0.477 19168 5045 1 12 . 1 1 62 62 LYS N N 62 122.015 122.015 121.028 0.987 19168 5046 1 12 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.076 0.052 19168 5047 1 12 . 1 1 62 62 LYS C C 62 179.843 179.843 178.731 1.112 19168 5048 1 12 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.427 -0.090 19168 5049 1 12 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.398 -0.751 19168 5050 1 12 . 1 1 63 63 ILE N N 63 120.882 120.882 119.664 1.218 19168 5051 1 12 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.678 -0.182 19168 5052 1 12 . 1 1 63 63 ILE C C 63 177.761 177.761 177.338 0.423 19168 5053 1 12 . 1 1 63 63 ILE CA C 63 65.182 65.182 65.235 -0.053 19168 5054 1 12 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.884 -0.498 19168 5055 1 12 . 1 1 64 64 TRP N N 64 120.279 120.279 121.525 -1.246 19168 5056 1 12 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.087 0.397 19168 5057 1 12 . 1 1 64 64 TRP C C 64 177.056 177.056 177.747 -0.691 19168 5058 1 12 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.539 -1.446 19168 5059 1 12 . 1 1 64 64 TRP CB C 64 29.635 29.635 29.726 -0.091 19168 5060 1 12 . 1 1 65 65 THR N N 65 109.483 109.483 113.987 -4.504 19168 5061 1 12 . 1 1 65 65 THR HA H 65 3.744 3.744 3.911 -0.167 19168 5062 1 12 . 1 1 65 65 THR C C 65 176.224 176.224 176.090 0.134 19168 5063 1 12 . 1 1 65 65 THR CA C 65 65.568 65.568 65.163 0.405 19168 5064 1 12 . 1 1 65 65 THR CB C 65 69.308 69.308 68.569 0.739 19168 5065 1 12 . 1 1 66 66 MET N N 66 117.791 117.791 117.622 0.169 19168 5066 1 12 . 1 1 66 66 MET HA H 66 4.110 4.110 4.245 -0.135 19168 5067 1 12 . 1 1 66 66 MET C C 66 177.782 177.782 177.927 -0.145 19168 5068 1 12 . 1 1 66 66 MET CA C 66 58.304 58.304 57.871 0.433 19168 5069 1 12 . 1 1 66 66 MET CB C 66 34.040 34.040 32.740 1.300 19168 5070 1 12 . 1 1 67 67 ILE N N 67 109.871 109.871 111.491 -1.620 19168 5071 1 12 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.278 0.364 19168 5072 1 12 . 1 1 67 67 ILE C C 67 176.713 176.713 176.807 -0.094 19168 5073 1 12 . 1 1 67 67 ILE CA C 67 61.174 61.174 61.592 -0.418 19168 5074 1 12 . 1 1 67 67 ILE CB C 67 39.813 39.813 37.778 2.035 19168 5075 1 12 . 1 1 68 68 GLU N N 68 121.972 121.972 121.961 0.011 19168 5076 1 12 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.002 -0.254 19168 5077 1 12 . 1 1 68 68 GLU C C 68 175.855 175.855 177.415 -1.560 19168 5078 1 12 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.702 -0.411 19168 5079 1 12 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.931 0.561 19168 5080 1 12 . 1 1 69 69 ASN N N 69 114.338 114.338 115.515 -1.177 19168 5081 1 12 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.462 0.118 19168 5082 1 12 . 1 1 69 69 ASN C C 69 175.904 175.904 176.094 -0.190 19168 5083 1 12 . 1 1 69 69 ASN CA C 69 54.597 54.597 54.769 -0.172 19168 5084 1 12 . 1 1 69 69 ASN CB C 69 38.323 38.323 38.188 0.136 19168 5085 1 12 . 1 1 70 70 GLU N N 70 116.936 116.936 116.879 0.057 19168 5086 1 12 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.540 0.008 19168 5087 1 12 . 1 1 70 70 GLU C C 70 174.941 174.941 174.385 0.556 19168 5088 1 12 . 1 1 70 70 GLU CA C 70 55.983 55.983 55.819 0.164 19168 5089 1 12 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.886 -0.538 19168 5090 1 12 . 1 1 71 71 ALA N N 71 122.966 122.966 121.418 1.548 19168 5091 1 12 . 1 1 71 71 ALA HA H 71 5.246 5.246 4.811 0.435 19168 5092 1 12 . 1 1 71 71 ALA C C 71 173.907 173.907 175.553 -1.646 19168 5093 1 12 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.527 0.291 19168 5094 1 12 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.434 1.626 19168 5095 1 12 . 1 1 72 72 ASN N N 72 115.820 115.820 119.572 -3.752 19168 5096 1 12 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.351 0.090 19168 5097 1 12 . 1 1 72 72 ASN C C 72 174.137 174.137 174.709 -0.572 19168 5098 1 12 . 1 1 72 72 ASN CA C 72 51.659 51.659 51.999 -0.340 19168 5099 1 12 . 1 1 72 72 ASN CB C 72 42.186 42.186 42.351 -0.165 19168 5100 1 12 . 1 1 73 73 ARG N N 73 118.340 118.340 122.805 -4.465 19168 5101 1 12 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.910 0.868 19168 5102 1 12 . 1 1 73 73 ARG C C 73 174.674 174.674 175.922 -1.248 19168 5103 1 12 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.368 -1.499 19168 5104 1 12 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.887 2.238 19168 5105 1 12 . 1 1 74 74 ASP N N 74 124.007 124.007 127.297 -3.290 19168 5106 1 12 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.523 0.019 19168 5107 1 12 . 1 1 74 74 ASP C C 74 175.935 175.935 176.526 -0.591 19168 5108 1 12 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.556 -1.159 19168 5109 1 12 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.999 0.221 19168 5110 1 12 . 1 1 75 75 LYS N N 75 116.482 116.482 115.818 0.664 19168 5111 1 12 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.440 0.005 19168 5112 1 12 . 1 1 75 75 LYS C C 75 175.135 175.135 174.135 1.000 19168 5113 1 12 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.597 -0.812 19168 5114 1 12 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.617 0.858 19168 5115 1 12 . 1 1 76 76 GLU N N 76 120.126 120.126 121.216 -1.090 19168 5116 1 12 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.283 -0.375 19168 5117 1 12 . 1 1 76 76 GLU C C 76 173.204 173.204 175.290 -2.086 19168 5118 1 12 . 1 1 76 76 GLU CA C 76 55.524 55.524 54.668 0.856 19168 5119 1 12 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.199 -1.688 19168 5120 1 12 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.580 0.197 19168 5121 1 12 . 1 1 77 77 PRO C C 77 174.933 174.933 175.990 -1.057 19168 5122 1 12 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.879 0.543 19168 5123 1 12 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.125 0.266 19168 5124 1 12 . 1 1 78 78 ASN N N 78 119.292 119.292 122.028 -2.736 19168 5125 1 12 . 1 1 78 78 ASN HA H 78 5.093 5.093 5.010 0.083 19168 5126 1 12 . 1 1 78 78 ASN C C 78 172.876 172.876 173.749 -0.873 19168 5127 1 12 . 1 1 78 78 ASN CA C 78 51.928 51.928 52.147 -0.219 19168 5128 1 12 . 1 1 78 78 ASN CB C 78 42.017 42.017 42.470 -0.453 19168 5129 1 12 . 1 1 79 79 PHE N N 79 125.023 125.023 126.034 -1.011 19168 5130 1 12 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.126 0.297 19168 5131 1 12 . 1 1 79 79 PHE C C 79 174.552 174.552 174.841 -0.289 19168 5132 1 12 . 1 1 79 79 PHE CA C 79 55.210 55.210 57.534 -2.324 19168 5133 1 12 . 1 1 79 79 PHE CB C 79 40.109 40.109 39.637 0.472 19168 5134 1 12 . 1 1 80 80 GLU N N 80 128.920 128.920 127.830 1.090 19168 5135 1 12 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.484 -0.276 19168 5136 1 12 . 1 1 80 80 GLU C C 80 175.538 175.538 176.211 -0.673 19168 5137 1 12 . 1 1 80 80 GLU CA C 80 55.724 55.724 55.062 0.662 19168 5138 1 12 . 1 1 80 80 GLU CB C 80 32.135 32.135 31.779 0.356 19168 5139 1 12 . 1 1 81 81 GLY N N 81 116.695 116.695 114.021 2.674 19168 5140 1 12 . 1 1 81 81 GLY C C 81 173.950 173.950 174.302 -0.352 19168 5141 1 12 . 1 1 81 81 GLY CA C 81 46.967 46.967 46.599 0.368 19168 5142 1 12 . 1 1 82 82 ARG N N 82 124.481 124.481 122.821 1.660 19168 5143 1 12 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.460 0.079 19168 5144 1 12 . 1 1 82 82 ARG C C 82 173.437 173.437 174.429 -0.992 19168 5145 1 12 . 1 1 82 82 ARG CA C 82 55.156 55.156 55.150 0.006 19168 5146 1 12 . 1 1 82 82 ARG CB C 82 30.255 30.255 31.951 -1.696 19168 5147 1 12 . 1 1 83 83 TYR N N 83 114.539 114.539 118.175 -3.636 19168 5148 1 12 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.590 0.358 19168 5149 1 12 . 1 1 83 83 TYR C C 83 175.909 175.909 174.815 1.094 19168 5150 1 12 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.260 -0.203 19168 5151 1 12 . 1 1 83 83 TYR CB C 83 42.999 42.999 41.981 1.018 19168 5152 1 12 . 1 1 84 84 VAL N N 84 118.812 118.812 123.268 -4.456 19168 5153 1 12 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.610 0.257 19168 5154 1 12 . 1 1 84 84 VAL C C 84 174.982 174.982 175.366 -0.384 19168 5155 1 12 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.931 -0.696 19168 5156 1 12 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.218 0.273 19168 5157 1 12 . 1 1 85 85 ASN N N 85 124.630 124.630 127.074 -2.444 19168 5158 1 12 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.193 -0.189 19168 5159 1 12 . 1 1 85 85 ASN C C 85 175.392 175.392 173.883 1.509 19168 5160 1 12 . 1 1 85 85 ASN CA C 85 52.596 52.596 52.079 0.517 19168 5161 1 12 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.511 1.695 19168 5162 1 12 . 1 1 86 86 MET N N 86 118.969 118.969 121.807 -2.838 19168 5163 1 12 . 1 1 86 86 MET HA H 86 4.640 4.640 4.888 -0.248 19168 5164 1 12 . 1 1 86 86 MET C C 86 172.378 172.378 173.451 -1.073 19168 5165 1 12 . 1 1 86 86 MET CA C 86 56.158 56.158 55.285 0.873 19168 5166 1 12 . 1 1 86 86 MET CB C 86 39.138 39.138 36.786 2.352 19168 5167 1 12 . 1 1 87 87 LEU N N 87 131.886 131.886 126.220 5.666 19168 5168 1 12 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.460 -0.079 19168 5169 1 12 . 1 1 87 87 LEU C C 87 176.003 176.003 176.040 -0.037 19168 5170 1 12 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.222 0.908 19168 5171 1 12 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.796 -0.323 19168 5172 1 12 . 1 1 88 88 VAL N N 88 121.165 121.165 117.978 3.187 19168 5173 1 12 . 1 1 88 88 VAL HA H 88 5.510 5.510 4.919 0.591 19168 5174 1 12 . 1 1 88 88 VAL C C 88 173.666 173.666 174.809 -1.143 19168 5175 1 12 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.797 -1.197 19168 5176 1 12 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.689 0.104 19168 5177 1 12 . 1 1 89 89 THR N N 89 111.786 111.786 120.708 -8.922 19168 5178 1 12 . 1 1 89 89 THR HA H 89 4.720 4.720 4.428 0.292 19168 5179 1 12 . 1 1 89 89 THR C C 89 171.898 171.898 172.545 -0.647 19168 5180 1 12 . 1 1 89 89 THR CA C 89 57.985 57.985 59.423 -1.438 19168 5181 1 12 . 1 1 89 89 THR CB C 89 69.113 69.113 69.331 -0.218 19168 5182 1 12 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.482 0.101 19168 5183 1 12 . 1 1 90 90 PRO C C 90 177.403 177.403 176.908 0.495 19168 5184 1 12 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.674 0.857 19168 5185 1 12 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.319 -0.276 19168 5186 1 12 . 1 1 91 91 LYS N N 91 123.696 123.696 123.402 0.294 19168 5187 1 12 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.223 -0.112 19168 5188 1 12 . 1 1 91 91 LYS C C 91 176.568 176.568 176.290 0.278 19168 5189 1 12 . 1 1 91 91 LYS CA C 91 57.208 57.208 57.271 -0.063 19168 5190 1 12 . 1 1 91 91 LYS CB C 91 33.183 33.183 31.081 2.102 19168 5191 1 12 . 1 1 92 92 LYS N N 92 122.054 122.054 122.669 -0.615 19168 5192 1 12 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.470 -0.154 19168 5193 1 12 . 1 1 92 92 LYS C C 92 175.956 175.956 175.218 0.738 19168 5194 1 12 . 1 1 92 92 LYS CA C 92 55.942 55.942 55.757 0.185 19168 5195 1 12 . 1 1 92 92 LYS CB C 92 33.000 33.000 34.369 -1.369 19168 5196 1 12 . 1 1 93 93 ALA N N 93 126.278 126.278 124.063 2.215 19168 5197 1 12 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.203 0.138 19168 5198 1 12 . 1 1 93 93 ALA C C 93 177.592 177.592 176.332 1.260 19168 5199 1 12 . 1 1 93 93 ALA CA C 93 52.279 52.279 52.057 0.222 19168 5200 1 12 . 1 1 93 93 ALA CB C 93 19.332 19.332 18.363 0.969 19168 5201 1 12 . 1 1 94 94 GLU N N 94 120.522 120.522 121.458 -0.936 19168 5202 1 12 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.509 -0.225 19168 5203 1 12 . 1 1 94 94 GLU C C 94 177.041 177.041 177.270 -0.229 19168 5204 1 12 . 1 1 94 94 GLU CA C 94 56.606 56.606 56.221 0.385 19168 5205 1 12 . 1 1 94 94 GLU CB C 94 30.353 30.353 29.897 0.456 19168 5206 1 12 . 1 1 95 95 GLY N N 95 109.755 109.755 114.382 -4.627 19168 5207 1 12 . 1 1 95 95 GLY C C 95 173.939 173.939 174.594 -0.655 19168 5208 1 12 . 1 1 95 95 GLY CA C 95 45.168 45.168 45.338 -0.170 19168 5209 1 13 . 1 1 5 5 VAL N N 5 123.289 123.289 122.266 1.023 19168 5210 1 13 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.302 -0.283 19168 5211 1 13 . 1 1 5 5 VAL C C 5 175.799 175.799 175.526 0.273 19168 5212 1 13 . 1 1 5 5 VAL CA C 5 62.120 62.120 62.124 -0.004 19168 5213 1 13 . 1 1 5 5 VAL CB C 5 32.757 32.757 32.230 0.527 19168 5214 1 13 . 1 1 6 6 ILE N N 6 126.794 126.794 128.684 -1.890 19168 5215 1 13 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.218 -0.251 19168 5216 1 13 . 1 1 6 6 ILE C C 6 175.103 175.103 174.671 0.432 19168 5217 1 13 . 1 1 6 6 ILE CA C 6 60.227 60.227 60.614 -0.387 19168 5218 1 13 . 1 1 6 6 ILE CB C 6 38.565 38.565 38.038 0.527 19168 5219 1 13 . 1 1 7 7 ASP N N 7 127.797 127.797 127.516 0.281 19168 5220 1 13 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.626 -0.082 19168 5221 1 13 . 1 1 7 7 ASP C C 7 174.000 174.000 175.256 -1.256 19168 5222 1 13 . 1 1 7 7 ASP CA C 7 53.591 53.591 53.503 0.088 19168 5223 1 13 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.926 0.226 19168 5224 1 13 . 1 1 8 8 ILE N N 8 122.764 122.764 125.915 -3.151 19168 5225 1 13 . 1 1 8 8 ILE HA H 8 4.320 4.320 3.929 0.392 19168 5226 1 13 . 1 1 8 8 ILE C C 8 176.337 176.337 175.730 0.607 19168 5227 1 13 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.972 -0.796 19168 5228 1 13 . 1 1 8 8 ILE CB C 8 39.542 39.542 38.409 1.133 19168 5229 1 13 . 1 1 9 9 LYS N N 9 127.990 127.990 127.863 0.127 19168 5230 1 13 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.284 0.038 19168 5231 1 13 . 1 1 9 9 LYS C C 9 174.759 174.759 175.455 -0.696 19168 5232 1 13 . 1 1 9 9 LYS CA C 9 52.315 52.315 54.337 -2.022 19168 5233 1 13 . 1 1 9 9 LYS CB C 9 32.902 32.902 33.042 -0.140 19168 5234 1 13 . 1 1 10 10 GLU N N 10 123.021 123.021 122.064 0.957 19168 5235 1 13 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.882 0.253 19168 5236 1 13 . 1 1 10 10 GLU C C 10 176.215 176.215 175.779 0.436 19168 5237 1 13 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.135 -0.233 19168 5238 1 13 . 1 1 10 10 GLU CB C 10 32.037 32.037 31.258 0.779 19168 5239 1 13 . 1 1 11 11 ILE N N 11 126.526 126.526 127.308 -0.782 19168 5240 1 13 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.143 0.192 19168 5241 1 13 . 1 1 11 11 ILE C C 11 174.334 174.334 174.789 -0.455 19168 5242 1 13 . 1 1 11 11 ILE CA C 11 60.310 60.310 59.038 1.272 19168 5243 1 13 . 1 1 11 11 ILE CB C 11 39.826 39.826 37.171 2.655 19168 5244 1 13 . 1 1 12 12 LYS N N 12 128.164 128.164 129.216 -1.052 19168 5245 1 13 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.062 0.283 19168 5246 1 13 . 1 1 12 12 LYS C C 12 176.378 176.378 175.520 0.858 19168 5247 1 13 . 1 1 12 12 LYS CA C 12 55.940 55.940 56.212 -0.272 19168 5248 1 13 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.661 0.395 19168 5249 1 13 . 1 1 13 13 LEU N N 13 121.881 121.881 124.942 -3.061 19168 5250 1 13 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.976 -0.022 19168 5251 1 13 . 1 1 13 13 LEU C C 13 175.137 175.137 175.013 0.124 19168 5252 1 13 . 1 1 13 13 LEU CA C 13 53.974 53.974 52.980 0.994 19168 5253 1 13 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.492 -0.207 19168 5254 1 13 . 1 1 14 14 SER N N 14 115.759 115.759 111.852 3.907 19168 5255 1 13 . 1 1 14 14 SER HA H 14 4.889 4.889 4.966 -0.077 19168 5256 1 13 . 1 1 14 14 SER C C 14 173.993 173.993 174.540 -0.547 19168 5257 1 13 . 1 1 14 14 SER CA C 14 56.052 56.052 56.710 -0.658 19168 5258 1 13 . 1 1 14 14 SER CB C 14 64.775 64.775 66.382 -1.607 19168 5259 1 13 . 1 1 15 15 VAL N N 15 120.993 120.993 120.011 0.982 19168 5260 1 13 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.844 -0.110 19168 5261 1 13 . 1 1 15 15 VAL C C 15 176.964 176.964 176.884 0.080 19168 5262 1 13 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.878 -0.451 19168 5263 1 13 . 1 1 15 15 VAL CB C 15 31.785 31.785 32.058 -0.273 19168 5264 1 13 . 1 1 16 16 LYS N N 16 118.897 118.897 120.036 -1.139 19168 5265 1 13 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.359 0.042 19168 5266 1 13 . 1 1 16 16 LYS C C 16 175.489 175.489 175.356 0.133 19168 5267 1 13 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.459 -0.304 19168 5268 1 13 . 1 1 16 16 LYS CB C 16 30.929 30.929 30.771 0.158 19168 5269 1 13 . 1 1 17 17 ILE N N 17 122.247 122.247 119.943 2.304 19168 5270 1 13 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.274 -0.089 19168 5271 1 13 . 1 1 17 17 ILE C C 17 173.426 173.426 174.505 -1.079 19168 5272 1 13 . 1 1 17 17 ILE CA C 17 61.276 61.276 59.646 1.630 19168 5273 1 13 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.409 -1.329 19168 5274 1 13 . 1 1 18 18 ALA N N 18 129.434 129.434 128.043 1.391 19168 5275 1 13 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.604 -0.125 19168 5276 1 13 . 1 1 18 18 ALA C C 18 179.130 179.130 177.941 1.189 19168 5277 1 13 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.226 0.211 19168 5278 1 13 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.564 -0.654 19168 5279 1 13 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.002 -0.205 19168 5280 1 13 . 1 1 19 19 GLN CA C 19 59.231 59.231 58.932 0.299 19168 5281 1 13 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.521 -0.346 19168 5282 1 13 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.507 -0.077 19168 5283 1 13 . 1 1 20 20 ASN C C 20 177.272 177.272 177.150 0.122 19168 5284 1 13 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.730 -0.546 19168 5285 1 13 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.862 -0.409 19168 5286 1 13 . 1 1 21 21 ASP N N 21 119.132 119.132 119.476 -0.344 19168 5287 1 13 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.494 0.304 19168 5288 1 13 . 1 1 21 21 ASP C C 21 178.707 178.707 178.734 -0.027 19168 5289 1 13 . 1 1 21 21 ASP CA C 21 56.886 56.886 58.026 -1.141 19168 5290 1 13 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.636 0.029 19168 5291 1 13 . 1 1 22 22 ILE N N 22 122.030 122.030 120.476 1.554 19168 5292 1 13 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.610 -0.192 19168 5293 1 13 . 1 1 22 22 ILE C C 22 177.454 177.454 177.893 -0.439 19168 5294 1 13 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.678 1.048 19168 5295 1 13 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.764 -0.198 19168 5296 1 13 . 1 1 23 23 ASN N N 23 116.728 116.728 118.669 -1.941 19168 5297 1 13 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.506 -0.293 19168 5298 1 13 . 1 1 23 23 ASN C C 23 178.260 178.260 177.866 0.394 19168 5299 1 13 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.194 0.080 19168 5300 1 13 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.274 -1.066 19168 5301 1 13 . 1 1 24 24 TYR N N 24 119.864 119.864 121.945 -2.081 19168 5302 1 13 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.158 0.135 19168 5303 1 13 . 1 1 24 24 TYR C C 24 177.719 177.719 177.572 0.147 19168 5304 1 13 . 1 1 24 24 TYR CA C 24 61.048 61.048 62.201 -1.153 19168 5305 1 13 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.688 -0.405 19168 5306 1 13 . 1 1 25 25 LYS N N 25 119.730 119.730 119.736 -0.006 19168 5307 1 13 . 1 1 25 25 LYS HA H 25 4.111 4.111 3.923 0.188 19168 5308 1 13 . 1 1 25 25 LYS C C 25 179.152 179.152 179.086 0.066 19168 5309 1 13 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.737 -0.575 19168 5310 1 13 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.681 -0.387 19168 5311 1 13 . 1 1 26 26 VAL N N 26 119.387 119.387 119.969 -0.582 19168 5312 1 13 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.778 -0.158 19168 5313 1 13 . 1 1 26 26 VAL C C 26 177.017 177.017 177.698 -0.681 19168 5314 1 13 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.813 0.848 19168 5315 1 13 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.581 -0.031 19168 5316 1 13 . 1 1 27 27 LYS N N 27 120.420 120.420 119.363 1.057 19168 5317 1 13 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.946 0.000 19168 5318 1 13 . 1 1 27 27 LYS C C 27 179.458 179.458 178.677 0.781 19168 5319 1 13 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.555 0.323 19168 5320 1 13 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.257 -0.409 19168 5321 1 13 . 1 1 28 28 HIS N N 28 118.160 118.160 118.923 -0.763 19168 5322 1 13 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.484 -0.297 19168 5323 1 13 . 1 1 28 28 HIS C C 28 177.085 177.085 177.132 -0.047 19168 5324 1 13 . 1 1 28 28 HIS CA C 28 57.885 57.885 58.377 -0.492 19168 5325 1 13 . 1 1 28 28 HIS CB C 28 29.756 29.756 30.168 -0.412 19168 5326 1 13 . 1 1 29 29 ALA N N 29 120.579 120.579 121.891 -1.312 19168 5327 1 13 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.196 -0.198 19168 5328 1 13 . 1 1 29 29 ALA C C 29 179.299 179.299 179.692 -0.393 19168 5329 1 13 . 1 1 29 29 ALA CA C 29 55.567 55.567 54.973 0.594 19168 5330 1 13 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.269 1.180 19168 5331 1 13 . 1 1 30 30 LEU N N 30 117.262 117.262 117.792 -0.530 19168 5332 1 13 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.940 0.135 19168 5333 1 13 . 1 1 30 30 LEU C C 30 180.017 180.017 178.967 1.050 19168 5334 1 13 . 1 1 30 30 LEU CA C 30 58.232 58.232 57.925 0.306 19168 5335 1 13 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.559 -0.233 19168 5336 1 13 . 1 1 31 31 GLU N N 31 120.625 120.625 119.177 1.448 19168 5337 1 13 . 1 1 31 31 GLU HA H 31 4.068 4.068 4.312 -0.244 19168 5338 1 13 . 1 1 31 31 GLU C C 31 179.572 179.572 179.200 0.372 19168 5339 1 13 . 1 1 31 31 GLU CA C 31 59.275 59.275 58.884 0.391 19168 5340 1 13 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.175 -0.200 19168 5341 1 13 . 1 1 32 32 PHE N N 32 118.245 118.245 117.964 0.281 19168 5342 1 13 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.235 0.291 19168 5343 1 13 . 1 1 32 32 PHE C C 32 179.123 179.123 177.400 1.723 19168 5344 1 13 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.149 -2.452 19168 5345 1 13 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.636 -1.384 19168 5346 1 13 . 1 1 33 33 LEU N N 33 121.684 121.684 120.658 1.026 19168 5347 1 13 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.219 0.372 19168 5348 1 13 . 1 1 33 33 LEU C C 33 181.655 181.655 179.920 1.735 19168 5349 1 13 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.516 0.656 19168 5350 1 13 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.574 0.118 19168 5351 1 13 . 1 1 34 34 GLU N N 34 122.046 122.046 118.485 3.561 19168 5352 1 13 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.014 0.138 19168 5353 1 13 . 1 1 34 34 GLU C C 34 178.237 178.237 178.153 0.084 19168 5354 1 13 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.876 0.270 19168 5355 1 13 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.266 -0.032 19168 5356 1 13 . 1 1 35 35 GLN N N 35 115.697 115.697 115.787 -0.090 19168 5357 1 13 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.311 0.076 19168 5358 1 13 . 1 1 35 35 GLN C C 35 176.456 176.456 176.746 -0.290 19168 5359 1 13 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.822 -0.135 19168 5360 1 13 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.336 -0.140 19168 5361 1 13 . 1 1 36 36 GLY N N 36 108.291 108.291 106.970 1.321 19168 5362 1 13 . 1 1 36 36 GLY C C 36 174.673 174.673 174.285 0.388 19168 5363 1 13 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.284 0.243 19168 5364 1 13 . 1 1 37 37 LYS N N 37 120.464 120.464 119.477 0.987 19168 5365 1 13 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.679 -0.182 19168 5366 1 13 . 1 1 37 37 LYS C C 37 174.580 174.580 176.158 -1.578 19168 5367 1 13 . 1 1 37 37 LYS CA C 37 55.089 55.089 55.050 0.039 19168 5368 1 13 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.252 -1.507 19168 5369 1 13 . 1 1 38 38 HIS N N 38 116.878 116.878 116.444 0.434 19168 5370 1 13 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.874 0.145 19168 5371 1 13 . 1 1 38 38 HIS C C 38 175.268 175.268 174.027 1.241 19168 5372 1 13 . 1 1 38 38 HIS CA C 38 54.150 54.150 54.728 -0.578 19168 5373 1 13 . 1 1 38 38 HIS CB C 38 32.877 32.877 33.340 -0.463 19168 5374 1 13 . 1 1 39 39 VAL N N 39 119.782 119.782 119.817 -0.035 19168 5375 1 13 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.499 0.297 19168 5376 1 13 . 1 1 39 39 VAL C C 39 173.320 173.320 174.126 -0.806 19168 5377 1 13 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.524 0.242 19168 5378 1 13 . 1 1 39 39 VAL CB C 39 35.433 35.433 34.075 1.358 19168 5379 1 13 . 1 1 40 40 ARG N N 40 128.358 128.358 127.457 0.901 19168 5380 1 13 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.820 0.295 19168 5381 1 13 . 1 1 40 40 ARG C C 40 175.659 175.659 175.112 0.547 19168 5382 1 13 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.294 -0.472 19168 5383 1 13 . 1 1 40 40 ARG CB C 40 33.007 33.007 31.973 1.034 19168 5384 1 13 . 1 1 41 41 PHE N N 41 126.396 126.396 127.908 -1.512 19168 5385 1 13 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.038 0.140 19168 5386 1 13 . 1 1 41 41 PHE C C 41 176.107 176.107 175.300 0.807 19168 5387 1 13 . 1 1 41 41 PHE CA C 41 57.696 57.696 58.169 -0.472 19168 5388 1 13 . 1 1 41 41 PHE CB C 41 42.046 42.046 40.003 2.043 19168 5389 1 13 . 1 1 42 42 ARG N N 42 120.641 120.641 124.069 -3.428 19168 5390 1 13 . 1 1 42 42 ARG HA H 42 5.539 5.539 4.846 0.693 19168 5391 1 13 . 1 1 42 42 ARG C C 42 175.010 175.010 174.387 0.623 19168 5392 1 13 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.789 -0.094 19168 5393 1 13 . 1 1 42 42 ARG CB C 42 34.374 34.374 32.033 2.341 19168 5394 1 13 . 1 1 43 43 VAL N N 43 125.565 125.565 124.771 0.794 19168 5395 1 13 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.161 -0.496 19168 5396 1 13 . 1 1 43 43 VAL C C 43 175.325 175.325 173.621 1.704 19168 5397 1 13 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.778 1.038 19168 5398 1 13 . 1 1 43 43 VAL CB C 43 32.983 32.983 34.600 -1.617 19168 5399 1 13 . 1 1 44 44 PHE N N 44 128.291 128.291 129.009 -0.718 19168 5400 1 13 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.588 0.030 19168 5401 1 13 . 1 1 44 44 PHE C C 44 174.477 174.477 173.823 0.654 19168 5402 1 13 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.962 0.186 19168 5403 1 13 . 1 1 44 44 PHE CB C 44 39.941 39.941 42.415 -2.474 19168 5404 1 13 . 1 1 45 45 LEU N N 45 128.360 128.360 127.892 0.468 19168 5405 1 13 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.550 -0.159 19168 5406 1 13 . 1 1 45 45 LEU C C 45 174.342 174.342 175.608 -1.266 19168 5407 1 13 . 1 1 45 45 LEU CA C 45 53.586 53.586 54.270 -0.684 19168 5408 1 13 . 1 1 45 45 LEU CB C 45 41.113 41.113 41.395 -0.282 19168 5409 1 13 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.401 -0.309 19168 5410 1 13 . 1 1 46 46 LYS CA C 46 55.079 55.079 56.667 -1.588 19168 5411 1 13 . 1 1 46 46 LYS CB C 46 34.295 34.295 34.859 -0.564 19168 5412 1 13 . 1 1 47 47 GLY CA C 47 46.813 46.813 44.537 2.276 19168 5413 1 13 . 1 1 48 48 ARG HA H 48 4.200 4.200 3.691 0.509 19168 5414 1 13 . 1 1 48 48 ARG C C 48 178.069 178.069 177.102 0.967 19168 5415 1 13 . 1 1 48 48 ARG CA C 48 57.862 57.862 58.900 -1.038 19168 5416 1 13 . 1 1 48 48 ARG CB C 48 29.444 29.444 29.172 0.272 19168 5417 1 13 . 1 1 49 49 GLU N N 49 119.779 119.779 117.293 2.486 19168 5418 1 13 . 1 1 49 49 GLU HA H 49 4.053 4.053 3.780 0.273 19168 5419 1 13 . 1 1 49 49 GLU C C 49 178.227 178.227 177.832 0.395 19168 5420 1 13 . 1 1 49 49 GLU CA C 49 57.436 57.436 58.715 -1.279 19168 5421 1 13 . 1 1 49 49 GLU CB C 49 29.745 29.745 28.004 1.741 19168 5422 1 13 . 1 1 50 50 MET N N 50 116.370 116.370 119.246 -2.876 19168 5423 1 13 . 1 1 50 50 MET HA H 50 4.024 4.024 4.174 -0.150 19168 5424 1 13 . 1 1 50 50 MET C C 50 175.912 175.912 176.994 -1.082 19168 5425 1 13 . 1 1 50 50 MET CA C 50 56.664 56.664 57.730 -1.066 19168 5426 1 13 . 1 1 50 50 MET CB C 50 32.033 32.033 32.635 -0.602 19168 5427 1 13 . 1 1 51 51 ALA N N 51 118.880 118.880 121.507 -2.627 19168 5428 1 13 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.104 0.240 19168 5429 1 13 . 1 1 51 51 ALA C C 51 177.746 177.746 177.521 0.225 19168 5430 1 13 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.499 -1.108 19168 5431 1 13 . 1 1 51 51 ALA CB C 51 19.443 19.443 18.785 0.658 19168 5432 1 13 . 1 1 52 52 THR N N 52 108.299 108.299 110.258 -1.959 19168 5433 1 13 . 1 1 52 52 THR HA H 52 4.869 4.869 4.657 0.212 19168 5434 1 13 . 1 1 52 52 THR C C 52 173.933 173.933 172.429 1.504 19168 5435 1 13 . 1 1 52 52 THR CA C 52 57.554 57.554 58.131 -0.577 19168 5436 1 13 . 1 1 52 52 THR CB C 52 69.479 69.479 69.660 -0.181 19168 5437 1 13 . 1 1 53 53 PRO HA H 53 3.931 3.931 4.087 -0.156 19168 5438 1 13 . 1 1 53 53 PRO C C 53 178.185 178.185 178.332 -0.147 19168 5439 1 13 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.469 0.550 19168 5440 1 13 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.667 -1.151 19168 5441 1 13 . 1 1 54 54 GLU N N 54 120.653 120.653 117.837 2.816 19168 5442 1 13 . 1 1 54 54 GLU HA H 54 4.016 4.016 3.927 0.089 19168 5443 1 13 . 1 1 54 54 GLU C C 54 178.608 178.608 178.217 0.391 19168 5444 1 13 . 1 1 54 54 GLU CA C 54 59.472 59.472 58.930 0.542 19168 5445 1 13 . 1 1 54 54 GLU CB C 54 27.419 27.419 29.138 -1.719 19168 5446 1 13 . 1 1 55 55 ALA N N 55 124.380 124.380 121.118 3.262 19168 5447 1 13 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.098 0.225 19168 5448 1 13 . 1 1 55 55 ALA C C 55 181.502 181.502 179.756 1.746 19168 5449 1 13 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.114 -0.334 19168 5450 1 13 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.061 0.340 19168 5451 1 13 . 1 1 56 56 GLY N N 56 105.673 105.673 106.724 -1.051 19168 5452 1 13 . 1 1 56 56 GLY C C 56 174.278 174.278 176.229 -1.951 19168 5453 1 13 . 1 1 56 56 GLY CA C 56 46.879 46.879 47.004 -0.125 19168 5454 1 13 . 1 1 57 57 VAL N N 57 122.685 122.685 123.045 -0.360 19168 5455 1 13 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.661 -0.339 19168 5456 1 13 . 1 1 57 57 VAL C C 57 177.134 177.134 177.505 -0.371 19168 5457 1 13 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.357 1.039 19168 5458 1 13 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.421 0.348 19168 5459 1 13 . 1 1 58 58 ALA N N 58 119.580 119.580 122.324 -2.744 19168 5460 1 13 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.054 0.040 19168 5461 1 13 . 1 1 58 58 ALA C C 58 180.788 180.788 179.678 1.110 19168 5462 1 13 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.302 -0.249 19168 5463 1 13 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.182 -0.328 19168 5464 1 13 . 1 1 59 59 LEU N N 59 119.723 119.723 120.290 -0.567 19168 5465 1 13 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.017 0.241 19168 5466 1 13 . 1 1 59 59 LEU C C 59 178.024 178.024 178.652 -0.628 19168 5467 1 13 . 1 1 59 59 LEU CA C 59 57.710 57.710 57.982 -0.272 19168 5468 1 13 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.007 -0.305 19168 5469 1 13 . 1 1 60 60 LEU N N 60 117.978 117.978 118.828 -0.850 19168 5470 1 13 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.796 0.061 19168 5471 1 13 . 1 1 60 60 LEU C C 60 178.851 178.851 179.185 -0.334 19168 5472 1 13 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.031 -0.387 19168 5473 1 13 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.225 -0.937 19168 5474 1 13 . 1 1 61 61 GLU N N 61 119.906 119.906 119.126 0.780 19168 5475 1 13 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.029 0.462 19168 5476 1 13 . 1 1 61 61 GLU C C 61 179.519 179.519 179.059 0.460 19168 5477 1 13 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.496 -0.754 19168 5478 1 13 . 1 1 61 61 GLU CB C 61 28.813 28.813 28.950 -0.137 19168 5479 1 13 . 1 1 62 62 LYS N N 62 122.015 122.015 120.385 1.630 19168 5480 1 13 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.096 0.032 19168 5481 1 13 . 1 1 62 62 LYS C C 62 179.843 179.843 179.130 0.713 19168 5482 1 13 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.306 0.031 19168 5483 1 13 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.308 -0.661 19168 5484 1 13 . 1 1 63 63 ILE N N 63 120.882 120.882 119.619 1.263 19168 5485 1 13 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.731 -0.235 19168 5486 1 13 . 1 1 63 63 ILE C C 63 177.761 177.761 177.250 0.511 19168 5487 1 13 . 1 1 63 63 ILE CA C 63 65.182 65.182 65.053 0.129 19168 5488 1 13 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.928 -0.542 19168 5489 1 13 . 1 1 64 64 TRP N N 64 120.279 120.279 121.668 -1.389 19168 5490 1 13 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.072 0.412 19168 5491 1 13 . 1 1 64 64 TRP C C 64 177.056 177.056 177.953 -0.897 19168 5492 1 13 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.518 -1.424 19168 5493 1 13 . 1 1 64 64 TRP CB C 64 29.635 29.635 29.902 -0.267 19168 5494 1 13 . 1 1 65 65 THR N N 65 109.483 109.483 113.411 -3.928 19168 5495 1 13 . 1 1 65 65 THR HA H 65 3.744 3.744 4.031 -0.287 19168 5496 1 13 . 1 1 65 65 THR C C 65 176.224 176.224 175.893 0.331 19168 5497 1 13 . 1 1 65 65 THR CA C 65 65.568 65.568 64.950 0.618 19168 5498 1 13 . 1 1 65 65 THR CB C 65 69.308 69.308 68.594 0.714 19168 5499 1 13 . 1 1 66 66 MET N N 66 117.791 117.791 117.499 0.292 19168 5500 1 13 . 1 1 66 66 MET HA H 66 4.110 4.110 4.257 -0.147 19168 5501 1 13 . 1 1 66 66 MET C C 66 177.782 177.782 177.656 0.126 19168 5502 1 13 . 1 1 66 66 MET CA C 66 58.304 58.304 58.374 -0.070 19168 5503 1 13 . 1 1 66 66 MET CB C 66 34.040 34.040 33.510 0.530 19168 5504 1 13 . 1 1 67 67 ILE N N 67 109.871 109.871 112.683 -2.812 19168 5505 1 13 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.313 0.329 19168 5506 1 13 . 1 1 67 67 ILE C C 67 176.713 176.713 176.400 0.313 19168 5507 1 13 . 1 1 67 67 ILE CA C 67 61.174 61.174 61.782 -0.608 19168 5508 1 13 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.472 1.341 19168 5509 1 13 . 1 1 68 68 GLU N N 68 121.972 121.972 120.905 1.067 19168 5510 1 13 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.165 -0.417 19168 5511 1 13 . 1 1 68 68 GLU C C 68 175.855 175.855 177.306 -1.451 19168 5512 1 13 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.390 -0.099 19168 5513 1 13 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.960 0.532 19168 5514 1 13 . 1 1 69 69 ASN N N 69 114.338 114.338 115.417 -1.079 19168 5515 1 13 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.351 0.229 19168 5516 1 13 . 1 1 69 69 ASN C C 69 175.904 175.904 176.539 -0.635 19168 5517 1 13 . 1 1 69 69 ASN CA C 69 54.597 54.597 55.020 -0.423 19168 5518 1 13 . 1 1 69 69 ASN CB C 69 38.323 38.323 38.305 0.018 19168 5519 1 13 . 1 1 70 70 GLU N N 70 116.936 116.936 114.337 2.599 19168 5520 1 13 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.495 0.053 19168 5521 1 13 . 1 1 70 70 GLU C C 70 174.941 174.941 175.036 -0.095 19168 5522 1 13 . 1 1 70 70 GLU CA C 70 55.983 55.983 55.677 0.306 19168 5523 1 13 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.004 0.344 19168 5524 1 13 . 1 1 71 71 ALA N N 71 122.966 122.966 122.359 0.607 19168 5525 1 13 . 1 1 71 71 ALA HA H 71 5.246 5.246 4.986 0.260 19168 5526 1 13 . 1 1 71 71 ALA C C 71 173.907 173.907 175.601 -1.694 19168 5527 1 13 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.564 0.254 19168 5528 1 13 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.461 1.599 19168 5529 1 13 . 1 1 72 72 ASN N N 72 115.820 115.820 119.496 -3.676 19168 5530 1 13 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.334 0.107 19168 5531 1 13 . 1 1 72 72 ASN C C 72 174.137 174.137 174.672 -0.535 19168 5532 1 13 . 1 1 72 72 ASN CA C 72 51.659 51.659 52.009 -0.350 19168 5533 1 13 . 1 1 72 72 ASN CB C 72 42.186 42.186 42.316 -0.130 19168 5534 1 13 . 1 1 73 73 ARG N N 73 118.340 118.340 123.385 -5.045 19168 5535 1 13 . 1 1 73 73 ARG HA H 73 4.778 4.778 4.057 0.721 19168 5536 1 13 . 1 1 73 73 ARG C C 73 174.674 174.674 175.269 -0.595 19168 5537 1 13 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.102 -1.233 19168 5538 1 13 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.434 2.691 19168 5539 1 13 . 1 1 74 74 ASP N N 74 124.007 124.007 127.897 -3.890 19168 5540 1 13 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.491 0.051 19168 5541 1 13 . 1 1 74 74 ASP C C 74 175.935 175.935 175.745 0.190 19168 5542 1 13 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.197 -0.800 19168 5543 1 13 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.708 0.512 19168 5544 1 13 . 1 1 75 75 LYS N N 75 116.482 116.482 117.768 -1.286 19168 5545 1 13 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.551 -0.106 19168 5546 1 13 . 1 1 75 75 LYS C C 75 175.135 175.135 174.851 0.284 19168 5547 1 13 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.062 -0.277 19168 5548 1 13 . 1 1 75 75 LYS CB C 75 35.475 35.475 35.546 -0.071 19168 5549 1 13 . 1 1 76 76 GLU N N 76 120.126 120.126 122.710 -2.584 19168 5550 1 13 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.346 -0.438 19168 5551 1 13 . 1 1 76 76 GLU C C 76 173.204 173.204 174.724 -1.520 19168 5552 1 13 . 1 1 76 76 GLU CA C 76 55.524 55.524 53.895 1.629 19168 5553 1 13 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.684 -2.173 19168 5554 1 13 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.651 0.126 19168 5555 1 13 . 1 1 77 77 PRO C C 77 174.933 174.933 175.741 -0.808 19168 5556 1 13 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.847 0.575 19168 5557 1 13 . 1 1 77 77 PRO CB C 77 32.391 32.391 31.756 0.635 19168 5558 1 13 . 1 1 78 78 ASN N N 78 119.292 119.292 123.248 -3.956 19168 5559 1 13 . 1 1 78 78 ASN HA H 78 5.093 5.093 4.964 0.129 19168 5560 1 13 . 1 1 78 78 ASN C C 78 172.876 172.876 173.728 -0.852 19168 5561 1 13 . 1 1 78 78 ASN CA C 78 51.928 51.928 51.838 0.090 19168 5562 1 13 . 1 1 78 78 ASN CB C 78 42.017 42.017 42.532 -0.515 19168 5563 1 13 . 1 1 79 79 PHE N N 79 125.023 125.023 125.559 -0.536 19168 5564 1 13 . 1 1 79 79 PHE HA H 79 5.423 5.423 4.938 0.485 19168 5565 1 13 . 1 1 79 79 PHE C C 79 174.552 174.552 174.857 -0.305 19168 5566 1 13 . 1 1 79 79 PHE CA C 79 55.210 55.210 58.177 -2.967 19168 5567 1 13 . 1 1 79 79 PHE CB C 79 40.109 40.109 39.491 0.618 19168 5568 1 13 . 1 1 80 80 GLU N N 80 128.920 128.920 128.195 0.725 19168 5569 1 13 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.387 -0.179 19168 5570 1 13 . 1 1 80 80 GLU C C 80 175.538 175.538 176.010 -0.472 19168 5571 1 13 . 1 1 80 80 GLU CA C 80 55.724 55.724 55.858 -0.134 19168 5572 1 13 . 1 1 80 80 GLU CB C 80 32.135 32.135 32.385 -0.250 19168 5573 1 13 . 1 1 81 81 GLY N N 81 116.695 116.695 115.564 1.131 19168 5574 1 13 . 1 1 81 81 GLY C C 81 173.950 173.950 174.306 -0.356 19168 5575 1 13 . 1 1 81 81 GLY CA C 81 46.967 46.967 45.719 1.248 19168 5576 1 13 . 1 1 82 82 ARG N N 82 124.481 124.481 111.088 13.393 19168 5577 1 13 . 1 1 82 82 ARG HA H 82 4.539 4.539 3.541 0.998 19168 5578 1 13 . 1 1 82 82 ARG C C 82 173.437 173.437 173.954 -0.517 19168 5579 1 13 . 1 1 82 82 ARG CA C 82 55.156 55.156 57.401 -2.245 19168 5580 1 13 . 1 1 82 82 ARG CB C 82 30.255 30.255 29.159 1.096 19168 5581 1 13 . 1 1 83 83 TYR N N 83 114.539 114.539 115.778 -1.239 19168 5582 1 13 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.251 0.697 19168 5583 1 13 . 1 1 83 83 TYR C C 83 175.909 175.909 175.322 0.587 19168 5584 1 13 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.521 -0.464 19168 5585 1 13 . 1 1 83 83 TYR CB C 83 42.999 42.999 41.788 1.211 19168 5586 1 13 . 1 1 84 84 VAL N N 84 118.812 118.812 123.395 -4.583 19168 5587 1 13 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.640 0.227 19168 5588 1 13 . 1 1 84 84 VAL C C 84 174.982 174.982 175.148 -0.166 19168 5589 1 13 . 1 1 84 84 VAL CA C 84 61.235 61.235 62.136 -0.901 19168 5590 1 13 . 1 1 84 84 VAL CB C 84 32.491 32.491 31.758 0.733 19168 5591 1 13 . 1 1 85 85 ASN N N 85 124.630 124.630 124.718 -0.088 19168 5592 1 13 . 1 1 85 85 ASN HA H 85 6.004 6.004 5.958 0.046 19168 5593 1 13 . 1 1 85 85 ASN C C 85 175.392 175.392 173.774 1.618 19168 5594 1 13 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.030 1.566 19168 5595 1 13 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.321 1.885 19168 5596 1 13 . 1 1 86 86 MET N N 86 118.969 118.969 120.094 -1.125 19168 5597 1 13 . 1 1 86 86 MET HA H 86 4.640 4.640 4.775 -0.135 19168 5598 1 13 . 1 1 86 86 MET C C 86 172.378 172.378 173.407 -1.029 19168 5599 1 13 . 1 1 86 86 MET CA C 86 56.158 56.158 55.024 1.134 19168 5600 1 13 . 1 1 86 86 MET CB C 86 39.138 39.138 37.082 2.056 19168 5601 1 13 . 1 1 87 87 LEU N N 87 131.886 131.886 126.657 5.229 19168 5602 1 13 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.542 -0.161 19168 5603 1 13 . 1 1 87 87 LEU C C 87 176.003 176.003 174.681 1.322 19168 5604 1 13 . 1 1 87 87 LEU CA C 87 54.130 54.130 52.937 1.193 19168 5605 1 13 . 1 1 87 87 LEU CB C 87 44.473 44.473 46.148 -1.675 19168 5606 1 13 . 1 1 88 88 VAL N N 88 121.165 121.165 119.605 1.560 19168 5607 1 13 . 1 1 88 88 VAL HA H 88 5.510 5.510 5.247 0.263 19168 5608 1 13 . 1 1 88 88 VAL C C 88 173.666 173.666 174.691 -1.025 19168 5609 1 13 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.557 -0.957 19168 5610 1 13 . 1 1 88 88 VAL CB C 88 34.793 34.793 36.079 -1.286 19168 5611 1 13 . 1 1 89 89 THR N N 89 111.786 111.786 116.248 -4.462 19168 5612 1 13 . 1 1 89 89 THR HA H 89 4.720 4.720 4.536 0.184 19168 5613 1 13 . 1 1 89 89 THR C C 89 171.898 171.898 172.128 -0.230 19168 5614 1 13 . 1 1 89 89 THR CA C 89 57.985 57.985 59.333 -1.348 19168 5615 1 13 . 1 1 89 89 THR CB C 89 69.113 69.113 70.496 -1.383 19168 5616 1 13 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.509 0.074 19168 5617 1 13 . 1 1 90 90 PRO C C 90 177.403 177.403 176.509 0.894 19168 5618 1 13 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.362 1.169 19168 5619 1 13 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.207 -0.164 19168 5620 1 13 . 1 1 91 91 LYS N N 91 123.696 123.696 124.691 -0.995 19168 5621 1 13 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.154 -0.043 19168 5622 1 13 . 1 1 91 91 LYS C C 91 176.568 176.568 176.637 -0.069 19168 5623 1 13 . 1 1 91 91 LYS CA C 91 57.208 57.208 57.223 -0.015 19168 5624 1 13 . 1 1 91 91 LYS CB C 91 33.183 33.183 32.233 0.949 19168 5625 1 13 . 1 1 92 92 LYS N N 92 122.054 122.054 121.313 0.741 19168 5626 1 13 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.028 0.288 19168 5627 1 13 . 1 1 92 92 LYS C C 92 175.956 175.956 175.643 0.313 19168 5628 1 13 . 1 1 92 92 LYS CA C 92 55.942 55.942 56.497 -0.555 19168 5629 1 13 . 1 1 92 92 LYS CB C 92 33.000 33.000 30.927 2.074 19168 5630 1 13 . 1 1 93 93 ALA N N 93 126.278 126.278 123.553 2.725 19168 5631 1 13 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.204 0.137 19168 5632 1 13 . 1 1 93 93 ALA C C 93 177.592 177.592 178.990 -1.398 19168 5633 1 13 . 1 1 93 93 ALA CA C 93 52.279 52.279 53.152 -0.873 19168 5634 1 13 . 1 1 93 93 ALA CB C 93 19.332 19.332 19.322 0.010 19168 5635 1 13 . 1 1 94 94 GLU N N 94 120.522 120.522 119.712 0.810 19168 5636 1 13 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.206 0.078 19168 5637 1 13 . 1 1 94 94 GLU C C 94 177.041 177.041 176.868 0.173 19168 5638 1 13 . 1 1 94 94 GLU CA C 94 56.606 56.606 56.319 0.287 19168 5639 1 13 . 1 1 94 94 GLU CB C 94 30.353 30.353 29.653 0.700 19168 5640 1 13 . 1 1 95 95 GLY N N 95 109.755 109.755 108.726 1.029 19168 5641 1 13 . 1 1 95 95 GLY C C 95 173.939 173.939 174.512 -0.573 19168 5642 1 13 . 1 1 95 95 GLY CA C 95 45.168 45.168 45.339 -0.171 19168 5643 1 14 . 1 1 5 5 VAL N N 5 123.289 123.289 124.435 -1.146 19168 5644 1 14 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.213 -0.194 19168 5645 1 14 . 1 1 5 5 VAL C C 5 175.799 175.799 175.447 0.352 19168 5646 1 14 . 1 1 5 5 VAL CA C 5 62.120 62.120 61.917 0.203 19168 5647 1 14 . 1 1 5 5 VAL CB C 5 32.757 32.757 31.556 1.201 19168 5648 1 14 . 1 1 6 6 ILE N N 6 126.794 126.794 128.049 -1.255 19168 5649 1 14 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.145 -0.178 19168 5650 1 14 . 1 1 6 6 ILE C C 6 175.103 175.103 175.899 -0.796 19168 5651 1 14 . 1 1 6 6 ILE CA C 6 60.227 60.227 60.032 0.195 19168 5652 1 14 . 1 1 6 6 ILE CB C 6 38.565 38.565 38.310 0.255 19168 5653 1 14 . 1 1 7 7 ASP N N 7 127.797 127.797 127.427 0.370 19168 5654 1 14 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.635 -0.091 19168 5655 1 14 . 1 1 7 7 ASP C C 7 174.000 174.000 174.967 -0.967 19168 5656 1 14 . 1 1 7 7 ASP CA C 7 53.591 53.591 54.001 -0.410 19168 5657 1 14 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.026 1.127 19168 5658 1 14 . 1 1 8 8 ILE N N 8 122.764 122.764 124.877 -2.113 19168 5659 1 14 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.153 0.167 19168 5660 1 14 . 1 1 8 8 ILE C C 8 176.337 176.337 175.454 0.883 19168 5661 1 14 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.079 0.097 19168 5662 1 14 . 1 1 8 8 ILE CB C 8 39.542 39.542 40.733 -1.191 19168 5663 1 14 . 1 1 9 9 LYS N N 9 127.990 127.990 126.473 1.517 19168 5664 1 14 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.247 0.075 19168 5665 1 14 . 1 1 9 9 LYS C C 9 174.759 174.759 175.363 -0.604 19168 5666 1 14 . 1 1 9 9 LYS CA C 9 52.315 52.315 55.398 -3.083 19168 5667 1 14 . 1 1 9 9 LYS CB C 9 32.902 32.902 33.606 -0.704 19168 5668 1 14 . 1 1 10 10 GLU N N 10 123.021 123.021 121.448 1.573 19168 5669 1 14 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.854 0.281 19168 5670 1 14 . 1 1 10 10 GLU C C 10 176.215 176.215 175.470 0.745 19168 5671 1 14 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.309 -0.407 19168 5672 1 14 . 1 1 10 10 GLU CB C 10 32.037 32.037 31.852 0.185 19168 5673 1 14 . 1 1 11 11 ILE N N 11 126.526 126.526 126.692 -0.166 19168 5674 1 14 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.203 0.132 19168 5675 1 14 . 1 1 11 11 ILE C C 11 174.334 174.334 174.548 -0.214 19168 5676 1 14 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.150 0.160 19168 5677 1 14 . 1 1 11 11 ILE CB C 11 39.826 39.826 39.701 0.125 19168 5678 1 14 . 1 1 12 12 LYS N N 12 128.164 128.164 129.624 -1.460 19168 5679 1 14 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.174 0.171 19168 5680 1 14 . 1 1 12 12 LYS C C 12 176.378 176.378 175.466 0.912 19168 5681 1 14 . 1 1 12 12 LYS CA C 12 55.940 55.940 56.162 -0.222 19168 5682 1 14 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.317 0.739 19168 5683 1 14 . 1 1 13 13 LEU N N 13 121.881 121.881 124.664 -2.783 19168 5684 1 14 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.845 0.109 19168 5685 1 14 . 1 1 13 13 LEU C C 13 175.137 175.137 174.892 0.245 19168 5686 1 14 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.468 0.506 19168 5687 1 14 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.595 -0.311 19168 5688 1 14 . 1 1 14 14 SER N N 14 115.759 115.759 112.698 3.061 19168 5689 1 14 . 1 1 14 14 SER HA H 14 4.889 4.889 5.080 -0.191 19168 5690 1 14 . 1 1 14 14 SER C C 14 173.993 173.993 174.964 -0.971 19168 5691 1 14 . 1 1 14 14 SER CA C 14 56.052 56.052 56.926 -0.874 19168 5692 1 14 . 1 1 14 14 SER CB C 14 64.775 64.775 66.406 -1.631 19168 5693 1 14 . 1 1 15 15 VAL N N 15 120.993 120.993 121.310 -0.317 19168 5694 1 14 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.862 -0.128 19168 5695 1 14 . 1 1 15 15 VAL C C 15 176.964 176.964 176.387 0.577 19168 5696 1 14 . 1 1 15 15 VAL CA C 15 65.427 65.427 64.885 0.542 19168 5697 1 14 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.769 0.016 19168 5698 1 14 . 1 1 16 16 LYS N N 16 118.897 118.897 117.830 1.067 19168 5699 1 14 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.352 0.049 19168 5700 1 14 . 1 1 16 16 LYS C C 16 175.489 175.489 175.982 -0.493 19168 5701 1 14 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.276 -0.121 19168 5702 1 14 . 1 1 16 16 LYS CB C 16 30.929 30.929 31.862 -0.933 19168 5703 1 14 . 1 1 17 17 ILE N N 17 122.247 122.247 121.062 1.185 19168 5704 1 14 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.118 0.067 19168 5705 1 14 . 1 1 17 17 ILE C C 17 173.426 173.426 175.363 -1.937 19168 5706 1 14 . 1 1 17 17 ILE CA C 17 61.276 61.276 60.817 0.459 19168 5707 1 14 . 1 1 17 17 ILE CB C 17 39.080 39.080 39.255 -0.175 19168 5708 1 14 . 1 1 18 18 ALA N N 18 129.434 129.434 130.885 -1.451 19168 5709 1 14 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.380 0.099 19168 5710 1 14 . 1 1 18 18 ALA C C 18 179.130 179.130 177.980 1.150 19168 5711 1 14 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.882 -0.445 19168 5712 1 14 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.264 -0.355 19168 5713 1 14 . 1 1 19 19 GLN HA H 19 3.797 3.797 3.966 -0.169 19168 5714 1 14 . 1 1 19 19 GLN CA C 19 59.231 59.231 59.295 -0.064 19168 5715 1 14 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.478 -0.303 19168 5716 1 14 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.490 -0.060 19168 5717 1 14 . 1 1 20 20 ASN C C 20 177.272 177.272 178.219 -0.947 19168 5718 1 14 . 1 1 20 20 ASN CA C 20 56.184 56.184 55.965 0.219 19168 5719 1 14 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.674 -0.221 19168 5720 1 14 . 1 1 21 21 ASP N N 21 119.132 119.132 121.153 -2.021 19168 5721 1 14 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.591 0.207 19168 5722 1 14 . 1 1 21 21 ASP C C 21 178.707 178.707 178.316 0.391 19168 5723 1 14 . 1 1 21 21 ASP CA C 21 56.886 56.886 56.702 0.184 19168 5724 1 14 . 1 1 21 21 ASP CB C 21 40.665 40.665 41.053 -0.388 19168 5725 1 14 . 1 1 22 22 ILE N N 22 122.030 122.030 120.436 1.594 19168 5726 1 14 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.598 -0.180 19168 5727 1 14 . 1 1 22 22 ILE C C 22 177.454 177.454 177.964 -0.510 19168 5728 1 14 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.576 1.150 19168 5729 1 14 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.762 -0.196 19168 5730 1 14 . 1 1 23 23 ASN N N 23 116.728 116.728 118.088 -1.360 19168 5731 1 14 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.496 -0.283 19168 5732 1 14 . 1 1 23 23 ASN C C 23 178.260 178.260 177.658 0.602 19168 5733 1 14 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.464 -0.190 19168 5734 1 14 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.223 -1.015 19168 5735 1 14 . 1 1 24 24 TYR N N 24 119.864 119.864 121.668 -1.804 19168 5736 1 14 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.245 0.048 19168 5737 1 14 . 1 1 24 24 TYR C C 24 177.719 177.719 177.438 0.281 19168 5738 1 14 . 1 1 24 24 TYR CA C 24 61.048 61.048 62.124 -1.076 19168 5739 1 14 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.764 -0.481 19168 5740 1 14 . 1 1 25 25 LYS N N 25 119.730 119.730 118.616 1.114 19168 5741 1 14 . 1 1 25 25 LYS HA H 25 4.111 4.111 4.014 0.097 19168 5742 1 14 . 1 1 25 25 LYS C C 25 179.152 179.152 179.347 -0.195 19168 5743 1 14 . 1 1 25 25 LYS CA C 25 59.162 59.162 58.792 0.370 19168 5744 1 14 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.075 0.219 19168 5745 1 14 . 1 1 26 26 VAL N N 26 119.387 119.387 120.118 -0.731 19168 5746 1 14 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.826 -0.206 19168 5747 1 14 . 1 1 26 26 VAL C C 26 177.017 177.017 177.783 -0.766 19168 5748 1 14 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.992 0.669 19168 5749 1 14 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.439 0.111 19168 5750 1 14 . 1 1 27 27 LYS N N 27 120.420 120.420 120.225 0.195 19168 5751 1 14 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.892 0.054 19168 5752 1 14 . 1 1 27 27 LYS C C 27 179.458 179.458 178.919 0.539 19168 5753 1 14 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.847 0.031 19168 5754 1 14 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.341 -0.493 19168 5755 1 14 . 1 1 28 28 HIS N N 28 118.160 118.160 118.020 0.140 19168 5756 1 14 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.630 -0.443 19168 5757 1 14 . 1 1 28 28 HIS C C 28 177.085 177.085 177.675 -0.590 19168 5758 1 14 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.533 -1.649 19168 5759 1 14 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.577 0.179 19168 5760 1 14 . 1 1 29 29 ALA N N 29 120.579 120.579 122.590 -2.011 19168 5761 1 14 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.242 -0.244 19168 5762 1 14 . 1 1 29 29 ALA C C 29 179.299 179.299 179.786 -0.487 19168 5763 1 14 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.286 0.281 19168 5764 1 14 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.235 1.214 19168 5765 1 14 . 1 1 30 30 LEU N N 30 117.262 117.262 118.494 -1.232 19168 5766 1 14 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.926 0.149 19168 5767 1 14 . 1 1 30 30 LEU C C 30 180.017 180.017 179.177 0.840 19168 5768 1 14 . 1 1 30 30 LEU CA C 30 58.232 58.232 58.105 0.126 19168 5769 1 14 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.615 -0.290 19168 5770 1 14 . 1 1 31 31 GLU N N 31 120.625 120.625 119.609 1.016 19168 5771 1 14 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.900 0.168 19168 5772 1 14 . 1 1 31 31 GLU C C 31 179.572 179.572 179.351 0.221 19168 5773 1 14 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.278 -0.003 19168 5774 1 14 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.187 -0.212 19168 5775 1 14 . 1 1 32 32 PHE N N 32 118.245 118.245 118.670 -0.425 19168 5776 1 14 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.248 0.278 19168 5777 1 14 . 1 1 32 32 PHE C C 32 179.123 179.123 177.756 1.367 19168 5778 1 14 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.836 -3.139 19168 5779 1 14 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.867 -1.615 19168 5780 1 14 . 1 1 33 33 LEU N N 33 121.684 121.684 120.585 1.099 19168 5781 1 14 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.296 0.295 19168 5782 1 14 . 1 1 33 33 LEU C C 33 181.655 181.655 179.972 1.683 19168 5783 1 14 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.540 0.632 19168 5784 1 14 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.736 -0.044 19168 5785 1 14 . 1 1 34 34 GLU N N 34 122.046 122.046 118.853 3.193 19168 5786 1 14 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.034 0.118 19168 5787 1 14 . 1 1 34 34 GLU C C 34 178.237 178.237 178.525 -0.288 19168 5788 1 14 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.982 0.164 19168 5789 1 14 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.295 -0.061 19168 5790 1 14 . 1 1 35 35 GLN N N 35 115.697 115.697 115.646 0.051 19168 5791 1 14 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.195 0.192 19168 5792 1 14 . 1 1 35 35 GLN C C 35 176.456 176.456 176.621 -0.165 19168 5793 1 14 . 1 1 35 35 GLN CA C 35 55.686 55.686 56.333 -0.647 19168 5794 1 14 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.267 -0.071 19168 5795 1 14 . 1 1 36 36 GLY N N 36 108.291 108.291 105.620 2.671 19168 5796 1 14 . 1 1 36 36 GLY C C 36 174.673 174.673 174.109 0.564 19168 5797 1 14 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.175 0.352 19168 5798 1 14 . 1 1 37 37 LYS N N 37 120.464 120.464 119.057 1.407 19168 5799 1 14 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.690 -0.193 19168 5800 1 14 . 1 1 37 37 LYS C C 37 174.580 174.580 175.313 -0.733 19168 5801 1 14 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.033 1.056 19168 5802 1 14 . 1 1 37 37 LYS CB C 37 32.745 32.745 36.504 -3.759 19168 5803 1 14 . 1 1 38 38 HIS N N 38 116.878 116.878 119.016 -2.138 19168 5804 1 14 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.852 0.167 19168 5805 1 14 . 1 1 38 38 HIS C C 38 175.268 175.268 174.473 0.795 19168 5806 1 14 . 1 1 38 38 HIS CA C 38 54.150 54.150 54.844 -0.694 19168 5807 1 14 . 1 1 38 38 HIS CB C 38 32.877 32.877 31.837 1.040 19168 5808 1 14 . 1 1 39 39 VAL N N 39 119.782 119.782 123.400 -3.618 19168 5809 1 14 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.203 0.593 19168 5810 1 14 . 1 1 39 39 VAL C C 39 173.320 173.320 174.360 -1.040 19168 5811 1 14 . 1 1 39 39 VAL CA C 39 60.766 60.766 61.287 -0.521 19168 5812 1 14 . 1 1 39 39 VAL CB C 39 35.433 35.433 32.648 2.785 19168 5813 1 14 . 1 1 40 40 ARG N N 40 128.358 128.358 128.016 0.342 19168 5814 1 14 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.605 0.510 19168 5815 1 14 . 1 1 40 40 ARG C C 40 175.659 175.659 175.068 0.591 19168 5816 1 14 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.431 -0.609 19168 5817 1 14 . 1 1 40 40 ARG CB C 40 33.007 33.007 31.615 1.392 19168 5818 1 14 . 1 1 41 41 PHE N N 41 126.396 126.396 127.598 -1.202 19168 5819 1 14 . 1 1 41 41 PHE HA H 41 5.178 5.178 4.957 0.221 19168 5820 1 14 . 1 1 41 41 PHE C C 41 176.107 176.107 175.242 0.865 19168 5821 1 14 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.926 -0.230 19168 5822 1 14 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.013 3.034 19168 5823 1 14 . 1 1 42 42 ARG N N 42 120.641 120.641 125.156 -4.515 19168 5824 1 14 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.556 -0.017 19168 5825 1 14 . 1 1 42 42 ARG C C 42 175.010 175.010 175.200 -0.190 19168 5826 1 14 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.927 -0.232 19168 5827 1 14 . 1 1 42 42 ARG CB C 42 34.374 34.374 31.627 2.747 19168 5828 1 14 . 1 1 43 43 VAL N N 43 125.565 125.565 125.644 -0.079 19168 5829 1 14 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.000 -0.335 19168 5830 1 14 . 1 1 43 43 VAL C C 43 175.325 175.325 173.936 1.389 19168 5831 1 14 . 1 1 43 43 VAL CA C 43 60.816 60.816 60.396 0.420 19168 5832 1 14 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.081 -2.098 19168 5833 1 14 . 1 1 44 44 PHE N N 44 128.291 128.291 129.020 -0.729 19168 5834 1 14 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.591 0.027 19168 5835 1 14 . 1 1 44 44 PHE C C 44 174.477 174.477 174.982 -0.505 19168 5836 1 14 . 1 1 44 44 PHE CA C 44 56.148 56.148 56.291 -0.143 19168 5837 1 14 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.027 -1.086 19168 5838 1 14 . 1 1 45 45 LEU N N 45 128.360 128.360 128.787 -0.427 19168 5839 1 14 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.009 0.382 19168 5840 1 14 . 1 1 45 45 LEU C C 45 174.342 174.342 176.097 -1.755 19168 5841 1 14 . 1 1 45 45 LEU CA C 45 53.586 53.586 56.797 -3.211 19168 5842 1 14 . 1 1 45 45 LEU CB C 45 41.113 41.113 42.290 -1.177 19168 5843 1 14 . 1 1 46 46 LYS HA H 46 4.092 4.092 3.676 0.416 19168 5844 1 14 . 1 1 46 46 LYS CA C 46 55.079 55.079 56.481 -1.402 19168 5845 1 14 . 1 1 46 46 LYS CB C 46 34.295 34.295 32.081 2.214 19168 5846 1 14 . 1 1 47 47 GLY CA C 47 46.813 46.813 45.148 1.665 19168 5847 1 14 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.160 0.040 19168 5848 1 14 . 1 1 48 48 ARG C C 48 178.069 178.069 178.188 -0.119 19168 5849 1 14 . 1 1 48 48 ARG CA C 48 57.862 57.862 57.437 0.425 19168 5850 1 14 . 1 1 48 48 ARG CB C 48 29.444 29.444 29.781 -0.337 19168 5851 1 14 . 1 1 49 49 GLU N N 49 119.779 119.779 120.757 -0.978 19168 5852 1 14 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.075 -0.022 19168 5853 1 14 . 1 1 49 49 GLU C C 49 178.227 178.227 178.207 0.020 19168 5854 1 14 . 1 1 49 49 GLU CA C 49 57.436 57.436 58.701 -1.265 19168 5855 1 14 . 1 1 49 49 GLU CB C 49 29.745 29.745 28.980 0.765 19168 5856 1 14 . 1 1 50 50 MET N N 50 116.370 116.370 116.470 -0.100 19168 5857 1 14 . 1 1 50 50 MET HA H 50 4.024 4.024 4.118 -0.094 19168 5858 1 14 . 1 1 50 50 MET C C 50 175.912 175.912 177.082 -1.170 19168 5859 1 14 . 1 1 50 50 MET CA C 50 56.664 56.664 57.439 -0.775 19168 5860 1 14 . 1 1 50 50 MET CB C 50 32.033 32.033 32.532 -0.499 19168 5861 1 14 . 1 1 51 51 ALA N N 51 118.880 118.880 119.239 -0.359 19168 5862 1 14 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.293 0.051 19168 5863 1 14 . 1 1 51 51 ALA C C 51 177.746 177.746 177.520 0.226 19168 5864 1 14 . 1 1 51 51 ALA CA C 51 52.391 52.391 52.763 -0.372 19168 5865 1 14 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.651 -0.208 19168 5866 1 14 . 1 1 52 52 THR N N 52 108.299 108.299 111.432 -3.133 19168 5867 1 14 . 1 1 52 52 THR HA H 52 4.869 4.869 4.630 0.239 19168 5868 1 14 . 1 1 52 52 THR C C 52 173.933 173.933 172.678 1.255 19168 5869 1 14 . 1 1 52 52 THR CA C 52 57.554 57.554 58.768 -1.214 19168 5870 1 14 . 1 1 52 52 THR CB C 52 69.479 69.479 70.158 -0.679 19168 5871 1 14 . 1 1 53 53 PRO HA H 53 3.931 3.931 4.143 -0.212 19168 5872 1 14 . 1 1 53 53 PRO C C 53 178.185 178.185 178.376 -0.191 19168 5873 1 14 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.057 0.962 19168 5874 1 14 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.798 -1.282 19168 5875 1 14 . 1 1 54 54 GLU N N 54 120.653 120.653 118.921 1.732 19168 5876 1 14 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.024 -0.008 19168 5877 1 14 . 1 1 54 54 GLU C C 54 178.608 178.608 178.337 0.271 19168 5878 1 14 . 1 1 54 54 GLU CA C 54 59.472 59.472 59.423 0.049 19168 5879 1 14 . 1 1 54 54 GLU CB C 54 27.419 27.419 28.968 -1.549 19168 5880 1 14 . 1 1 55 55 ALA N N 55 124.380 124.380 121.387 2.993 19168 5881 1 14 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.106 0.217 19168 5882 1 14 . 1 1 55 55 ALA C C 55 181.502 181.502 179.749 1.753 19168 5883 1 14 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.053 -0.273 19168 5884 1 14 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.111 0.290 19168 5885 1 14 . 1 1 56 56 GLY N N 56 105.673 105.673 107.077 -1.404 19168 5886 1 14 . 1 1 56 56 GLY C C 56 174.278 174.278 176.361 -2.083 19168 5887 1 14 . 1 1 56 56 GLY CA C 56 46.879 46.879 47.056 -0.177 19168 5888 1 14 . 1 1 57 57 VAL N N 57 122.685 122.685 122.897 -0.212 19168 5889 1 14 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.663 -0.341 19168 5890 1 14 . 1 1 57 57 VAL C C 57 177.134 177.134 177.952 -0.818 19168 5891 1 14 . 1 1 57 57 VAL CA C 57 67.396 67.396 65.776 1.620 19168 5892 1 14 . 1 1 57 57 VAL CB C 57 31.769 31.769 30.971 0.798 19168 5893 1 14 . 1 1 58 58 ALA N N 58 119.580 119.580 123.039 -3.459 19168 5894 1 14 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.329 -0.235 19168 5895 1 14 . 1 1 58 58 ALA C C 58 180.788 180.788 180.018 0.770 19168 5896 1 14 . 1 1 58 58 ALA CA C 58 55.053 55.053 54.983 0.070 19168 5897 1 14 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.512 -0.657 19168 5898 1 14 . 1 1 59 59 LEU N N 59 119.723 119.723 119.697 0.026 19168 5899 1 14 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.065 0.193 19168 5900 1 14 . 1 1 59 59 LEU C C 59 178.024 178.024 178.588 -0.564 19168 5901 1 14 . 1 1 59 59 LEU CA C 59 57.710 57.710 57.825 -0.115 19168 5902 1 14 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.026 -0.325 19168 5903 1 14 . 1 1 60 60 LEU N N 60 117.978 117.978 118.883 -0.905 19168 5904 1 14 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.760 0.097 19168 5905 1 14 . 1 1 60 60 LEU C C 60 178.851 178.851 179.073 -0.222 19168 5906 1 14 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.156 -0.512 19168 5907 1 14 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.338 -1.050 19168 5908 1 14 . 1 1 61 61 GLU N N 61 119.906 119.906 119.668 0.238 19168 5909 1 14 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.014 0.477 19168 5910 1 14 . 1 1 61 61 GLU C C 61 179.519 179.519 178.926 0.593 19168 5911 1 14 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.948 -1.206 19168 5912 1 14 . 1 1 61 61 GLU CB C 61 28.813 28.813 29.266 -0.453 19168 5913 1 14 . 1 1 62 62 LYS N N 62 122.015 122.015 120.296 1.719 19168 5914 1 14 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.079 0.049 19168 5915 1 14 . 1 1 62 62 LYS C C 62 179.843 179.843 179.147 0.696 19168 5916 1 14 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.383 -0.046 19168 5917 1 14 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.438 -0.791 19168 5918 1 14 . 1 1 63 63 ILE N N 63 120.882 120.882 119.272 1.610 19168 5919 1 14 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.739 -0.243 19168 5920 1 14 . 1 1 63 63 ILE C C 63 177.761 177.761 177.382 0.379 19168 5921 1 14 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.792 0.390 19168 5922 1 14 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.934 -0.548 19168 5923 1 14 . 1 1 64 64 TRP N N 64 120.279 120.279 121.859 -1.580 19168 5924 1 14 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.073 0.411 19168 5925 1 14 . 1 1 64 64 TRP C C 64 177.056 177.056 177.868 -0.812 19168 5926 1 14 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.419 -1.325 19168 5927 1 14 . 1 1 64 64 TRP CB C 64 29.635 29.635 29.863 -0.228 19168 5928 1 14 . 1 1 65 65 THR N N 65 109.483 109.483 114.014 -4.531 19168 5929 1 14 . 1 1 65 65 THR HA H 65 3.744 3.744 3.671 0.073 19168 5930 1 14 . 1 1 65 65 THR C C 65 176.224 176.224 175.727 0.497 19168 5931 1 14 . 1 1 65 65 THR CA C 65 65.568 65.568 64.882 0.686 19168 5932 1 14 . 1 1 65 65 THR CB C 65 69.308 69.308 68.612 0.696 19168 5933 1 14 . 1 1 66 66 MET N N 66 117.791 117.791 118.414 -0.623 19168 5934 1 14 . 1 1 66 66 MET HA H 66 4.110 4.110 4.361 -0.251 19168 5935 1 14 . 1 1 66 66 MET C C 66 177.782 177.782 177.713 0.069 19168 5936 1 14 . 1 1 66 66 MET CA C 66 58.304 58.304 58.418 -0.114 19168 5937 1 14 . 1 1 66 66 MET CB C 66 34.040 34.040 33.917 0.123 19168 5938 1 14 . 1 1 67 67 ILE N N 67 109.871 109.871 114.085 -4.214 19168 5939 1 14 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.496 0.146 19168 5940 1 14 . 1 1 67 67 ILE C C 67 176.713 176.713 176.228 0.485 19168 5941 1 14 . 1 1 67 67 ILE CA C 67 61.174 61.174 61.752 -0.578 19168 5942 1 14 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.622 1.191 19168 5943 1 14 . 1 1 68 68 GLU N N 68 121.972 121.972 121.260 0.712 19168 5944 1 14 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.639 -0.891 19168 5945 1 14 . 1 1 68 68 GLU C C 68 175.855 175.855 177.281 -1.426 19168 5946 1 14 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.043 0.248 19168 5947 1 14 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.567 0.926 19168 5948 1 14 . 1 1 69 69 ASN N N 69 114.338 114.338 114.812 -0.474 19168 5949 1 14 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.491 0.089 19168 5950 1 14 . 1 1 69 69 ASN C C 69 175.904 175.904 176.949 -1.045 19168 5951 1 14 . 1 1 69 69 ASN CA C 69 54.597 54.597 54.987 -0.390 19168 5952 1 14 . 1 1 69 69 ASN CB C 69 38.323 38.323 37.944 0.379 19168 5953 1 14 . 1 1 70 70 GLU N N 70 116.936 116.936 118.497 -1.561 19168 5954 1 14 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.599 -0.051 19168 5955 1 14 . 1 1 70 70 GLU C C 70 174.941 174.941 175.083 -0.142 19168 5956 1 14 . 1 1 70 70 GLU CA C 70 55.983 55.983 56.246 -0.263 19168 5957 1 14 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.692 -0.344 19168 5958 1 14 . 1 1 71 71 ALA N N 71 122.966 122.966 121.555 1.411 19168 5959 1 14 . 1 1 71 71 ALA HA H 71 5.246 5.246 5.153 0.093 19168 5960 1 14 . 1 1 71 71 ALA C C 71 173.907 173.907 175.413 -1.506 19168 5961 1 14 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.416 0.402 19168 5962 1 14 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.270 1.790 19168 5963 1 14 . 1 1 72 72 ASN N N 72 115.820 115.820 118.919 -3.099 19168 5964 1 14 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.380 0.061 19168 5965 1 14 . 1 1 72 72 ASN C C 72 174.137 174.137 174.926 -0.789 19168 5966 1 14 . 1 1 72 72 ASN CA C 72 51.659 51.659 51.968 -0.309 19168 5967 1 14 . 1 1 72 72 ASN CB C 72 42.186 42.186 41.352 0.834 19168 5968 1 14 . 1 1 73 73 ARG N N 73 118.340 118.340 123.454 -5.114 19168 5969 1 14 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.896 0.882 19168 5970 1 14 . 1 1 73 73 ARG C C 73 174.674 174.674 175.675 -1.001 19168 5971 1 14 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.690 -1.821 19168 5972 1 14 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.937 2.188 19168 5973 1 14 . 1 1 74 74 ASP N N 74 124.007 124.007 127.148 -3.141 19168 5974 1 14 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.582 -0.040 19168 5975 1 14 . 1 1 74 74 ASP C C 74 175.935 175.935 176.590 -0.655 19168 5976 1 14 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.331 -0.934 19168 5977 1 14 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.953 0.268 19168 5978 1 14 . 1 1 75 75 LYS N N 75 116.482 116.482 116.417 0.065 19168 5979 1 14 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.473 -0.028 19168 5980 1 14 . 1 1 75 75 LYS C C 75 175.135 175.135 174.104 1.031 19168 5981 1 14 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.523 -0.738 19168 5982 1 14 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.767 0.709 19168 5983 1 14 . 1 1 76 76 GLU N N 76 120.126 120.126 121.942 -1.816 19168 5984 1 14 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.254 -0.346 19168 5985 1 14 . 1 1 76 76 GLU C C 76 173.204 173.204 175.424 -2.220 19168 5986 1 14 . 1 1 76 76 GLU CA C 76 55.524 55.524 54.634 0.890 19168 5987 1 14 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.154 -1.643 19168 5988 1 14 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.431 0.346 19168 5989 1 14 . 1 1 77 77 PRO C C 77 174.933 174.933 175.844 -0.911 19168 5990 1 14 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.964 0.458 19168 5991 1 14 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.048 0.343 19168 5992 1 14 . 1 1 78 78 ASN N N 78 119.292 119.292 121.795 -2.503 19168 5993 1 14 . 1 1 78 78 ASN HA H 78 5.093 5.093 5.006 0.087 19168 5994 1 14 . 1 1 78 78 ASN C C 78 172.876 172.876 173.739 -0.863 19168 5995 1 14 . 1 1 78 78 ASN CA C 78 51.928 51.928 51.915 0.013 19168 5996 1 14 . 1 1 78 78 ASN CB C 78 42.017 42.017 42.561 -0.544 19168 5997 1 14 . 1 1 79 79 PHE N N 79 125.023 125.023 124.125 0.898 19168 5998 1 14 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.178 0.245 19168 5999 1 14 . 1 1 79 79 PHE C C 79 174.552 174.552 174.773 -0.221 19168 6000 1 14 . 1 1 79 79 PHE CA C 79 55.210 55.210 56.963 -1.753 19168 6001 1 14 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.137 -0.028 19168 6002 1 14 . 1 1 80 80 GLU N N 80 128.920 128.920 126.473 2.447 19168 6003 1 14 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.502 -0.294 19168 6004 1 14 . 1 1 80 80 GLU C C 80 175.538 175.538 175.864 -0.326 19168 6005 1 14 . 1 1 80 80 GLU CA C 80 55.724 55.724 54.853 0.871 19168 6006 1 14 . 1 1 80 80 GLU CB C 80 32.135 32.135 32.647 -0.512 19168 6007 1 14 . 1 1 81 81 GLY N N 81 116.695 116.695 112.716 3.979 19168 6008 1 14 . 1 1 81 81 GLY C C 81 173.950 173.950 174.571 -0.621 19168 6009 1 14 . 1 1 81 81 GLY CA C 81 46.967 46.967 46.982 -0.015 19168 6010 1 14 . 1 1 82 82 ARG N N 82 124.481 124.481 122.965 1.516 19168 6011 1 14 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.528 0.011 19168 6012 1 14 . 1 1 82 82 ARG C C 82 173.437 173.437 174.638 -1.201 19168 6013 1 14 . 1 1 82 82 ARG CA C 82 55.156 55.156 55.327 -0.171 19168 6014 1 14 . 1 1 82 82 ARG CB C 82 30.255 30.255 31.997 -1.742 19168 6015 1 14 . 1 1 83 83 TYR N N 83 114.539 114.539 118.491 -3.952 19168 6016 1 14 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.413 0.535 19168 6017 1 14 . 1 1 83 83 TYR C C 83 175.909 175.909 174.346 1.563 19168 6018 1 14 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.682 -0.625 19168 6019 1 14 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.828 0.171 19168 6020 1 14 . 1 1 84 84 VAL N N 84 118.812 118.812 122.287 -3.475 19168 6021 1 14 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.582 0.285 19168 6022 1 14 . 1 1 84 84 VAL C C 84 174.982 174.982 175.184 -0.202 19168 6023 1 14 . 1 1 84 84 VAL CA C 84 61.235 61.235 62.042 -0.807 19168 6024 1 14 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.014 0.477 19168 6025 1 14 . 1 1 85 85 ASN N N 85 124.630 124.630 126.253 -1.623 19168 6026 1 14 . 1 1 85 85 ASN HA H 85 6.004 6.004 5.986 0.018 19168 6027 1 14 . 1 1 85 85 ASN C C 85 175.392 175.392 173.894 1.498 19168 6028 1 14 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.613 0.983 19168 6029 1 14 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.215 1.991 19168 6030 1 14 . 1 1 86 86 MET N N 86 118.969 118.969 122.850 -3.881 19168 6031 1 14 . 1 1 86 86 MET HA H 86 4.640 4.640 4.846 -0.206 19168 6032 1 14 . 1 1 86 86 MET C C 86 172.378 172.378 173.581 -1.203 19168 6033 1 14 . 1 1 86 86 MET CA C 86 56.158 56.158 54.544 1.614 19168 6034 1 14 . 1 1 86 86 MET CB C 86 39.138 39.138 36.209 2.929 19168 6035 1 14 . 1 1 87 87 LEU N N 87 131.886 131.886 127.904 3.982 19168 6036 1 14 . 1 1 87 87 LEU HA H 87 5.381 5.381 4.725 0.656 19168 6037 1 14 . 1 1 87 87 LEU C C 87 176.003 176.003 174.805 1.198 19168 6038 1 14 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.203 0.927 19168 6039 1 14 . 1 1 87 87 LEU CB C 87 44.473 44.473 43.276 1.197 19168 6040 1 14 . 1 1 88 88 VAL N N 88 121.165 121.165 122.108 -0.943 19168 6041 1 14 . 1 1 88 88 VAL HA H 88 5.510 5.510 4.827 0.683 19168 6042 1 14 . 1 1 88 88 VAL C C 88 173.666 173.666 174.587 -0.921 19168 6043 1 14 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.492 -0.892 19168 6044 1 14 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.687 0.106 19168 6045 1 14 . 1 1 89 89 THR N N 89 111.786 111.786 119.512 -7.726 19168 6046 1 14 . 1 1 89 89 THR HA H 89 4.720 4.720 5.229 -0.509 19168 6047 1 14 . 1 1 89 89 THR C C 89 171.898 171.898 172.626 -0.728 19168 6048 1 14 . 1 1 89 89 THR CA C 89 57.985 57.985 59.495 -1.510 19168 6049 1 14 . 1 1 89 89 THR CB C 89 69.113 69.113 70.628 -1.515 19168 6050 1 14 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.735 -0.152 19168 6051 1 14 . 1 1 90 90 PRO C C 90 177.403 177.403 176.682 0.721 19168 6052 1 14 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.447 1.084 19168 6053 1 14 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.671 -0.628 19168 6054 1 14 . 1 1 91 91 LYS N N 91 123.696 123.696 123.039 0.657 19168 6055 1 14 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.354 -0.243 19168 6056 1 14 . 1 1 91 91 LYS C C 91 176.568 176.568 176.651 -0.083 19168 6057 1 14 . 1 1 91 91 LYS CA C 91 57.208 57.208 56.760 0.448 19168 6058 1 14 . 1 1 91 91 LYS CB C 91 33.183 33.183 32.908 0.275 19168 6059 1 14 . 1 1 92 92 LYS N N 92 122.054 122.054 122.053 0.001 19168 6060 1 14 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.009 0.307 19168 6061 1 14 . 1 1 92 92 LYS C C 92 175.956 175.956 175.201 0.755 19168 6062 1 14 . 1 1 92 92 LYS CA C 92 55.942 55.942 57.341 -1.399 19168 6063 1 14 . 1 1 92 92 LYS CB C 92 33.000 33.000 32.003 0.997 19168 6064 1 14 . 1 1 93 93 ALA N N 93 126.278 126.278 124.854 1.424 19168 6065 1 14 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.442 -0.101 19168 6066 1 14 . 1 1 93 93 ALA C C 93 177.592 177.592 176.947 0.645 19168 6067 1 14 . 1 1 93 93 ALA CA C 93 52.279 52.279 52.596 -0.317 19168 6068 1 14 . 1 1 93 93 ALA CB C 93 19.332 19.332 19.153 0.179 19168 6069 1 14 . 1 1 94 94 GLU N N 94 120.522 120.522 116.764 3.758 19168 6070 1 14 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.275 0.009 19168 6071 1 14 . 1 1 94 94 GLU C C 94 177.041 177.041 176.295 0.746 19168 6072 1 14 . 1 1 94 94 GLU CA C 94 56.606 56.606 57.277 -0.671 19168 6073 1 14 . 1 1 94 94 GLU CB C 94 30.353 30.353 28.303 2.050 19168 6074 1 14 . 1 1 95 95 GLY N N 95 109.755 109.755 107.990 1.765 19168 6075 1 14 . 1 1 95 95 GLY C C 95 173.939 173.939 173.531 0.408 19168 6076 1 14 . 1 1 95 95 GLY CA C 95 45.168 45.168 44.866 0.302 19168 6077 1 15 . 1 1 5 5 VAL N N 5 123.289 123.289 123.582 -0.293 19168 6078 1 15 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.423 -0.404 19168 6079 1 15 . 1 1 5 5 VAL C C 5 175.799 175.799 175.170 0.629 19168 6080 1 15 . 1 1 5 5 VAL CA C 5 62.120 62.120 61.749 0.371 19168 6081 1 15 . 1 1 5 5 VAL CB C 5 32.757 32.757 33.890 -1.133 19168 6082 1 15 . 1 1 6 6 ILE N N 6 126.794 126.794 123.577 3.217 19168 6083 1 15 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.332 -0.365 19168 6084 1 15 . 1 1 6 6 ILE C C 6 175.103 175.103 175.328 -0.225 19168 6085 1 15 . 1 1 6 6 ILE CA C 6 60.227 60.227 61.044 -0.817 19168 6086 1 15 . 1 1 6 6 ILE CB C 6 38.565 38.565 38.488 0.077 19168 6087 1 15 . 1 1 7 7 ASP N N 7 127.797 127.797 127.005 0.792 19168 6088 1 15 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.632 -0.088 19168 6089 1 15 . 1 1 7 7 ASP C C 7 174.000 174.000 175.310 -1.310 19168 6090 1 15 . 1 1 7 7 ASP CA C 7 53.591 53.591 53.566 0.024 19168 6091 1 15 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.153 1.000 19168 6092 1 15 . 1 1 8 8 ILE N N 8 122.764 122.764 125.612 -2.848 19168 6093 1 15 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.098 0.223 19168 6094 1 15 . 1 1 8 8 ILE C C 8 176.337 176.337 175.909 0.428 19168 6095 1 15 . 1 1 8 8 ILE CA C 8 60.176 60.176 61.013 -0.837 19168 6096 1 15 . 1 1 8 8 ILE CB C 8 39.542 39.542 38.731 0.811 19168 6097 1 15 . 1 1 9 9 LYS N N 9 127.990 127.990 127.578 0.412 19168 6098 1 15 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.306 0.016 19168 6099 1 15 . 1 1 9 9 LYS C C 9 174.759 174.759 175.305 -0.546 19168 6100 1 15 . 1 1 9 9 LYS CA C 9 52.315 52.315 54.003 -1.688 19168 6101 1 15 . 1 1 9 9 LYS CB C 9 32.902 32.902 32.602 0.300 19168 6102 1 15 . 1 1 10 10 GLU N N 10 123.021 123.021 123.312 -0.291 19168 6103 1 15 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.803 0.332 19168 6104 1 15 . 1 1 10 10 GLU C C 10 176.215 176.215 175.707 0.508 19168 6105 1 15 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.305 -0.403 19168 6106 1 15 . 1 1 10 10 GLU CB C 10 32.037 32.037 30.969 1.068 19168 6107 1 15 . 1 1 11 11 ILE N N 11 126.526 126.526 127.400 -0.874 19168 6108 1 15 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.214 0.121 19168 6109 1 15 . 1 1 11 11 ILE C C 11 174.334 174.334 174.411 -0.077 19168 6110 1 15 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.286 0.024 19168 6111 1 15 . 1 1 11 11 ILE CB C 11 39.826 39.826 39.182 0.644 19168 6112 1 15 . 1 1 12 12 LYS N N 12 128.164 128.164 129.354 -1.190 19168 6113 1 15 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.273 0.072 19168 6114 1 15 . 1 1 12 12 LYS C C 12 176.378 176.378 175.651 0.727 19168 6115 1 15 . 1 1 12 12 LYS CA C 12 55.940 55.940 55.632 0.308 19168 6116 1 15 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.854 0.202 19168 6117 1 15 . 1 1 13 13 LEU N N 13 121.881 121.881 125.687 -3.806 19168 6118 1 15 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.870 0.084 19168 6119 1 15 . 1 1 13 13 LEU C C 13 175.137 175.137 175.680 -0.543 19168 6120 1 15 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.418 0.556 19168 6121 1 15 . 1 1 13 13 LEU CB C 13 46.284 46.284 45.560 0.723 19168 6122 1 15 . 1 1 14 14 SER N N 14 115.759 115.759 112.358 3.401 19168 6123 1 15 . 1 1 14 14 SER HA H 14 4.889 4.889 4.908 -0.019 19168 6124 1 15 . 1 1 14 14 SER C C 14 173.993 173.993 174.308 -0.315 19168 6125 1 15 . 1 1 14 14 SER CA C 14 56.052 56.052 57.104 -1.052 19168 6126 1 15 . 1 1 14 14 SER CB C 14 64.775 64.775 66.633 -1.858 19168 6127 1 15 . 1 1 15 15 VAL N N 15 120.993 120.993 119.425 1.568 19168 6128 1 15 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.879 -0.145 19168 6129 1 15 . 1 1 15 15 VAL C C 15 176.964 176.964 177.300 -0.336 19168 6130 1 15 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.448 -0.021 19168 6131 1 15 . 1 1 15 15 VAL CB C 15 31.785 31.785 32.020 -0.235 19168 6132 1 15 . 1 1 16 16 LYS N N 16 118.897 118.897 119.464 -0.567 19168 6133 1 15 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.339 0.062 19168 6134 1 15 . 1 1 16 16 LYS C C 16 175.489 175.489 175.363 0.126 19168 6135 1 15 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.983 -0.828 19168 6136 1 15 . 1 1 16 16 LYS CB C 16 30.929 30.929 30.359 0.570 19168 6137 1 15 . 1 1 17 17 ILE N N 17 122.247 122.247 119.670 2.577 19168 6138 1 15 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.351 -0.166 19168 6139 1 15 . 1 1 17 17 ILE C C 17 173.426 173.426 174.592 -1.166 19168 6140 1 15 . 1 1 17 17 ILE CA C 17 61.276 61.276 59.876 1.400 19168 6141 1 15 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.793 -1.713 19168 6142 1 15 . 1 1 18 18 ALA N N 18 129.434 129.434 128.174 1.260 19168 6143 1 15 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.578 -0.099 19168 6144 1 15 . 1 1 18 18 ALA C C 18 179.130 179.130 177.844 1.286 19168 6145 1 15 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.276 0.161 19168 6146 1 15 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.248 -0.339 19168 6147 1 15 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.010 -0.213 19168 6148 1 15 . 1 1 19 19 GLN CA C 19 59.231 59.231 58.775 0.456 19168 6149 1 15 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.534 -0.359 19168 6150 1 15 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.453 -0.023 19168 6151 1 15 . 1 1 20 20 ASN C C 20 177.272 177.272 177.455 -0.183 19168 6152 1 15 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.461 -0.277 19168 6153 1 15 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.873 -0.420 19168 6154 1 15 . 1 1 21 21 ASP N N 21 119.132 119.132 120.304 -1.172 19168 6155 1 15 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.511 0.287 19168 6156 1 15 . 1 1 21 21 ASP C C 21 178.707 178.707 178.633 0.074 19168 6157 1 15 . 1 1 21 21 ASP CA C 21 56.886 56.886 57.071 -0.185 19168 6158 1 15 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.863 -0.198 19168 6159 1 15 . 1 1 22 22 ILE N N 22 122.030 122.030 119.915 2.115 19168 6160 1 15 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.631 -0.213 19168 6161 1 15 . 1 1 22 22 ILE C C 22 177.454 177.454 177.986 -0.532 19168 6162 1 15 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.474 1.252 19168 6163 1 15 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.708 -0.142 19168 6164 1 15 . 1 1 23 23 ASN N N 23 116.728 116.728 118.838 -2.110 19168 6165 1 15 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.504 -0.291 19168 6166 1 15 . 1 1 23 23 ASN C C 23 178.260 178.260 177.959 0.301 19168 6167 1 15 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.096 0.177 19168 6168 1 15 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.288 -1.080 19168 6169 1 15 . 1 1 24 24 TYR N N 24 119.864 119.864 122.095 -2.231 19168 6170 1 15 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.237 0.056 19168 6171 1 15 . 1 1 24 24 TYR C C 24 177.719 177.719 177.448 0.271 19168 6172 1 15 . 1 1 24 24 TYR CA C 24 61.048 61.048 62.056 -1.008 19168 6173 1 15 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.788 -0.505 19168 6174 1 15 . 1 1 25 25 LYS N N 25 119.730 119.730 118.201 1.529 19168 6175 1 15 . 1 1 25 25 LYS HA H 25 4.111 4.111 4.077 0.034 19168 6176 1 15 . 1 1 25 25 LYS C C 25 179.152 179.152 179.250 -0.098 19168 6177 1 15 . 1 1 25 25 LYS CA C 25 59.162 59.162 58.763 0.399 19168 6178 1 15 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.207 0.087 19168 6179 1 15 . 1 1 26 26 VAL N N 26 119.387 119.387 116.545 2.842 19168 6180 1 15 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.996 -0.376 19168 6181 1 15 . 1 1 26 26 VAL C C 26 177.017 177.017 177.620 -0.603 19168 6182 1 15 . 1 1 26 26 VAL CA C 26 67.661 67.661 65.998 1.663 19168 6183 1 15 . 1 1 26 26 VAL CB C 26 31.550 31.550 30.589 0.961 19168 6184 1 15 . 1 1 27 27 LYS N N 27 120.420 120.420 121.464 -1.044 19168 6185 1 15 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.869 0.077 19168 6186 1 15 . 1 1 27 27 LYS C C 27 179.458 179.458 178.810 0.648 19168 6187 1 15 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.742 0.136 19168 6188 1 15 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.234 -0.386 19168 6189 1 15 . 1 1 28 28 HIS N N 28 118.160 118.160 117.953 0.207 19168 6190 1 15 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.755 -0.568 19168 6191 1 15 . 1 1 28 28 HIS C C 28 177.085 177.085 177.545 -0.460 19168 6192 1 15 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.390 -1.505 19168 6193 1 15 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.852 -0.096 19168 6194 1 15 . 1 1 29 29 ALA N N 29 120.579 120.579 122.591 -2.012 19168 6195 1 15 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.289 -0.291 19168 6196 1 15 . 1 1 29 29 ALA C C 29 179.299 179.299 179.666 -0.367 19168 6197 1 15 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.244 0.323 19168 6198 1 15 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.398 1.051 19168 6199 1 15 . 1 1 30 30 LEU N N 30 117.262 117.262 117.655 -0.393 19168 6200 1 15 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.901 0.174 19168 6201 1 15 . 1 1 30 30 LEU C C 30 180.017 180.017 179.005 1.012 19168 6202 1 15 . 1 1 30 30 LEU CA C 30 58.232 58.232 58.051 0.181 19168 6203 1 15 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.511 -0.185 19168 6204 1 15 . 1 1 31 31 GLU N N 31 120.625 120.625 119.740 0.885 19168 6205 1 15 . 1 1 31 31 GLU HA H 31 4.068 4.068 4.191 -0.123 19168 6206 1 15 . 1 1 31 31 GLU C C 31 179.572 179.572 179.447 0.125 19168 6207 1 15 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.076 0.199 19168 6208 1 15 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.143 -0.168 19168 6209 1 15 . 1 1 32 32 PHE N N 32 118.245 118.245 118.234 0.011 19168 6210 1 15 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.260 0.266 19168 6211 1 15 . 1 1 32 32 PHE C C 32 179.123 179.123 177.764 1.359 19168 6212 1 15 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.755 -3.058 19168 6213 1 15 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.783 -1.531 19168 6214 1 15 . 1 1 33 33 LEU N N 33 121.684 121.684 120.753 0.931 19168 6215 1 15 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.253 0.338 19168 6216 1 15 . 1 1 33 33 LEU C C 33 181.655 181.655 180.038 1.617 19168 6217 1 15 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.565 0.607 19168 6218 1 15 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.560 0.132 19168 6219 1 15 . 1 1 34 34 GLU N N 34 122.046 122.046 119.175 2.871 19168 6220 1 15 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.029 0.123 19168 6221 1 15 . 1 1 34 34 GLU C C 34 178.237 178.237 178.055 0.182 19168 6222 1 15 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.932 0.214 19168 6223 1 15 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.357 -0.123 19168 6224 1 15 . 1 1 35 35 GLN N N 35 115.697 115.697 115.829 -0.132 19168 6225 1 15 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.303 0.084 19168 6226 1 15 . 1 1 35 35 GLN C C 35 176.456 176.456 176.379 0.077 19168 6227 1 15 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.787 -0.101 19168 6228 1 15 . 1 1 35 35 GLN CB C 35 29.196 29.196 28.962 0.234 19168 6229 1 15 . 1 1 36 36 GLY N N 36 108.291 108.291 106.818 1.473 19168 6230 1 15 . 1 1 36 36 GLY C C 36 174.673 174.673 174.643 0.030 19168 6231 1 15 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.227 0.300 19168 6232 1 15 . 1 1 37 37 LYS N N 37 120.464 120.464 120.185 0.279 19168 6233 1 15 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.578 -0.081 19168 6234 1 15 . 1 1 37 37 LYS C C 37 174.580 174.580 175.864 -1.284 19168 6235 1 15 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.808 0.281 19168 6236 1 15 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.205 -1.460 19168 6237 1 15 . 1 1 38 38 HIS N N 38 116.878 116.878 119.625 -2.747 19168 6238 1 15 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.838 0.181 19168 6239 1 15 . 1 1 38 38 HIS C C 38 175.268 175.268 174.733 0.535 19168 6240 1 15 . 1 1 38 38 HIS CA C 38 54.150 54.150 56.633 -2.483 19168 6241 1 15 . 1 1 38 38 HIS CB C 38 32.877 32.877 31.954 0.923 19168 6242 1 15 . 1 1 39 39 VAL N N 39 119.782 119.782 122.868 -3.086 19168 6243 1 15 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.726 0.070 19168 6244 1 15 . 1 1 39 39 VAL C C 39 173.320 173.320 174.101 -0.781 19168 6245 1 15 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.644 0.122 19168 6246 1 15 . 1 1 39 39 VAL CB C 39 35.433 35.433 33.918 1.515 19168 6247 1 15 . 1 1 40 40 ARG N N 40 128.358 128.358 127.056 1.302 19168 6248 1 15 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.638 0.477 19168 6249 1 15 . 1 1 40 40 ARG C C 40 175.659 175.659 174.676 0.983 19168 6250 1 15 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.557 -0.735 19168 6251 1 15 . 1 1 40 40 ARG CB C 40 33.007 33.007 31.931 1.076 19168 6252 1 15 . 1 1 41 41 PHE N N 41 126.396 126.396 127.509 -1.113 19168 6253 1 15 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.330 -0.152 19168 6254 1 15 . 1 1 41 41 PHE C C 41 176.107 176.107 175.228 0.879 19168 6255 1 15 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.655 0.041 19168 6256 1 15 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.975 2.071 19168 6257 1 15 . 1 1 42 42 ARG N N 42 120.641 120.641 123.332 -2.691 19168 6258 1 15 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.423 0.116 19168 6259 1 15 . 1 1 42 42 ARG C C 42 175.010 175.010 174.317 0.693 19168 6260 1 15 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.900 -0.205 19168 6261 1 15 . 1 1 42 42 ARG CB C 42 34.374 34.374 34.478 -0.104 19168 6262 1 15 . 1 1 43 43 VAL N N 43 125.565 125.565 122.524 3.041 19168 6263 1 15 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.298 -0.633 19168 6264 1 15 . 1 1 43 43 VAL C C 43 175.325 175.325 173.692 1.633 19168 6265 1 15 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.861 0.955 19168 6266 1 15 . 1 1 43 43 VAL CB C 43 32.983 32.983 36.239 -3.256 19168 6267 1 15 . 1 1 44 44 PHE N N 44 128.291 128.291 129.724 -1.433 19168 6268 1 15 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.586 0.032 19168 6269 1 15 . 1 1 44 44 PHE C C 44 174.477 174.477 173.794 0.683 19168 6270 1 15 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.656 0.492 19168 6271 1 15 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.603 -1.662 19168 6272 1 15 . 1 1 45 45 LEU N N 45 128.360 128.360 128.080 0.280 19168 6273 1 15 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.502 -0.111 19168 6274 1 15 . 1 1 45 45 LEU C C 45 174.342 174.342 175.568 -1.226 19168 6275 1 15 . 1 1 45 45 LEU CA C 45 53.586 53.586 53.742 -0.157 19168 6276 1 15 . 1 1 45 45 LEU CB C 45 41.113 41.113 42.284 -1.171 19168 6277 1 15 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.323 -0.231 19168 6278 1 15 . 1 1 46 46 LYS CA C 46 55.079 55.079 55.585 -0.506 19168 6279 1 15 . 1 1 46 46 LYS CB C 46 34.295 34.295 34.347 -0.052 19168 6280 1 15 . 1 1 47 47 GLY CA C 47 46.813 46.813 46.418 0.395 19168 6281 1 15 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.219 -0.019 19168 6282 1 15 . 1 1 48 48 ARG C C 48 178.069 178.069 178.520 -0.451 19168 6283 1 15 . 1 1 48 48 ARG CA C 48 57.862 57.862 57.523 0.339 19168 6284 1 15 . 1 1 48 48 ARG CB C 48 29.444 29.444 30.103 -0.659 19168 6285 1 15 . 1 1 49 49 GLU N N 49 119.779 119.779 120.959 -1.180 19168 6286 1 15 . 1 1 49 49 GLU HA H 49 4.053 4.053 3.979 0.074 19168 6287 1 15 . 1 1 49 49 GLU C C 49 178.227 178.227 177.998 0.229 19168 6288 1 15 . 1 1 49 49 GLU CA C 49 57.436 57.436 58.689 -1.253 19168 6289 1 15 . 1 1 49 49 GLU CB C 49 29.745 29.745 29.337 0.409 19168 6290 1 15 . 1 1 50 50 MET N N 50 116.370 116.370 117.194 -0.824 19168 6291 1 15 . 1 1 50 50 MET HA H 50 4.024 4.024 4.123 -0.099 19168 6292 1 15 . 1 1 50 50 MET C C 50 175.912 175.912 177.306 -1.394 19168 6293 1 15 . 1 1 50 50 MET CA C 50 56.664 56.664 57.434 -0.770 19168 6294 1 15 . 1 1 50 50 MET CB C 50 32.033 32.033 32.468 -0.435 19168 6295 1 15 . 1 1 51 51 ALA N N 51 118.880 118.880 119.452 -0.572 19168 6296 1 15 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.253 0.091 19168 6297 1 15 . 1 1 51 51 ALA C C 51 177.746 177.746 177.575 0.171 19168 6298 1 15 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.038 -0.647 19168 6299 1 15 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.462 -0.019 19168 6300 1 15 . 1 1 52 52 THR N N 52 108.299 108.299 112.655 -4.356 19168 6301 1 15 . 1 1 52 52 THR HA H 52 4.869 4.869 4.613 0.256 19168 6302 1 15 . 1 1 52 52 THR C C 52 173.933 173.933 172.831 1.102 19168 6303 1 15 . 1 1 52 52 THR CA C 52 57.554 57.554 59.149 -1.595 19168 6304 1 15 . 1 1 52 52 THR CB C 52 69.479 69.479 69.753 -0.274 19168 6305 1 15 . 1 1 53 53 PRO HA H 53 3.931 3.931 4.256 -0.325 19168 6306 1 15 . 1 1 53 53 PRO C C 53 178.185 178.185 177.620 0.565 19168 6307 1 15 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.439 0.580 19168 6308 1 15 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.993 -1.477 19168 6309 1 15 . 1 1 54 54 GLU N N 54 120.653 120.653 118.936 1.717 19168 6310 1 15 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.076 -0.060 19168 6311 1 15 . 1 1 54 54 GLU C C 54 178.608 178.608 178.128 0.480 19168 6312 1 15 . 1 1 54 54 GLU CA C 54 59.472 59.472 58.713 0.759 19168 6313 1 15 . 1 1 54 54 GLU CB C 54 27.419 27.419 27.559 -0.140 19168 6314 1 15 . 1 1 55 55 ALA N N 55 124.380 124.380 121.954 2.426 19168 6315 1 15 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.130 0.193 19168 6316 1 15 . 1 1 55 55 ALA C C 55 181.502 181.502 179.759 1.743 19168 6317 1 15 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.035 -0.255 19168 6318 1 15 . 1 1 55 55 ALA CB C 55 18.401 18.401 17.983 0.418 19168 6319 1 15 . 1 1 56 56 GLY N N 56 105.673 105.673 106.892 -1.219 19168 6320 1 15 . 1 1 56 56 GLY C C 56 174.278 174.278 176.243 -1.965 19168 6321 1 15 . 1 1 56 56 GLY CA C 56 46.879 46.879 46.959 -0.080 19168 6322 1 15 . 1 1 57 57 VAL N N 57 122.685 122.685 123.245 -0.560 19168 6323 1 15 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.668 -0.346 19168 6324 1 15 . 1 1 57 57 VAL C C 57 177.134 177.134 177.691 -0.557 19168 6325 1 15 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.237 1.159 19168 6326 1 15 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.372 0.397 19168 6327 1 15 . 1 1 58 58 ALA N N 58 119.580 119.580 122.544 -2.964 19168 6328 1 15 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.128 -0.034 19168 6329 1 15 . 1 1 58 58 ALA C C 58 180.788 180.788 179.754 1.034 19168 6330 1 15 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.004 0.049 19168 6331 1 15 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.479 -0.625 19168 6332 1 15 . 1 1 59 59 LEU N N 59 119.723 119.723 119.822 -0.099 19168 6333 1 15 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.059 0.199 19168 6334 1 15 . 1 1 59 59 LEU C C 59 178.024 178.024 178.619 -0.595 19168 6335 1 15 . 1 1 59 59 LEU CA C 59 57.710 57.710 57.876 -0.166 19168 6336 1 15 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.025 -0.324 19168 6337 1 15 . 1 1 60 60 LEU N N 60 117.978 117.978 118.731 -0.753 19168 6338 1 15 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.813 0.044 19168 6339 1 15 . 1 1 60 60 LEU C C 60 178.851 178.851 179.204 -0.353 19168 6340 1 15 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.194 -0.550 19168 6341 1 15 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.432 -1.144 19168 6342 1 15 . 1 1 61 61 GLU N N 61 119.906 119.906 119.010 0.896 19168 6343 1 15 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.056 0.435 19168 6344 1 15 . 1 1 61 61 GLU C C 61 179.519 179.519 178.952 0.567 19168 6345 1 15 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.769 -1.027 19168 6346 1 15 . 1 1 61 61 GLU CB C 61 28.813 28.813 29.248 -0.435 19168 6347 1 15 . 1 1 62 62 LYS N N 62 122.015 122.015 120.923 1.092 19168 6348 1 15 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.083 0.045 19168 6349 1 15 . 1 1 62 62 LYS C C 62 179.843 179.843 179.185 0.658 19168 6350 1 15 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.404 -0.066 19168 6351 1 15 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.417 -0.770 19168 6352 1 15 . 1 1 63 63 ILE N N 63 120.882 120.882 119.787 1.095 19168 6353 1 15 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.681 -0.185 19168 6354 1 15 . 1 1 63 63 ILE C C 63 177.761 177.761 177.327 0.434 19168 6355 1 15 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.965 0.217 19168 6356 1 15 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.689 -0.303 19168 6357 1 15 . 1 1 64 64 TRP N N 64 120.279 120.279 122.219 -1.940 19168 6358 1 15 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.106 0.378 19168 6359 1 15 . 1 1 64 64 TRP C C 64 177.056 177.056 177.698 -0.642 19168 6360 1 15 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.352 -1.258 19168 6361 1 15 . 1 1 64 64 TRP CB C 64 29.635 29.635 30.133 -0.498 19168 6362 1 15 . 1 1 65 65 THR N N 65 109.483 109.483 109.017 0.466 19168 6363 1 15 . 1 1 65 65 THR HA H 65 3.744 3.744 3.947 -0.203 19168 6364 1 15 . 1 1 65 65 THR C C 65 176.224 176.224 175.828 0.396 19168 6365 1 15 . 1 1 65 65 THR CA C 65 65.568 65.568 64.035 1.533 19168 6366 1 15 . 1 1 65 65 THR CB C 65 69.308 69.308 68.512 0.796 19168 6367 1 15 . 1 1 66 66 MET N N 66 117.791 117.791 118.576 -0.785 19168 6368 1 15 . 1 1 66 66 MET HA H 66 4.110 4.110 4.384 -0.274 19168 6369 1 15 . 1 1 66 66 MET C C 66 177.782 177.782 177.382 0.400 19168 6370 1 15 . 1 1 66 66 MET CA C 66 58.304 58.304 57.732 0.572 19168 6371 1 15 . 1 1 66 66 MET CB C 66 34.040 34.040 33.895 0.145 19168 6372 1 15 . 1 1 67 67 ILE N N 67 109.871 109.871 112.587 -2.716 19168 6373 1 15 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.401 0.241 19168 6374 1 15 . 1 1 67 67 ILE C C 67 176.713 176.713 176.389 0.324 19168 6375 1 15 . 1 1 67 67 ILE CA C 67 61.174 61.174 60.942 0.232 19168 6376 1 15 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.831 0.982 19168 6377 1 15 . 1 1 68 68 GLU N N 68 121.972 121.972 121.462 0.510 19168 6378 1 15 . 1 1 68 68 GLU HA H 68 2.748 2.748 2.955 -0.207 19168 6379 1 15 . 1 1 68 68 GLU C C 68 175.855 175.855 176.996 -1.141 19168 6380 1 15 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.553 -0.262 19168 6381 1 15 . 1 1 68 68 GLU CB C 68 28.492 28.492 28.031 0.461 19168 6382 1 15 . 1 1 69 69 ASN N N 69 114.338 114.338 113.985 0.353 19168 6383 1 15 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.445 0.135 19168 6384 1 15 . 1 1 69 69 ASN C C 69 175.904 175.904 176.233 -0.329 19168 6385 1 15 . 1 1 69 69 ASN CA C 69 54.597 54.597 54.987 -0.390 19168 6386 1 15 . 1 1 69 69 ASN CB C 69 38.323 38.323 38.136 0.187 19168 6387 1 15 . 1 1 70 70 GLU N N 70 116.936 116.936 119.041 -2.105 19168 6388 1 15 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.527 0.021 19168 6389 1 15 . 1 1 70 70 GLU C C 70 174.941 174.941 175.155 -0.214 19168 6390 1 15 . 1 1 70 70 GLU CA C 70 55.983 55.983 56.316 -0.332 19168 6391 1 15 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.412 -0.064 19168 6392 1 15 . 1 1 71 71 ALA N N 71 122.966 122.966 121.784 1.182 19168 6393 1 15 . 1 1 71 71 ALA HA H 71 5.246 5.246 4.697 0.549 19168 6394 1 15 . 1 1 71 71 ALA C C 71 173.907 173.907 175.552 -1.645 19168 6395 1 15 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.594 0.224 19168 6396 1 15 . 1 1 71 71 ALA CB C 71 24.060 24.060 21.850 2.210 19168 6397 1 15 . 1 1 72 72 ASN N N 72 115.820 115.820 119.740 -3.920 19168 6398 1 15 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.377 0.064 19168 6399 1 15 . 1 1 72 72 ASN C C 72 174.137 174.137 174.704 -0.567 19168 6400 1 15 . 1 1 72 72 ASN CA C 72 51.659 51.659 52.002 -0.343 19168 6401 1 15 . 1 1 72 72 ASN CB C 72 42.186 42.186 42.337 -0.152 19168 6402 1 15 . 1 1 73 73 ARG N N 73 118.340 118.340 123.678 -5.338 19168 6403 1 15 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.878 0.900 19168 6404 1 15 . 1 1 73 73 ARG C C 73 174.674 174.674 175.861 -1.187 19168 6405 1 15 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.958 -2.088 19168 6406 1 15 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.748 2.377 19168 6407 1 15 . 1 1 74 74 ASP N N 74 124.007 124.007 128.019 -4.012 19168 6408 1 15 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.641 -0.099 19168 6409 1 15 . 1 1 74 74 ASP C C 74 175.935 175.935 176.050 -0.115 19168 6410 1 15 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.102 -0.705 19168 6411 1 15 . 1 1 74 74 ASP CB C 74 42.220 42.220 42.512 -0.292 19168 6412 1 15 . 1 1 75 75 LYS N N 75 116.482 116.482 117.920 -1.438 19168 6413 1 15 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.493 -0.048 19168 6414 1 15 . 1 1 75 75 LYS C C 75 175.135 175.135 174.700 0.435 19168 6415 1 15 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.221 -0.436 19168 6416 1 15 . 1 1 75 75 LYS CB C 75 35.475 35.475 35.375 0.100 19168 6417 1 15 . 1 1 76 76 GLU N N 76 120.126 120.126 121.979 -1.853 19168 6418 1 15 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.389 -0.481 19168 6419 1 15 . 1 1 76 76 GLU C C 76 173.204 173.204 175.302 -2.098 19168 6420 1 15 . 1 1 76 76 GLU CA C 76 55.524 55.524 54.447 1.077 19168 6421 1 15 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.265 -1.754 19168 6422 1 15 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.886 -0.109 19168 6423 1 15 . 1 1 77 77 PRO C C 77 174.933 174.933 176.070 -1.137 19168 6424 1 15 . 1 1 77 77 PRO CA C 77 63.422 63.422 63.029 0.393 19168 6425 1 15 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.110 0.281 19168 6426 1 15 . 1 1 78 78 ASN N N 78 119.292 119.292 120.192 -0.900 19168 6427 1 15 . 1 1 78 78 ASN HA H 78 5.093 5.093 4.866 0.227 19168 6428 1 15 . 1 1 78 78 ASN C C 78 172.876 172.876 172.882 -0.006 19168 6429 1 15 . 1 1 78 78 ASN CA C 78 51.928 51.928 51.962 -0.033 19168 6430 1 15 . 1 1 78 78 ASN CB C 78 42.017 42.017 40.974 1.043 19168 6431 1 15 . 1 1 79 79 PHE N N 79 125.023 125.023 121.073 3.950 19168 6432 1 15 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.390 0.033 19168 6433 1 15 . 1 1 79 79 PHE C C 79 174.552 174.552 174.870 -0.318 19168 6434 1 15 . 1 1 79 79 PHE CA C 79 55.210 55.210 57.115 -1.905 19168 6435 1 15 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.334 -0.225 19168 6436 1 15 . 1 1 80 80 GLU N N 80 128.920 128.920 126.747 2.173 19168 6437 1 15 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.456 -0.248 19168 6438 1 15 . 1 1 80 80 GLU C C 80 175.538 175.538 176.194 -0.656 19168 6439 1 15 . 1 1 80 80 GLU CA C 80 55.724 55.724 55.471 0.253 19168 6440 1 15 . 1 1 80 80 GLU CB C 80 32.135 32.135 32.612 -0.477 19168 6441 1 15 . 1 1 81 81 GLY N N 81 116.695 116.695 113.825 2.870 19168 6442 1 15 . 1 1 81 81 GLY C C 81 173.950 173.950 174.254 -0.304 19168 6443 1 15 . 1 1 81 81 GLY CA C 81 46.967 46.967 45.891 1.076 19168 6444 1 15 . 1 1 82 82 ARG N N 82 124.481 124.481 110.949 13.532 19168 6445 1 15 . 1 1 82 82 ARG HA H 82 4.539 4.539 3.469 1.070 19168 6446 1 15 . 1 1 82 82 ARG C C 82 173.437 173.437 173.741 -0.304 19168 6447 1 15 . 1 1 82 82 ARG CA C 82 55.156 55.156 57.503 -2.347 19168 6448 1 15 . 1 1 82 82 ARG CB C 82 30.255 30.255 28.982 1.274 19168 6449 1 15 . 1 1 83 83 TYR N N 83 114.539 114.539 115.911 -1.372 19168 6450 1 15 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.321 0.627 19168 6451 1 15 . 1 1 83 83 TYR C C 83 175.909 175.909 175.089 0.820 19168 6452 1 15 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.638 -0.581 19168 6453 1 15 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.019 0.980 19168 6454 1 15 . 1 1 84 84 VAL N N 84 118.812 118.812 123.687 -4.875 19168 6455 1 15 . 1 1 84 84 VAL HA H 84 4.867 4.867 5.036 -0.169 19168 6456 1 15 . 1 1 84 84 VAL C C 84 174.982 174.982 175.433 -0.451 19168 6457 1 15 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.909 -0.674 19168 6458 1 15 . 1 1 84 84 VAL CB C 84 32.491 32.491 31.951 0.540 19168 6459 1 15 . 1 1 85 85 ASN N N 85 124.630 124.630 126.775 -2.145 19168 6460 1 15 . 1 1 85 85 ASN HA H 85 6.004 6.004 5.867 0.137 19168 6461 1 15 . 1 1 85 85 ASN C C 85 175.392 175.392 173.746 1.646 19168 6462 1 15 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.892 0.703 19168 6463 1 15 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.312 1.895 19168 6464 1 15 . 1 1 86 86 MET N N 86 118.969 118.969 121.287 -2.318 19168 6465 1 15 . 1 1 86 86 MET HA H 86 4.640 4.640 4.856 -0.216 19168 6466 1 15 . 1 1 86 86 MET C C 86 172.378 172.378 173.131 -0.753 19168 6467 1 15 . 1 1 86 86 MET CA C 86 56.158 56.158 54.424 1.734 19168 6468 1 15 . 1 1 86 86 MET CB C 86 39.138 39.138 36.873 2.265 19168 6469 1 15 . 1 1 87 87 LEU N N 87 131.886 131.886 127.651 4.235 19168 6470 1 15 . 1 1 87 87 LEU HA H 87 5.381 5.381 4.967 0.414 19168 6471 1 15 . 1 1 87 87 LEU C C 87 176.003 176.003 174.771 1.232 19168 6472 1 15 . 1 1 87 87 LEU CA C 87 54.130 54.130 52.933 1.197 19168 6473 1 15 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.632 -0.159 19168 6474 1 15 . 1 1 88 88 VAL N N 88 121.165 121.165 121.134 0.031 19168 6475 1 15 . 1 1 88 88 VAL HA H 88 5.510 5.510 5.032 0.478 19168 6476 1 15 . 1 1 88 88 VAL C C 88 173.666 173.666 174.921 -1.255 19168 6477 1 15 . 1 1 88 88 VAL CA C 88 58.600 58.600 60.155 -1.555 19168 6478 1 15 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.327 0.466 19168 6479 1 15 . 1 1 89 89 THR N N 89 111.786 111.786 121.435 -9.649 19168 6480 1 15 . 1 1 89 89 THR HA H 89 4.720 4.720 4.663 0.057 19168 6481 1 15 . 1 1 89 89 THR C C 89 171.898 171.898 172.653 -0.755 19168 6482 1 15 . 1 1 89 89 THR CA C 89 57.985 57.985 59.720 -1.735 19168 6483 1 15 . 1 1 89 89 THR CB C 89 69.113 69.113 70.031 -0.918 19168 6484 1 15 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.450 0.133 19168 6485 1 15 . 1 1 90 90 PRO C C 90 177.403 177.403 176.856 0.547 19168 6486 1 15 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.556 0.975 19168 6487 1 15 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.306 -0.263 19168 6488 1 15 . 1 1 91 91 LYS N N 91 123.696 123.696 123.171 0.525 19168 6489 1 15 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.136 -0.025 19168 6490 1 15 . 1 1 91 91 LYS C C 91 176.568 176.568 176.058 0.510 19168 6491 1 15 . 1 1 91 91 LYS CA C 91 57.208 57.208 57.348 -0.140 19168 6492 1 15 . 1 1 91 91 LYS CB C 91 33.183 33.183 31.273 1.910 19168 6493 1 15 . 1 1 92 92 LYS N N 92 122.054 122.054 124.126 -2.072 19168 6494 1 15 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.417 -0.101 19168 6495 1 15 . 1 1 92 92 LYS C C 92 175.956 175.956 175.514 0.442 19168 6496 1 15 . 1 1 92 92 LYS CA C 92 55.942 55.942 55.487 0.455 19168 6497 1 15 . 1 1 92 92 LYS CB C 92 33.000 33.000 35.069 -2.069 19168 6498 1 15 . 1 1 93 93 ALA N N 93 126.278 126.278 128.430 -2.152 19168 6499 1 15 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.727 -0.386 19168 6500 1 15 . 1 1 93 93 ALA C C 93 177.592 177.592 176.500 1.092 19168 6501 1 15 . 1 1 93 93 ALA CA C 93 52.279 52.279 52.093 0.186 19168 6502 1 15 . 1 1 93 93 ALA CB C 93 19.332 19.332 19.036 0.296 19168 6503 1 15 . 1 1 94 94 GLU N N 94 120.522 120.522 122.074 -1.552 19168 6504 1 15 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.471 -0.187 19168 6505 1 15 . 1 1 94 94 GLU C C 94 177.041 177.041 175.269 1.772 19168 6506 1 15 . 1 1 94 94 GLU CA C 94 56.606 56.606 56.136 0.470 19168 6507 1 15 . 1 1 94 94 GLU CB C 94 30.353 30.353 31.283 -0.930 19168 6508 1 15 . 1 1 95 95 GLY N N 95 109.755 109.755 111.329 -1.574 19168 6509 1 15 . 1 1 95 95 GLY C C 95 173.939 173.939 172.854 1.085 19168 6510 1 15 . 1 1 95 95 GLY CA C 95 45.168 45.168 44.530 0.638 19168 6511 1 16 . 1 1 5 5 VAL N N 5 123.289 123.289 121.186 2.103 19168 6512 1 16 . 1 1 5 5 VAL HA H 5 4.019 4.019 3.978 0.041 19168 6513 1 16 . 1 1 5 5 VAL C C 5 175.799 175.799 176.484 -0.685 19168 6514 1 16 . 1 1 5 5 VAL CA C 5 62.120 62.120 64.025 -1.905 19168 6515 1 16 . 1 1 5 5 VAL CB C 5 32.757 32.757 32.026 0.731 19168 6516 1 16 . 1 1 6 6 ILE N N 6 126.794 126.794 121.552 5.242 19168 6517 1 16 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.150 -0.183 19168 6518 1 16 . 1 1 6 6 ILE C C 6 175.103 175.103 174.660 0.443 19168 6519 1 16 . 1 1 6 6 ILE CA C 6 60.227 60.227 60.425 -0.198 19168 6520 1 16 . 1 1 6 6 ILE CB C 6 38.565 38.565 38.820 -0.255 19168 6521 1 16 . 1 1 7 7 ASP N N 7 127.797 127.797 128.104 -0.307 19168 6522 1 16 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.613 -0.069 19168 6523 1 16 . 1 1 7 7 ASP C C 7 174.000 174.000 174.971 -0.971 19168 6524 1 16 . 1 1 7 7 ASP CA C 7 53.591 53.591 54.562 -0.972 19168 6525 1 16 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.275 0.877 19168 6526 1 16 . 1 1 8 8 ILE N N 8 122.764 122.764 124.882 -2.118 19168 6527 1 16 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.033 0.287 19168 6528 1 16 . 1 1 8 8 ILE C C 8 176.337 176.337 175.175 1.162 19168 6529 1 16 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.591 -0.415 19168 6530 1 16 . 1 1 8 8 ILE CB C 8 39.542 39.542 38.832 0.710 19168 6531 1 16 . 1 1 9 9 LYS N N 9 127.990 127.990 127.972 0.018 19168 6532 1 16 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.251 0.071 19168 6533 1 16 . 1 1 9 9 LYS C C 9 174.759 174.759 175.320 -0.561 19168 6534 1 16 . 1 1 9 9 LYS CA C 9 52.315 52.315 54.790 -2.475 19168 6535 1 16 . 1 1 9 9 LYS CB C 9 32.902 32.902 32.841 0.061 19168 6536 1 16 . 1 1 10 10 GLU N N 10 123.021 123.021 121.807 1.214 19168 6537 1 16 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.785 0.350 19168 6538 1 16 . 1 1 10 10 GLU C C 10 176.215 176.215 175.476 0.739 19168 6539 1 16 . 1 1 10 10 GLU CA C 10 54.902 54.902 54.647 0.255 19168 6540 1 16 . 1 1 10 10 GLU CB C 10 32.037 32.037 31.332 0.704 19168 6541 1 16 . 1 1 11 11 ILE N N 11 126.526 126.526 126.268 0.258 19168 6542 1 16 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.234 0.101 19168 6543 1 16 . 1 1 11 11 ILE C C 11 174.334 174.334 175.308 -0.974 19168 6544 1 16 . 1 1 11 11 ILE CA C 11 60.310 60.310 59.156 1.154 19168 6545 1 16 . 1 1 11 11 ILE CB C 11 39.826 39.826 37.632 2.194 19168 6546 1 16 . 1 1 12 12 LYS N N 12 128.164 128.164 128.173 -0.009 19168 6547 1 16 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.337 0.008 19168 6548 1 16 . 1 1 12 12 LYS C C 12 176.378 176.378 175.913 0.465 19168 6549 1 16 . 1 1 12 12 LYS CA C 12 55.940 55.940 56.315 -0.375 19168 6550 1 16 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.606 0.450 19168 6551 1 16 . 1 1 13 13 LEU N N 13 121.881 121.881 124.714 -2.833 19168 6552 1 16 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.814 0.140 19168 6553 1 16 . 1 1 13 13 LEU C C 13 175.137 175.137 174.740 0.397 19168 6554 1 16 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.822 0.152 19168 6555 1 16 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.842 -0.558 19168 6556 1 16 . 1 1 14 14 SER N N 14 115.759 115.759 113.154 2.605 19168 6557 1 16 . 1 1 14 14 SER HA H 14 4.889 4.889 5.412 -0.523 19168 6558 1 16 . 1 1 14 14 SER C C 14 173.993 173.993 174.749 -0.756 19168 6559 1 16 . 1 1 14 14 SER CA C 14 56.052 56.052 56.801 -0.749 19168 6560 1 16 . 1 1 14 14 SER CB C 14 64.775 64.775 66.202 -1.427 19168 6561 1 16 . 1 1 15 15 VAL N N 15 120.993 120.993 121.895 -0.902 19168 6562 1 16 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.770 -0.036 19168 6563 1 16 . 1 1 15 15 VAL C C 15 176.964 176.964 176.772 0.192 19168 6564 1 16 . 1 1 15 15 VAL CA C 15 65.427 65.427 66.207 -0.780 19168 6565 1 16 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.967 -0.182 19168 6566 1 16 . 1 1 16 16 LYS N N 16 118.897 118.897 118.988 -0.091 19168 6567 1 16 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.290 0.111 19168 6568 1 16 . 1 1 16 16 LYS C C 16 175.489 175.489 175.472 0.017 19168 6569 1 16 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.647 -0.492 19168 6570 1 16 . 1 1 16 16 LYS CB C 16 30.929 30.929 29.888 1.041 19168 6571 1 16 . 1 1 17 17 ILE N N 17 122.247 122.247 120.241 2.006 19168 6572 1 16 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.296 -0.111 19168 6573 1 16 . 1 1 17 17 ILE C C 17 173.426 173.426 174.836 -1.410 19168 6574 1 16 . 1 1 17 17 ILE CA C 17 61.276 61.276 60.183 1.093 19168 6575 1 16 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.224 -1.145 19168 6576 1 16 . 1 1 18 18 ALA N N 18 129.434 129.434 127.925 1.509 19168 6577 1 16 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.630 -0.151 19168 6578 1 16 . 1 1 18 18 ALA C C 18 179.130 179.130 177.708 1.422 19168 6579 1 16 . 1 1 18 18 ALA CA C 18 51.437 51.437 50.986 0.451 19168 6580 1 16 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.468 -0.559 19168 6581 1 16 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.014 -0.217 19168 6582 1 16 . 1 1 19 19 GLN CA C 19 59.231 59.231 58.839 0.392 19168 6583 1 16 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.507 -0.332 19168 6584 1 16 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.487 -0.057 19168 6585 1 16 . 1 1 20 20 ASN C C 20 177.272 177.272 177.511 -0.239 19168 6586 1 16 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.151 0.033 19168 6587 1 16 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.613 -0.160 19168 6588 1 16 . 1 1 21 21 ASP N N 21 119.132 119.132 120.269 -1.137 19168 6589 1 16 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.496 0.302 19168 6590 1 16 . 1 1 21 21 ASP C C 21 178.707 178.707 178.749 -0.042 19168 6591 1 16 . 1 1 21 21 ASP CA C 21 56.886 56.886 57.098 -0.212 19168 6592 1 16 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.818 -0.153 19168 6593 1 16 . 1 1 22 22 ILE N N 22 122.030 122.030 120.639 1.391 19168 6594 1 16 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.670 -0.252 19168 6595 1 16 . 1 1 22 22 ILE C C 22 177.454 177.454 177.964 -0.510 19168 6596 1 16 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.265 1.461 19168 6597 1 16 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.767 -0.202 19168 6598 1 16 . 1 1 23 23 ASN N N 23 116.728 116.728 118.613 -1.885 19168 6599 1 16 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.422 -0.209 19168 6600 1 16 . 1 1 23 23 ASN C C 23 178.260 178.260 177.841 0.419 19168 6601 1 16 . 1 1 23 23 ASN CA C 23 56.274 56.274 57.016 -0.742 19168 6602 1 16 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.538 -1.330 19168 6603 1 16 . 1 1 24 24 TYR N N 24 119.864 119.864 122.145 -2.281 19168 6604 1 16 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.179 0.114 19168 6605 1 16 . 1 1 24 24 TYR C C 24 177.719 177.719 177.543 0.176 19168 6606 1 16 . 1 1 24 24 TYR CA C 24 61.048 61.048 62.228 -1.181 19168 6607 1 16 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.642 -0.358 19168 6608 1 16 . 1 1 25 25 LYS N N 25 119.730 119.730 119.096 0.634 19168 6609 1 16 . 1 1 25 25 LYS HA H 25 4.111 4.111 4.085 0.026 19168 6610 1 16 . 1 1 25 25 LYS C C 25 179.152 179.152 179.304 -0.152 19168 6611 1 16 . 1 1 25 25 LYS CA C 25 59.162 59.162 58.870 0.292 19168 6612 1 16 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.366 -0.072 19168 6613 1 16 . 1 1 26 26 VAL N N 26 119.387 119.387 116.540 2.847 19168 6614 1 16 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.868 -0.248 19168 6615 1 16 . 1 1 26 26 VAL C C 26 177.017 177.017 177.579 -0.562 19168 6616 1 16 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.368 1.293 19168 6617 1 16 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.331 0.219 19168 6618 1 16 . 1 1 27 27 LYS N N 27 120.420 120.420 120.186 0.234 19168 6619 1 16 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.851 0.095 19168 6620 1 16 . 1 1 27 27 LYS C C 27 179.458 179.458 178.387 1.071 19168 6621 1 16 . 1 1 27 27 LYS CA C 27 59.878 59.878 60.118 -0.240 19168 6622 1 16 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.217 -0.369 19168 6623 1 16 . 1 1 28 28 HIS N N 28 118.160 118.160 118.751 -0.591 19168 6624 1 16 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.444 -0.257 19168 6625 1 16 . 1 1 28 28 HIS C C 28 177.085 177.085 177.193 -0.108 19168 6626 1 16 . 1 1 28 28 HIS CA C 28 57.885 57.885 58.567 -0.682 19168 6627 1 16 . 1 1 28 28 HIS CB C 28 29.756 29.756 30.327 -0.571 19168 6628 1 16 . 1 1 29 29 ALA N N 29 120.579 120.579 121.936 -1.357 19168 6629 1 16 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.219 -0.221 19168 6630 1 16 . 1 1 29 29 ALA C C 29 179.299 179.299 179.755 -0.456 19168 6631 1 16 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.056 0.512 19168 6632 1 16 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.428 1.021 19168 6633 1 16 . 1 1 30 30 LEU N N 30 117.262 117.262 117.828 -0.566 19168 6634 1 16 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.920 0.155 19168 6635 1 16 . 1 1 30 30 LEU C C 30 180.017 180.017 179.003 1.014 19168 6636 1 16 . 1 1 30 30 LEU CA C 30 58.232 58.232 58.036 0.195 19168 6637 1 16 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.584 -0.258 19168 6638 1 16 . 1 1 31 31 GLU N N 31 120.625 120.625 119.327 1.298 19168 6639 1 16 . 1 1 31 31 GLU HA H 31 4.068 4.068 4.224 -0.156 19168 6640 1 16 . 1 1 31 31 GLU C C 31 179.572 179.572 179.208 0.364 19168 6641 1 16 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.089 0.186 19168 6642 1 16 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.136 -0.161 19168 6643 1 16 . 1 1 32 32 PHE N N 32 118.245 118.245 117.691 0.554 19168 6644 1 16 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.179 0.347 19168 6645 1 16 . 1 1 32 32 PHE C C 32 179.123 179.123 177.470 1.653 19168 6646 1 16 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.251 -2.554 19168 6647 1 16 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.523 -1.271 19168 6648 1 16 . 1 1 33 33 LEU N N 33 121.684 121.684 120.319 1.365 19168 6649 1 16 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.334 0.257 19168 6650 1 16 . 1 1 33 33 LEU C C 33 181.655 181.655 180.008 1.647 19168 6651 1 16 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.469 0.703 19168 6652 1 16 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.640 0.052 19168 6653 1 16 . 1 1 34 34 GLU N N 34 122.046 122.046 117.881 4.165 19168 6654 1 16 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.085 0.067 19168 6655 1 16 . 1 1 34 34 GLU C C 34 178.237 178.237 177.886 0.351 19168 6656 1 16 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.588 0.558 19168 6657 1 16 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.311 -0.077 19168 6658 1 16 . 1 1 35 35 GLN N N 35 115.697 115.697 115.859 -0.162 19168 6659 1 16 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.359 0.028 19168 6660 1 16 . 1 1 35 35 GLN C C 35 176.456 176.456 176.929 -0.473 19168 6661 1 16 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.058 0.628 19168 6662 1 16 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.035 0.161 19168 6663 1 16 . 1 1 36 36 GLY N N 36 108.291 108.291 107.748 0.543 19168 6664 1 16 . 1 1 36 36 GLY C C 36 174.673 174.673 174.200 0.473 19168 6665 1 16 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.495 0.032 19168 6666 1 16 . 1 1 37 37 LYS N N 37 120.464 120.464 119.135 1.329 19168 6667 1 16 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.766 -0.269 19168 6668 1 16 . 1 1 37 37 LYS C C 37 174.580 174.580 175.856 -1.276 19168 6669 1 16 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.598 0.491 19168 6670 1 16 . 1 1 37 37 LYS CB C 37 32.745 32.745 35.061 -2.316 19168 6671 1 16 . 1 1 38 38 HIS N N 38 116.878 116.878 116.684 0.194 19168 6672 1 16 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.911 0.108 19168 6673 1 16 . 1 1 38 38 HIS C C 38 175.268 175.268 174.130 1.138 19168 6674 1 16 . 1 1 38 38 HIS CA C 38 54.150 54.150 54.789 -0.639 19168 6675 1 16 . 1 1 38 38 HIS CB C 38 32.877 32.877 33.323 -0.446 19168 6676 1 16 . 1 1 39 39 VAL N N 39 119.782 119.782 118.885 0.897 19168 6677 1 16 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.399 0.397 19168 6678 1 16 . 1 1 39 39 VAL C C 39 173.320 173.320 174.318 -0.998 19168 6679 1 16 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.396 0.370 19168 6680 1 16 . 1 1 39 39 VAL CB C 39 35.433 35.433 34.063 1.370 19168 6681 1 16 . 1 1 40 40 ARG N N 40 128.358 128.358 127.295 1.063 19168 6682 1 16 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.551 0.564 19168 6683 1 16 . 1 1 40 40 ARG C C 40 175.659 175.659 174.871 0.788 19168 6684 1 16 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.643 -0.821 19168 6685 1 16 . 1 1 40 40 ARG CB C 40 33.007 33.007 31.121 1.886 19168 6686 1 16 . 1 1 41 41 PHE N N 41 126.396 126.396 127.486 -1.090 19168 6687 1 16 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.002 0.176 19168 6688 1 16 . 1 1 41 41 PHE C C 41 176.107 176.107 175.273 0.834 19168 6689 1 16 . 1 1 41 41 PHE CA C 41 57.696 57.696 58.073 -0.377 19168 6690 1 16 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.659 2.387 19168 6691 1 16 . 1 1 42 42 ARG N N 42 120.641 120.641 125.436 -4.795 19168 6692 1 16 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.287 0.252 19168 6693 1 16 . 1 1 42 42 ARG C C 42 175.010 175.010 174.782 0.228 19168 6694 1 16 . 1 1 42 42 ARG CA C 42 54.695 54.695 55.068 -0.373 19168 6695 1 16 . 1 1 42 42 ARG CB C 42 34.374 34.374 32.490 1.884 19168 6696 1 16 . 1 1 43 43 VAL N N 43 125.565 125.565 125.254 0.311 19168 6697 1 16 . 1 1 43 43 VAL HA H 43 4.665 4.665 4.997 -0.332 19168 6698 1 16 . 1 1 43 43 VAL C C 43 175.325 175.325 173.871 1.454 19168 6699 1 16 . 1 1 43 43 VAL CA C 43 60.816 60.816 60.493 0.323 19168 6700 1 16 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.066 -2.083 19168 6701 1 16 . 1 1 44 44 PHE N N 44 128.291 128.291 130.162 -1.871 19168 6702 1 16 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.960 -0.342 19168 6703 1 16 . 1 1 44 44 PHE C C 44 174.477 174.477 174.870 -0.393 19168 6704 1 16 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.322 0.826 19168 6705 1 16 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.559 -1.617 19168 6706 1 16 . 1 1 45 45 LEU N N 45 128.360 128.360 129.575 -1.215 19168 6707 1 16 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.189 0.202 19168 6708 1 16 . 1 1 45 45 LEU C C 45 174.342 174.342 175.438 -1.096 19168 6709 1 16 . 1 1 45 45 LEU CA C 45 53.586 53.586 53.933 -0.347 19168 6710 1 16 . 1 1 45 45 LEU CB C 45 41.113 41.113 40.278 0.835 19168 6711 1 16 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.295 -0.203 19168 6712 1 16 . 1 1 46 46 LYS CA C 46 55.079 55.079 56.893 -1.814 19168 6713 1 16 . 1 1 46 46 LYS CB C 46 34.295 34.295 33.099 1.196 19168 6714 1 16 . 1 1 47 47 GLY CA C 47 46.813 46.813 45.022 1.791 19168 6715 1 16 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.472 -0.272 19168 6716 1 16 . 1 1 48 48 ARG C C 48 178.069 178.069 177.350 0.719 19168 6717 1 16 . 1 1 48 48 ARG CA C 48 57.862 57.862 56.276 1.586 19168 6718 1 16 . 1 1 48 48 ARG CB C 48 29.444 29.444 30.548 -1.104 19168 6719 1 16 . 1 1 49 49 GLU N N 49 119.779 119.779 119.969 -0.190 19168 6720 1 16 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.134 -0.081 19168 6721 1 16 . 1 1 49 49 GLU C C 49 178.227 178.227 177.504 0.723 19168 6722 1 16 . 1 1 49 49 GLU CA C 49 57.436 57.436 57.871 -0.435 19168 6723 1 16 . 1 1 49 49 GLU CB C 49 29.745 29.745 28.748 0.997 19168 6724 1 16 . 1 1 50 50 MET N N 50 116.370 116.370 118.157 -1.787 19168 6725 1 16 . 1 1 50 50 MET HA H 50 4.024 4.024 4.058 -0.034 19168 6726 1 16 . 1 1 50 50 MET C C 50 175.912 175.912 176.448 -0.536 19168 6727 1 16 . 1 1 50 50 MET CA C 50 56.664 56.664 57.532 -0.868 19168 6728 1 16 . 1 1 50 50 MET CB C 50 32.033 32.033 32.277 -0.244 19168 6729 1 16 . 1 1 51 51 ALA N N 51 118.880 118.880 119.330 -0.450 19168 6730 1 16 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.259 0.085 19168 6731 1 16 . 1 1 51 51 ALA C C 51 177.746 177.746 177.716 0.030 19168 6732 1 16 . 1 1 51 51 ALA CA C 51 52.391 52.391 52.896 -0.505 19168 6733 1 16 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.375 0.068 19168 6734 1 16 . 1 1 52 52 THR N N 52 108.299 108.299 111.647 -3.348 19168 6735 1 16 . 1 1 52 52 THR HA H 52 4.869 4.869 4.624 0.245 19168 6736 1 16 . 1 1 52 52 THR C C 52 173.933 173.933 172.801 1.132 19168 6737 1 16 . 1 1 52 52 THR CA C 52 57.554 57.554 58.725 -1.171 19168 6738 1 16 . 1 1 52 52 THR CB C 52 69.479 69.479 69.980 -0.501 19168 6739 1 16 . 1 1 53 53 PRO HA H 53 3.931 3.931 4.093 -0.162 19168 6740 1 16 . 1 1 53 53 PRO C C 53 178.185 178.185 178.228 -0.043 19168 6741 1 16 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.157 0.862 19168 6742 1 16 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.343 -0.827 19168 6743 1 16 . 1 1 54 54 GLU N N 54 120.653 120.653 118.879 1.774 19168 6744 1 16 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.059 -0.043 19168 6745 1 16 . 1 1 54 54 GLU C C 54 178.608 178.608 177.846 0.762 19168 6746 1 16 . 1 1 54 54 GLU CA C 54 59.472 59.472 58.933 0.539 19168 6747 1 16 . 1 1 54 54 GLU CB C 54 27.419 27.419 29.177 -1.758 19168 6748 1 16 . 1 1 55 55 ALA N N 55 124.380 124.380 121.155 3.225 19168 6749 1 16 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.078 0.245 19168 6750 1 16 . 1 1 55 55 ALA C C 55 181.502 181.502 179.720 1.782 19168 6751 1 16 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.243 -0.463 19168 6752 1 16 . 1 1 55 55 ALA CB C 55 18.401 18.401 17.966 0.435 19168 6753 1 16 . 1 1 56 56 GLY N N 56 105.673 105.673 106.763 -1.090 19168 6754 1 16 . 1 1 56 56 GLY C C 56 174.278 174.278 176.253 -1.975 19168 6755 1 16 . 1 1 56 56 GLY CA C 56 46.879 46.879 46.938 -0.059 19168 6756 1 16 . 1 1 57 57 VAL N N 57 122.685 122.685 123.036 -0.351 19168 6757 1 16 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.581 -0.259 19168 6758 1 16 . 1 1 57 57 VAL C C 57 177.134 177.134 177.697 -0.563 19168 6759 1 16 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.479 0.917 19168 6760 1 16 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.608 0.161 19168 6761 1 16 . 1 1 58 58 ALA N N 58 119.580 119.580 122.491 -2.911 19168 6762 1 16 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.057 0.037 19168 6763 1 16 . 1 1 58 58 ALA C C 58 180.788 180.788 179.579 1.209 19168 6764 1 16 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.341 -0.288 19168 6765 1 16 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.276 -0.422 19168 6766 1 16 . 1 1 59 59 LEU N N 59 119.723 119.723 120.456 -0.733 19168 6767 1 16 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.023 0.235 19168 6768 1 16 . 1 1 59 59 LEU C C 59 178.024 178.024 178.639 -0.615 19168 6769 1 16 . 1 1 59 59 LEU CA C 59 57.710 57.710 57.978 -0.268 19168 6770 1 16 . 1 1 59 59 LEU CB C 59 41.701 41.701 41.999 -0.298 19168 6771 1 16 . 1 1 60 60 LEU N N 60 117.978 117.978 119.170 -1.192 19168 6772 1 16 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.810 0.047 19168 6773 1 16 . 1 1 60 60 LEU C C 60 178.851 178.851 179.150 -0.299 19168 6774 1 16 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.207 -0.563 19168 6775 1 16 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.253 -0.965 19168 6776 1 16 . 1 1 61 61 GLU N N 61 119.906 119.906 119.192 0.714 19168 6777 1 16 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.055 0.436 19168 6778 1 16 . 1 1 61 61 GLU C C 61 179.519 179.519 179.106 0.413 19168 6779 1 16 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.581 -0.839 19168 6780 1 16 . 1 1 61 61 GLU CB C 61 28.813 28.813 28.943 -0.130 19168 6781 1 16 . 1 1 62 62 LYS N N 62 122.015 122.015 120.540 1.475 19168 6782 1 16 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.099 0.029 19168 6783 1 16 . 1 1 62 62 LYS C C 62 179.843 179.843 179.236 0.607 19168 6784 1 16 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.377 -0.040 19168 6785 1 16 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.376 -0.729 19168 6786 1 16 . 1 1 63 63 ILE N N 63 120.882 120.882 119.685 1.197 19168 6787 1 16 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.676 -0.180 19168 6788 1 16 . 1 1 63 63 ILE C C 63 177.761 177.761 177.441 0.320 19168 6789 1 16 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.978 0.204 19168 6790 1 16 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.843 -0.457 19168 6791 1 16 . 1 1 64 64 TRP N N 64 120.279 120.279 121.643 -1.364 19168 6792 1 16 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.042 0.442 19168 6793 1 16 . 1 1 64 64 TRP C C 64 177.056 177.056 177.781 -0.725 19168 6794 1 16 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.423 -1.329 19168 6795 1 16 . 1 1 64 64 TRP CB C 64 29.635 29.635 29.865 -0.230 19168 6796 1 16 . 1 1 65 65 THR N N 65 109.483 109.483 113.702 -4.219 19168 6797 1 16 . 1 1 65 65 THR HA H 65 3.744 3.744 3.580 0.164 19168 6798 1 16 . 1 1 65 65 THR C C 65 176.224 176.224 175.993 0.231 19168 6799 1 16 . 1 1 65 65 THR CA C 65 65.568 65.568 65.380 0.188 19168 6800 1 16 . 1 1 65 65 THR CB C 65 69.308 69.308 68.415 0.893 19168 6801 1 16 . 1 1 66 66 MET N N 66 117.791 117.791 117.700 0.091 19168 6802 1 16 . 1 1 66 66 MET HA H 66 4.110 4.110 4.283 -0.173 19168 6803 1 16 . 1 1 66 66 MET C C 66 177.782 177.782 178.046 -0.264 19168 6804 1 16 . 1 1 66 66 MET CA C 66 58.304 58.304 56.615 1.689 19168 6805 1 16 . 1 1 66 66 MET CB C 66 34.040 34.040 32.662 1.378 19168 6806 1 16 . 1 1 67 67 ILE N N 67 109.871 109.871 111.834 -1.963 19168 6807 1 16 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.356 0.286 19168 6808 1 16 . 1 1 67 67 ILE C C 67 176.713 176.713 176.640 0.073 19168 6809 1 16 . 1 1 67 67 ILE CA C 67 61.174 61.174 62.006 -0.832 19168 6810 1 16 . 1 1 67 67 ILE CB C 67 39.813 39.813 37.769 2.045 19168 6811 1 16 . 1 1 68 68 GLU N N 68 121.972 121.972 121.483 0.489 19168 6812 1 16 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.569 -0.821 19168 6813 1 16 . 1 1 68 68 GLU C C 68 175.855 175.855 177.276 -1.421 19168 6814 1 16 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.169 0.122 19168 6815 1 16 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.407 1.085 19168 6816 1 16 . 1 1 69 69 ASN N N 69 114.338 114.338 117.000 -2.662 19168 6817 1 16 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.392 0.188 19168 6818 1 16 . 1 1 69 69 ASN C C 69 175.904 175.904 177.450 -1.546 19168 6819 1 16 . 1 1 69 69 ASN CA C 69 54.597 54.597 56.082 -1.485 19168 6820 1 16 . 1 1 69 69 ASN CB C 69 38.323 38.323 38.538 -0.214 19168 6821 1 16 . 1 1 70 70 GLU N N 70 116.936 116.936 116.887 0.049 19168 6822 1 16 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.601 -0.053 19168 6823 1 16 . 1 1 70 70 GLU C C 70 174.941 174.941 174.358 0.583 19168 6824 1 16 . 1 1 70 70 GLU CA C 70 55.983 55.983 55.511 0.472 19168 6825 1 16 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.293 0.055 19168 6826 1 16 . 1 1 71 71 ALA N N 71 122.966 122.966 122.057 0.909 19168 6827 1 16 . 1 1 71 71 ALA HA H 71 5.246 5.246 5.049 0.197 19168 6828 1 16 . 1 1 71 71 ALA C C 71 173.907 173.907 175.588 -1.681 19168 6829 1 16 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.712 0.107 19168 6830 1 16 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.546 1.514 19168 6831 1 16 . 1 1 72 72 ASN N N 72 115.820 115.820 119.771 -3.951 19168 6832 1 16 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.398 0.043 19168 6833 1 16 . 1 1 72 72 ASN C C 72 174.137 174.137 173.727 0.410 19168 6834 1 16 . 1 1 72 72 ASN CA C 72 51.659 51.659 52.283 -0.624 19168 6835 1 16 . 1 1 72 72 ASN CB C 72 42.186 42.186 42.288 -0.101 19168 6836 1 16 . 1 1 73 73 ARG N N 73 118.340 118.340 122.729 -4.389 19168 6837 1 16 . 1 1 73 73 ARG HA H 73 4.778 4.778 4.058 0.720 19168 6838 1 16 . 1 1 73 73 ARG C C 73 174.674 174.674 175.865 -1.191 19168 6839 1 16 . 1 1 73 73 ARG CA C 73 54.869 54.869 55.663 -0.794 19168 6840 1 16 . 1 1 73 73 ARG CB C 73 32.125 32.125 30.345 1.780 19168 6841 1 16 . 1 1 74 74 ASP N N 74 124.007 124.007 127.698 -3.691 19168 6842 1 16 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.442 0.100 19168 6843 1 16 . 1 1 74 74 ASP C C 74 175.935 175.935 176.221 -0.286 19168 6844 1 16 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.433 -1.036 19168 6845 1 16 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.773 0.447 19168 6846 1 16 . 1 1 75 75 LYS N N 75 116.482 116.482 116.359 0.123 19168 6847 1 16 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.465 -0.020 19168 6848 1 16 . 1 1 75 75 LYS C C 75 175.135 175.135 174.212 0.923 19168 6849 1 16 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.382 -0.597 19168 6850 1 16 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.762 0.713 19168 6851 1 16 . 1 1 76 76 GLU N N 76 120.126 120.126 121.404 -1.278 19168 6852 1 16 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.268 -0.360 19168 6853 1 16 . 1 1 76 76 GLU C C 76 173.204 173.204 175.353 -2.149 19168 6854 1 16 . 1 1 76 76 GLU CA C 76 55.524 55.524 54.846 0.678 19168 6855 1 16 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.145 -1.634 19168 6856 1 16 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.662 0.115 19168 6857 1 16 . 1 1 77 77 PRO C C 77 174.933 174.933 176.058 -1.125 19168 6858 1 16 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.924 0.498 19168 6859 1 16 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.341 0.050 19168 6860 1 16 . 1 1 78 78 ASN N N 78 119.292 119.292 120.789 -1.497 19168 6861 1 16 . 1 1 78 78 ASN HA H 78 5.093 5.093 5.027 0.066 19168 6862 1 16 . 1 1 78 78 ASN C C 78 172.876 172.876 173.958 -1.082 19168 6863 1 16 . 1 1 78 78 ASN CA C 78 51.928 51.928 52.644 -0.716 19168 6864 1 16 . 1 1 78 78 ASN CB C 78 42.017 42.017 42.247 -0.230 19168 6865 1 16 . 1 1 79 79 PHE N N 79 125.023 125.023 125.408 -0.385 19168 6866 1 16 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.200 0.223 19168 6867 1 16 . 1 1 79 79 PHE C C 79 174.552 174.552 174.947 -0.395 19168 6868 1 16 . 1 1 79 79 PHE CA C 79 55.210 55.210 57.867 -2.657 19168 6869 1 16 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.318 -0.209 19168 6870 1 16 . 1 1 80 80 GLU N N 80 128.920 128.920 127.938 0.982 19168 6871 1 16 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.474 -0.266 19168 6872 1 16 . 1 1 80 80 GLU C C 80 175.538 175.538 175.689 -0.151 19168 6873 1 16 . 1 1 80 80 GLU CA C 80 55.724 55.724 54.871 0.853 19168 6874 1 16 . 1 1 80 80 GLU CB C 80 32.135 32.135 32.620 -0.485 19168 6875 1 16 . 1 1 81 81 GLY N N 81 116.695 116.695 114.238 2.457 19168 6876 1 16 . 1 1 81 81 GLY C C 81 173.950 173.950 174.832 -0.882 19168 6877 1 16 . 1 1 81 81 GLY CA C 81 46.967 46.967 47.050 -0.083 19168 6878 1 16 . 1 1 82 82 ARG N N 82 124.481 124.481 122.736 1.745 19168 6879 1 16 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.518 0.021 19168 6880 1 16 . 1 1 82 82 ARG C C 82 173.437 173.437 174.485 -1.048 19168 6881 1 16 . 1 1 82 82 ARG CA C 82 55.156 55.156 54.715 0.441 19168 6882 1 16 . 1 1 82 82 ARG CB C 82 30.255 30.255 31.246 -0.991 19168 6883 1 16 . 1 1 83 83 TYR N N 83 114.539 114.539 118.914 -4.375 19168 6884 1 16 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.574 0.374 19168 6885 1 16 . 1 1 83 83 TYR C C 83 175.909 175.909 174.609 1.300 19168 6886 1 16 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.753 -0.696 19168 6887 1 16 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.105 0.895 19168 6888 1 16 . 1 1 84 84 VAL N N 84 118.812 118.812 122.041 -3.229 19168 6889 1 16 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.656 0.211 19168 6890 1 16 . 1 1 84 84 VAL C C 84 174.982 174.982 175.110 -0.128 19168 6891 1 16 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.806 -0.571 19168 6892 1 16 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.805 -0.314 19168 6893 1 16 . 1 1 85 85 ASN N N 85 124.630 124.630 126.173 -1.543 19168 6894 1 16 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.091 -0.087 19168 6895 1 16 . 1 1 85 85 ASN C C 85 175.392 175.392 173.850 1.542 19168 6896 1 16 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.815 0.781 19168 6897 1 16 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.210 1.996 19168 6898 1 16 . 1 1 86 86 MET N N 86 118.969 118.969 122.450 -3.481 19168 6899 1 16 . 1 1 86 86 MET HA H 86 4.640 4.640 4.873 -0.233 19168 6900 1 16 . 1 1 86 86 MET C C 86 172.378 172.378 173.463 -1.085 19168 6901 1 16 . 1 1 86 86 MET CA C 86 56.158 56.158 54.950 1.208 19168 6902 1 16 . 1 1 86 86 MET CB C 86 39.138 39.138 36.703 2.435 19168 6903 1 16 . 1 1 87 87 LEU N N 87 131.886 131.886 128.241 3.645 19168 6904 1 16 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.171 0.210 19168 6905 1 16 . 1 1 87 87 LEU C C 87 176.003 176.003 175.171 0.832 19168 6906 1 16 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.213 0.917 19168 6907 1 16 . 1 1 87 87 LEU CB C 87 44.473 44.473 43.768 0.705 19168 6908 1 16 . 1 1 88 88 VAL N N 88 121.165 121.165 121.188 -0.023 19168 6909 1 16 . 1 1 88 88 VAL HA H 88 5.510 5.510 4.841 0.669 19168 6910 1 16 . 1 1 88 88 VAL C C 88 173.666 173.666 174.924 -1.258 19168 6911 1 16 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.955 -1.355 19168 6912 1 16 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.860 -0.067 19168 6913 1 16 . 1 1 89 89 THR N N 89 111.786 111.786 119.833 -8.047 19168 6914 1 16 . 1 1 89 89 THR HA H 89 4.720 4.720 4.145 0.575 19168 6915 1 16 . 1 1 89 89 THR C C 89 171.898 171.898 172.457 -0.559 19168 6916 1 16 . 1 1 89 89 THR CA C 89 57.985 57.985 59.295 -1.310 19168 6917 1 16 . 1 1 89 89 THR CB C 89 69.113 69.113 69.161 -0.048 19168 6918 1 16 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.441 0.142 19168 6919 1 16 . 1 1 90 90 PRO C C 90 177.403 177.403 176.372 1.031 19168 6920 1 16 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.665 0.866 19168 6921 1 16 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.226 -0.183 19168 6922 1 16 . 1 1 91 91 LYS N N 91 123.696 123.696 124.263 -0.567 19168 6923 1 16 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.328 -0.217 19168 6924 1 16 . 1 1 91 91 LYS C C 91 176.568 176.568 176.151 0.417 19168 6925 1 16 . 1 1 91 91 LYS CA C 91 57.208 57.208 55.637 1.571 19168 6926 1 16 . 1 1 91 91 LYS CB C 91 33.183 33.183 32.434 0.749 19168 6927 1 16 . 1 1 92 92 LYS N N 92 122.054 122.054 125.890 -3.836 19168 6928 1 16 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.321 -0.005 19168 6929 1 16 . 1 1 92 92 LYS C C 92 175.956 175.956 176.974 -1.018 19168 6930 1 16 . 1 1 92 92 LYS CA C 92 55.942 55.942 56.657 -0.715 19168 6931 1 16 . 1 1 92 92 LYS CB C 92 33.000 33.000 32.503 0.497 19168 6932 1 16 . 1 1 93 93 ALA N N 93 126.278 126.278 128.456 -2.178 19168 6933 1 16 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.389 -0.048 19168 6934 1 16 . 1 1 93 93 ALA C C 93 177.592 177.592 178.829 -1.237 19168 6935 1 16 . 1 1 93 93 ALA CA C 93 52.279 52.279 53.134 -0.855 19168 6936 1 16 . 1 1 93 93 ALA CB C 93 19.332 19.332 18.561 0.771 19168 6937 1 16 . 1 1 94 94 GLU N N 94 120.522 120.522 118.732 1.790 19168 6938 1 16 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.182 0.102 19168 6939 1 16 . 1 1 94 94 GLU C C 94 177.041 177.041 176.538 0.503 19168 6940 1 16 . 1 1 94 94 GLU CA C 94 56.606 56.606 56.919 -0.313 19168 6941 1 16 . 1 1 94 94 GLU CB C 94 30.353 30.353 29.853 0.500 19168 6942 1 16 . 1 1 95 95 GLY N N 95 109.755 109.755 107.342 2.413 19168 6943 1 16 . 1 1 95 95 GLY C C 95 173.939 173.939 173.508 0.431 19168 6944 1 16 . 1 1 95 95 GLY CA C 95 45.168 45.168 44.409 0.759 19168 6945 1 17 . 1 1 5 5 VAL N N 5 123.289 123.289 122.661 0.628 19168 6946 1 17 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.233 -0.214 19168 6947 1 17 . 1 1 5 5 VAL C C 5 175.799 175.799 175.356 0.443 19168 6948 1 17 . 1 1 5 5 VAL CA C 5 62.120 62.120 61.858 0.262 19168 6949 1 17 . 1 1 5 5 VAL CB C 5 32.757 32.757 32.186 0.571 19168 6950 1 17 . 1 1 6 6 ILE N N 6 126.794 126.794 122.131 4.663 19168 6951 1 17 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.084 -0.117 19168 6952 1 17 . 1 1 6 6 ILE C C 6 175.103 175.103 174.895 0.208 19168 6953 1 17 . 1 1 6 6 ILE CA C 6 60.227 60.227 60.705 -0.478 19168 6954 1 17 . 1 1 6 6 ILE CB C 6 38.565 38.565 38.149 0.416 19168 6955 1 17 . 1 1 7 7 ASP N N 7 127.797 127.797 128.251 -0.454 19168 6956 1 17 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.564 -0.020 19168 6957 1 17 . 1 1 7 7 ASP C C 7 174.000 174.000 175.627 -1.627 19168 6958 1 17 . 1 1 7 7 ASP CA C 7 53.591 53.591 54.125 -0.534 19168 6959 1 17 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.392 0.760 19168 6960 1 17 . 1 1 8 8 ILE N N 8 122.764 122.764 125.603 -2.839 19168 6961 1 17 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.052 0.268 19168 6962 1 17 . 1 1 8 8 ILE C C 8 176.337 176.337 175.827 0.510 19168 6963 1 17 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.964 -0.788 19168 6964 1 17 . 1 1 8 8 ILE CB C 8 39.542 39.542 38.676 0.866 19168 6965 1 17 . 1 1 9 9 LYS N N 9 127.990 127.990 127.219 0.771 19168 6966 1 17 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.336 -0.014 19168 6967 1 17 . 1 1 9 9 LYS C C 9 174.759 174.759 175.565 -0.806 19168 6968 1 17 . 1 1 9 9 LYS CA C 9 52.315 52.315 53.814 -1.499 19168 6969 1 17 . 1 1 9 9 LYS CB C 9 32.902 32.902 32.645 0.257 19168 6970 1 17 . 1 1 10 10 GLU N N 10 123.021 123.021 123.882 -0.861 19168 6971 1 17 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.764 0.371 19168 6972 1 17 . 1 1 10 10 GLU C C 10 176.215 176.215 175.538 0.677 19168 6973 1 17 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.154 -0.252 19168 6974 1 17 . 1 1 10 10 GLU CB C 10 32.037 32.037 30.661 1.376 19168 6975 1 17 . 1 1 11 11 ILE N N 11 126.526 126.526 126.926 -0.400 19168 6976 1 17 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.105 0.230 19168 6977 1 17 . 1 1 11 11 ILE C C 11 174.334 174.334 174.926 -0.592 19168 6978 1 17 . 1 1 11 11 ILE CA C 11 60.310 60.310 59.065 1.245 19168 6979 1 17 . 1 1 11 11 ILE CB C 11 39.826 39.826 37.495 2.331 19168 6980 1 17 . 1 1 12 12 LYS N N 12 128.164 128.164 129.364 -1.200 19168 6981 1 17 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.178 0.167 19168 6982 1 17 . 1 1 12 12 LYS C C 12 176.378 176.378 175.653 0.725 19168 6983 1 17 . 1 1 12 12 LYS CA C 12 55.940 55.940 56.093 -0.152 19168 6984 1 17 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.729 0.327 19168 6985 1 17 . 1 1 13 13 LEU N N 13 121.881 121.881 126.239 -4.358 19168 6986 1 17 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.852 0.102 19168 6987 1 17 . 1 1 13 13 LEU C C 13 175.137 175.137 174.899 0.238 19168 6988 1 17 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.935 0.039 19168 6989 1 17 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.001 0.284 19168 6990 1 17 . 1 1 14 14 SER N N 14 115.759 115.759 112.498 3.261 19168 6991 1 17 . 1 1 14 14 SER HA H 14 4.889 4.889 5.162 -0.273 19168 6992 1 17 . 1 1 14 14 SER C C 14 173.993 173.993 174.514 -0.521 19168 6993 1 17 . 1 1 14 14 SER CA C 14 56.052 56.052 56.867 -0.815 19168 6994 1 17 . 1 1 14 14 SER CB C 14 64.775 64.775 66.007 -1.232 19168 6995 1 17 . 1 1 15 15 VAL N N 15 120.993 120.993 122.421 -1.428 19168 6996 1 17 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.760 -0.026 19168 6997 1 17 . 1 1 15 15 VAL C C 15 176.964 176.964 177.017 -0.053 19168 6998 1 17 . 1 1 15 15 VAL CA C 15 65.427 65.427 66.262 -0.835 19168 6999 1 17 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.914 -0.129 19168 7000 1 17 . 1 1 16 16 LYS N N 16 118.897 118.897 119.038 -0.141 19168 7001 1 17 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.279 0.122 19168 7002 1 17 . 1 1 16 16 LYS C C 16 175.489 175.489 175.414 0.075 19168 7003 1 17 . 1 1 16 16 LYS CA C 16 55.155 55.155 56.152 -0.997 19168 7004 1 17 . 1 1 16 16 LYS CB C 16 30.929 30.929 30.500 0.429 19168 7005 1 17 . 1 1 17 17 ILE N N 17 122.247 122.247 120.696 1.551 19168 7006 1 17 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.323 -0.138 19168 7007 1 17 . 1 1 17 17 ILE C C 17 173.426 173.426 174.538 -1.112 19168 7008 1 17 . 1 1 17 17 ILE CA C 17 61.276 61.276 59.651 1.625 19168 7009 1 17 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.464 -1.384 19168 7010 1 17 . 1 1 18 18 ALA N N 18 129.434 129.434 126.565 2.869 19168 7011 1 17 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.695 -0.216 19168 7012 1 17 . 1 1 18 18 ALA C C 18 179.130 179.130 177.501 1.629 19168 7013 1 17 . 1 1 18 18 ALA CA C 18 51.437 51.437 50.511 0.926 19168 7014 1 17 . 1 1 18 18 ALA CB C 18 19.909 19.909 21.101 -1.192 19168 7015 1 17 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.051 -0.254 19168 7016 1 17 . 1 1 19 19 GLN CA C 19 59.231 59.231 58.918 0.313 19168 7017 1 17 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.360 -0.185 19168 7018 1 17 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.555 -0.125 19168 7019 1 17 . 1 1 20 20 ASN C C 20 177.272 177.272 177.395 -0.123 19168 7020 1 17 . 1 1 20 20 ASN CA C 20 56.184 56.184 55.965 0.219 19168 7021 1 17 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.201 0.252 19168 7022 1 17 . 1 1 21 21 ASP N N 21 119.132 119.132 120.132 -1.000 19168 7023 1 17 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.504 0.294 19168 7024 1 17 . 1 1 21 21 ASP C C 21 178.707 178.707 178.534 0.173 19168 7025 1 17 . 1 1 21 21 ASP CA C 21 56.886 56.886 56.801 0.085 19168 7026 1 17 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.671 -0.006 19168 7027 1 17 . 1 1 22 22 ILE N N 22 122.030 122.030 119.976 2.054 19168 7028 1 17 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.645 -0.227 19168 7029 1 17 . 1 1 22 22 ILE C C 22 177.454 177.454 177.908 -0.454 19168 7030 1 17 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.425 1.301 19168 7031 1 17 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.771 -0.205 19168 7032 1 17 . 1 1 23 23 ASN N N 23 116.728 116.728 118.835 -2.107 19168 7033 1 17 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.470 -0.257 19168 7034 1 17 . 1 1 23 23 ASN C C 23 178.260 178.260 177.938 0.322 19168 7035 1 17 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.905 -0.631 19168 7036 1 17 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.706 -1.498 19168 7037 1 17 . 1 1 24 24 TYR N N 24 119.864 119.864 121.643 -1.779 19168 7038 1 17 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.194 0.099 19168 7039 1 17 . 1 1 24 24 TYR C C 24 177.719 177.719 177.474 0.245 19168 7040 1 17 . 1 1 24 24 TYR CA C 24 61.048 61.048 62.204 -1.156 19168 7041 1 17 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.703 -0.420 19168 7042 1 17 . 1 1 25 25 LYS N N 25 119.730 119.730 118.862 0.868 19168 7043 1 17 . 1 1 25 25 LYS HA H 25 4.111 4.111 4.032 0.079 19168 7044 1 17 . 1 1 25 25 LYS C C 25 179.152 179.152 179.034 0.118 19168 7045 1 17 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.736 -0.574 19168 7046 1 17 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.858 -0.564 19168 7047 1 17 . 1 1 26 26 VAL N N 26 119.387 119.387 117.044 2.343 19168 7048 1 17 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.890 -0.270 19168 7049 1 17 . 1 1 26 26 VAL C C 26 177.017 177.017 177.673 -0.656 19168 7050 1 17 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.371 1.290 19168 7051 1 17 . 1 1 26 26 VAL CB C 26 31.550 31.550 30.714 0.836 19168 7052 1 17 . 1 1 27 27 LYS N N 27 120.420 120.420 120.918 -0.498 19168 7053 1 17 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.902 0.044 19168 7054 1 17 . 1 1 27 27 LYS C C 27 179.458 179.458 179.198 0.260 19168 7055 1 17 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.811 0.067 19168 7056 1 17 . 1 1 27 27 LYS CB C 27 31.848 31.848 31.997 -0.149 19168 7057 1 17 . 1 1 28 28 HIS N N 28 118.160 118.160 118.968 -0.808 19168 7058 1 17 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.739 -0.552 19168 7059 1 17 . 1 1 28 28 HIS C C 28 177.085 177.085 177.736 -0.651 19168 7060 1 17 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.638 -1.753 19168 7061 1 17 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.980 -0.224 19168 7062 1 17 . 1 1 29 29 ALA N N 29 120.579 120.579 122.432 -1.853 19168 7063 1 17 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.288 -0.290 19168 7064 1 17 . 1 1 29 29 ALA C C 29 179.299 179.299 179.726 -0.427 19168 7065 1 17 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.296 0.271 19168 7066 1 17 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.347 1.102 19168 7067 1 17 . 1 1 30 30 LEU N N 30 117.262 117.262 117.571 -0.309 19168 7068 1 17 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.912 0.163 19168 7069 1 17 . 1 1 30 30 LEU C C 30 180.017 180.017 179.096 0.921 19168 7070 1 17 . 1 1 30 30 LEU CA C 30 58.232 58.232 58.116 0.116 19168 7071 1 17 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.591 -0.265 19168 7072 1 17 . 1 1 31 31 GLU N N 31 120.625 120.625 119.874 0.751 19168 7073 1 17 . 1 1 31 31 GLU HA H 31 4.068 4.068 4.365 -0.297 19168 7074 1 17 . 1 1 31 31 GLU C C 31 179.572 179.572 179.449 0.123 19168 7075 1 17 . 1 1 31 31 GLU CA C 31 59.275 59.275 58.991 0.284 19168 7076 1 17 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.297 -0.322 19168 7077 1 17 . 1 1 32 32 PHE N N 32 118.245 118.245 118.406 -0.161 19168 7078 1 17 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.269 0.257 19168 7079 1 17 . 1 1 32 32 PHE C C 32 179.123 179.123 177.861 1.262 19168 7080 1 17 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.740 -3.043 19168 7081 1 17 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.868 -1.616 19168 7082 1 17 . 1 1 33 33 LEU N N 33 121.684 121.684 120.237 1.447 19168 7083 1 17 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.274 0.317 19168 7084 1 17 . 1 1 33 33 LEU C C 33 181.655 181.655 179.837 1.818 19168 7085 1 17 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.487 0.685 19168 7086 1 17 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.552 0.140 19168 7087 1 17 . 1 1 34 34 GLU N N 34 122.046 122.046 119.214 2.832 19168 7088 1 17 . 1 1 34 34 GLU HA H 34 4.152 4.152 3.996 0.156 19168 7089 1 17 . 1 1 34 34 GLU C C 34 178.237 178.237 178.326 -0.089 19168 7090 1 17 . 1 1 34 34 GLU CA C 34 59.146 59.146 59.020 0.126 19168 7091 1 17 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.182 0.052 19168 7092 1 17 . 1 1 35 35 GLN N N 35 115.697 115.697 116.124 -0.427 19168 7093 1 17 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.273 0.114 19168 7094 1 17 . 1 1 35 35 GLN C C 35 176.456 176.456 176.565 -0.109 19168 7095 1 17 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.750 -0.064 19168 7096 1 17 . 1 1 35 35 GLN CB C 35 29.196 29.196 28.753 0.443 19168 7097 1 17 . 1 1 36 36 GLY N N 36 108.291 108.291 106.150 2.141 19168 7098 1 17 . 1 1 36 36 GLY C C 36 174.673 174.673 174.363 0.310 19168 7099 1 17 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.316 0.210 19168 7100 1 17 . 1 1 37 37 LYS N N 37 120.464 120.464 118.975 1.489 19168 7101 1 17 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.728 -0.231 19168 7102 1 17 . 1 1 37 37 LYS C C 37 174.580 174.580 176.008 -1.428 19168 7103 1 17 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.667 0.422 19168 7104 1 17 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.734 -1.989 19168 7105 1 17 . 1 1 38 38 HIS N N 38 116.878 116.878 117.039 -0.161 19168 7106 1 17 . 1 1 38 38 HIS HA H 38 5.019 5.019 5.255 -0.236 19168 7107 1 17 . 1 1 38 38 HIS C C 38 175.268 175.268 174.422 0.846 19168 7108 1 17 . 1 1 38 38 HIS CA C 38 54.150 54.150 54.604 -0.454 19168 7109 1 17 . 1 1 38 38 HIS CB C 38 32.877 32.877 33.380 -0.503 19168 7110 1 17 . 1 1 39 39 VAL N N 39 119.782 119.782 119.778 0.004 19168 7111 1 17 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.678 0.118 19168 7112 1 17 . 1 1 39 39 VAL C C 39 173.320 173.320 174.220 -0.900 19168 7113 1 17 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.494 0.272 19168 7114 1 17 . 1 1 39 39 VAL CB C 39 35.433 35.433 34.190 1.243 19168 7115 1 17 . 1 1 40 40 ARG N N 40 128.358 128.358 127.446 0.912 19168 7116 1 17 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.766 0.349 19168 7117 1 17 . 1 1 40 40 ARG C C 40 175.659 175.659 174.932 0.727 19168 7118 1 17 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.412 -0.590 19168 7119 1 17 . 1 1 40 40 ARG CB C 40 33.007 33.007 31.777 1.230 19168 7120 1 17 . 1 1 41 41 PHE N N 41 126.396 126.396 127.744 -1.348 19168 7121 1 17 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.167 0.011 19168 7122 1 17 . 1 1 41 41 PHE C C 41 176.107 176.107 175.386 0.721 19168 7123 1 17 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.728 -0.032 19168 7124 1 17 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.501 2.545 19168 7125 1 17 . 1 1 42 42 ARG N N 42 120.641 120.641 125.248 -4.607 19168 7126 1 17 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.077 0.462 19168 7127 1 17 . 1 1 42 42 ARG C C 42 175.010 175.010 174.607 0.403 19168 7128 1 17 . 1 1 42 42 ARG CA C 42 54.695 54.695 55.067 -0.372 19168 7129 1 17 . 1 1 42 42 ARG CB C 42 34.374 34.374 32.870 1.504 19168 7130 1 17 . 1 1 43 43 VAL N N 43 125.565 125.565 124.559 1.006 19168 7131 1 17 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.190 -0.525 19168 7132 1 17 . 1 1 43 43 VAL C C 43 175.325 175.325 173.638 1.687 19168 7133 1 17 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.528 1.288 19168 7134 1 17 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.208 -2.225 19168 7135 1 17 . 1 1 44 44 PHE N N 44 128.291 128.291 129.357 -1.066 19168 7136 1 17 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.849 -0.231 19168 7137 1 17 . 1 1 44 44 PHE C C 44 174.477 174.477 174.819 -0.342 19168 7138 1 17 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.209 0.939 19168 7139 1 17 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.233 -1.292 19168 7140 1 17 . 1 1 45 45 LEU N N 45 128.360 128.360 129.415 -1.055 19168 7141 1 17 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.160 0.231 19168 7142 1 17 . 1 1 45 45 LEU C C 45 174.342 174.342 175.538 -1.196 19168 7143 1 17 . 1 1 45 45 LEU CA C 45 53.586 53.586 53.970 -0.384 19168 7144 1 17 . 1 1 45 45 LEU CB C 45 41.113 41.113 40.282 0.831 19168 7145 1 17 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.229 -0.137 19168 7146 1 17 . 1 1 46 46 LYS CA C 46 55.079 55.079 55.919 -0.840 19168 7147 1 17 . 1 1 46 46 LYS CB C 46 34.295 34.295 32.614 1.681 19168 7148 1 17 . 1 1 47 47 GLY CA C 47 46.813 46.813 45.051 1.762 19168 7149 1 17 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.428 -0.228 19168 7150 1 17 . 1 1 48 48 ARG C C 48 178.069 178.069 176.195 1.874 19168 7151 1 17 . 1 1 48 48 ARG CA C 48 57.862 57.862 55.907 1.954 19168 7152 1 17 . 1 1 48 48 ARG CB C 48 29.444 29.444 31.082 -1.638 19168 7153 1 17 . 1 1 49 49 GLU N N 49 119.779 119.779 120.508 -0.729 19168 7154 1 17 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.209 -0.156 19168 7155 1 17 . 1 1 49 49 GLU C C 49 178.227 178.227 177.836 0.391 19168 7156 1 17 . 1 1 49 49 GLU CA C 49 57.436 57.436 57.985 -0.549 19168 7157 1 17 . 1 1 49 49 GLU CB C 49 29.745 29.745 28.669 1.076 19168 7158 1 17 . 1 1 50 50 MET N N 50 116.370 116.370 118.004 -1.634 19168 7159 1 17 . 1 1 50 50 MET HA H 50 4.024 4.024 4.193 -0.169 19168 7160 1 17 . 1 1 50 50 MET C C 50 175.912 175.912 177.088 -1.176 19168 7161 1 17 . 1 1 50 50 MET CA C 50 56.664 56.664 57.799 -1.135 19168 7162 1 17 . 1 1 50 50 MET CB C 50 32.033 32.033 32.028 0.005 19168 7163 1 17 . 1 1 51 51 ALA N N 51 118.880 118.880 120.136 -1.256 19168 7164 1 17 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.139 0.205 19168 7165 1 17 . 1 1 51 51 ALA C C 51 177.746 177.746 177.781 -0.035 19168 7166 1 17 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.406 -1.015 19168 7167 1 17 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.283 0.160 19168 7168 1 17 . 1 1 52 52 THR N N 52 108.299 108.299 111.771 -3.472 19168 7169 1 17 . 1 1 52 52 THR HA H 52 4.869 4.869 4.570 0.299 19168 7170 1 17 . 1 1 52 52 THR C C 52 173.933 173.933 172.363 1.570 19168 7171 1 17 . 1 1 52 52 THR CA C 52 57.554 57.554 59.930 -2.376 19168 7172 1 17 . 1 1 52 52 THR CB C 52 69.479 69.479 70.695 -1.216 19168 7173 1 17 . 1 1 53 53 PRO HA H 53 3.931 3.931 4.290 -0.359 19168 7174 1 17 . 1 1 53 53 PRO C C 53 178.185 178.185 177.807 0.378 19168 7175 1 17 . 1 1 53 53 PRO CA C 53 65.019 65.019 63.866 1.153 19168 7176 1 17 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.927 -1.411 19168 7177 1 17 . 1 1 54 54 GLU N N 54 120.653 120.653 121.000 -0.347 19168 7178 1 17 . 1 1 54 54 GLU HA H 54 4.016 4.016 3.906 0.110 19168 7179 1 17 . 1 1 54 54 GLU C C 54 178.608 178.608 177.882 0.726 19168 7180 1 17 . 1 1 54 54 GLU CA C 54 59.472 59.472 59.742 -0.270 19168 7181 1 17 . 1 1 54 54 GLU CB C 54 27.419 27.419 28.553 -1.134 19168 7182 1 17 . 1 1 55 55 ALA N N 55 124.380 124.380 121.010 3.370 19168 7183 1 17 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.094 0.229 19168 7184 1 17 . 1 1 55 55 ALA C C 55 181.502 181.502 179.817 1.685 19168 7185 1 17 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.359 -0.579 19168 7186 1 17 . 1 1 55 55 ALA CB C 55 18.401 18.401 17.882 0.519 19168 7187 1 17 . 1 1 56 56 GLY N N 56 105.673 105.673 106.920 -1.247 19168 7188 1 17 . 1 1 56 56 GLY C C 56 174.278 174.278 176.518 -2.240 19168 7189 1 17 . 1 1 56 56 GLY CA C 56 46.879 46.879 47.090 -0.210 19168 7190 1 17 . 1 1 57 57 VAL N N 57 122.685 122.685 123.063 -0.378 19168 7191 1 17 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.691 -0.369 19168 7192 1 17 . 1 1 57 57 VAL C C 57 177.134 177.134 178.034 -0.900 19168 7193 1 17 . 1 1 57 57 VAL CA C 57 67.396 67.396 65.827 1.569 19168 7194 1 17 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.039 0.730 19168 7195 1 17 . 1 1 58 58 ALA N N 58 119.580 119.580 122.375 -2.795 19168 7196 1 17 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.064 0.030 19168 7197 1 17 . 1 1 58 58 ALA C C 58 180.788 180.788 179.697 1.091 19168 7198 1 17 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.134 -0.081 19168 7199 1 17 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.412 -0.558 19168 7200 1 17 . 1 1 59 59 LEU N N 59 119.723 119.723 120.233 -0.510 19168 7201 1 17 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.030 0.228 19168 7202 1 17 . 1 1 59 59 LEU C C 59 178.024 178.024 178.540 -0.516 19168 7203 1 17 . 1 1 59 59 LEU CA C 59 57.710 57.710 57.916 -0.206 19168 7204 1 17 . 1 1 59 59 LEU CB C 59 41.701 41.701 41.956 -0.255 19168 7205 1 17 . 1 1 60 60 LEU N N 60 117.978 117.978 118.428 -0.450 19168 7206 1 17 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.740 0.117 19168 7207 1 17 . 1 1 60 60 LEU C C 60 178.851 178.851 179.202 -0.351 19168 7208 1 17 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.159 -0.515 19168 7209 1 17 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.412 -1.124 19168 7210 1 17 . 1 1 61 61 GLU N N 61 119.906 119.906 118.996 0.910 19168 7211 1 17 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.108 0.383 19168 7212 1 17 . 1 1 61 61 GLU C C 61 179.519 179.519 179.034 0.485 19168 7213 1 17 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.834 -1.092 19168 7214 1 17 . 1 1 61 61 GLU CB C 61 28.813 28.813 29.304 -0.491 19168 7215 1 17 . 1 1 62 62 LYS N N 62 122.015 122.015 121.106 0.909 19168 7216 1 17 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.081 0.047 19168 7217 1 17 . 1 1 62 62 LYS C C 62 179.843 179.843 178.949 0.894 19168 7218 1 17 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.332 0.005 19168 7219 1 17 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.427 -0.780 19168 7220 1 17 . 1 1 63 63 ILE N N 63 120.882 120.882 119.345 1.537 19168 7221 1 17 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.703 -0.207 19168 7222 1 17 . 1 1 63 63 ILE C C 63 177.761 177.761 177.474 0.287 19168 7223 1 17 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.814 0.368 19168 7224 1 17 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.950 -0.564 19168 7225 1 17 . 1 1 64 64 TRP N N 64 120.279 120.279 122.155 -1.876 19168 7226 1 17 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.098 0.386 19168 7227 1 17 . 1 1 64 64 TRP C C 64 177.056 177.056 177.557 -0.501 19168 7228 1 17 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.572 -1.478 19168 7229 1 17 . 1 1 64 64 TRP CB C 64 29.635 29.635 29.584 0.052 19168 7230 1 17 . 1 1 65 65 THR N N 65 109.483 109.483 113.319 -3.836 19168 7231 1 17 . 1 1 65 65 THR HA H 65 3.744 3.744 3.777 -0.033 19168 7232 1 17 . 1 1 65 65 THR C C 65 176.224 176.224 175.497 0.727 19168 7233 1 17 . 1 1 65 65 THR CA C 65 65.568 65.568 64.608 0.960 19168 7234 1 17 . 1 1 65 65 THR CB C 65 69.308 69.308 68.458 0.850 19168 7235 1 17 . 1 1 66 66 MET N N 66 117.791 117.791 116.996 0.795 19168 7236 1 17 . 1 1 66 66 MET HA H 66 4.110 4.110 4.211 -0.101 19168 7237 1 17 . 1 1 66 66 MET C C 66 177.782 177.782 177.350 0.432 19168 7238 1 17 . 1 1 66 66 MET CA C 66 58.304 58.304 58.244 0.060 19168 7239 1 17 . 1 1 66 66 MET CB C 66 34.040 34.040 33.397 0.643 19168 7240 1 17 . 1 1 67 67 ILE N N 67 109.871 109.871 112.288 -2.417 19168 7241 1 17 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.424 0.218 19168 7242 1 17 . 1 1 67 67 ILE C C 67 176.713 176.713 176.707 0.006 19168 7243 1 17 . 1 1 67 67 ILE CA C 67 61.174 61.174 61.225 -0.051 19168 7244 1 17 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.759 1.054 19168 7245 1 17 . 1 1 68 68 GLU N N 68 121.972 121.972 121.442 0.530 19168 7246 1 17 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.454 -0.706 19168 7247 1 17 . 1 1 68 68 GLU C C 68 175.855 175.855 177.727 -1.872 19168 7248 1 17 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.198 0.093 19168 7249 1 17 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.935 0.557 19168 7250 1 17 . 1 1 69 69 ASN N N 69 114.338 114.338 117.036 -2.698 19168 7251 1 17 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.451 0.129 19168 7252 1 17 . 1 1 69 69 ASN C C 69 175.904 175.904 175.883 0.021 19168 7253 1 17 . 1 1 69 69 ASN CA C 69 54.597 54.597 54.558 0.039 19168 7254 1 17 . 1 1 69 69 ASN CB C 69 38.323 38.323 37.962 0.361 19168 7255 1 17 . 1 1 70 70 GLU N N 70 116.936 116.936 114.520 2.416 19168 7256 1 17 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.573 -0.025 19168 7257 1 17 . 1 1 70 70 GLU C C 70 174.941 174.941 174.175 0.766 19168 7258 1 17 . 1 1 70 70 GLU CA C 70 55.983 55.983 55.384 0.599 19168 7259 1 17 . 1 1 70 70 GLU CB C 70 31.348 31.348 29.779 1.569 19168 7260 1 17 . 1 1 71 71 ALA N N 71 122.966 122.966 122.371 0.595 19168 7261 1 17 . 1 1 71 71 ALA HA H 71 5.246 5.246 5.100 0.146 19168 7262 1 17 . 1 1 71 71 ALA C C 71 173.907 173.907 175.522 -1.615 19168 7263 1 17 . 1 1 71 71 ALA CA C 71 50.818 50.818 51.262 -0.444 19168 7264 1 17 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.683 1.377 19168 7265 1 17 . 1 1 72 72 ASN N N 72 115.820 115.820 119.206 -3.386 19168 7266 1 17 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.339 0.102 19168 7267 1 17 . 1 1 72 72 ASN C C 72 174.137 174.137 174.675 -0.538 19168 7268 1 17 . 1 1 72 72 ASN CA C 72 51.659 51.659 52.160 -0.501 19168 7269 1 17 . 1 1 72 72 ASN CB C 72 42.186 42.186 41.631 0.555 19168 7270 1 17 . 1 1 73 73 ARG N N 73 118.340 118.340 123.855 -5.515 19168 7271 1 17 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.700 1.078 19168 7272 1 17 . 1 1 73 73 ARG C C 73 174.674 174.674 175.596 -0.922 19168 7273 1 17 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.617 -1.748 19168 7274 1 17 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.521 2.604 19168 7275 1 17 . 1 1 74 74 ASP N N 74 124.007 124.007 127.303 -3.296 19168 7276 1 17 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.490 0.052 19168 7277 1 17 . 1 1 74 74 ASP C C 74 175.935 175.935 176.580 -0.645 19168 7278 1 17 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.470 -1.073 19168 7279 1 17 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.787 0.433 19168 7280 1 17 . 1 1 75 75 LYS N N 75 116.482 116.482 116.974 -0.492 19168 7281 1 17 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.563 -0.118 19168 7282 1 17 . 1 1 75 75 LYS C C 75 175.135 175.135 174.521 0.614 19168 7283 1 17 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.412 -0.627 19168 7284 1 17 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.832 0.643 19168 7285 1 17 . 1 1 76 76 GLU N N 76 120.126 120.126 124.451 -4.325 19168 7286 1 17 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.218 -0.310 19168 7287 1 17 . 1 1 76 76 GLU C C 76 173.204 173.204 175.216 -2.012 19168 7288 1 17 . 1 1 76 76 GLU CA C 76 55.524 55.524 55.094 0.430 19168 7289 1 17 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.152 -1.641 19168 7290 1 17 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.792 -0.015 19168 7291 1 17 . 1 1 77 77 PRO C C 77 174.933 174.933 176.006 -1.073 19168 7292 1 17 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.968 0.454 19168 7293 1 17 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.241 0.150 19168 7294 1 17 . 1 1 78 78 ASN N N 78 119.292 119.292 121.305 -2.013 19168 7295 1 17 . 1 1 78 78 ASN HA H 78 5.093 5.093 5.012 0.081 19168 7296 1 17 . 1 1 78 78 ASN C C 78 172.876 172.876 173.992 -1.116 19168 7297 1 17 . 1 1 78 78 ASN CA C 78 51.928 51.928 52.586 -0.658 19168 7298 1 17 . 1 1 78 78 ASN CB C 78 42.017 42.017 42.164 -0.147 19168 7299 1 17 . 1 1 79 79 PHE N N 79 125.023 125.023 126.722 -1.699 19168 7300 1 17 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.078 0.345 19168 7301 1 17 . 1 1 79 79 PHE C C 79 174.552 174.552 174.746 -0.194 19168 7302 1 17 . 1 1 79 79 PHE CA C 79 55.210 55.210 57.715 -2.506 19168 7303 1 17 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.066 0.043 19168 7304 1 17 . 1 1 80 80 GLU N N 80 128.920 128.920 129.076 -0.156 19168 7305 1 17 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.466 -0.258 19168 7306 1 17 . 1 1 80 80 GLU C C 80 175.538 175.538 176.065 -0.527 19168 7307 1 17 . 1 1 80 80 GLU CA C 80 55.724 55.724 54.891 0.833 19168 7308 1 17 . 1 1 80 80 GLU CB C 80 32.135 32.135 31.831 0.304 19168 7309 1 17 . 1 1 81 81 GLY N N 81 116.695 116.695 115.733 0.962 19168 7310 1 17 . 1 1 81 81 GLY C C 81 173.950 173.950 174.690 -0.740 19168 7311 1 17 . 1 1 81 81 GLY CA C 81 46.967 46.967 46.901 0.066 19168 7312 1 17 . 1 1 82 82 ARG N N 82 124.481 124.481 122.499 1.982 19168 7313 1 17 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.572 -0.033 19168 7314 1 17 . 1 1 82 82 ARG C C 82 173.437 173.437 174.562 -1.125 19168 7315 1 17 . 1 1 82 82 ARG CA C 82 55.156 55.156 55.223 -0.067 19168 7316 1 17 . 1 1 82 82 ARG CB C 82 30.255 30.255 32.838 -2.583 19168 7317 1 17 . 1 1 83 83 TYR N N 83 114.539 114.539 119.139 -4.600 19168 7318 1 17 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.659 0.289 19168 7319 1 17 . 1 1 83 83 TYR C C 83 175.909 175.909 174.692 1.217 19168 7320 1 17 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.651 -0.595 19168 7321 1 17 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.278 0.721 19168 7322 1 17 . 1 1 84 84 VAL N N 84 118.812 118.812 123.636 -4.824 19168 7323 1 17 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.730 0.137 19168 7324 1 17 . 1 1 84 84 VAL C C 84 174.982 174.982 175.260 -0.278 19168 7325 1 17 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.837 -0.602 19168 7326 1 17 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.336 0.155 19168 7327 1 17 . 1 1 85 85 ASN N N 85 124.630 124.630 126.805 -2.175 19168 7328 1 17 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.049 -0.045 19168 7329 1 17 . 1 1 85 85 ASN C C 85 175.392 175.392 173.836 1.556 19168 7330 1 17 . 1 1 85 85 ASN CA C 85 52.596 52.596 52.114 0.482 19168 7331 1 17 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.482 1.724 19168 7332 1 17 . 1 1 86 86 MET N N 86 118.969 118.969 121.741 -2.772 19168 7333 1 17 . 1 1 86 86 MET HA H 86 4.640 4.640 4.836 -0.196 19168 7334 1 17 . 1 1 86 86 MET C C 86 172.378 172.378 173.338 -0.960 19168 7335 1 17 . 1 1 86 86 MET CA C 86 56.158 56.158 54.758 1.400 19168 7336 1 17 . 1 1 86 86 MET CB C 86 39.138 39.138 37.044 2.094 19168 7337 1 17 . 1 1 87 87 LEU N N 87 131.886 131.886 126.448 5.438 19168 7338 1 17 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.382 -0.001 19168 7339 1 17 . 1 1 87 87 LEU C C 87 176.003 176.003 175.848 0.155 19168 7340 1 17 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.355 0.775 19168 7341 1 17 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.814 -0.341 19168 7342 1 17 . 1 1 88 88 VAL N N 88 121.165 121.165 118.741 2.424 19168 7343 1 17 . 1 1 88 88 VAL HA H 88 5.510 5.510 4.935 0.575 19168 7344 1 17 . 1 1 88 88 VAL C C 88 173.666 173.666 175.133 -1.467 19168 7345 1 17 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.654 -1.054 19168 7346 1 17 . 1 1 88 88 VAL CB C 88 34.793 34.793 33.647 1.146 19168 7347 1 17 . 1 1 89 89 THR N N 89 111.786 111.786 121.309 -9.523 19168 7348 1 17 . 1 1 89 89 THR HA H 89 4.720 4.720 4.402 0.318 19168 7349 1 17 . 1 1 89 89 THR C C 89 171.898 171.898 172.385 -0.487 19168 7350 1 17 . 1 1 89 89 THR CA C 89 57.985 57.985 59.425 -1.440 19168 7351 1 17 . 1 1 89 89 THR CB C 89 69.113 69.113 69.408 -0.295 19168 7352 1 17 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.384 0.199 19168 7353 1 17 . 1 1 90 90 PRO C C 90 177.403 177.403 176.483 0.920 19168 7354 1 17 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.473 1.058 19168 7355 1 17 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.469 -0.426 19168 7356 1 17 . 1 1 91 91 LYS N N 91 123.696 123.696 123.714 -0.018 19168 7357 1 17 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.087 0.024 19168 7358 1 17 . 1 1 91 91 LYS C C 91 176.568 176.568 176.766 -0.198 19168 7359 1 17 . 1 1 91 91 LYS CA C 91 57.208 57.208 57.167 0.041 19168 7360 1 17 . 1 1 91 91 LYS CB C 91 33.183 33.183 32.570 0.613 19168 7361 1 17 . 1 1 92 92 LYS N N 92 122.054 122.054 126.505 -4.451 19168 7362 1 17 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.184 0.132 19168 7363 1 17 . 1 1 92 92 LYS C C 92 175.956 175.956 175.948 0.008 19168 7364 1 17 . 1 1 92 92 LYS CA C 92 55.942 55.942 56.899 -0.957 19168 7365 1 17 . 1 1 92 92 LYS CB C 92 33.000 33.000 33.137 -0.137 19168 7366 1 17 . 1 1 93 93 ALA N N 93 126.278 126.278 127.126 -0.848 19168 7367 1 17 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.351 -0.010 19168 7368 1 17 . 1 1 93 93 ALA C C 93 177.592 177.592 176.910 0.682 19168 7369 1 17 . 1 1 93 93 ALA CA C 93 52.279 52.279 52.519 -0.240 19168 7370 1 17 . 1 1 93 93 ALA CB C 93 19.332 19.332 18.469 0.863 19168 7371 1 17 . 1 1 94 94 GLU N N 94 120.522 120.522 123.931 -3.409 19168 7372 1 17 . 1 1 94 94 GLU HA H 94 4.284 4.284 3.960 0.324 19168 7373 1 17 . 1 1 94 94 GLU C C 94 177.041 177.041 175.624 1.417 19168 7374 1 17 . 1 1 94 94 GLU CA C 94 56.606 56.606 56.736 -0.130 19168 7375 1 17 . 1 1 94 94 GLU CB C 94 30.353 30.353 29.707 0.646 19168 7376 1 17 . 1 1 95 95 GLY N N 95 109.755 109.755 112.407 -2.652 19168 7377 1 17 . 1 1 95 95 GLY C C 95 173.939 173.939 173.649 0.290 19168 7378 1 17 . 1 1 95 95 GLY CA C 95 45.168 45.168 44.538 0.630 19168 7379 1 18 . 1 1 5 5 VAL N N 5 123.289 123.289 122.004 1.285 19168 7380 1 18 . 1 1 5 5 VAL HA H 5 4.019 4.019 3.866 0.153 19168 7381 1 18 . 1 1 5 5 VAL C C 5 175.799 175.799 174.432 1.367 19168 7382 1 18 . 1 1 5 5 VAL CA C 5 62.120 62.120 62.534 -0.414 19168 7383 1 18 . 1 1 5 5 VAL CB C 5 32.757 32.757 31.331 1.426 19168 7384 1 18 . 1 1 6 6 ILE N N 6 126.794 126.794 125.731 1.063 19168 7385 1 18 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.244 -0.277 19168 7386 1 18 . 1 1 6 6 ILE C C 6 175.103 175.103 175.061 0.042 19168 7387 1 18 . 1 1 6 6 ILE CA C 6 60.227 60.227 59.679 0.548 19168 7388 1 18 . 1 1 6 6 ILE CB C 6 38.565 38.565 38.370 0.195 19168 7389 1 18 . 1 1 7 7 ASP N N 7 127.797 127.797 128.299 -0.502 19168 7390 1 18 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.648 -0.104 19168 7391 1 18 . 1 1 7 7 ASP C C 7 174.000 174.000 174.810 -0.810 19168 7392 1 18 . 1 1 7 7 ASP CA C 7 53.591 53.591 53.770 -0.179 19168 7393 1 18 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.326 0.826 19168 7394 1 18 . 1 1 8 8 ILE N N 8 122.764 122.764 124.416 -1.652 19168 7395 1 18 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.334 -0.014 19168 7396 1 18 . 1 1 8 8 ILE C C 8 176.337 176.337 175.232 1.105 19168 7397 1 18 . 1 1 8 8 ILE CA C 8 60.176 60.176 59.933 0.243 19168 7398 1 18 . 1 1 8 8 ILE CB C 8 39.542 39.542 40.777 -1.235 19168 7399 1 18 . 1 1 9 9 LYS N N 9 127.990 127.990 126.958 1.032 19168 7400 1 18 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.225 0.097 19168 7401 1 18 . 1 1 9 9 LYS C C 9 174.759 174.759 175.583 -0.824 19168 7402 1 18 . 1 1 9 9 LYS CA C 9 52.315 52.315 54.008 -1.693 19168 7403 1 18 . 1 1 9 9 LYS CB C 9 32.902 32.902 32.154 0.748 19168 7404 1 18 . 1 1 10 10 GLU N N 10 123.021 123.021 125.259 -2.238 19168 7405 1 18 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.595 0.540 19168 7406 1 18 . 1 1 10 10 GLU C C 10 176.215 176.215 175.846 0.369 19168 7407 1 18 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.217 -0.315 19168 7408 1 18 . 1 1 10 10 GLU CB C 10 32.037 32.037 29.366 2.671 19168 7409 1 18 . 1 1 11 11 ILE N N 11 126.526 126.526 127.562 -1.036 19168 7410 1 18 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.259 0.076 19168 7411 1 18 . 1 1 11 11 ILE C C 11 174.334 174.334 174.311 0.023 19168 7412 1 18 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.305 0.005 19168 7413 1 18 . 1 1 11 11 ILE CB C 11 39.826 39.826 39.415 0.411 19168 7414 1 18 . 1 1 12 12 LYS N N 12 128.164 128.164 129.789 -1.625 19168 7415 1 18 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.358 -0.013 19168 7416 1 18 . 1 1 12 12 LYS C C 12 176.378 176.378 175.301 1.077 19168 7417 1 18 . 1 1 12 12 LYS CA C 12 55.940 55.940 55.627 0.313 19168 7418 1 18 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.930 0.126 19168 7419 1 18 . 1 1 13 13 LEU N N 13 121.881 121.881 124.260 -2.379 19168 7420 1 18 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.904 0.050 19168 7421 1 18 . 1 1 13 13 LEU C C 13 175.137 175.137 175.307 -0.170 19168 7422 1 18 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.331 0.643 19168 7423 1 18 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.481 -0.197 19168 7424 1 18 . 1 1 14 14 SER N N 14 115.759 115.759 111.903 3.856 19168 7425 1 18 . 1 1 14 14 SER HA H 14 4.889 4.889 4.907 -0.018 19168 7426 1 18 . 1 1 14 14 SER C C 14 173.993 173.993 174.501 -0.508 19168 7427 1 18 . 1 1 14 14 SER CA C 14 56.052 56.052 56.628 -0.576 19168 7428 1 18 . 1 1 14 14 SER CB C 14 64.775 64.775 66.243 -1.468 19168 7429 1 18 . 1 1 15 15 VAL N N 15 120.993 120.993 119.087 1.906 19168 7430 1 18 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.889 -0.155 19168 7431 1 18 . 1 1 15 15 VAL C C 15 176.964 176.964 177.141 -0.177 19168 7432 1 18 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.269 0.158 19168 7433 1 18 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.756 0.029 19168 7434 1 18 . 1 1 16 16 LYS N N 16 118.897 118.897 119.987 -1.090 19168 7435 1 18 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.397 0.004 19168 7436 1 18 . 1 1 16 16 LYS C C 16 175.489 175.489 175.270 0.219 19168 7437 1 18 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.571 -0.416 19168 7438 1 18 . 1 1 16 16 LYS CB C 16 30.929 30.929 30.890 0.039 19168 7439 1 18 . 1 1 17 17 ILE N N 17 122.247 122.247 120.553 1.694 19168 7440 1 18 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.351 -0.166 19168 7441 1 18 . 1 1 17 17 ILE C C 17 173.426 173.426 174.596 -1.170 19168 7442 1 18 . 1 1 17 17 ILE CA C 17 61.276 61.276 60.016 1.260 19168 7443 1 18 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.822 -1.742 19168 7444 1 18 . 1 1 18 18 ALA N N 18 129.434 129.434 129.185 0.249 19168 7445 1 18 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.476 0.003 19168 7446 1 18 . 1 1 18 18 ALA C C 18 179.130 179.130 178.072 1.058 19168 7447 1 18 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.837 -0.400 19168 7448 1 18 . 1 1 18 18 ALA CB C 18 19.909 19.909 19.905 0.004 19168 7449 1 18 . 1 1 19 19 GLN HA H 19 3.797 3.797 3.990 -0.193 19168 7450 1 18 . 1 1 19 19 GLN CA C 19 59.231 59.231 58.947 0.284 19168 7451 1 18 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.562 -0.387 19168 7452 1 18 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.445 -0.015 19168 7453 1 18 . 1 1 20 20 ASN C C 20 177.272 177.272 177.346 -0.074 19168 7454 1 18 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.281 -0.097 19168 7455 1 18 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.815 -0.362 19168 7456 1 18 . 1 1 21 21 ASP N N 21 119.132 119.132 120.639 -1.507 19168 7457 1 18 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.451 0.347 19168 7458 1 18 . 1 1 21 21 ASP C C 21 178.707 178.707 178.708 -0.001 19168 7459 1 18 . 1 1 21 21 ASP CA C 21 56.886 56.886 57.108 -0.223 19168 7460 1 18 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.837 -0.172 19168 7461 1 18 . 1 1 22 22 ILE N N 22 122.030 122.030 120.564 1.466 19168 7462 1 18 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.654 -0.236 19168 7463 1 18 . 1 1 22 22 ILE C C 22 177.454 177.454 177.911 -0.457 19168 7464 1 18 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.220 1.506 19168 7465 1 18 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.762 -0.196 19168 7466 1 18 . 1 1 23 23 ASN N N 23 116.728 116.728 118.822 -2.094 19168 7467 1 18 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.439 -0.226 19168 7468 1 18 . 1 1 23 23 ASN C C 23 178.260 178.260 177.892 0.368 19168 7469 1 18 . 1 1 23 23 ASN CA C 23 56.274 56.274 57.043 -0.769 19168 7470 1 18 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.682 -1.474 19168 7471 1 18 . 1 1 24 24 TYR N N 24 119.864 119.864 121.762 -1.898 19168 7472 1 18 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.142 0.151 19168 7473 1 18 . 1 1 24 24 TYR C C 24 177.719 177.719 177.378 0.341 19168 7474 1 18 . 1 1 24 24 TYR CA C 24 61.048 61.048 61.823 -0.775 19168 7475 1 18 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.533 -0.250 19168 7476 1 18 . 1 1 25 25 LYS N N 25 119.730 119.730 118.654 1.076 19168 7477 1 18 . 1 1 25 25 LYS HA H 25 4.111 4.111 3.886 0.225 19168 7478 1 18 . 1 1 25 25 LYS C C 25 179.152 179.152 179.239 -0.087 19168 7479 1 18 . 1 1 25 25 LYS CA C 25 59.162 59.162 58.681 0.481 19168 7480 1 18 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.394 -0.100 19168 7481 1 18 . 1 1 26 26 VAL N N 26 119.387 119.387 116.579 2.808 19168 7482 1 18 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.838 -0.218 19168 7483 1 18 . 1 1 26 26 VAL C C 26 177.017 177.017 177.506 -0.489 19168 7484 1 18 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.468 1.193 19168 7485 1 18 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.162 0.388 19168 7486 1 18 . 1 1 27 27 LYS N N 27 120.420 120.420 120.611 -0.191 19168 7487 1 18 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.923 0.023 19168 7488 1 18 . 1 1 27 27 LYS C C 27 179.458 179.458 178.731 0.727 19168 7489 1 18 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.869 0.009 19168 7490 1 18 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.215 -0.367 19168 7491 1 18 . 1 1 28 28 HIS N N 28 118.160 118.160 118.261 -0.101 19168 7492 1 18 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.321 -0.134 19168 7493 1 18 . 1 1 28 28 HIS C C 28 177.085 177.085 177.583 -0.498 19168 7494 1 18 . 1 1 28 28 HIS CA C 28 57.885 57.885 58.665 -0.780 19168 7495 1 18 . 1 1 28 28 HIS CB C 28 29.756 29.756 30.145 -0.389 19168 7496 1 18 . 1 1 29 29 ALA N N 29 120.579 120.579 122.571 -1.992 19168 7497 1 18 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.163 -0.165 19168 7498 1 18 . 1 1 29 29 ALA C C 29 179.299 179.299 179.779 -0.480 19168 7499 1 18 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.513 0.055 19168 7500 1 18 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.380 1.069 19168 7501 1 18 . 1 1 30 30 LEU N N 30 117.262 117.262 118.372 -1.110 19168 7502 1 18 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.917 0.158 19168 7503 1 18 . 1 1 30 30 LEU C C 30 180.017 180.017 179.346 0.671 19168 7504 1 18 . 1 1 30 30 LEU CA C 30 58.232 58.232 58.070 0.162 19168 7505 1 18 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.679 -0.353 19168 7506 1 18 . 1 1 31 31 GLU N N 31 120.625 120.625 119.217 1.408 19168 7507 1 18 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.919 0.149 19168 7508 1 18 . 1 1 31 31 GLU C C 31 179.572 179.572 178.646 0.926 19168 7509 1 18 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.187 0.089 19168 7510 1 18 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.329 -0.354 19168 7511 1 18 . 1 1 32 32 PHE N N 32 118.245 118.245 116.719 1.526 19168 7512 1 18 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.409 0.117 19168 7513 1 18 . 1 1 32 32 PHE C C 32 179.123 179.123 177.180 1.943 19168 7514 1 18 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.019 -2.322 19168 7515 1 18 . 1 1 32 32 PHE CB C 32 37.252 37.252 39.378 -2.126 19168 7516 1 18 . 1 1 33 33 LEU N N 33 121.684 121.684 121.233 0.451 19168 7517 1 18 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.285 0.306 19168 7518 1 18 . 1 1 33 33 LEU C C 33 181.655 181.655 179.724 1.931 19168 7519 1 18 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.637 0.535 19168 7520 1 18 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.910 -0.218 19168 7521 1 18 . 1 1 34 34 GLU N N 34 122.046 122.046 117.969 4.077 19168 7522 1 18 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.111 0.041 19168 7523 1 18 . 1 1 34 34 GLU C C 34 178.237 178.237 177.880 0.357 19168 7524 1 18 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.506 0.640 19168 7525 1 18 . 1 1 34 34 GLU CB C 34 29.234 29.234 28.671 0.563 19168 7526 1 18 . 1 1 35 35 GLN N N 35 115.697 115.697 118.135 -2.438 19168 7527 1 18 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.237 0.150 19168 7528 1 18 . 1 1 35 35 GLN C C 35 176.456 176.456 177.023 -0.567 19168 7529 1 18 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.943 -0.257 19168 7530 1 18 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.076 0.120 19168 7531 1 18 . 1 1 36 36 GLY N N 36 108.291 108.291 106.688 1.603 19168 7532 1 18 . 1 1 36 36 GLY C C 36 174.673 174.673 174.013 0.660 19168 7533 1 18 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.085 0.442 19168 7534 1 18 . 1 1 37 37 LYS N N 37 120.464 120.464 119.313 1.151 19168 7535 1 18 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.862 -0.365 19168 7536 1 18 . 1 1 37 37 LYS C C 37 174.580 174.580 176.118 -1.538 19168 7537 1 18 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.827 0.263 19168 7538 1 18 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.774 -2.029 19168 7539 1 18 . 1 1 38 38 HIS N N 38 116.878 116.878 116.625 0.253 19168 7540 1 18 . 1 1 38 38 HIS HA H 38 5.019 5.019 5.276 -0.257 19168 7541 1 18 . 1 1 38 38 HIS C C 38 175.268 175.268 174.166 1.102 19168 7542 1 18 . 1 1 38 38 HIS CA C 38 54.150 54.150 54.313 -0.163 19168 7543 1 18 . 1 1 38 38 HIS CB C 38 32.877 32.877 33.256 -0.379 19168 7544 1 18 . 1 1 39 39 VAL N N 39 119.782 119.782 119.425 0.357 19168 7545 1 18 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.671 0.125 19168 7546 1 18 . 1 1 39 39 VAL C C 39 173.320 173.320 174.171 -0.851 19168 7547 1 18 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.562 0.204 19168 7548 1 18 . 1 1 39 39 VAL CB C 39 35.433 35.433 34.130 1.303 19168 7549 1 18 . 1 1 40 40 ARG N N 40 128.358 128.358 127.161 1.197 19168 7550 1 18 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.936 0.179 19168 7551 1 18 . 1 1 40 40 ARG C C 40 175.659 175.659 174.797 0.862 19168 7552 1 18 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.018 -0.196 19168 7553 1 18 . 1 1 40 40 ARG CB C 40 33.007 33.007 32.443 0.564 19168 7554 1 18 . 1 1 41 41 PHE N N 41 126.396 126.396 127.502 -1.106 19168 7555 1 18 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.433 -0.255 19168 7556 1 18 . 1 1 41 41 PHE C C 41 176.107 176.107 175.292 0.815 19168 7557 1 18 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.293 0.403 19168 7558 1 18 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.850 2.196 19168 7559 1 18 . 1 1 42 42 ARG N N 42 120.641 120.641 123.980 -3.339 19168 7560 1 18 . 1 1 42 42 ARG HA H 42 5.539 5.539 4.861 0.678 19168 7561 1 18 . 1 1 42 42 ARG C C 42 175.010 175.010 174.643 0.367 19168 7562 1 18 . 1 1 42 42 ARG CA C 42 54.695 54.695 55.021 -0.326 19168 7563 1 18 . 1 1 42 42 ARG CB C 42 34.374 34.374 32.199 2.175 19168 7564 1 18 . 1 1 43 43 VAL N N 43 125.565 125.565 125.576 -0.011 19168 7565 1 18 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.144 -0.479 19168 7566 1 18 . 1 1 43 43 VAL C C 43 175.325 175.325 173.731 1.594 19168 7567 1 18 . 1 1 43 43 VAL CA C 43 60.816 60.816 60.319 0.497 19168 7568 1 18 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.247 -2.264 19168 7569 1 18 . 1 1 44 44 PHE N N 44 128.291 128.291 130.327 -2.036 19168 7570 1 18 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.564 0.054 19168 7571 1 18 . 1 1 44 44 PHE C C 44 174.477 174.477 174.457 0.020 19168 7572 1 18 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.401 0.747 19168 7573 1 18 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.285 -1.344 19168 7574 1 18 . 1 1 45 45 LEU N N 45 128.360 128.360 128.515 -0.155 19168 7575 1 18 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.268 0.123 19168 7576 1 18 . 1 1 45 45 LEU C C 45 174.342 174.342 176.468 -2.126 19168 7577 1 18 . 1 1 45 45 LEU CA C 45 53.586 53.586 54.670 -1.084 19168 7578 1 18 . 1 1 45 45 LEU CB C 45 41.113 41.113 40.517 0.596 19168 7579 1 18 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.218 -0.126 19168 7580 1 18 . 1 1 46 46 LYS CA C 46 55.079 55.079 58.072 -2.994 19168 7581 1 18 . 1 1 46 46 LYS CB C 46 34.295 34.295 33.102 1.194 19168 7582 1 18 . 1 1 47 47 GLY CA C 47 46.813 46.813 44.125 2.688 19168 7583 1 18 . 1 1 48 48 ARG HA H 48 4.200 4.200 3.719 0.481 19168 7584 1 18 . 1 1 48 48 ARG C C 48 178.069 178.069 177.059 1.010 19168 7585 1 18 . 1 1 48 48 ARG CA C 48 57.862 57.862 58.544 -0.682 19168 7586 1 18 . 1 1 48 48 ARG CB C 48 29.444 29.444 29.033 0.411 19168 7587 1 18 . 1 1 49 49 GLU N N 49 119.779 119.779 118.089 1.690 19168 7588 1 18 . 1 1 49 49 GLU HA H 49 4.053 4.053 3.966 0.087 19168 7589 1 18 . 1 1 49 49 GLU C C 49 178.227 178.227 178.207 0.020 19168 7590 1 18 . 1 1 49 49 GLU CA C 49 57.436 57.436 59.228 -1.792 19168 7591 1 18 . 1 1 49 49 GLU CB C 49 29.745 29.745 29.097 0.648 19168 7592 1 18 . 1 1 50 50 MET N N 50 116.370 116.370 117.022 -0.652 19168 7593 1 18 . 1 1 50 50 MET HA H 50 4.024 4.024 4.112 -0.088 19168 7594 1 18 . 1 1 50 50 MET C C 50 175.912 175.912 176.876 -0.964 19168 7595 1 18 . 1 1 50 50 MET CA C 50 56.664 56.664 57.163 -0.499 19168 7596 1 18 . 1 1 50 50 MET CB C 50 32.033 32.033 32.194 -0.161 19168 7597 1 18 . 1 1 51 51 ALA N N 51 118.880 118.880 120.234 -1.354 19168 7598 1 18 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.261 0.083 19168 7599 1 18 . 1 1 51 51 ALA C C 51 177.746 177.746 177.600 0.146 19168 7600 1 18 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.071 -0.680 19168 7601 1 18 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.560 -0.117 19168 7602 1 18 . 1 1 52 52 THR N N 52 108.299 108.299 114.277 -5.978 19168 7603 1 18 . 1 1 52 52 THR HA H 52 4.869 4.869 4.551 0.318 19168 7604 1 18 . 1 1 52 52 THR C C 52 173.933 173.933 172.541 1.392 19168 7605 1 18 . 1 1 52 52 THR CA C 52 57.554 57.554 59.607 -2.053 19168 7606 1 18 . 1 1 52 52 THR CB C 52 69.479 69.479 69.877 -0.398 19168 7607 1 18 . 1 1 53 53 PRO HA H 53 3.931 3.931 4.141 -0.210 19168 7608 1 18 . 1 1 53 53 PRO C C 53 178.185 178.185 178.179 0.006 19168 7609 1 18 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.187 0.832 19168 7610 1 18 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.683 -1.167 19168 7611 1 18 . 1 1 54 54 GLU N N 54 120.653 120.653 119.080 1.573 19168 7612 1 18 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.027 -0.011 19168 7613 1 18 . 1 1 54 54 GLU C C 54 178.608 178.608 177.907 0.701 19168 7614 1 18 . 1 1 54 54 GLU CA C 54 59.472 59.472 59.291 0.181 19168 7615 1 18 . 1 1 54 54 GLU CB C 54 27.419 27.419 29.240 -1.821 19168 7616 1 18 . 1 1 55 55 ALA N N 55 124.380 124.380 120.599 3.781 19168 7617 1 18 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.131 0.192 19168 7618 1 18 . 1 1 55 55 ALA C C 55 181.502 181.502 179.724 1.778 19168 7619 1 18 . 1 1 55 55 ALA CA C 55 54.780 54.780 54.958 -0.178 19168 7620 1 18 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.087 0.313 19168 7621 1 18 . 1 1 56 56 GLY N N 56 105.673 105.673 107.189 -1.516 19168 7622 1 18 . 1 1 56 56 GLY C C 56 174.278 174.278 176.227 -1.949 19168 7623 1 18 . 1 1 56 56 GLY CA C 56 46.879 46.879 46.977 -0.098 19168 7624 1 18 . 1 1 57 57 VAL N N 57 122.685 122.685 122.830 -0.145 19168 7625 1 18 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.612 -0.290 19168 7626 1 18 . 1 1 57 57 VAL C C 57 177.134 177.134 177.669 -0.535 19168 7627 1 18 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.220 1.176 19168 7628 1 18 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.600 0.169 19168 7629 1 18 . 1 1 58 58 ALA N N 58 119.580 119.580 123.004 -3.424 19168 7630 1 18 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.091 0.003 19168 7631 1 18 . 1 1 58 58 ALA C C 58 180.788 180.788 179.744 1.044 19168 7632 1 18 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.007 0.046 19168 7633 1 18 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.560 -0.706 19168 7634 1 18 . 1 1 59 59 LEU N N 59 119.723 119.723 120.340 -0.617 19168 7635 1 18 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.004 0.254 19168 7636 1 18 . 1 1 59 59 LEU C C 59 178.024 178.024 178.624 -0.600 19168 7637 1 18 . 1 1 59 59 LEU CA C 59 57.710 57.710 58.096 -0.386 19168 7638 1 18 . 1 1 59 59 LEU CB C 59 41.701 41.701 41.967 -0.266 19168 7639 1 18 . 1 1 60 60 LEU N N 60 117.978 117.978 118.671 -0.693 19168 7640 1 18 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.745 0.112 19168 7641 1 18 . 1 1 60 60 LEU C C 60 178.851 178.851 179.157 -0.306 19168 7642 1 18 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.148 -0.504 19168 7643 1 18 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.397 -1.109 19168 7644 1 18 . 1 1 61 61 GLU N N 61 119.906 119.906 119.585 0.321 19168 7645 1 18 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.053 0.438 19168 7646 1 18 . 1 1 61 61 GLU C C 61 179.519 179.519 178.937 0.582 19168 7647 1 18 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.716 -0.974 19168 7648 1 18 . 1 1 61 61 GLU CB C 61 28.813 28.813 29.386 -0.573 19168 7649 1 18 . 1 1 62 62 LYS N N 62 122.015 122.015 120.667 1.348 19168 7650 1 18 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.066 0.062 19168 7651 1 18 . 1 1 62 62 LYS C C 62 179.843 179.843 178.989 0.854 19168 7652 1 18 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.308 0.029 19168 7653 1 18 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.423 -0.776 19168 7654 1 18 . 1 1 63 63 ILE N N 63 120.882 120.882 119.176 1.706 19168 7655 1 18 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.719 -0.223 19168 7656 1 18 . 1 1 63 63 ILE C C 63 177.761 177.761 178.110 -0.349 19168 7657 1 18 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.830 0.352 19168 7658 1 18 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.913 -0.527 19168 7659 1 18 . 1 1 64 64 TRP N N 64 120.279 120.279 122.245 -1.966 19168 7660 1 18 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.159 0.325 19168 7661 1 18 . 1 1 64 64 TRP C C 64 177.056 177.056 177.427 -0.371 19168 7662 1 18 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.306 -1.212 19168 7663 1 18 . 1 1 64 64 TRP CB C 64 29.635 29.635 29.887 -0.252 19168 7664 1 18 . 1 1 65 65 THR N N 65 109.483 109.483 113.645 -4.162 19168 7665 1 18 . 1 1 65 65 THR HA H 65 3.744 3.744 3.780 -0.036 19168 7666 1 18 . 1 1 65 65 THR C C 65 176.224 176.224 175.744 0.480 19168 7667 1 18 . 1 1 65 65 THR CA C 65 65.568 65.568 65.476 0.092 19168 7668 1 18 . 1 1 65 65 THR CB C 65 69.308 69.308 68.515 0.793 19168 7669 1 18 . 1 1 66 66 MET N N 66 117.791 117.791 117.251 0.540 19168 7670 1 18 . 1 1 66 66 MET HA H 66 4.110 4.110 4.388 -0.278 19168 7671 1 18 . 1 1 66 66 MET C C 66 177.782 177.782 176.911 0.871 19168 7672 1 18 . 1 1 66 66 MET CA C 66 58.304 58.304 57.871 0.433 19168 7673 1 18 . 1 1 66 66 MET CB C 66 34.040 34.040 33.925 0.115 19168 7674 1 18 . 1 1 67 67 ILE N N 67 109.871 109.871 111.434 -1.563 19168 7675 1 18 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.358 0.284 19168 7676 1 18 . 1 1 67 67 ILE C C 67 176.713 176.713 175.864 0.849 19168 7677 1 18 . 1 1 67 67 ILE CA C 67 61.174 61.174 59.936 1.238 19168 7678 1 18 . 1 1 67 67 ILE CB C 67 39.813 39.813 37.892 1.921 19168 7679 1 18 . 1 1 68 68 GLU N N 68 121.972 121.972 118.795 3.177 19168 7680 1 18 . 1 1 68 68 GLU HA H 68 2.748 2.748 2.787 -0.039 19168 7681 1 18 . 1 1 68 68 GLU C C 68 175.855 175.855 175.553 0.302 19168 7682 1 18 . 1 1 68 68 GLU CA C 68 58.291 58.291 56.693 1.599 19168 7683 1 18 . 1 1 68 68 GLU CB C 68 28.492 28.492 28.265 0.227 19168 7684 1 18 . 1 1 69 69 ASN N N 69 114.338 114.338 117.834 -3.496 19168 7685 1 18 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.444 0.136 19168 7686 1 18 . 1 1 69 69 ASN C C 69 175.904 175.904 175.816 0.088 19168 7687 1 18 . 1 1 69 69 ASN CA C 69 54.597 54.597 53.613 0.984 19168 7688 1 18 . 1 1 69 69 ASN CB C 69 38.323 38.323 38.433 -0.110 19168 7689 1 18 . 1 1 70 70 GLU N N 70 116.936 116.936 115.064 1.872 19168 7690 1 18 . 1 1 70 70 GLU HA H 70 4.548 4.548 3.911 0.637 19168 7691 1 18 . 1 1 70 70 GLU C C 70 174.941 174.941 174.899 0.042 19168 7692 1 18 . 1 1 70 70 GLU CA C 70 55.983 55.983 57.707 -1.724 19168 7693 1 18 . 1 1 70 70 GLU CB C 70 31.348 31.348 28.120 3.228 19168 7694 1 18 . 1 1 71 71 ALA N N 71 122.966 122.966 120.571 2.395 19168 7695 1 18 . 1 1 71 71 ALA HA H 71 5.246 5.246 5.238 0.008 19168 7696 1 18 . 1 1 71 71 ALA C C 71 173.907 173.907 176.053 -2.146 19168 7697 1 18 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.449 0.369 19168 7698 1 18 . 1 1 71 71 ALA CB C 71 24.060 24.060 23.026 1.034 19168 7699 1 18 . 1 1 72 72 ASN N N 72 115.820 115.820 117.561 -1.741 19168 7700 1 18 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.335 0.106 19168 7701 1 18 . 1 1 72 72 ASN C C 72 174.137 174.137 173.395 0.742 19168 7702 1 18 . 1 1 72 72 ASN CA C 72 51.659 51.659 52.680 -1.021 19168 7703 1 18 . 1 1 72 72 ASN CB C 72 42.186 42.186 42.122 0.064 19168 7704 1 18 . 1 1 73 73 ARG N N 73 118.340 118.340 121.065 -2.725 19168 7705 1 18 . 1 1 73 73 ARG HA H 73 4.778 4.778 4.219 0.559 19168 7706 1 18 . 1 1 73 73 ARG C C 73 174.674 174.674 175.085 -0.411 19168 7707 1 18 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.293 -1.424 19168 7708 1 18 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.981 2.144 19168 7709 1 18 . 1 1 74 74 ASP N N 74 124.007 124.007 124.856 -0.849 19168 7710 1 18 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.473 0.069 19168 7711 1 18 . 1 1 74 74 ASP C C 74 175.935 175.935 175.796 0.139 19168 7712 1 18 . 1 1 74 74 ASP CA C 74 55.397 55.397 55.707 -0.310 19168 7713 1 18 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.745 0.475 19168 7714 1 18 . 1 1 75 75 LYS N N 75 116.482 116.482 117.384 -0.902 19168 7715 1 18 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.418 0.027 19168 7716 1 18 . 1 1 75 75 LYS C C 75 175.135 175.135 174.277 0.858 19168 7717 1 18 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.303 -0.518 19168 7718 1 18 . 1 1 75 75 LYS CB C 75 35.475 35.475 35.566 -0.091 19168 7719 1 18 . 1 1 76 76 GLU N N 76 120.126 120.126 122.197 -2.071 19168 7720 1 18 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.549 -0.641 19168 7721 1 18 . 1 1 76 76 GLU C C 76 173.204 173.204 174.714 -1.510 19168 7722 1 18 . 1 1 76 76 GLU CA C 76 55.524 55.524 53.706 1.819 19168 7723 1 18 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.481 -1.970 19168 7724 1 18 . 1 1 77 77 PRO HA H 77 4.777 4.777 5.016 -0.239 19168 7725 1 18 . 1 1 77 77 PRO C C 77 174.933 174.933 176.081 -1.148 19168 7726 1 18 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.882 0.540 19168 7727 1 18 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.002 0.389 19168 7728 1 18 . 1 1 78 78 ASN N N 78 119.292 119.292 121.120 -1.828 19168 7729 1 18 . 1 1 78 78 ASN HA H 78 5.093 5.093 4.897 0.196 19168 7730 1 18 . 1 1 78 78 ASN C C 78 172.876 172.876 173.174 -0.298 19168 7731 1 18 . 1 1 78 78 ASN CA C 78 51.928 51.928 51.991 -0.063 19168 7732 1 18 . 1 1 78 78 ASN CB C 78 42.017 42.017 41.520 0.497 19168 7733 1 18 . 1 1 79 79 PHE N N 79 125.023 125.023 124.203 0.820 19168 7734 1 18 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.262 0.161 19168 7735 1 18 . 1 1 79 79 PHE C C 79 174.552 174.552 174.728 -0.176 19168 7736 1 18 . 1 1 79 79 PHE CA C 79 55.210 55.210 57.480 -2.270 19168 7737 1 18 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.014 0.095 19168 7738 1 18 . 1 1 80 80 GLU N N 80 128.920 128.920 128.020 0.900 19168 7739 1 18 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.332 -0.124 19168 7740 1 18 . 1 1 80 80 GLU C C 80 175.538 175.538 175.817 -0.279 19168 7741 1 18 . 1 1 80 80 GLU CA C 80 55.724 55.724 55.832 -0.108 19168 7742 1 18 . 1 1 80 80 GLU CB C 80 32.135 32.135 31.825 0.310 19168 7743 1 18 . 1 1 81 81 GLY N N 81 116.695 116.695 116.030 0.665 19168 7744 1 18 . 1 1 81 81 GLY C C 81 173.950 173.950 174.184 -0.234 19168 7745 1 18 . 1 1 81 81 GLY CA C 81 46.967 46.967 45.780 1.187 19168 7746 1 18 . 1 1 82 82 ARG N N 82 124.481 124.481 111.290 13.191 19168 7747 1 18 . 1 1 82 82 ARG HA H 82 4.539 4.539 3.324 1.215 19168 7748 1 18 . 1 1 82 82 ARG C C 82 173.437 173.437 173.876 -0.439 19168 7749 1 18 . 1 1 82 82 ARG CA C 82 55.156 55.156 57.125 -1.969 19168 7750 1 18 . 1 1 82 82 ARG CB C 82 30.255 30.255 28.128 2.127 19168 7751 1 18 . 1 1 83 83 TYR N N 83 114.539 114.539 116.348 -1.809 19168 7752 1 18 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.308 0.640 19168 7753 1 18 . 1 1 83 83 TYR C C 83 175.909 175.909 175.314 0.595 19168 7754 1 18 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.800 -0.743 19168 7755 1 18 . 1 1 83 83 TYR CB C 83 42.999 42.999 41.690 1.309 19168 7756 1 18 . 1 1 84 84 VAL N N 84 118.812 118.812 123.374 -4.562 19168 7757 1 18 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.833 0.034 19168 7758 1 18 . 1 1 84 84 VAL C C 84 174.982 174.982 175.450 -0.468 19168 7759 1 18 . 1 1 84 84 VAL CA C 84 61.235 61.235 60.885 0.351 19168 7760 1 18 . 1 1 84 84 VAL CB C 84 32.491 32.491 31.082 1.409 19168 7761 1 18 . 1 1 85 85 ASN N N 85 124.630 124.630 124.810 -0.180 19168 7762 1 18 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.061 -0.057 19168 7763 1 18 . 1 1 85 85 ASN C C 85 175.392 175.392 173.975 1.417 19168 7764 1 18 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.078 1.518 19168 7765 1 18 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.215 1.991 19168 7766 1 18 . 1 1 86 86 MET N N 86 118.969 118.969 120.513 -1.544 19168 7767 1 18 . 1 1 86 86 MET HA H 86 4.640 4.640 4.860 -0.220 19168 7768 1 18 . 1 1 86 86 MET C C 86 172.378 172.378 173.611 -1.233 19168 7769 1 18 . 1 1 86 86 MET CA C 86 56.158 56.158 55.149 1.009 19168 7770 1 18 . 1 1 86 86 MET CB C 86 39.138 39.138 36.881 2.257 19168 7771 1 18 . 1 1 87 87 LEU N N 87 131.886 131.886 125.658 6.228 19168 7772 1 18 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.374 0.007 19168 7773 1 18 . 1 1 87 87 LEU C C 87 176.003 176.003 176.103 -0.100 19168 7774 1 18 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.098 1.032 19168 7775 1 18 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.645 -0.172 19168 7776 1 18 . 1 1 88 88 VAL N N 88 121.165 121.165 118.307 2.858 19168 7777 1 18 . 1 1 88 88 VAL HA H 88 5.510 5.510 4.969 0.541 19168 7778 1 18 . 1 1 88 88 VAL C C 88 173.666 173.666 175.056 -1.390 19168 7779 1 18 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.885 -1.285 19168 7780 1 18 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.496 0.297 19168 7781 1 18 . 1 1 89 89 THR N N 89 111.786 111.786 120.398 -8.612 19168 7782 1 18 . 1 1 89 89 THR HA H 89 4.720 4.720 4.692 0.028 19168 7783 1 18 . 1 1 89 89 THR C C 89 171.898 171.898 172.427 -0.529 19168 7784 1 18 . 1 1 89 89 THR CA C 89 57.985 57.985 59.019 -1.034 19168 7785 1 18 . 1 1 89 89 THR CB C 89 69.113 69.113 70.305 -1.192 19168 7786 1 18 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.759 -0.176 19168 7787 1 18 . 1 1 90 90 PRO C C 90 177.403 177.403 176.595 0.808 19168 7788 1 18 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.215 1.316 19168 7789 1 18 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.453 -0.410 19168 7790 1 18 . 1 1 91 91 LYS N N 91 123.696 123.696 121.085 2.611 19168 7791 1 18 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.180 -0.069 19168 7792 1 18 . 1 1 91 91 LYS C C 91 176.568 176.568 177.070 -0.502 19168 7793 1 18 . 1 1 91 91 LYS CA C 91 57.208 57.208 56.947 0.261 19168 7794 1 18 . 1 1 91 91 LYS CB C 91 33.183 33.183 32.902 0.281 19168 7795 1 18 . 1 1 92 92 LYS N N 92 122.054 122.054 125.058 -3.004 19168 7796 1 18 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.086 0.230 19168 7797 1 18 . 1 1 92 92 LYS C C 92 175.956 175.956 176.317 -0.361 19168 7798 1 18 . 1 1 92 92 LYS CA C 92 55.942 55.942 56.355 -0.413 19168 7799 1 18 . 1 1 92 92 LYS CB C 92 33.000 33.000 31.515 1.485 19168 7800 1 18 . 1 1 93 93 ALA N N 93 126.278 126.278 127.122 -0.844 19168 7801 1 18 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.154 0.187 19168 7802 1 18 . 1 1 93 93 ALA C C 93 177.592 177.592 177.239 0.353 19168 7803 1 18 . 1 1 93 93 ALA CA C 93 52.279 52.279 54.107 -1.828 19168 7804 1 18 . 1 1 93 93 ALA CB C 93 19.332 19.332 19.480 -0.148 19168 7805 1 18 . 1 1 94 94 GLU N N 94 120.522 120.522 119.158 1.364 19168 7806 1 18 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.420 -0.136 19168 7807 1 18 . 1 1 94 94 GLU C C 94 177.041 177.041 175.994 1.047 19168 7808 1 18 . 1 1 94 94 GLU CA C 94 56.606 56.606 55.385 1.221 19168 7809 1 18 . 1 1 94 94 GLU CB C 94 30.353 30.353 30.980 -0.626 19168 7810 1 18 . 1 1 95 95 GLY N N 95 109.755 109.755 113.699 -3.944 19168 7811 1 18 . 1 1 95 95 GLY C C 95 173.939 173.939 173.628 0.311 19168 7812 1 18 . 1 1 95 95 GLY CA C 95 45.168 45.168 44.832 0.336 19168 7813 1 19 . 1 1 5 5 VAL N N 5 123.289 123.289 123.454 -0.165 19168 7814 1 19 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.381 -0.362 19168 7815 1 19 . 1 1 5 5 VAL C C 5 175.799 175.799 174.937 0.862 19168 7816 1 19 . 1 1 5 5 VAL CA C 5 62.120 62.120 62.619 -0.499 19168 7817 1 19 . 1 1 5 5 VAL CB C 5 32.757 32.757 32.181 0.576 19168 7818 1 19 . 1 1 6 6 ILE N N 6 126.794 126.794 126.767 0.027 19168 7819 1 19 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.282 -0.315 19168 7820 1 19 . 1 1 6 6 ILE C C 6 175.103 175.103 174.861 0.242 19168 7821 1 19 . 1 1 6 6 ILE CA C 6 60.227 60.227 60.878 -0.651 19168 7822 1 19 . 1 1 6 6 ILE CB C 6 38.565 38.565 38.608 -0.043 19168 7823 1 19 . 1 1 7 7 ASP N N 7 127.797 127.797 128.374 -0.577 19168 7824 1 19 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.738 -0.194 19168 7825 1 19 . 1 1 7 7 ASP C C 7 174.000 174.000 175.035 -1.035 19168 7826 1 19 . 1 1 7 7 ASP CA C 7 53.591 53.591 53.184 0.407 19168 7827 1 19 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.586 0.566 19168 7828 1 19 . 1 1 8 8 ILE N N 8 122.764 122.764 125.759 -2.995 19168 7829 1 19 . 1 1 8 8 ILE HA H 8 4.320 4.320 3.987 0.333 19168 7830 1 19 . 1 1 8 8 ILE C C 8 176.337 176.337 175.799 0.538 19168 7831 1 19 . 1 1 8 8 ILE CA C 8 60.176 60.176 61.176 -1.000 19168 7832 1 19 . 1 1 8 8 ILE CB C 8 39.542 39.542 38.689 0.853 19168 7833 1 19 . 1 1 9 9 LYS N N 9 127.990 127.990 128.535 -0.545 19168 7834 1 19 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.373 -0.051 19168 7835 1 19 . 1 1 9 9 LYS C C 9 174.759 174.759 174.852 -0.093 19168 7836 1 19 . 1 1 9 9 LYS CA C 9 52.315 52.315 54.450 -2.135 19168 7837 1 19 . 1 1 9 9 LYS CB C 9 32.902 32.902 33.208 -0.305 19168 7838 1 19 . 1 1 10 10 GLU N N 10 123.021 123.021 122.752 0.269 19168 7839 1 19 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.848 0.287 19168 7840 1 19 . 1 1 10 10 GLU C C 10 176.215 176.215 175.670 0.545 19168 7841 1 19 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.232 -0.330 19168 7842 1 19 . 1 1 10 10 GLU CB C 10 32.037 32.037 31.128 0.909 19168 7843 1 19 . 1 1 11 11 ILE N N 11 126.526 126.526 126.844 -0.318 19168 7844 1 19 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.143 0.192 19168 7845 1 19 . 1 1 11 11 ILE C C 11 174.334 174.334 174.803 -0.469 19168 7846 1 19 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.576 -0.266 19168 7847 1 19 . 1 1 11 11 ILE CB C 11 39.826 39.826 39.198 0.628 19168 7848 1 19 . 1 1 12 12 LYS N N 12 128.164 128.164 128.914 -0.750 19168 7849 1 19 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.584 -0.239 19168 7850 1 19 . 1 1 12 12 LYS C C 12 176.378 176.378 175.601 0.777 19168 7851 1 19 . 1 1 12 12 LYS CA C 12 55.940 55.940 55.697 0.243 19168 7852 1 19 . 1 1 12 12 LYS CB C 12 34.056 34.056 34.104 -0.048 19168 7853 1 19 . 1 1 13 13 LEU N N 13 121.881 121.881 125.522 -3.641 19168 7854 1 19 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.894 0.060 19168 7855 1 19 . 1 1 13 13 LEU C C 13 175.137 175.137 175.392 -0.255 19168 7856 1 19 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.781 0.194 19168 7857 1 19 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.516 -0.232 19168 7858 1 19 . 1 1 14 14 SER N N 14 115.759 115.759 113.403 2.356 19168 7859 1 19 . 1 1 14 14 SER HA H 14 4.889 4.889 5.128 -0.239 19168 7860 1 19 . 1 1 14 14 SER C C 14 173.993 173.993 174.648 -0.655 19168 7861 1 19 . 1 1 14 14 SER CA C 14 56.052 56.052 56.898 -0.846 19168 7862 1 19 . 1 1 14 14 SER CB C 14 64.775 64.775 66.157 -1.382 19168 7863 1 19 . 1 1 15 15 VAL N N 15 120.993 120.993 121.315 -0.322 19168 7864 1 19 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.817 -0.083 19168 7865 1 19 . 1 1 15 15 VAL C C 15 176.964 176.964 177.098 -0.134 19168 7866 1 19 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.018 0.409 19168 7867 1 19 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.865 -0.080 19168 7868 1 19 . 1 1 16 16 LYS N N 16 118.897 118.897 118.550 0.347 19168 7869 1 19 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.360 0.041 19168 7870 1 19 . 1 1 16 16 LYS C C 16 175.489 175.489 175.162 0.327 19168 7871 1 19 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.718 -0.563 19168 7872 1 19 . 1 1 16 16 LYS CB C 16 30.929 30.929 29.879 1.050 19168 7873 1 19 . 1 1 17 17 ILE N N 17 122.247 122.247 121.160 1.087 19168 7874 1 19 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.248 -0.063 19168 7875 1 19 . 1 1 17 17 ILE C C 17 173.426 173.426 175.302 -1.876 19168 7876 1 19 . 1 1 17 17 ILE CA C 17 61.276 61.276 60.583 0.693 19168 7877 1 19 . 1 1 17 17 ILE CB C 17 39.080 39.080 39.728 -0.648 19168 7878 1 19 . 1 1 18 18 ALA N N 18 129.434 129.434 129.823 -0.389 19168 7879 1 19 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.449 0.030 19168 7880 1 19 . 1 1 18 18 ALA C C 18 179.130 179.130 178.402 0.728 19168 7881 1 19 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.824 -0.387 19168 7882 1 19 . 1 1 18 18 ALA CB C 18 19.909 19.909 19.829 0.080 19168 7883 1 19 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.003 -0.206 19168 7884 1 19 . 1 1 19 19 GLN CA C 19 59.231 59.231 59.547 -0.316 19168 7885 1 19 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.702 -0.527 19168 7886 1 19 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.501 -0.071 19168 7887 1 19 . 1 1 20 20 ASN C C 20 177.272 177.272 177.349 -0.077 19168 7888 1 19 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.117 0.067 19168 7889 1 19 . 1 1 20 20 ASN CB C 20 37.453 37.453 38.025 -0.572 19168 7890 1 19 . 1 1 21 21 ASP N N 21 119.132 119.132 120.017 -0.885 19168 7891 1 19 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.506 0.292 19168 7892 1 19 . 1 1 21 21 ASP C C 21 178.707 178.707 178.620 0.087 19168 7893 1 19 . 1 1 21 21 ASP CA C 21 56.886 56.886 56.993 -0.107 19168 7894 1 19 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.722 -0.057 19168 7895 1 19 . 1 1 22 22 ILE N N 22 122.030 122.030 119.861 2.169 19168 7896 1 19 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.616 -0.198 19168 7897 1 19 . 1 1 22 22 ILE C C 22 177.454 177.454 177.965 -0.511 19168 7898 1 19 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.618 1.108 19168 7899 1 19 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.728 -0.162 19168 7900 1 19 . 1 1 23 23 ASN N N 23 116.728 116.728 118.442 -1.714 19168 7901 1 19 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.439 -0.226 19168 7902 1 19 . 1 1 23 23 ASN C C 23 178.260 178.260 177.931 0.329 19168 7903 1 19 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.896 -0.622 19168 7904 1 19 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.569 -1.361 19168 7905 1 19 . 1 1 24 24 TYR N N 24 119.864 119.864 121.929 -2.065 19168 7906 1 19 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.205 0.088 19168 7907 1 19 . 1 1 24 24 TYR C C 24 177.719 177.719 177.659 0.060 19168 7908 1 19 . 1 1 24 24 TYR CA C 24 61.048 61.048 62.418 -1.370 19168 7909 1 19 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.735 -0.452 19168 7910 1 19 . 1 1 25 25 LYS N N 25 119.730 119.730 119.728 0.002 19168 7911 1 19 . 1 1 25 25 LYS HA H 25 4.111 4.111 4.016 0.095 19168 7912 1 19 . 1 1 25 25 LYS C C 25 179.152 179.152 179.136 0.016 19168 7913 1 19 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.909 -0.747 19168 7914 1 19 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.751 -0.457 19168 7915 1 19 . 1 1 26 26 VAL N N 26 119.387 119.387 119.891 -0.504 19168 7916 1 19 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.812 -0.192 19168 7917 1 19 . 1 1 26 26 VAL C C 26 177.017 177.017 177.702 -0.685 19168 7918 1 19 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.764 0.897 19168 7919 1 19 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.579 -0.029 19168 7920 1 19 . 1 1 27 27 LYS N N 27 120.420 120.420 119.754 0.666 19168 7921 1 19 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.922 0.024 19168 7922 1 19 . 1 1 27 27 LYS C C 27 179.458 179.458 178.915 0.543 19168 7923 1 19 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.543 0.335 19168 7924 1 19 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.330 -0.482 19168 7925 1 19 . 1 1 28 28 HIS N N 28 118.160 118.160 118.496 -0.336 19168 7926 1 19 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.269 -0.082 19168 7927 1 19 . 1 1 28 28 HIS C C 28 177.085 177.085 177.394 -0.309 19168 7928 1 19 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.716 -1.831 19168 7929 1 19 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.919 -0.163 19168 7930 1 19 . 1 1 29 29 ALA N N 29 120.579 120.579 121.631 -1.052 19168 7931 1 19 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.357 -0.359 19168 7932 1 19 . 1 1 29 29 ALA C C 29 179.299 179.299 179.407 -0.108 19168 7933 1 19 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.246 0.321 19168 7934 1 19 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.259 1.190 19168 7935 1 19 . 1 1 30 30 LEU N N 30 117.262 117.262 117.793 -0.531 19168 7936 1 19 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.978 0.097 19168 7937 1 19 . 1 1 30 30 LEU C C 30 180.017 180.017 179.099 0.918 19168 7938 1 19 . 1 1 30 30 LEU CA C 30 58.232 58.232 57.812 0.420 19168 7939 1 19 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.583 -0.257 19168 7940 1 19 . 1 1 31 31 GLU N N 31 120.625 120.625 119.342 1.283 19168 7941 1 19 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.927 0.141 19168 7942 1 19 . 1 1 31 31 GLU C C 31 179.572 179.572 179.241 0.331 19168 7943 1 19 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.060 0.215 19168 7944 1 19 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.151 -0.176 19168 7945 1 19 . 1 1 32 32 PHE N N 32 118.245 118.245 118.692 -0.447 19168 7946 1 19 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.242 0.284 19168 7947 1 19 . 1 1 32 32 PHE C C 32 179.123 179.123 177.648 1.475 19168 7948 1 19 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.814 -3.117 19168 7949 1 19 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.813 -1.561 19168 7950 1 19 . 1 1 33 33 LEU N N 33 121.684 121.684 120.230 1.454 19168 7951 1 19 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.237 0.354 19168 7952 1 19 . 1 1 33 33 LEU C C 33 181.655 181.655 179.923 1.732 19168 7953 1 19 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.492 0.680 19168 7954 1 19 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.620 0.073 19168 7955 1 19 . 1 1 34 34 GLU N N 34 122.046 122.046 115.933 6.113 19168 7956 1 19 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.058 0.094 19168 7957 1 19 . 1 1 34 34 GLU C C 34 178.237 178.237 177.571 0.666 19168 7958 1 19 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.569 0.577 19168 7959 1 19 . 1 1 34 34 GLU CB C 34 29.234 29.234 28.892 0.342 19168 7960 1 19 . 1 1 35 35 GLN N N 35 115.697 115.697 114.904 0.793 19168 7961 1 19 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.363 0.024 19168 7962 1 19 . 1 1 35 35 GLN C C 35 176.456 176.456 177.048 -0.592 19168 7963 1 19 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.170 0.516 19168 7964 1 19 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.346 -0.150 19168 7965 1 19 . 1 1 36 36 GLY N N 36 108.291 108.291 106.629 1.662 19168 7966 1 19 . 1 1 36 36 GLY C C 36 174.673 174.673 174.083 0.590 19168 7967 1 19 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.468 0.059 19168 7968 1 19 . 1 1 37 37 LYS N N 37 120.464 120.464 118.975 1.489 19168 7969 1 19 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.614 -0.117 19168 7970 1 19 . 1 1 37 37 LYS C C 37 174.580 174.580 175.057 -0.477 19168 7971 1 19 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.136 0.953 19168 7972 1 19 . 1 1 37 37 LYS CB C 37 32.745 32.745 35.304 -2.559 19168 7973 1 19 . 1 1 38 38 HIS N N 38 116.878 116.878 117.721 -0.843 19168 7974 1 19 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.823 0.196 19168 7975 1 19 . 1 1 38 38 HIS C C 38 175.268 175.268 174.312 0.956 19168 7976 1 19 . 1 1 38 38 HIS CA C 38 54.150 54.150 56.051 -1.901 19168 7977 1 19 . 1 1 38 38 HIS CB C 38 32.877 32.877 32.633 0.244 19168 7978 1 19 . 1 1 39 39 VAL N N 39 119.782 119.782 121.007 -1.225 19168 7979 1 19 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.543 0.253 19168 7980 1 19 . 1 1 39 39 VAL C C 39 173.320 173.320 174.118 -0.798 19168 7981 1 19 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.739 0.027 19168 7982 1 19 . 1 1 39 39 VAL CB C 39 35.433 35.433 33.340 2.093 19168 7983 1 19 . 1 1 40 40 ARG N N 40 128.358 128.358 127.315 1.043 19168 7984 1 19 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.847 0.268 19168 7985 1 19 . 1 1 40 40 ARG C C 40 175.659 175.659 174.944 0.715 19168 7986 1 19 . 1 1 40 40 ARG CA C 40 53.822 53.822 53.941 -0.120 19168 7987 1 19 . 1 1 40 40 ARG CB C 40 33.007 33.007 32.297 0.710 19168 7988 1 19 . 1 1 41 41 PHE N N 41 126.396 126.396 127.458 -1.062 19168 7989 1 19 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.028 0.150 19168 7990 1 19 . 1 1 41 41 PHE C C 41 176.107 176.107 175.205 0.902 19168 7991 1 19 . 1 1 41 41 PHE CA C 41 57.696 57.696 58.006 -0.310 19168 7992 1 19 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.182 2.864 19168 7993 1 19 . 1 1 42 42 ARG N N 42 120.641 120.641 124.230 -3.589 19168 7994 1 19 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.340 0.199 19168 7995 1 19 . 1 1 42 42 ARG C C 42 175.010 175.010 174.704 0.306 19168 7996 1 19 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.727 -0.032 19168 7997 1 19 . 1 1 42 42 ARG CB C 42 34.374 34.374 33.443 0.931 19168 7998 1 19 . 1 1 43 43 VAL N N 43 125.565 125.565 123.342 2.223 19168 7999 1 19 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.079 -0.414 19168 8000 1 19 . 1 1 43 43 VAL C C 43 175.325 175.325 173.493 1.832 19168 8001 1 19 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.758 1.058 19168 8002 1 19 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.307 -2.324 19168 8003 1 19 . 1 1 44 44 PHE N N 44 128.291 128.291 129.659 -1.368 19168 8004 1 19 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.644 -0.026 19168 8005 1 19 . 1 1 44 44 PHE C C 44 174.477 174.477 174.203 0.274 19168 8006 1 19 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.714 0.434 19168 8007 1 19 . 1 1 44 44 PHE CB C 44 39.941 39.941 40.509 -0.568 19168 8008 1 19 . 1 1 45 45 LEU N N 45 128.360 128.360 128.532 -0.172 19168 8009 1 19 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.152 0.239 19168 8010 1 19 . 1 1 45 45 LEU C C 45 174.342 174.342 175.528 -1.186 19168 8011 1 19 . 1 1 45 45 LEU CA C 45 53.586 53.586 55.056 -1.470 19168 8012 1 19 . 1 1 45 45 LEU CB C 45 41.113 41.113 41.858 -0.745 19168 8013 1 19 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.243 -0.151 19168 8014 1 19 . 1 1 46 46 LYS CA C 46 55.079 55.079 55.692 -0.613 19168 8015 1 19 . 1 1 46 46 LYS CB C 46 34.295 34.295 34.749 -0.454 19168 8016 1 19 . 1 1 47 47 GLY CA C 47 46.813 46.813 45.145 1.668 19168 8017 1 19 . 1 1 48 48 ARG HA H 48 4.200 4.200 3.813 0.387 19168 8018 1 19 . 1 1 48 48 ARG C C 48 178.069 178.069 176.012 2.057 19168 8019 1 19 . 1 1 48 48 ARG CA C 48 57.862 57.862 57.841 0.021 19168 8020 1 19 . 1 1 48 48 ARG CB C 48 29.444 29.444 29.135 0.309 19168 8021 1 19 . 1 1 49 49 GLU N N 49 119.779 119.779 118.356 1.423 19168 8022 1 19 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.106 -0.053 19168 8023 1 19 . 1 1 49 49 GLU C C 49 178.227 178.227 177.892 0.335 19168 8024 1 19 . 1 1 49 49 GLU CA C 49 57.436 57.436 58.252 -0.815 19168 8025 1 19 . 1 1 49 49 GLU CB C 49 29.745 29.745 29.205 0.540 19168 8026 1 19 . 1 1 50 50 MET N N 50 116.370 116.370 118.495 -2.125 19168 8027 1 19 . 1 1 50 50 MET HA H 50 4.024 4.024 4.270 -0.246 19168 8028 1 19 . 1 1 50 50 MET C C 50 175.912 175.912 177.333 -1.421 19168 8029 1 19 . 1 1 50 50 MET CA C 50 56.664 56.664 57.290 -0.626 19168 8030 1 19 . 1 1 50 50 MET CB C 50 32.033 32.033 31.874 0.159 19168 8031 1 19 . 1 1 51 51 ALA N N 51 118.880 118.880 118.968 -0.088 19168 8032 1 19 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.284 0.060 19168 8033 1 19 . 1 1 51 51 ALA C C 51 177.746 177.746 177.666 0.080 19168 8034 1 19 . 1 1 51 51 ALA CA C 51 52.391 52.391 52.924 -0.533 19168 8035 1 19 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.184 0.259 19168 8036 1 19 . 1 1 52 52 THR N N 52 108.299 108.299 115.735 -7.436 19168 8037 1 19 . 1 1 52 52 THR HA H 52 4.869 4.869 4.654 0.215 19168 8038 1 19 . 1 1 52 52 THR C C 52 173.933 173.933 172.729 1.204 19168 8039 1 19 . 1 1 52 52 THR CA C 52 57.554 57.554 59.859 -2.305 19168 8040 1 19 . 1 1 52 52 THR CB C 52 69.479 69.479 69.317 0.161 19168 8041 1 19 . 1 1 53 53 PRO HA H 53 3.931 3.931 3.897 0.034 19168 8042 1 19 . 1 1 53 53 PRO C C 53 178.185 178.185 178.046 0.139 19168 8043 1 19 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.813 0.206 19168 8044 1 19 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.810 -1.294 19168 8045 1 19 . 1 1 54 54 GLU N N 54 120.653 120.653 118.626 2.027 19168 8046 1 19 . 1 1 54 54 GLU HA H 54 4.016 4.016 3.981 0.035 19168 8047 1 19 . 1 1 54 54 GLU C C 54 178.608 178.608 177.663 0.945 19168 8048 1 19 . 1 1 54 54 GLU CA C 54 59.472 59.472 58.945 0.527 19168 8049 1 19 . 1 1 54 54 GLU CB C 54 27.419 27.419 28.634 -1.215 19168 8050 1 19 . 1 1 55 55 ALA N N 55 124.380 124.380 120.540 3.840 19168 8051 1 19 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.042 0.281 19168 8052 1 19 . 1 1 55 55 ALA C C 55 181.502 181.502 179.598 1.904 19168 8053 1 19 . 1 1 55 55 ALA CA C 55 54.780 54.780 54.985 -0.205 19168 8054 1 19 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.390 0.011 19168 8055 1 19 . 1 1 56 56 GLY N N 56 105.673 105.673 106.419 -0.746 19168 8056 1 19 . 1 1 56 56 GLY C C 56 174.278 174.278 176.207 -1.929 19168 8057 1 19 . 1 1 56 56 GLY CA C 56 46.879 46.879 46.592 0.287 19168 8058 1 19 . 1 1 57 57 VAL N N 57 122.685 122.685 123.212 -0.527 19168 8059 1 19 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.693 -0.371 19168 8060 1 19 . 1 1 57 57 VAL C C 57 177.134 177.134 177.888 -0.754 19168 8061 1 19 . 1 1 57 57 VAL CA C 57 67.396 67.396 65.859 1.537 19168 8062 1 19 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.018 0.751 19168 8063 1 19 . 1 1 58 58 ALA N N 58 119.580 119.580 122.130 -2.550 19168 8064 1 19 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.428 -0.334 19168 8065 1 19 . 1 1 58 58 ALA C C 58 180.788 180.788 179.837 0.951 19168 8066 1 19 . 1 1 58 58 ALA CA C 58 55.053 55.053 54.885 0.168 19168 8067 1 19 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.525 -0.671 19168 8068 1 19 . 1 1 59 59 LEU N N 59 119.723 119.723 120.300 -0.577 19168 8069 1 19 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.024 0.234 19168 8070 1 19 . 1 1 59 59 LEU C C 59 178.024 178.024 178.617 -0.593 19168 8071 1 19 . 1 1 59 59 LEU CA C 59 57.710 57.710 57.884 -0.174 19168 8072 1 19 . 1 1 59 59 LEU CB C 59 41.701 41.701 41.994 -0.293 19168 8073 1 19 . 1 1 60 60 LEU N N 60 117.978 117.978 118.598 -0.620 19168 8074 1 19 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.785 0.072 19168 8075 1 19 . 1 1 60 60 LEU C C 60 178.851 178.851 179.036 -0.185 19168 8076 1 19 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.056 -0.411 19168 8077 1 19 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.360 -1.072 19168 8078 1 19 . 1 1 61 61 GLU N N 61 119.906 119.906 119.917 -0.011 19168 8079 1 19 . 1 1 61 61 GLU HA H 61 4.491 4.491 3.998 0.493 19168 8080 1 19 . 1 1 61 61 GLU C C 61 179.519 179.519 179.035 0.484 19168 8081 1 19 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.947 -1.205 19168 8082 1 19 . 1 1 61 61 GLU CB C 61 28.813 28.813 29.256 -0.443 19168 8083 1 19 . 1 1 62 62 LYS N N 62 122.015 122.015 120.680 1.335 19168 8084 1 19 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.064 0.064 19168 8085 1 19 . 1 1 62 62 LYS C C 62 179.843 179.843 178.928 0.915 19168 8086 1 19 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.304 0.033 19168 8087 1 19 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.388 -0.741 19168 8088 1 19 . 1 1 63 63 ILE N N 63 120.882 120.882 119.404 1.478 19168 8089 1 19 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.639 -0.143 19168 8090 1 19 . 1 1 63 63 ILE C C 63 177.761 177.761 177.447 0.314 19168 8091 1 19 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.932 0.250 19168 8092 1 19 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.681 -0.294 19168 8093 1 19 . 1 1 64 64 TRP N N 64 120.279 120.279 122.095 -1.816 19168 8094 1 19 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.132 0.352 19168 8095 1 19 . 1 1 64 64 TRP C C 64 177.056 177.056 177.684 -0.628 19168 8096 1 19 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.389 -1.295 19168 8097 1 19 . 1 1 64 64 TRP CB C 64 29.635 29.635 29.913 -0.278 19168 8098 1 19 . 1 1 65 65 THR N N 65 109.483 109.483 113.851 -4.368 19168 8099 1 19 . 1 1 65 65 THR HA H 65 3.744 3.744 4.076 -0.332 19168 8100 1 19 . 1 1 65 65 THR C C 65 176.224 176.224 175.818 0.406 19168 8101 1 19 . 1 1 65 65 THR CA C 65 65.568 65.568 65.150 0.418 19168 8102 1 19 . 1 1 65 65 THR CB C 65 69.308 69.308 68.551 0.757 19168 8103 1 19 . 1 1 66 66 MET N N 66 117.791 117.791 118.189 -0.398 19168 8104 1 19 . 1 1 66 66 MET HA H 66 4.110 4.110 4.350 -0.240 19168 8105 1 19 . 1 1 66 66 MET C C 66 177.782 177.782 177.524 0.258 19168 8106 1 19 . 1 1 66 66 MET CA C 66 58.304 58.304 56.669 1.635 19168 8107 1 19 . 1 1 66 66 MET CB C 66 34.040 34.040 33.445 0.595 19168 8108 1 19 . 1 1 67 67 ILE N N 67 109.871 109.871 112.615 -2.744 19168 8109 1 19 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.636 0.006 19168 8110 1 19 . 1 1 67 67 ILE C C 67 176.713 176.713 175.854 0.859 19168 8111 1 19 . 1 1 67 67 ILE CA C 67 61.174 61.174 60.511 0.663 19168 8112 1 19 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.395 1.418 19168 8113 1 19 . 1 1 68 68 GLU N N 68 121.972 121.972 120.408 1.564 19168 8114 1 19 . 1 1 68 68 GLU HA H 68 2.748 2.748 2.522 0.226 19168 8115 1 19 . 1 1 68 68 GLU C C 68 175.855 175.855 176.552 -0.697 19168 8116 1 19 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.029 0.262 19168 8117 1 19 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.996 0.496 19168 8118 1 19 . 1 1 69 69 ASN N N 69 114.338 114.338 116.519 -2.181 19168 8119 1 19 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.475 0.105 19168 8120 1 19 . 1 1 69 69 ASN C C 69 175.904 175.904 176.771 -0.867 19168 8121 1 19 . 1 1 69 69 ASN CA C 69 54.597 54.597 55.342 -0.745 19168 8122 1 19 . 1 1 69 69 ASN CB C 69 38.323 38.323 37.737 0.586 19168 8123 1 19 . 1 1 70 70 GLU N N 70 116.936 116.936 118.707 -1.771 19168 8124 1 19 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.462 0.086 19168 8125 1 19 . 1 1 70 70 GLU C C 70 174.941 174.941 174.945 -0.004 19168 8126 1 19 . 1 1 70 70 GLU CA C 70 55.983 55.983 56.382 -0.399 19168 8127 1 19 . 1 1 70 70 GLU CB C 70 31.348 31.348 29.850 1.498 19168 8128 1 19 . 1 1 71 71 ALA N N 71 122.966 122.966 121.277 1.689 19168 8129 1 19 . 1 1 71 71 ALA HA H 71 5.246 5.246 5.059 0.187 19168 8130 1 19 . 1 1 71 71 ALA C C 71 173.907 173.907 175.370 -1.463 19168 8131 1 19 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.479 0.339 19168 8132 1 19 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.247 1.812 19168 8133 1 19 . 1 1 72 72 ASN N N 72 115.820 115.820 118.554 -2.734 19168 8134 1 19 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.328 0.113 19168 8135 1 19 . 1 1 72 72 ASN C C 72 174.137 174.137 174.896 -0.759 19168 8136 1 19 . 1 1 72 72 ASN CA C 72 51.659 51.659 51.889 -0.230 19168 8137 1 19 . 1 1 72 72 ASN CB C 72 42.186 42.186 41.219 0.967 19168 8138 1 19 . 1 1 73 73 ARG N N 73 118.340 118.340 124.336 -5.996 19168 8139 1 19 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.849 0.929 19168 8140 1 19 . 1 1 73 73 ARG C C 73 174.674 174.674 175.591 -0.917 19168 8141 1 19 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.858 -1.989 19168 8142 1 19 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.531 2.594 19168 8143 1 19 . 1 1 74 74 ASP N N 74 124.007 124.007 127.568 -3.561 19168 8144 1 19 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.516 0.026 19168 8145 1 19 . 1 1 74 74 ASP C C 74 175.935 175.935 176.646 -0.711 19168 8146 1 19 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.482 -1.085 19168 8147 1 19 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.999 0.221 19168 8148 1 19 . 1 1 75 75 LYS N N 75 116.482 116.482 116.811 -0.329 19168 8149 1 19 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.557 -0.112 19168 8150 1 19 . 1 1 75 75 LYS C C 75 175.135 175.135 174.429 0.706 19168 8151 1 19 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.405 -0.620 19168 8152 1 19 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.859 0.616 19168 8153 1 19 . 1 1 76 76 GLU N N 76 120.126 120.126 122.511 -2.385 19168 8154 1 19 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.339 -0.431 19168 8155 1 19 . 1 1 76 76 GLU C C 76 173.204 173.204 175.329 -2.125 19168 8156 1 19 . 1 1 76 76 GLU CA C 76 55.524 55.524 54.580 0.944 19168 8157 1 19 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.164 -1.653 19168 8158 1 19 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.558 0.219 19168 8159 1 19 . 1 1 77 77 PRO C C 77 174.933 174.933 175.760 -0.827 19168 8160 1 19 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.992 0.430 19168 8161 1 19 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.014 0.377 19168 8162 1 19 . 1 1 78 78 ASN N N 78 119.292 119.292 121.499 -2.207 19168 8163 1 19 . 1 1 78 78 ASN HA H 78 5.093 5.093 5.011 0.082 19168 8164 1 19 . 1 1 78 78 ASN C C 78 172.876 172.876 173.633 -0.757 19168 8165 1 19 . 1 1 78 78 ASN CA C 78 51.928 51.928 51.889 0.039 19168 8166 1 19 . 1 1 78 78 ASN CB C 78 42.017 42.017 42.542 -0.525 19168 8167 1 19 . 1 1 79 79 PHE N N 79 125.023 125.023 124.010 1.013 19168 8168 1 19 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.284 0.139 19168 8169 1 19 . 1 1 79 79 PHE C C 79 174.552 174.552 174.420 0.132 19168 8170 1 19 . 1 1 79 79 PHE CA C 79 55.210 55.210 56.635 -1.425 19168 8171 1 19 . 1 1 79 79 PHE CB C 79 40.109 40.109 41.101 -0.992 19168 8172 1 19 . 1 1 80 80 GLU N N 80 128.920 128.920 129.009 -0.089 19168 8173 1 19 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.498 -0.290 19168 8174 1 19 . 1 1 80 80 GLU C C 80 175.538 175.538 175.712 -0.174 19168 8175 1 19 . 1 1 80 80 GLU CA C 80 55.724 55.724 54.988 0.736 19168 8176 1 19 . 1 1 80 80 GLU CB C 80 32.135 32.135 31.793 0.342 19168 8177 1 19 . 1 1 81 81 GLY N N 81 116.695 116.695 116.896 -0.201 19168 8178 1 19 . 1 1 81 81 GLY C C 81 173.950 173.950 174.640 -0.690 19168 8179 1 19 . 1 1 81 81 GLY CA C 81 46.967 46.967 47.066 -0.099 19168 8180 1 19 . 1 1 82 82 ARG N N 82 124.481 124.481 118.863 5.618 19168 8181 1 19 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.572 -0.033 19168 8182 1 19 . 1 1 82 82 ARG C C 82 173.437 173.437 174.100 -0.663 19168 8183 1 19 . 1 1 82 82 ARG CA C 82 55.156 55.156 55.288 -0.132 19168 8184 1 19 . 1 1 82 82 ARG CB C 82 30.255 30.255 31.296 -1.041 19168 8185 1 19 . 1 1 83 83 TYR N N 83 114.539 114.539 119.999 -5.460 19168 8186 1 19 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.805 0.143 19168 8187 1 19 . 1 1 83 83 TYR C C 83 175.909 175.909 174.480 1.429 19168 8188 1 19 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.378 -0.321 19168 8189 1 19 . 1 1 83 83 TYR CB C 83 42.999 42.999 41.749 1.250 19168 8190 1 19 . 1 1 84 84 VAL N N 84 118.812 118.812 122.813 -4.001 19168 8191 1 19 . 1 1 84 84 VAL HA H 84 4.867 4.867 5.303 -0.436 19168 8192 1 19 . 1 1 84 84 VAL C C 84 174.982 174.982 175.163 -0.181 19168 8193 1 19 . 1 1 84 84 VAL CA C 84 61.235 61.235 60.242 0.993 19168 8194 1 19 . 1 1 84 84 VAL CB C 84 32.491 32.491 33.230 -0.739 19168 8195 1 19 . 1 1 85 85 ASN N N 85 124.630 124.630 123.167 1.463 19168 8196 1 19 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.189 -0.185 19168 8197 1 19 . 1 1 85 85 ASN C C 85 175.392 175.392 173.593 1.799 19168 8198 1 19 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.457 1.139 19168 8199 1 19 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.780 1.426 19168 8200 1 19 . 1 1 86 86 MET N N 86 118.969 118.969 120.897 -1.928 19168 8201 1 19 . 1 1 86 86 MET HA H 86 4.640 4.640 4.829 -0.189 19168 8202 1 19 . 1 1 86 86 MET C C 86 172.378 172.378 173.508 -1.130 19168 8203 1 19 . 1 1 86 86 MET CA C 86 56.158 56.158 54.674 1.484 19168 8204 1 19 . 1 1 86 86 MET CB C 86 39.138 39.138 37.059 2.079 19168 8205 1 19 . 1 1 87 87 LEU N N 87 131.886 131.886 127.030 4.856 19168 8206 1 19 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.235 0.146 19168 8207 1 19 . 1 1 87 87 LEU C C 87 176.003 176.003 174.773 1.230 19168 8208 1 19 . 1 1 87 87 LEU CA C 87 54.130 54.130 52.692 1.438 19168 8209 1 19 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.615 -0.142 19168 8210 1 19 . 1 1 88 88 VAL N N 88 121.165 121.165 122.611 -1.446 19168 8211 1 19 . 1 1 88 88 VAL HA H 88 5.510 5.510 5.005 0.505 19168 8212 1 19 . 1 1 88 88 VAL C C 88 173.666 173.666 175.074 -1.408 19168 8213 1 19 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.842 -1.242 19168 8214 1 19 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.368 0.425 19168 8215 1 19 . 1 1 89 89 THR N N 89 111.786 111.786 122.078 -10.292 19168 8216 1 19 . 1 1 89 89 THR HA H 89 4.720 4.720 5.052 -0.332 19168 8217 1 19 . 1 1 89 89 THR C C 89 171.898 171.898 172.798 -0.900 19168 8218 1 19 . 1 1 89 89 THR CA C 89 57.985 57.985 59.829 -1.844 19168 8219 1 19 . 1 1 89 89 THR CB C 89 69.113 69.113 69.937 -0.824 19168 8220 1 19 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.474 0.109 19168 8221 1 19 . 1 1 90 90 PRO C C 90 177.403 177.403 176.838 0.565 19168 8222 1 19 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.689 0.842 19168 8223 1 19 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.224 -0.181 19168 8224 1 19 . 1 1 91 91 LYS N N 91 123.696 123.696 124.255 -0.559 19168 8225 1 19 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.363 -0.252 19168 8226 1 19 . 1 1 91 91 LYS C C 91 176.568 176.568 176.813 -0.245 19168 8227 1 19 . 1 1 91 91 LYS CA C 91 57.208 57.208 56.241 0.967 19168 8228 1 19 . 1 1 91 91 LYS CB C 91 33.183 33.183 30.724 2.459 19168 8229 1 19 . 1 1 92 92 LYS N N 92 122.054 122.054 124.725 -2.671 19168 8230 1 19 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.261 0.055 19168 8231 1 19 . 1 1 92 92 LYS C C 92 175.956 175.956 176.317 -0.361 19168 8232 1 19 . 1 1 92 92 LYS CA C 92 55.942 55.942 57.906 -1.964 19168 8233 1 19 . 1 1 92 92 LYS CB C 92 33.000 33.000 33.365 -0.365 19168 8234 1 19 . 1 1 93 93 ALA N N 93 126.278 126.278 122.620 3.658 19168 8235 1 19 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.416 -0.075 19168 8236 1 19 . 1 1 93 93 ALA C C 93 177.592 177.592 175.645 1.947 19168 8237 1 19 . 1 1 93 93 ALA CA C 93 52.279 52.279 51.763 0.516 19168 8238 1 19 . 1 1 93 93 ALA CB C 93 19.332 19.332 19.113 0.218 19168 8239 1 19 . 1 1 94 94 GLU N N 94 120.522 120.522 121.313 -0.791 19168 8240 1 19 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.554 -0.270 19168 8241 1 19 . 1 1 94 94 GLU C C 94 177.041 177.041 176.477 0.564 19168 8242 1 19 . 1 1 94 94 GLU CA C 94 56.606 56.606 55.977 0.629 19168 8243 1 19 . 1 1 94 94 GLU CB C 94 30.353 30.353 30.266 0.087 19168 8244 1 19 . 1 1 95 95 GLY N N 95 109.755 109.755 110.244 -0.489 19168 8245 1 19 . 1 1 95 95 GLY C C 95 173.939 173.939 174.170 -0.231 19168 8246 1 19 . 1 1 95 95 GLY CA C 95 45.168 45.168 44.726 0.442 19168 8247 1 20 . 1 1 5 5 VAL N N 5 123.289 123.289 120.860 2.429 19168 8248 1 20 . 1 1 5 5 VAL HA H 5 4.019 4.019 3.784 0.235 19168 8249 1 20 . 1 1 5 5 VAL C C 5 175.799 175.799 174.638 1.161 19168 8250 1 20 . 1 1 5 5 VAL CA C 5 62.120 62.120 62.541 -0.422 19168 8251 1 20 . 1 1 5 5 VAL CB C 5 32.757 32.757 31.859 0.898 19168 8252 1 20 . 1 1 6 6 ILE N N 6 126.794 126.794 124.246 2.548 19168 8253 1 20 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.069 -0.102 19168 8254 1 20 . 1 1 6 6 ILE C C 6 175.103 175.103 175.307 -0.204 19168 8255 1 20 . 1 1 6 6 ILE CA C 6 60.227 60.227 60.595 -0.368 19168 8256 1 20 . 1 1 6 6 ILE CB C 6 38.565 38.565 36.609 1.956 19168 8257 1 20 . 1 1 7 7 ASP N N 7 127.797 127.797 128.328 -0.531 19168 8258 1 20 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.608 -0.064 19168 8259 1 20 . 1 1 7 7 ASP C C 7 174.000 174.000 175.346 -1.346 19168 8260 1 20 . 1 1 7 7 ASP CA C 7 53.591 53.591 54.116 -0.525 19168 8261 1 20 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.849 0.303 19168 8262 1 20 . 1 1 8 8 ILE N N 8 122.764 122.764 126.233 -3.469 19168 8263 1 20 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.094 0.226 19168 8264 1 20 . 1 1 8 8 ILE C C 8 176.337 176.337 175.675 0.662 19168 8265 1 20 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.831 -0.655 19168 8266 1 20 . 1 1 8 8 ILE CB C 8 39.542 39.542 39.197 0.345 19168 8267 1 20 . 1 1 9 9 LYS N N 9 127.990 127.990 127.321 0.669 19168 8268 1 20 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.432 -0.110 19168 8269 1 20 . 1 1 9 9 LYS C C 9 174.759 174.759 175.476 -0.717 19168 8270 1 20 . 1 1 9 9 LYS CA C 9 52.315 52.315 53.812 -1.497 19168 8271 1 20 . 1 1 9 9 LYS CB C 9 32.902 32.902 33.358 -0.456 19168 8272 1 20 . 1 1 10 10 GLU N N 10 123.021 123.021 120.180 2.841 19168 8273 1 20 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.945 0.190 19168 8274 1 20 . 1 1 10 10 GLU C C 10 176.215 176.215 175.436 0.779 19168 8275 1 20 . 1 1 10 10 GLU CA C 10 54.902 54.902 54.555 0.347 19168 8276 1 20 . 1 1 10 10 GLU CB C 10 32.037 32.037 32.321 -0.284 19168 8277 1 20 . 1 1 11 11 ILE N N 11 126.526 126.526 125.461 1.065 19168 8278 1 20 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.273 0.062 19168 8279 1 20 . 1 1 11 11 ILE C C 11 174.334 174.334 174.805 -0.471 19168 8280 1 20 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.170 0.140 19168 8281 1 20 . 1 1 11 11 ILE CB C 11 39.826 39.826 40.143 -0.317 19168 8282 1 20 . 1 1 12 12 LYS N N 12 128.164 128.164 128.963 -0.799 19168 8283 1 20 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.155 0.190 19168 8284 1 20 . 1 1 12 12 LYS C C 12 176.378 176.378 175.845 0.533 19168 8285 1 20 . 1 1 12 12 LYS CA C 12 55.940 55.940 56.096 -0.156 19168 8286 1 20 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.760 0.296 19168 8287 1 20 . 1 1 13 13 LEU N N 13 121.881 121.881 124.848 -2.967 19168 8288 1 20 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.873 0.081 19168 8289 1 20 . 1 1 13 13 LEU C C 13 175.137 175.137 174.998 0.139 19168 8290 1 20 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.483 0.491 19168 8291 1 20 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.231 0.053 19168 8292 1 20 . 1 1 14 14 SER N N 14 115.759 115.759 112.981 2.778 19168 8293 1 20 . 1 1 14 14 SER HA H 14 4.889 4.889 5.098 -0.209 19168 8294 1 20 . 1 1 14 14 SER C C 14 173.993 173.993 175.192 -1.199 19168 8295 1 20 . 1 1 14 14 SER CA C 14 56.052 56.052 57.379 -1.327 19168 8296 1 20 . 1 1 14 14 SER CB C 14 64.775 64.775 66.698 -1.923 19168 8297 1 20 . 1 1 15 15 VAL N N 15 120.993 120.993 121.145 -0.152 19168 8298 1 20 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.844 -0.110 19168 8299 1 20 . 1 1 15 15 VAL C C 15 176.964 176.964 176.395 0.569 19168 8300 1 20 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.286 0.141 19168 8301 1 20 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.823 -0.038 19168 8302 1 20 . 1 1 16 16 LYS N N 16 118.897 118.897 117.281 1.616 19168 8303 1 20 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.344 0.057 19168 8304 1 20 . 1 1 16 16 LYS C C 16 175.489 175.489 176.007 -0.518 19168 8305 1 20 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.490 -0.336 19168 8306 1 20 . 1 1 16 16 LYS CB C 16 30.929 30.929 31.668 -0.739 19168 8307 1 20 . 1 1 17 17 ILE N N 17 122.247 122.247 119.937 2.310 19168 8308 1 20 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.036 0.149 19168 8309 1 20 . 1 1 17 17 ILE C C 17 173.426 173.426 174.969 -1.543 19168 8310 1 20 . 1 1 17 17 ILE CA C 17 61.276 61.276 61.352 -0.076 19168 8311 1 20 . 1 1 17 17 ILE CB C 17 39.080 39.080 39.079 0.001 19168 8312 1 20 . 1 1 18 18 ALA N N 18 129.434 129.434 129.161 0.273 19168 8313 1 20 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.471 0.008 19168 8314 1 20 . 1 1 18 18 ALA C C 18 179.130 179.130 177.614 1.516 19168 8315 1 20 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.402 0.035 19168 8316 1 20 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.653 -0.744 19168 8317 1 20 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.031 -0.234 19168 8318 1 20 . 1 1 19 19 GLN CA C 19 59.231 59.231 59.060 0.171 19168 8319 1 20 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.211 -0.036 19168 8320 1 20 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.549 -0.119 19168 8321 1 20 . 1 1 20 20 ASN C C 20 177.272 177.272 177.538 -0.266 19168 8322 1 20 . 1 1 20 20 ASN CA C 20 56.184 56.184 55.997 0.187 19168 8323 1 20 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.290 0.163 19168 8324 1 20 . 1 1 21 21 ASP N N 21 119.132 119.132 119.933 -0.801 19168 8325 1 20 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.564 0.234 19168 8326 1 20 . 1 1 21 21 ASP C C 21 178.707 178.707 178.479 0.228 19168 8327 1 20 . 1 1 21 21 ASP CA C 21 56.886 56.886 56.835 0.051 19168 8328 1 20 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.863 -0.198 19168 8329 1 20 . 1 1 22 22 ILE N N 22 122.030 122.030 120.547 1.483 19168 8330 1 20 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.612 -0.194 19168 8331 1 20 . 1 1 22 22 ILE C C 22 177.454 177.454 177.995 -0.541 19168 8332 1 20 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.555 1.171 19168 8333 1 20 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.825 -0.259 19168 8334 1 20 . 1 1 23 23 ASN N N 23 116.728 116.728 118.394 -1.666 19168 8335 1 20 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.453 -0.240 19168 8336 1 20 . 1 1 23 23 ASN C C 23 178.260 178.260 177.885 0.375 19168 8337 1 20 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.259 0.015 19168 8338 1 20 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.153 -0.945 19168 8339 1 20 . 1 1 24 24 TYR N N 24 119.864 119.864 121.706 -1.842 19168 8340 1 20 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.242 0.051 19168 8341 1 20 . 1 1 24 24 TYR C C 24 177.719 177.719 177.508 0.211 19168 8342 1 20 . 1 1 24 24 TYR CA C 24 61.048 61.048 62.010 -0.962 19168 8343 1 20 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.791 -0.508 19168 8344 1 20 . 1 1 25 25 LYS N N 25 119.730 119.730 119.391 0.339 19168 8345 1 20 . 1 1 25 25 LYS HA H 25 4.111 4.111 3.998 0.113 19168 8346 1 20 . 1 1 25 25 LYS C C 25 179.152 179.152 179.003 0.149 19168 8347 1 20 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.962 -0.800 19168 8348 1 20 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.868 -0.574 19168 8349 1 20 . 1 1 26 26 VAL N N 26 119.387 119.387 116.661 2.726 19168 8350 1 20 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.809 -0.189 19168 8351 1 20 . 1 1 26 26 VAL C C 26 177.017 177.017 177.349 -0.332 19168 8352 1 20 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.322 1.339 19168 8353 1 20 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.257 0.293 19168 8354 1 20 . 1 1 27 27 LYS N N 27 120.420 120.420 121.022 -0.602 19168 8355 1 20 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.905 0.041 19168 8356 1 20 . 1 1 27 27 LYS C C 27 179.458 179.458 178.462 0.996 19168 8357 1 20 . 1 1 27 27 LYS CA C 27 59.878 59.878 60.004 -0.126 19168 8358 1 20 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.302 -0.454 19168 8359 1 20 . 1 1 28 28 HIS N N 28 118.160 118.160 118.377 -0.217 19168 8360 1 20 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.506 -0.319 19168 8361 1 20 . 1 1 28 28 HIS C C 28 177.085 177.085 177.669 -0.584 19168 8362 1 20 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.904 -2.019 19168 8363 1 20 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.829 -0.073 19168 8364 1 20 . 1 1 29 29 ALA N N 29 120.579 120.579 122.788 -2.209 19168 8365 1 20 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.212 -0.214 19168 8366 1 20 . 1 1 29 29 ALA C C 29 179.299 179.299 179.692 -0.393 19168 8367 1 20 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.444 0.123 19168 8368 1 20 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.344 1.105 19168 8369 1 20 . 1 1 30 30 LEU N N 30 117.262 117.262 118.703 -1.441 19168 8370 1 20 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.896 0.179 19168 8371 1 20 . 1 1 30 30 LEU C C 30 180.017 180.017 179.166 0.851 19168 8372 1 20 . 1 1 30 30 LEU CA C 30 58.232 58.232 58.162 0.070 19168 8373 1 20 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.639 -0.313 19168 8374 1 20 . 1 1 31 31 GLU N N 31 120.625 120.625 119.610 1.015 19168 8375 1 20 . 1 1 31 31 GLU HA H 31 4.068 4.068 3.860 0.208 19168 8376 1 20 . 1 1 31 31 GLU C C 31 179.572 179.572 179.407 0.165 19168 8377 1 20 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.255 0.020 19168 8378 1 20 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.268 -0.293 19168 8379 1 20 . 1 1 32 32 PHE N N 32 118.245 118.245 118.670 -0.425 19168 8380 1 20 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.227 0.299 19168 8381 1 20 . 1 1 32 32 PHE C C 32 179.123 179.123 177.789 1.334 19168 8382 1 20 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.897 -3.200 19168 8383 1 20 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.971 -1.720 19168 8384 1 20 . 1 1 33 33 LEU N N 33 121.684 121.684 120.287 1.397 19168 8385 1 20 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.359 0.232 19168 8386 1 20 . 1 1 33 33 LEU C C 33 181.655 181.655 179.756 1.899 19168 8387 1 20 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.427 0.745 19168 8388 1 20 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.943 -0.251 19168 8389 1 20 . 1 1 34 34 GLU N N 34 122.046 122.046 116.551 5.495 19168 8390 1 20 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.111 0.041 19168 8391 1 20 . 1 1 34 34 GLU C C 34 178.237 178.237 177.596 0.641 19168 8392 1 20 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.388 0.758 19168 8393 1 20 . 1 1 34 34 GLU CB C 34 29.234 29.234 28.777 0.456 19168 8394 1 20 . 1 1 35 35 GLN N N 35 115.697 115.697 117.744 -2.047 19168 8395 1 20 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.328 0.059 19168 8396 1 20 . 1 1 35 35 GLN C C 35 176.456 176.456 176.651 -0.195 19168 8397 1 20 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.700 -0.014 19168 8398 1 20 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.141 0.055 19168 8399 1 20 . 1 1 36 36 GLY N N 36 108.291 108.291 107.737 0.554 19168 8400 1 20 . 1 1 36 36 GLY C C 36 174.673 174.673 173.947 0.726 19168 8401 1 20 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.327 0.201 19168 8402 1 20 . 1 1 37 37 LYS N N 37 120.464 120.464 119.736 0.728 19168 8403 1 20 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.877 -0.380 19168 8404 1 20 . 1 1 37 37 LYS C C 37 174.580 174.580 175.846 -1.266 19168 8405 1 20 . 1 1 37 37 LYS CA C 37 55.089 55.089 53.922 1.167 19168 8406 1 20 . 1 1 37 37 LYS CB C 37 32.745 32.745 35.374 -2.629 19168 8407 1 20 . 1 1 38 38 HIS N N 38 116.878 116.878 119.087 -2.209 19168 8408 1 20 . 1 1 38 38 HIS HA H 38 5.019 5.019 5.080 -0.061 19168 8409 1 20 . 1 1 38 38 HIS C C 38 175.268 175.268 174.447 0.821 19168 8410 1 20 . 1 1 38 38 HIS CA C 38 54.150 54.150 55.403 -1.253 19168 8411 1 20 . 1 1 38 38 HIS CB C 38 32.877 32.877 32.628 0.249 19168 8412 1 20 . 1 1 39 39 VAL N N 39 119.782 119.782 121.226 -1.444 19168 8413 1 20 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.751 0.045 19168 8414 1 20 . 1 1 39 39 VAL C C 39 173.320 173.320 174.178 -0.858 19168 8415 1 20 . 1 1 39 39 VAL CA C 39 60.766 60.766 61.072 -0.306 19168 8416 1 20 . 1 1 39 39 VAL CB C 39 35.433 35.433 34.161 1.272 19168 8417 1 20 . 1 1 40 40 ARG N N 40 128.358 128.358 126.784 1.574 19168 8418 1 20 . 1 1 40 40 ARG HA H 40 5.115 5.115 5.131 -0.016 19168 8419 1 20 . 1 1 40 40 ARG C C 40 175.659 175.659 175.009 0.650 19168 8420 1 20 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.119 -0.297 19168 8421 1 20 . 1 1 40 40 ARG CB C 40 33.007 33.007 32.303 0.704 19168 8422 1 20 . 1 1 41 41 PHE N N 41 126.396 126.396 127.528 -1.132 19168 8423 1 20 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.336 -0.158 19168 8424 1 20 . 1 1 41 41 PHE C C 41 176.107 176.107 175.287 0.820 19168 8425 1 20 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.572 0.124 19168 8426 1 20 . 1 1 41 41 PHE CB C 41 42.046 42.046 40.092 1.954 19168 8427 1 20 . 1 1 42 42 ARG N N 42 120.641 120.641 124.502 -3.861 19168 8428 1 20 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.329 0.210 19168 8429 1 20 . 1 1 42 42 ARG C C 42 175.010 175.010 174.789 0.221 19168 8430 1 20 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.934 -0.239 19168 8431 1 20 . 1 1 42 42 ARG CB C 42 34.374 34.374 33.394 0.980 19168 8432 1 20 . 1 1 43 43 VAL N N 43 125.565 125.565 124.118 1.447 19168 8433 1 20 . 1 1 43 43 VAL HA H 43 4.665 4.665 4.947 -0.282 19168 8434 1 20 . 1 1 43 43 VAL C C 43 175.325 175.325 173.667 1.658 19168 8435 1 20 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.728 1.088 19168 8436 1 20 . 1 1 43 43 VAL CB C 43 32.983 32.983 34.996 -2.013 19168 8437 1 20 . 1 1 44 44 PHE N N 44 128.291 128.291 129.583 -1.292 19168 8438 1 20 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.432 0.186 19168 8439 1 20 . 1 1 44 44 PHE C C 44 174.477 174.477 174.624 -0.147 19168 8440 1 20 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.834 0.314 19168 8441 1 20 . 1 1 44 44 PHE CB C 44 39.941 39.941 40.662 -0.721 19168 8442 1 20 . 1 1 45 45 LEU N N 45 128.360 128.360 130.472 -2.112 19168 8443 1 20 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.239 0.152 19168 8444 1 20 . 1 1 45 45 LEU C C 45 174.342 174.342 175.440 -1.098 19168 8445 1 20 . 1 1 45 45 LEU CA C 45 53.586 53.586 53.520 0.066 19168 8446 1 20 . 1 1 45 45 LEU CB C 45 41.113 41.113 40.329 0.784 19168 8447 1 20 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.057 0.035 19168 8448 1 20 . 1 1 46 46 LYS CA C 46 55.079 55.079 57.309 -2.230 19168 8449 1 20 . 1 1 46 46 LYS CB C 46 34.295 34.295 32.960 1.335 19168 8450 1 20 . 1 1 47 47 GLY CA C 47 46.813 46.813 44.836 1.977 19168 8451 1 20 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.371 -0.171 19168 8452 1 20 . 1 1 48 48 ARG C C 48 178.069 178.069 177.298 0.771 19168 8453 1 20 . 1 1 48 48 ARG CA C 48 57.862 57.862 56.188 1.674 19168 8454 1 20 . 1 1 48 48 ARG CB C 48 29.444 29.444 29.992 -0.548 19168 8455 1 20 . 1 1 49 49 GLU N N 49 119.779 119.779 120.504 -0.725 19168 8456 1 20 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.050 0.003 19168 8457 1 20 . 1 1 49 49 GLU C C 49 178.227 178.227 177.801 0.426 19168 8458 1 20 . 1 1 49 49 GLU CA C 49 57.436 57.436 58.389 -0.953 19168 8459 1 20 . 1 1 49 49 GLU CB C 49 29.745 29.745 28.769 0.976 19168 8460 1 20 . 1 1 50 50 MET N N 50 116.370 116.370 116.865 -0.495 19168 8461 1 20 . 1 1 50 50 MET HA H 50 4.024 4.024 4.121 -0.097 19168 8462 1 20 . 1 1 50 50 MET C C 50 175.912 175.912 177.128 -1.216 19168 8463 1 20 . 1 1 50 50 MET CA C 50 56.664 56.664 57.266 -0.601 19168 8464 1 20 . 1 1 50 50 MET CB C 50 32.033 32.033 32.153 -0.120 19168 8465 1 20 . 1 1 51 51 ALA N N 51 118.880 118.880 120.125 -1.245 19168 8466 1 20 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.219 0.125 19168 8467 1 20 . 1 1 51 51 ALA C C 51 177.746 177.746 177.791 -0.045 19168 8468 1 20 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.493 -1.102 19168 8469 1 20 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.439 0.004 19168 8470 1 20 . 1 1 52 52 THR N N 52 108.299 108.299 112.524 -4.225 19168 8471 1 20 . 1 1 52 52 THR HA H 52 4.869 4.869 4.701 0.168 19168 8472 1 20 . 1 1 52 52 THR C C 52 173.933 173.933 172.770 1.163 19168 8473 1 20 . 1 1 52 52 THR CA C 52 57.554 57.554 59.133 -1.579 19168 8474 1 20 . 1 1 52 52 THR CB C 52 69.479 69.479 70.220 -0.741 19168 8475 1 20 . 1 1 53 53 PRO HA H 53 3.931 3.931 3.794 0.137 19168 8476 1 20 . 1 1 53 53 PRO C C 53 178.185 178.185 177.668 0.517 19168 8477 1 20 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.070 0.949 19168 8478 1 20 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.587 -1.071 19168 8479 1 20 . 1 1 54 54 GLU N N 54 120.653 120.653 118.470 2.183 19168 8480 1 20 . 1 1 54 54 GLU HA H 54 4.016 4.016 3.946 0.070 19168 8481 1 20 . 1 1 54 54 GLU C C 54 178.608 178.608 178.273 0.335 19168 8482 1 20 . 1 1 54 54 GLU CA C 54 59.472 59.472 59.021 0.451 19168 8483 1 20 . 1 1 54 54 GLU CB C 54 27.419 27.419 28.913 -1.494 19168 8484 1 20 . 1 1 55 55 ALA N N 55 124.380 124.380 121.629 2.751 19168 8485 1 20 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.085 0.238 19168 8486 1 20 . 1 1 55 55 ALA C C 55 181.502 181.502 179.745 1.757 19168 8487 1 20 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.082 -0.302 19168 8488 1 20 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.084 0.317 19168 8489 1 20 . 1 1 56 56 GLY N N 56 105.673 105.673 106.779 -1.106 19168 8490 1 20 . 1 1 56 56 GLY C C 56 174.278 174.278 176.290 -2.012 19168 8491 1 20 . 1 1 56 56 GLY CA C 56 46.879 46.879 46.893 -0.014 19168 8492 1 20 . 1 1 57 57 VAL N N 57 122.685 122.685 123.108 -0.423 19168 8493 1 20 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.643 -0.321 19168 8494 1 20 . 1 1 57 57 VAL C C 57 177.134 177.134 177.623 -0.489 19168 8495 1 20 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.593 0.803 19168 8496 1 20 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.428 0.341 19168 8497 1 20 . 1 1 58 58 ALA N N 58 119.580 119.580 122.190 -2.610 19168 8498 1 20 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.051 0.043 19168 8499 1 20 . 1 1 58 58 ALA C C 58 180.788 180.788 179.587 1.201 19168 8500 1 20 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.267 -0.214 19168 8501 1 20 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.151 -0.297 19168 8502 1 20 . 1 1 59 59 LEU N N 59 119.723 119.723 119.820 -0.097 19168 8503 1 20 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.043 0.215 19168 8504 1 20 . 1 1 59 59 LEU C C 59 178.024 178.024 178.556 -0.532 19168 8505 1 20 . 1 1 59 59 LEU CA C 59 57.710 57.710 57.853 -0.143 19168 8506 1 20 . 1 1 59 59 LEU CB C 59 41.701 41.701 41.987 -0.286 19168 8507 1 20 . 1 1 60 60 LEU N N 60 117.978 117.978 118.984 -1.006 19168 8508 1 20 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.818 0.039 19168 8509 1 20 . 1 1 60 60 LEU C C 60 178.851 178.851 179.136 -0.285 19168 8510 1 20 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.102 -0.458 19168 8511 1 20 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.245 -0.957 19168 8512 1 20 . 1 1 61 61 GLU N N 61 119.906 119.906 119.297 0.609 19168 8513 1 20 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.005 0.486 19168 8514 1 20 . 1 1 61 61 GLU C C 61 179.519 179.519 179.092 0.427 19168 8515 1 20 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.539 -0.797 19168 8516 1 20 . 1 1 61 61 GLU CB C 61 28.813 28.813 28.955 -0.142 19168 8517 1 20 . 1 1 62 62 LYS N N 62 122.015 122.015 120.122 1.893 19168 8518 1 20 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.102 0.026 19168 8519 1 20 . 1 1 62 62 LYS C C 62 179.843 179.843 179.280 0.563 19168 8520 1 20 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.141 0.196 19168 8521 1 20 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.421 -0.774 19168 8522 1 20 . 1 1 63 63 ILE N N 63 120.882 120.882 119.997 0.885 19168 8523 1 20 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.627 -0.131 19168 8524 1 20 . 1 1 63 63 ILE C C 63 177.761 177.761 177.207 0.554 19168 8525 1 20 . 1 1 63 63 ILE CA C 63 65.182 65.182 65.211 -0.029 19168 8526 1 20 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.940 -0.554 19168 8527 1 20 . 1 1 64 64 TRP N N 64 120.279 120.279 122.161 -1.882 19168 8528 1 20 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.126 0.358 19168 8529 1 20 . 1 1 64 64 TRP C C 64 177.056 177.056 177.709 -0.653 19168 8530 1 20 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.458 -1.364 19168 8531 1 20 . 1 1 64 64 TRP CB C 64 29.635 29.635 30.028 -0.393 19168 8532 1 20 . 1 1 65 65 THR N N 65 109.483 109.483 110.147 -0.664 19168 8533 1 20 . 1 1 65 65 THR HA H 65 3.744 3.744 3.771 -0.027 19168 8534 1 20 . 1 1 65 65 THR C C 65 176.224 176.224 175.900 0.324 19168 8535 1 20 . 1 1 65 65 THR CA C 65 65.568 65.568 64.244 1.324 19168 8536 1 20 . 1 1 65 65 THR CB C 65 69.308 69.308 68.231 1.077 19168 8537 1 20 . 1 1 66 66 MET N N 66 117.791 117.791 118.114 -0.323 19168 8538 1 20 . 1 1 66 66 MET HA H 66 4.110 4.110 4.322 -0.212 19168 8539 1 20 . 1 1 66 66 MET C C 66 177.782 177.782 177.252 0.530 19168 8540 1 20 . 1 1 66 66 MET CA C 66 58.304 58.304 56.732 1.572 19168 8541 1 20 . 1 1 66 66 MET CB C 66 34.040 34.040 32.824 1.216 19168 8542 1 20 . 1 1 67 67 ILE N N 67 109.871 109.871 111.704 -1.833 19168 8543 1 20 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.604 0.038 19168 8544 1 20 . 1 1 67 67 ILE C C 67 176.713 176.713 176.810 -0.097 19168 8545 1 20 . 1 1 67 67 ILE CA C 67 61.174 61.174 61.038 0.136 19168 8546 1 20 . 1 1 67 67 ILE CB C 67 39.813 39.813 39.154 0.659 19168 8547 1 20 . 1 1 68 68 GLU N N 68 121.972 121.972 121.328 0.644 19168 8548 1 20 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.447 -0.699 19168 8549 1 20 . 1 1 68 68 GLU C C 68 175.855 175.855 177.194 -1.339 19168 8550 1 20 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.472 -0.181 19168 8551 1 20 . 1 1 68 68 GLU CB C 68 28.492 28.492 28.059 0.433 19168 8552 1 20 . 1 1 69 69 ASN N N 69 114.338 114.338 116.125 -1.787 19168 8553 1 20 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.358 0.222 19168 8554 1 20 . 1 1 69 69 ASN C C 69 175.904 175.904 177.186 -1.282 19168 8555 1 20 . 1 1 69 69 ASN CA C 69 54.597 54.597 55.393 -0.796 19168 8556 1 20 . 1 1 69 69 ASN CB C 69 38.323 38.323 37.836 0.487 19168 8557 1 20 . 1 1 70 70 GLU N N 70 116.936 116.936 117.704 -0.768 19168 8558 1 20 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.632 -0.084 19168 8559 1 20 . 1 1 70 70 GLU C C 70 174.941 174.941 174.495 0.446 19168 8560 1 20 . 1 1 70 70 GLU CA C 70 55.983 55.983 55.558 0.425 19168 8561 1 20 . 1 1 70 70 GLU CB C 70 31.348 31.348 31.051 0.297 19168 8562 1 20 . 1 1 71 71 ALA N N 71 122.966 122.966 121.664 1.302 19168 8563 1 20 . 1 1 71 71 ALA HA H 71 5.246 5.246 5.238 0.008 19168 8564 1 20 . 1 1 71 71 ALA C C 71 173.907 173.907 175.288 -1.381 19168 8565 1 20 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.598 0.220 19168 8566 1 20 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.570 1.490 19168 8567 1 20 . 1 1 72 72 ASN N N 72 115.820 115.820 120.217 -4.397 19168 8568 1 20 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.422 0.019 19168 8569 1 20 . 1 1 72 72 ASN C C 72 174.137 174.137 174.831 -0.694 19168 8570 1 20 . 1 1 72 72 ASN CA C 72 51.659 51.659 51.762 -0.103 19168 8571 1 20 . 1 1 72 72 ASN CB C 72 42.186 42.186 41.675 0.511 19168 8572 1 20 . 1 1 73 73 ARG N N 73 118.340 118.340 123.964 -5.624 19168 8573 1 20 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.831 0.947 19168 8574 1 20 . 1 1 73 73 ARG C C 73 174.674 174.674 174.957 -0.283 19168 8575 1 20 . 1 1 73 73 ARG CA C 73 54.869 54.869 57.189 -2.320 19168 8576 1 20 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.774 2.351 19168 8577 1 20 . 1 1 74 74 ASP N N 74 124.007 124.007 126.779 -2.772 19168 8578 1 20 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.600 -0.058 19168 8579 1 20 . 1 1 74 74 ASP C C 74 175.935 175.935 176.043 -0.108 19168 8580 1 20 . 1 1 74 74 ASP CA C 74 55.397 55.397 55.699 -0.302 19168 8581 1 20 . 1 1 74 74 ASP CB C 74 42.220 42.220 42.315 -0.095 19168 8582 1 20 . 1 1 75 75 LYS N N 75 116.482 116.482 118.213 -1.731 19168 8583 1 20 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.532 -0.087 19168 8584 1 20 . 1 1 75 75 LYS C C 75 175.135 175.135 174.713 0.422 19168 8585 1 20 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.280 -0.495 19168 8586 1 20 . 1 1 75 75 LYS CB C 75 35.475 35.475 35.463 0.012 19168 8587 1 20 . 1 1 76 76 GLU N N 76 120.126 120.126 121.669 -1.543 19168 8588 1 20 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.385 -0.477 19168 8589 1 20 . 1 1 76 76 GLU C C 76 173.204 173.204 175.243 -2.039 19168 8590 1 20 . 1 1 76 76 GLU CA C 76 55.524 55.524 54.171 1.353 19168 8591 1 20 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.533 -2.022 19168 8592 1 20 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.458 0.319 19168 8593 1 20 . 1 1 77 77 PRO C C 77 174.933 174.933 175.787 -0.854 19168 8594 1 20 . 1 1 77 77 PRO CA C 77 63.422 63.422 63.031 0.391 19168 8595 1 20 . 1 1 77 77 PRO CB C 77 32.391 32.391 31.925 0.466 19168 8596 1 20 . 1 1 78 78 ASN N N 78 119.292 119.292 122.400 -3.108 19168 8597 1 20 . 1 1 78 78 ASN HA H 78 5.093 5.093 4.961 0.132 19168 8598 1 20 . 1 1 78 78 ASN C C 78 172.876 172.876 173.600 -0.724 19168 8599 1 20 . 1 1 78 78 ASN CA C 78 51.928 51.928 52.345 -0.417 19168 8600 1 20 . 1 1 78 78 ASN CB C 78 42.017 42.017 42.443 -0.426 19168 8601 1 20 . 1 1 79 79 PHE N N 79 125.023 125.023 126.374 -1.351 19168 8602 1 20 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.448 -0.025 19168 8603 1 20 . 1 1 79 79 PHE C C 79 174.552 174.552 174.628 -0.076 19168 8604 1 20 . 1 1 79 79 PHE CA C 79 55.210 55.210 57.063 -1.853 19168 8605 1 20 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.108 0.001 19168 8606 1 20 . 1 1 80 80 GLU N N 80 128.920 128.920 127.723 1.197 19168 8607 1 20 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.216 -0.008 19168 8608 1 20 . 1 1 80 80 GLU C C 80 175.538 175.538 175.707 -0.169 19168 8609 1 20 . 1 1 80 80 GLU CA C 80 55.724 55.724 55.627 0.097 19168 8610 1 20 . 1 1 80 80 GLU CB C 80 32.135 32.135 32.118 0.017 19168 8611 1 20 . 1 1 81 81 GLY N N 81 116.695 116.695 114.203 2.492 19168 8612 1 20 . 1 1 81 81 GLY C C 81 173.950 173.950 174.024 -0.074 19168 8613 1 20 . 1 1 81 81 GLY CA C 81 46.967 46.967 45.870 1.097 19168 8614 1 20 . 1 1 82 82 ARG N N 82 124.481 124.481 111.510 12.971 19168 8615 1 20 . 1 1 82 82 ARG HA H 82 4.539 4.539 3.731 0.808 19168 8616 1 20 . 1 1 82 82 ARG C C 82 173.437 173.437 174.041 -0.604 19168 8617 1 20 . 1 1 82 82 ARG CA C 82 55.156 55.156 57.431 -2.275 19168 8618 1 20 . 1 1 82 82 ARG CB C 82 30.255 30.255 29.075 1.180 19168 8619 1 20 . 1 1 83 83 TYR N N 83 114.539 114.539 115.763 -1.224 19168 8620 1 20 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.533 0.415 19168 8621 1 20 . 1 1 83 83 TYR C C 83 175.909 175.909 174.993 0.916 19168 8622 1 20 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.502 -0.445 19168 8623 1 20 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.306 0.693 19168 8624 1 20 . 1 1 84 84 VAL N N 84 118.812 118.812 123.025 -4.213 19168 8625 1 20 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.932 -0.065 19168 8626 1 20 . 1 1 84 84 VAL C C 84 174.982 174.982 175.068 -0.086 19168 8627 1 20 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.548 -0.313 19168 8628 1 20 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.650 -0.159 19168 8629 1 20 . 1 1 85 85 ASN N N 85 124.630 124.630 124.474 0.156 19168 8630 1 20 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.304 -0.300 19168 8631 1 20 . 1 1 85 85 ASN C C 85 175.392 175.392 173.657 1.735 19168 8632 1 20 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.297 1.299 19168 8633 1 20 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.785 1.421 19168 8634 1 20 . 1 1 86 86 MET N N 86 118.969 118.969 120.404 -1.435 19168 8635 1 20 . 1 1 86 86 MET HA H 86 4.640 4.640 4.915 -0.275 19168 8636 1 20 . 1 1 86 86 MET C C 86 172.378 172.378 173.660 -1.282 19168 8637 1 20 . 1 1 86 86 MET CA C 86 56.158 56.158 54.850 1.308 19168 8638 1 20 . 1 1 86 86 MET CB C 86 39.138 39.138 37.155 1.983 19168 8639 1 20 . 1 1 87 87 LEU N N 87 131.886 131.886 125.334 6.552 19168 8640 1 20 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.193 0.188 19168 8641 1 20 . 1 1 87 87 LEU C C 87 176.003 176.003 175.876 0.127 19168 8642 1 20 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.432 0.698 19168 8643 1 20 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.075 0.398 19168 8644 1 20 . 1 1 88 88 VAL N N 88 121.165 121.165 118.524 2.641 19168 8645 1 20 . 1 1 88 88 VAL HA H 88 5.510 5.510 5.023 0.487 19168 8646 1 20 . 1 1 88 88 VAL C C 88 173.666 173.666 175.001 -1.335 19168 8647 1 20 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.736 -1.136 19168 8648 1 20 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.819 -0.026 19168 8649 1 20 . 1 1 89 89 THR N N 89 111.786 111.786 120.411 -8.625 19168 8650 1 20 . 1 1 89 89 THR HA H 89 4.720 4.720 4.376 0.344 19168 8651 1 20 . 1 1 89 89 THR C C 89 171.898 171.898 172.377 -0.479 19168 8652 1 20 . 1 1 89 89 THR CA C 89 57.985 57.985 59.403 -1.418 19168 8653 1 20 . 1 1 89 89 THR CB C 89 69.113 69.113 69.344 -0.231 19168 8654 1 20 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.641 -0.058 19168 8655 1 20 . 1 1 90 90 PRO C C 90 177.403 177.403 177.260 0.143 19168 8656 1 20 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.781 0.750 19168 8657 1 20 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.108 -0.065 19168 8658 1 20 . 1 1 91 91 LYS N N 91 123.696 123.696 124.591 -0.895 19168 8659 1 20 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.249 -0.138 19168 8660 1 20 . 1 1 91 91 LYS C C 91 176.568 176.568 176.462 0.106 19168 8661 1 20 . 1 1 91 91 LYS CA C 91 57.208 57.208 56.158 1.050 19168 8662 1 20 . 1 1 91 91 LYS CB C 91 33.183 33.183 31.089 2.094 19168 8663 1 20 . 1 1 92 92 LYS N N 92 122.054 122.054 119.393 2.661 19168 8664 1 20 . 1 1 92 92 LYS HA H 92 4.316 4.316 3.870 0.446 19168 8665 1 20 . 1 1 92 92 LYS C C 92 175.956 175.956 175.982 -0.026 19168 8666 1 20 . 1 1 92 92 LYS CA C 92 55.942 55.942 59.257 -3.315 19168 8667 1 20 . 1 1 92 92 LYS CB C 92 33.000 33.000 31.311 1.689 19168 8668 1 20 . 1 1 93 93 ALA N N 93 126.278 126.278 121.869 4.409 19168 8669 1 20 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.527 -0.186 19168 8670 1 20 . 1 1 93 93 ALA C C 93 177.592 177.592 176.282 1.310 19168 8671 1 20 . 1 1 93 93 ALA CA C 93 52.279 52.279 51.812 0.466 19168 8672 1 20 . 1 1 93 93 ALA CB C 93 19.332 19.332 20.126 -0.794 19168 8673 1 20 . 1 1 94 94 GLU N N 94 120.522 120.522 120.590 -0.068 19168 8674 1 20 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.370 -0.086 19168 8675 1 20 . 1 1 94 94 GLU C C 94 177.041 177.041 177.116 -0.075 19168 8676 1 20 . 1 1 94 94 GLU CA C 94 56.606 56.606 56.464 0.142 19168 8677 1 20 . 1 1 94 94 GLU CB C 94 30.353 30.353 30.730 -0.377 19168 8678 1 20 . 1 1 95 95 GLY N N 95 109.755 109.755 112.462 -2.707 19168 8679 1 20 . 1 1 95 95 GLY C C 95 173.939 173.939 173.838 0.101 19168 8680 1 20 . 1 1 95 95 GLY CA C 95 45.168 45.168 45.018 0.150 19168 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 83 2.877 0.058 2.894 19168 2 1 1 "Average Difference" HA 91 0.290 -0.061 0.285 19168 3 1 1 "Average Difference" C 88 0.876 0.036 0.880 19168 4 1 1 "Average Difference" CA 91 1.004 0.187 0.991 19168 5 1 1 "Average Difference" CB 86 1.092 -0.110 1.093 19168 6 1 1 "Average Difference" HN 0 0.000 0.000 0.000 19168 7 1 2 "Average Difference" N 83 2.258 0.325 2.248 19168 8 1 2 "Average Difference" HA 91 0.255 -0.038 0.253 19168 9 1 2 "Average Difference" C 88 0.843 0.021 0.847 19168 10 1 2 "Average Difference" CA 91 0.886 0.132 0.881 19168 11 1 2 "Average Difference" CB 86 1.047 -0.024 1.052 19168 12 1 2 "Average Difference" HN 0 0.000 0.000 0.000 19168 13 1 3 "Average Difference" N 83 2.666 0.302 2.665 19168 14 1 3 "Average Difference" HA 91 0.275 -0.012 0.276 19168 15 1 3 "Average Difference" C 88 0.897 -0.014 0.902 19168 16 1 3 "Average Difference" CA 91 0.982 0.112 0.981 19168 17 1 3 "Average Difference" CB 86 1.052 0.017 1.058 19168 18 1 3 "Average Difference" HN 0 0.000 0.000 0.000 19168 19 1 4 "Average Difference" N 83 2.590 0.372 2.579 19168 20 1 4 "Average Difference" HA 91 0.275 -0.025 0.276 19168 21 1 4 "Average Difference" C 88 0.915 0.026 0.920 19168 22 1 4 "Average Difference" CA 91 0.989 0.136 0.985 19168 23 1 4 "Average Difference" CB 86 1.054 -0.005 1.060 19168 24 1 4 "Average Difference" HN 0 0.000 0.000 0.000 19168 25 1 5 "Average Difference" N 83 2.533 0.333 2.527 19168 26 1 5 "Average Difference" HA 91 0.255 -0.056 0.251 19168 27 1 5 "Average Difference" C 88 0.920 0.065 0.923 19168 28 1 5 "Average Difference" CA 91 0.846 0.184 0.831 19168 29 1 5 "Average Difference" CB 86 0.991 -0.153 0.985 19168 30 1 5 "Average Difference" HN 0 0.000 0.000 0.000 19168 31 1 6 "Average Difference" N 83 2.261 0.650 2.178 19168 32 1 6 "Average Difference" HA 91 0.253 -0.035 0.252 19168 33 1 6 "Average Difference" C 88 0.879 -0.057 0.882 19168 34 1 6 "Average Difference" CA 91 0.959 0.074 0.962 19168 35 1 6 "Average Difference" CB 86 0.958 -0.029 0.964 19168 36 1 6 "Average Difference" HN 0 0.000 0.000 0.000 19168 37 1 7 "Average Difference" N 83 2.876 0.197 2.887 19168 38 1 7 "Average Difference" HA 91 0.304 -0.052 0.301 19168 39 1 7 "Average Difference" C 88 0.869 0.023 0.873 19168 40 1 7 "Average Difference" CA 91 0.924 0.121 0.921 19168 41 1 7 "Average Difference" CB 86 1.060 -0.178 1.051 19168 42 1 7 "Average Difference" HN 0 0.000 0.000 0.000 19168 43 1 8 "Average Difference" N 83 2.308 0.286 2.304 19168 44 1 8 "Average Difference" HA 91 0.261 -0.039 0.259 19168 45 1 8 "Average Difference" C 88 0.972 0.032 0.977 19168 46 1 8 "Average Difference" CA 91 0.883 0.061 0.886 19168 47 1 8 "Average Difference" CB 86 0.974 -0.041 0.979 19168 48 1 8 "Average Difference" HN 0 0.000 0.000 0.000 19168 49 1 9 "Average Difference" N 83 2.912 0.098 2.928 19168 50 1 9 "Average Difference" HA 91 0.268 -0.039 0.267 19168 51 1 9 "Average Difference" C 88 0.874 0.018 0.879 19168 52 1 9 "Average Difference" CA 91 1.011 0.054 1.015 19168 53 1 9 "Average Difference" CB 86 0.962 -0.016 0.967 19168 54 1 9 "Average Difference" HN 0 0.000 0.000 0.000 19168 55 1 10 "Average Difference" N 83 2.332 0.467 2.299 19168 56 1 10 "Average Difference" HA 91 0.257 -0.050 0.253 19168 57 1 10 "Average Difference" C 88 0.851 -0.022 0.855 19168 58 1 10 "Average Difference" CA 91 0.867 0.085 0.867 19168 59 1 10 "Average Difference" CB 86 1.053 0.016 1.059 19168 60 1 10 "Average Difference" HN 0 0.000 0.000 0.000 19168 61 1 11 "Average Difference" N 83 2.386 0.533 2.339 19168 62 1 11 "Average Difference" HA 91 0.294 -0.041 0.292 19168 63 1 11 "Average Difference" C 88 0.876 0.033 0.880 19168 64 1 11 "Average Difference" CA 91 0.976 0.143 0.971 19168 65 1 11 "Average Difference" CB 86 1.013 -0.054 1.018 19168 66 1 11 "Average Difference" HN 0 0.000 0.000 0.000 19168 67 1 12 "Average Difference" N 83 2.476 0.272 2.476 19168 68 1 12 "Average Difference" HA 91 0.257 -0.060 0.251 19168 69 1 12 "Average Difference" C 88 0.886 0.025 0.890 19168 70 1 12 "Average Difference" CA 91 0.833 0.165 0.821 19168 71 1 12 "Average Difference" CB 86 0.961 -0.026 0.966 19168 72 1 12 "Average Difference" HN 0 0.000 0.000 0.000 19168 73 1 13 "Average Difference" N 83 2.546 0.135 2.558 19168 74 1 13 "Average Difference" HA 91 0.292 -0.082 0.281 19168 75 1 13 "Average Difference" C 88 0.846 -0.016 0.850 19168 76 1 13 "Average Difference" CA 91 0.922 0.145 0.915 19168 77 1 13 "Average Difference" CB 86 1.060 -0.080 1.064 19168 78 1 13 "Average Difference" HN 0 0.000 0.000 0.000 19168 79 1 14 "Average Difference" N 83 2.273 0.497 2.231 19168 80 1 14 "Average Difference" HA 91 0.295 -0.065 0.289 19168 81 1 14 "Average Difference" C 88 0.900 0.064 0.903 19168 82 1 14 "Average Difference" CA 91 0.943 0.198 0.927 19168 83 1 14 "Average Difference" CB 86 1.175 -0.068 1.180 19168 84 1 14 "Average Difference" HN 0 0.000 0.000 0.000 19168 85 1 15 "Average Difference" N 83 2.781 0.328 2.778 19168 86 1 15 "Average Difference" HA 91 0.299 -0.039 0.298 19168 87 1 15 "Average Difference" C 88 0.857 -0.037 0.861 19168 88 1 15 "Average Difference" CA 91 0.931 0.123 0.928 19168 89 1 15 "Average Difference" CB 86 1.017 -0.003 1.023 19168 90 1 15 "Average Difference" HN 0 0.000 0.000 0.000 19168 91 1 16 "Average Difference" N 83 2.268 0.399 2.246 19168 92 1 16 "Average Difference" HA 91 0.274 -0.053 0.271 19168 93 1 16 "Average Difference" C 88 0.911 0.028 0.916 19168 94 1 16 "Average Difference" CA 91 0.934 0.125 0.930 19168 95 1 16 "Average Difference" CB 86 1.006 -0.115 1.005 19168 96 1 16 "Average Difference" HN 0 0.000 0.000 0.000 19168 97 1 17 "Average Difference" N 83 2.528 0.689 2.447 19168 98 1 17 "Average Difference" HA 91 0.282 -0.044 0.280 19168 99 1 17 "Average Difference" C 88 0.920 -0.001 0.925 19168 100 1 17 "Average Difference" CA 91 0.941 0.129 0.937 19168 101 1 17 "Average Difference" CB 86 1.057 -0.128 1.056 19168 102 1 17 "Average Difference" HN 0 0.000 0.000 0.000 19168 103 1 18 "Average Difference" N 83 2.754 0.159 2.766 19168 104 1 18 "Average Difference" HA 91 0.293 -0.067 0.286 19168 105 1 18 "Average Difference" C 88 0.879 -0.082 0.880 19168 106 1 18 "Average Difference" CA 91 1.002 0.071 1.005 19168 107 1 18 "Average Difference" CB 86 1.114 -0.124 1.113 19168 108 1 18 "Average Difference" HN 0 0.000 0.000 0.000 19168 109 1 19 "Average Difference" N 83 2.591 0.550 2.547 19168 110 1 19 "Average Difference" HA 91 0.262 -0.031 0.262 19168 111 1 19 "Average Difference" C 88 0.911 -0.058 0.915 19168 112 1 19 "Average Difference" CA 91 0.958 0.117 0.956 19168 113 1 19 "Average Difference" CB 86 0.997 -0.081 0.999 19168 114 1 19 "Average Difference" HN 0 0.000 0.000 0.000 19168 115 1 20 "Average Difference" N 83 2.792 0.162 2.805 19168 116 1 20 "Average Difference" HA 91 0.262 -0.052 0.259 19168 117 1 20 "Average Difference" C 88 0.864 -0.012 0.869 19168 118 1 20 "Average Difference" CA 91 1.021 0.137 1.018 19168 119 1 20 "Average Difference" CB 86 0.948 -0.073 0.950 19168 120 1 20 "Average Difference" HN 0 0.000 0.000 0.000 19168 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 19168 _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 5 5 VAL N N 5 123.289 123.289 122.461 0.828 19168 2 1 . 1 1 5 5 VAL HA H 5 4.019 4.019 4.191 -0.172 19168 3 1 . 1 1 5 5 VAL C C 5 175.799 175.799 175.530 0.268 19168 4 1 . 1 1 5 5 VAL CA C 5 62.120 62.120 62.242 -0.122 19168 5 1 . 1 1 5 5 VAL CB C 5 32.757 32.757 32.504 0.253 19168 6 1 . 1 1 6 6 ILE N N 6 126.794 126.794 124.577 2.217 19168 7 1 . 1 1 6 6 ILE HA H 6 3.967 3.967 4.116 -0.149 19168 8 1 . 1 1 6 6 ILE C C 6 175.103 175.103 175.175 -0.072 19168 9 1 . 1 1 6 6 ILE CA C 6 60.227 60.227 60.707 -0.480 19168 10 1 . 1 1 6 6 ILE CB C 6 38.565 38.565 38.106 0.459 19168 11 1 . 1 1 7 7 ASP N N 7 127.797 127.797 128.129 -0.332 19168 12 1 . 1 1 7 7 ASP HA H 7 4.544 4.544 4.633 -0.089 19168 13 1 . 1 1 7 7 ASP C C 7 174.000 174.000 175.103 -1.103 19168 14 1 . 1 1 7 7 ASP CA C 7 53.591 53.591 54.046 -0.455 19168 15 1 . 1 1 7 7 ASP CB C 7 42.152 42.152 41.437 0.715 19168 16 1 . 1 1 8 8 ILE N N 8 122.764 122.764 124.853 -2.088 19168 17 1 . 1 1 8 8 ILE HA H 8 4.320 4.320 4.171 0.149 19168 18 1 . 1 1 8 8 ILE C C 8 176.337 176.337 175.472 0.865 19168 19 1 . 1 1 8 8 ILE CA C 8 60.176 60.176 60.481 -0.305 19168 20 1 . 1 1 8 8 ILE CB C 8 39.542 39.542 39.607 -0.065 19168 21 1 . 1 1 9 9 LYS N N 9 127.990 127.990 127.240 0.750 19168 22 1 . 1 1 9 9 LYS HA H 9 4.322 4.322 4.352 -0.030 19168 23 1 . 1 1 9 9 LYS C C 9 174.759 174.759 175.323 -0.564 19168 24 1 . 1 1 9 9 LYS CA C 9 52.315 52.315 54.120 -1.805 19168 25 1 . 1 1 9 9 LYS CB C 9 32.902 32.902 33.027 -0.125 19168 26 1 . 1 1 10 10 GLU N N 10 123.021 123.021 122.732 0.289 19168 27 1 . 1 1 10 10 GLU HA H 10 5.135 5.135 4.823 0.312 19168 28 1 . 1 1 10 10 GLU C C 10 176.215 176.215 175.668 0.547 19168 29 1 . 1 1 10 10 GLU CA C 10 54.902 54.902 55.171 -0.269 19168 30 1 . 1 1 10 10 GLU CB C 10 32.037 32.037 31.102 0.935 19168 31 1 . 1 1 11 11 ILE N N 11 126.526 126.526 126.834 -0.308 19168 32 1 . 1 1 11 11 ILE HA H 11 4.335 4.335 4.193 0.142 19168 33 1 . 1 1 11 11 ILE C C 11 174.334 174.334 174.714 -0.380 19168 34 1 . 1 1 11 11 ILE CA C 11 60.310 60.310 60.122 0.188 19168 35 1 . 1 1 11 11 ILE CB C 11 39.826 39.826 38.982 0.844 19168 36 1 . 1 1 12 12 LYS N N 12 128.164 128.164 128.996 -0.832 19168 37 1 . 1 1 12 12 LYS HA H 12 5.345 5.345 5.338 0.007 19168 38 1 . 1 1 12 12 LYS C C 12 176.378 176.378 175.590 0.788 19168 39 1 . 1 1 12 12 LYS CA C 12 55.940 55.940 55.823 0.117 19168 40 1 . 1 1 12 12 LYS CB C 12 34.056 34.056 33.954 0.102 19168 41 1 . 1 1 13 13 LEU N N 13 121.881 121.881 125.097 -3.216 19168 42 1 . 1 1 13 13 LEU HA H 13 4.954 4.954 4.872 0.082 19168 43 1 . 1 1 13 13 LEU C C 13 175.137 175.137 175.063 0.074 19168 44 1 . 1 1 13 13 LEU CA C 13 53.974 53.974 53.624 0.350 19168 45 1 . 1 1 13 13 LEU CB C 13 46.284 46.284 46.410 -0.126 19168 46 1 . 1 1 14 14 SER N N 14 115.759 115.759 112.737 3.022 19168 47 1 . 1 1 14 14 SER HA H 14 4.889 4.889 5.111 -0.222 19168 48 1 . 1 1 14 14 SER C C 14 173.993 173.993 174.742 -0.749 19168 49 1 . 1 1 14 14 SER CA C 14 56.052 56.052 56.805 -0.753 19168 50 1 . 1 1 14 14 SER CB C 14 64.775 64.775 66.208 -1.433 19168 51 1 . 1 1 15 15 VAL N N 15 120.993 120.993 120.952 0.041 19168 52 1 . 1 1 15 15 VAL HA H 15 3.734 3.734 3.825 -0.091 19168 53 1 . 1 1 15 15 VAL C C 15 176.964 176.964 176.925 0.039 19168 54 1 . 1 1 15 15 VAL CA C 15 65.427 65.427 65.541 -0.114 19168 55 1 . 1 1 15 15 VAL CB C 15 31.785 31.785 31.867 -0.082 19168 56 1 . 1 1 16 16 LYS N N 16 118.897 118.897 119.006 -0.109 19168 57 1 . 1 1 16 16 LYS HA H 16 4.401 4.401 4.358 0.043 19168 58 1 . 1 1 16 16 LYS C C 16 175.489 175.489 175.413 0.076 19168 59 1 . 1 1 16 16 LYS CA C 16 55.155 55.155 55.624 -0.469 19168 60 1 . 1 1 16 16 LYS CB C 16 30.929 30.929 30.835 0.094 19168 61 1 . 1 1 17 17 ILE N N 17 122.247 122.247 120.510 1.737 19168 62 1 . 1 1 17 17 ILE HA H 17 4.185 4.185 4.259 -0.074 19168 63 1 . 1 1 17 17 ILE C C 17 173.426 173.426 174.831 -1.405 19168 64 1 . 1 1 17 17 ILE CA C 17 61.276 61.276 60.156 1.120 19168 65 1 . 1 1 17 17 ILE CB C 17 39.080 39.080 40.260 -1.180 19168 66 1 . 1 1 18 18 ALA N N 18 129.434 129.434 128.482 0.952 19168 67 1 . 1 1 18 18 ALA HA H 18 4.479 4.479 4.522 -0.043 19168 68 1 . 1 1 18 18 ALA C C 18 179.130 179.130 177.878 1.252 19168 69 1 . 1 1 18 18 ALA CA C 18 51.437 51.437 51.484 -0.047 19168 70 1 . 1 1 18 18 ALA CB C 18 19.909 19.909 20.234 -0.325 19168 71 1 . 1 1 19 19 GLN HA H 19 3.797 3.797 4.011 -0.214 19168 72 1 . 1 1 19 19 GLN CA C 19 59.231 59.231 59.065 0.166 19168 73 1 . 1 1 19 19 GLN CB C 19 28.175 28.175 28.504 -0.329 19168 74 1 . 1 1 20 20 ASN HA H 20 4.430 4.430 4.500 -0.070 19168 75 1 . 1 1 20 20 ASN C C 20 177.272 177.272 177.463 -0.191 19168 76 1 . 1 1 20 20 ASN CA C 20 56.184 56.184 56.181 0.003 19168 77 1 . 1 1 20 20 ASN CB C 20 37.453 37.453 37.608 -0.155 19168 78 1 . 1 1 21 21 ASP N N 21 119.132 119.132 120.241 -1.109 19168 79 1 . 1 1 21 21 ASP HA H 21 4.798 4.798 4.516 0.282 19168 80 1 . 1 1 21 21 ASP C C 21 178.707 178.707 178.547 0.160 19168 81 1 . 1 1 21 21 ASP CA C 21 56.886 56.886 57.072 -0.186 19168 82 1 . 1 1 21 21 ASP CB C 21 40.665 40.665 40.813 -0.148 19168 83 1 . 1 1 22 22 ILE N N 22 122.030 122.030 120.206 1.824 19168 84 1 . 1 1 22 22 ILE HA H 22 3.418 3.418 3.637 -0.219 19168 85 1 . 1 1 22 22 ILE C C 22 177.454 177.454 177.929 -0.475 19168 86 1 . 1 1 22 22 ILE CA C 22 66.726 66.726 65.468 1.258 19168 87 1 . 1 1 22 22 ILE CB C 22 37.566 37.566 37.757 -0.191 19168 88 1 . 1 1 23 23 ASN N N 23 116.728 116.728 118.529 -1.801 19168 89 1 . 1 1 23 23 ASN HA H 23 4.213 4.213 4.457 -0.244 19168 90 1 . 1 1 23 23 ASN C C 23 178.260 178.260 177.831 0.429 19168 91 1 . 1 1 23 23 ASN CA C 23 56.274 56.274 56.528 -0.254 19168 92 1 . 1 1 23 23 ASN CB C 23 37.208 37.208 38.436 -1.228 19168 93 1 . 1 1 24 24 TYR N N 24 119.864 119.864 121.717 -1.853 19168 94 1 . 1 1 24 24 TYR HA H 24 4.293 4.293 4.206 0.087 19168 95 1 . 1 1 24 24 TYR C C 24 177.719 177.719 177.471 0.248 19168 96 1 . 1 1 24 24 TYR CA C 24 61.048 61.048 62.021 -0.973 19168 97 1 . 1 1 24 24 TYR CB C 24 38.283 38.283 38.733 -0.450 19168 98 1 . 1 1 25 25 LYS N N 25 119.730 119.730 119.069 0.661 19168 99 1 . 1 1 25 25 LYS HA H 25 4.111 4.111 4.026 0.085 19168 100 1 . 1 1 25 25 LYS C C 25 179.152 179.152 179.164 -0.012 19168 101 1 . 1 1 25 25 LYS CA C 25 59.162 59.162 59.361 -0.199 19168 102 1 . 1 1 25 25 LYS CB C 25 32.294 32.294 32.551 -0.257 19168 103 1 . 1 1 26 26 VAL N N 26 119.387 119.387 117.512 1.875 19168 104 1 . 1 1 26 26 VAL HA H 26 3.620 3.620 3.862 -0.242 19168 105 1 . 1 1 26 26 VAL C C 26 177.017 177.017 177.587 -0.570 19168 106 1 . 1 1 26 26 VAL CA C 26 67.661 67.661 66.421 1.239 19168 107 1 . 1 1 26 26 VAL CB C 26 31.550 31.550 31.146 0.404 19168 108 1 . 1 1 27 27 LYS N N 27 120.420 120.420 120.321 0.099 19168 109 1 . 1 1 27 27 LYS HA H 27 3.946 3.946 3.899 0.047 19168 110 1 . 1 1 27 27 LYS C C 27 179.458 179.458 178.717 0.741 19168 111 1 . 1 1 27 27 LYS CA C 27 59.878 59.878 59.773 0.105 19168 112 1 . 1 1 27 27 LYS CB C 27 31.848 31.848 32.186 -0.338 19168 113 1 . 1 1 28 28 HIS N N 28 118.160 118.160 118.259 -0.099 19168 114 1 . 1 1 28 28 HIS HA H 28 4.187 4.187 4.509 -0.322 19168 115 1 . 1 1 28 28 HIS C C 28 177.085 177.085 177.413 -0.328 19168 116 1 . 1 1 28 28 HIS CA C 28 57.885 57.885 59.230 -1.345 19168 117 1 . 1 1 28 28 HIS CB C 28 29.756 29.756 29.936 -0.180 19168 118 1 . 1 1 29 29 ALA N N 29 120.579 120.579 122.365 -1.786 19168 119 1 . 1 1 29 29 ALA HA H 29 3.998 3.998 4.243 -0.245 19168 120 1 . 1 1 29 29 ALA C C 29 179.299 179.299 179.670 -0.371 19168 121 1 . 1 1 29 29 ALA CA C 29 55.567 55.567 55.273 0.294 19168 122 1 . 1 1 29 29 ALA CB C 29 19.449 19.449 18.364 1.085 19168 123 1 . 1 1 30 30 LEU N N 30 117.262 117.262 118.103 -0.841 19168 124 1 . 1 1 30 30 LEU HA H 30 4.075 4.075 3.923 0.152 19168 125 1 . 1 1 30 30 LEU C C 30 180.017 180.017 179.102 0.915 19168 126 1 . 1 1 30 30 LEU CA C 30 58.232 58.232 57.996 0.235 19168 127 1 . 1 1 30 30 LEU CB C 30 41.326 41.326 41.549 -0.223 19168 128 1 . 1 1 31 31 GLU N N 31 120.625 120.625 119.517 1.108 19168 129 1 . 1 1 31 31 GLU HA H 31 4.068 4.068 4.002 0.066 19168 130 1 . 1 1 31 31 GLU C C 31 179.572 179.572 179.255 0.317 19168 131 1 . 1 1 31 31 GLU CA C 31 59.275 59.275 59.221 0.054 19168 132 1 . 1 1 31 31 GLU CB C 31 28.975 28.975 29.115 -0.140 19168 133 1 . 1 1 32 32 PHE N N 32 118.245 118.245 118.182 0.063 19168 134 1 . 1 1 32 32 PHE HA H 32 4.526 4.526 4.264 0.262 19168 135 1 . 1 1 32 32 PHE C C 32 179.123 179.123 177.703 1.420 19168 136 1 . 1 1 32 32 PHE CA C 32 58.697 58.697 61.573 -2.876 19168 137 1 . 1 1 32 32 PHE CB C 32 37.252 37.252 38.802 -1.550 19168 138 1 . 1 1 33 33 LEU N N 33 121.684 121.684 120.717 0.967 19168 139 1 . 1 1 33 33 LEU HA H 33 4.591 4.591 4.299 0.292 19168 140 1 . 1 1 33 33 LEU C C 33 181.655 181.655 179.967 1.688 19168 141 1 . 1 1 33 33 LEU CA C 33 58.172 58.172 57.603 0.569 19168 142 1 . 1 1 33 33 LEU CB C 33 41.692 41.692 41.666 0.026 19168 143 1 . 1 1 34 34 GLU N N 34 122.046 122.046 118.236 3.810 19168 144 1 . 1 1 34 34 GLU HA H 34 4.152 4.152 4.072 0.080 19168 145 1 . 1 1 34 34 GLU C C 34 178.237 178.237 178.141 0.096 19168 146 1 . 1 1 34 34 GLU CA C 34 59.146 59.146 58.773 0.373 19168 147 1 . 1 1 34 34 GLU CB C 34 29.234 29.234 29.063 0.171 19168 148 1 . 1 1 35 35 GLN N N 35 115.697 115.697 116.104 -0.407 19168 149 1 . 1 1 35 35 GLN HA H 35 4.387 4.387 4.292 0.095 19168 150 1 . 1 1 35 35 GLN C C 35 176.456 176.456 176.744 -0.288 19168 151 1 . 1 1 35 35 GLN CA C 35 55.686 55.686 55.881 -0.195 19168 152 1 . 1 1 35 35 GLN CB C 35 29.196 29.196 29.184 0.012 19168 153 1 . 1 1 36 36 GLY N N 36 108.291 108.291 106.656 1.635 19168 154 1 . 1 1 36 36 GLY C C 36 174.673 174.673 174.231 0.441 19168 155 1 . 1 1 36 36 GLY CA C 36 45.527 45.527 45.207 0.320 19168 156 1 . 1 1 37 37 LYS N N 37 120.464 120.464 119.496 0.968 19168 157 1 . 1 1 37 37 LYS HA H 37 4.497 4.497 4.711 -0.214 19168 158 1 . 1 1 37 37 LYS C C 37 174.580 174.580 175.723 -1.143 19168 159 1 . 1 1 37 37 LYS CA C 37 55.089 55.089 54.522 0.567 19168 160 1 . 1 1 37 37 LYS CB C 37 32.745 32.745 34.915 -2.170 19168 161 1 . 1 1 38 38 HIS N N 38 116.878 116.878 117.981 -1.103 19168 162 1 . 1 1 38 38 HIS HA H 38 5.019 5.019 4.948 0.071 19168 163 1 . 1 1 38 38 HIS C C 38 175.268 175.268 174.306 0.962 19168 164 1 . 1 1 38 38 HIS CA C 38 54.150 54.150 55.430 -1.280 19168 165 1 . 1 1 38 38 HIS CB C 38 32.877 32.877 32.653 0.224 19168 166 1 . 1 1 39 39 VAL N N 39 119.782 119.782 121.111 -1.329 19168 167 1 . 1 1 39 39 VAL HA H 39 4.796 4.796 4.672 0.124 19168 168 1 . 1 1 39 39 VAL C C 39 173.320 173.320 174.214 -0.894 19168 169 1 . 1 1 39 39 VAL CA C 39 60.766 60.766 60.661 0.105 19168 170 1 . 1 1 39 39 VAL CB C 39 35.433 35.433 33.799 1.634 19168 171 1 . 1 1 40 40 ARG N N 40 128.358 128.358 127.260 1.098 19168 172 1 . 1 1 40 40 ARG HA H 40 5.115 5.115 4.834 0.281 19168 173 1 . 1 1 40 40 ARG C C 40 175.659 175.659 174.906 0.753 19168 174 1 . 1 1 40 40 ARG CA C 40 53.822 53.822 54.235 -0.413 19168 175 1 . 1 1 40 40 ARG CB C 40 33.007 33.007 32.072 0.935 19168 176 1 . 1 1 41 41 PHE N N 41 126.396 126.396 127.465 -1.069 19168 177 1 . 1 1 41 41 PHE HA H 41 5.178 5.178 5.240 -0.062 19168 178 1 . 1 1 41 41 PHE C C 41 176.107 176.107 175.317 0.790 19168 179 1 . 1 1 41 41 PHE CA C 41 57.696 57.696 57.719 -0.023 19168 180 1 . 1 1 41 41 PHE CB C 41 42.046 42.046 39.815 2.231 19168 181 1 . 1 1 42 42 ARG N N 42 120.641 120.641 124.065 -3.424 19168 182 1 . 1 1 42 42 ARG HA H 42 5.539 5.539 5.302 0.237 19168 183 1 . 1 1 42 42 ARG C C 42 175.010 175.010 174.593 0.417 19168 184 1 . 1 1 42 42 ARG CA C 42 54.695 54.695 54.903 -0.208 19168 185 1 . 1 1 42 42 ARG CB C 42 34.374 34.374 33.424 0.950 19168 186 1 . 1 1 43 43 VAL N N 43 125.565 125.565 123.978 1.587 19168 187 1 . 1 1 43 43 VAL HA H 43 4.665 4.665 5.173 -0.508 19168 188 1 . 1 1 43 43 VAL C C 43 175.325 175.325 173.707 1.618 19168 189 1 . 1 1 43 43 VAL CA C 43 60.816 60.816 59.868 0.948 19168 190 1 . 1 1 43 43 VAL CB C 43 32.983 32.983 35.445 -2.462 19168 191 1 . 1 1 44 44 PHE N N 44 128.291 128.291 129.740 -1.449 19168 192 1 . 1 1 44 44 PHE HA H 44 4.618 4.618 4.681 -0.063 19168 193 1 . 1 1 44 44 PHE C C 44 174.477 174.477 174.291 0.186 19168 194 1 . 1 1 44 44 PHE CA C 44 56.148 56.148 55.658 0.490 19168 195 1 . 1 1 44 44 PHE CB C 44 39.941 39.941 41.436 -1.495 19168 196 1 . 1 1 45 45 LEU N N 45 128.360 128.360 128.689 -0.329 19168 197 1 . 1 1 45 45 LEU HA H 45 4.391 4.391 4.284 0.107 19168 198 1 . 1 1 45 45 LEU C C 45 174.342 174.342 175.791 -1.449 19168 199 1 . 1 1 45 45 LEU CA C 45 53.586 53.586 54.226 -0.640 19168 200 1 . 1 1 45 45 LEU CB C 45 41.113 41.113 41.381 -0.268 19168 201 1 . 1 1 46 46 LYS HA H 46 4.092 4.092 4.222 -0.130 19168 202 1 . 1 1 46 46 LYS CA C 46 55.079 55.079 56.541 -1.462 19168 203 1 . 1 1 46 46 LYS CB C 46 34.295 34.295 33.462 0.833 19168 204 1 . 1 1 47 47 GLY CA C 47 46.813 46.813 45.132 1.681 19168 205 1 . 1 1 48 48 ARG HA H 48 4.200 4.200 4.159 0.041 19168 206 1 . 1 1 48 48 ARG C C 48 178.069 178.069 177.355 0.714 19168 207 1 . 1 1 48 48 ARG CA C 48 57.862 57.862 57.381 0.481 19168 208 1 . 1 1 48 48 ARG CB C 48 29.444 29.444 29.824 -0.380 19168 209 1 . 1 1 49 49 GLU N N 49 119.779 119.779 119.721 0.058 19168 210 1 . 1 1 49 49 GLU HA H 49 4.053 4.053 4.072 -0.019 19168 211 1 . 1 1 49 49 GLU C C 49 178.227 178.227 177.893 0.334 19168 212 1 . 1 1 49 49 GLU CA C 49 57.436 57.436 58.325 -0.889 19168 213 1 . 1 1 49 49 GLU CB C 49 29.745 29.745 28.917 0.828 19168 214 1 . 1 1 50 50 MET N N 50 116.370 116.370 117.950 -1.580 19168 215 1 . 1 1 50 50 MET HA H 50 4.024 4.024 4.134 -0.110 19168 216 1 . 1 1 50 50 MET C C 50 175.912 175.912 177.195 -1.283 19168 217 1 . 1 1 50 50 MET CA C 50 56.664 56.664 57.434 -0.770 19168 218 1 . 1 1 50 50 MET CB C 50 32.033 32.033 32.237 -0.204 19168 219 1 . 1 1 51 51 ALA N N 51 118.880 118.880 120.045 -1.165 19168 220 1 . 1 1 51 51 ALA HA H 51 4.344 4.344 4.202 0.142 19168 221 1 . 1 1 51 51 ALA C C 51 177.746 177.746 177.626 0.120 19168 222 1 . 1 1 51 51 ALA CA C 51 52.391 52.391 53.249 -0.858 19168 223 1 . 1 1 51 51 ALA CB C 51 19.443 19.443 19.283 0.160 19168 224 1 . 1 1 52 52 THR N N 52 108.299 108.299 112.436 -4.137 19168 225 1 . 1 1 52 52 THR HA H 52 4.869 4.869 4.623 0.246 19168 226 1 . 1 1 52 52 THR C C 52 173.933 173.933 172.667 1.266 19168 227 1 . 1 1 52 52 THR CA C 52 57.554 57.554 58.955 -1.401 19168 228 1 . 1 1 52 52 THR CB C 52 69.479 69.479 69.866 -0.387 19168 229 1 . 1 1 53 53 PRO HA H 53 3.931 3.931 4.033 -0.102 19168 230 1 . 1 1 53 53 PRO C C 53 178.185 178.185 178.088 0.097 19168 231 1 . 1 1 53 53 PRO CA C 53 65.019 65.019 64.254 0.765 19168 232 1 . 1 1 53 53 PRO CB C 53 30.516 30.516 31.606 -1.091 19168 233 1 . 1 1 54 54 GLU N N 54 120.653 120.653 118.579 2.074 19168 234 1 . 1 1 54 54 GLU HA H 54 4.016 4.016 4.010 0.006 19168 235 1 . 1 1 54 54 GLU C C 54 178.608 178.608 177.975 0.633 19168 236 1 . 1 1 54 54 GLU CA C 54 59.472 59.472 58.998 0.474 19168 237 1 . 1 1 54 54 GLU CB C 54 27.419 27.419 28.888 -1.469 19168 238 1 . 1 1 55 55 ALA N N 55 124.380 124.380 121.261 3.119 19168 239 1 . 1 1 55 55 ALA HA H 55 4.323 4.323 4.093 0.230 19168 240 1 . 1 1 55 55 ALA C C 55 181.502 181.502 179.725 1.777 19168 241 1 . 1 1 55 55 ALA CA C 55 54.780 54.780 55.065 -0.285 19168 242 1 . 1 1 55 55 ALA CB C 55 18.401 18.401 18.073 0.328 19168 243 1 . 1 1 56 56 GLY N N 56 105.673 105.673 106.826 -1.153 19168 244 1 . 1 1 56 56 GLY C C 56 174.278 174.278 176.263 -1.985 19168 245 1 . 1 1 56 56 GLY CA C 56 46.879 46.879 46.975 -0.096 19168 246 1 . 1 1 57 57 VAL N N 57 122.685 122.685 123.037 -0.352 19168 247 1 . 1 1 57 57 VAL HA H 57 3.322 3.322 3.654 -0.332 19168 248 1 . 1 1 57 57 VAL C C 57 177.134 177.134 177.698 -0.564 19168 249 1 . 1 1 57 57 VAL CA C 57 67.396 67.396 66.124 1.272 19168 250 1 . 1 1 57 57 VAL CB C 57 31.769 31.769 31.319 0.450 19168 251 1 . 1 1 58 58 ALA N N 58 119.580 119.580 122.563 -2.983 19168 252 1 . 1 1 58 58 ALA HA H 58 4.094 4.094 4.160 -0.066 19168 253 1 . 1 1 58 58 ALA C C 58 180.788 180.788 179.751 1.037 19168 254 1 . 1 1 58 58 ALA CA C 58 55.053 55.053 55.153 -0.100 19168 255 1 . 1 1 58 58 ALA CB C 58 17.854 17.854 18.366 -0.512 19168 256 1 . 1 1 59 59 LEU N N 59 119.723 119.723 120.182 -0.459 19168 257 1 . 1 1 59 59 LEU HA H 59 4.258 4.258 4.026 0.233 19168 258 1 . 1 1 59 59 LEU C C 59 178.024 178.024 178.622 -0.598 19168 259 1 . 1 1 59 59 LEU CA C 59 57.710 57.710 57.983 -0.273 19168 260 1 . 1 1 59 59 LEU CB C 59 41.701 41.701 42.028 -0.327 19168 261 1 . 1 1 60 60 LEU N N 60 117.978 117.978 118.773 -0.795 19168 262 1 . 1 1 60 60 LEU HA H 60 3.857 3.857 3.798 0.059 19168 263 1 . 1 1 60 60 LEU C C 60 178.851 178.851 179.134 -0.283 19168 264 1 . 1 1 60 60 LEU CA C 60 57.644 57.644 58.117 -0.473 19168 265 1 . 1 1 60 60 LEU CB C 60 40.288 40.288 41.344 -1.056 19168 266 1 . 1 1 61 61 GLU N N 61 119.906 119.906 119.237 0.669 19168 267 1 . 1 1 61 61 GLU HA H 61 4.491 4.491 4.054 0.437 19168 268 1 . 1 1 61 61 GLU C C 61 179.519 179.519 178.981 0.538 19168 269 1 . 1 1 61 61 GLU CA C 61 58.742 58.742 59.607 -0.865 19168 270 1 . 1 1 61 61 GLU CB C 61 28.813 28.813 29.082 -0.269 19168 271 1 . 1 1 62 62 LYS N N 62 122.015 122.015 120.626 1.389 19168 272 1 . 1 1 62 62 LYS HA H 62 4.128 4.128 4.087 0.041 19168 273 1 . 1 1 62 62 LYS C C 62 179.843 179.843 179.063 0.780 19168 274 1 . 1 1 62 62 LYS CA C 62 59.337 59.337 59.311 0.026 19168 275 1 . 1 1 62 62 LYS CB C 62 31.647 31.647 32.385 -0.738 19168 276 1 . 1 1 63 63 ILE N N 63 120.882 120.882 119.597 1.285 19168 277 1 . 1 1 63 63 ILE HA H 63 3.496 3.496 3.677 -0.181 19168 278 1 . 1 1 63 63 ILE C C 63 177.761 177.761 177.462 0.299 19168 279 1 . 1 1 63 63 ILE CA C 63 65.182 65.182 64.949 0.233 19168 280 1 . 1 1 63 63 ILE CB C 63 37.386 37.386 37.832 -0.446 19168 281 1 . 1 1 64 64 TRP N N 64 120.279 120.279 121.957 -1.678 19168 282 1 . 1 1 64 64 TRP HA H 64 4.484 4.484 4.105 0.379 19168 283 1 . 1 1 64 64 TRP C C 64 177.056 177.056 177.748 -0.692 19168 284 1 . 1 1 64 64 TRP CA C 64 59.094 59.094 60.337 -1.243 19168 285 1 . 1 1 64 64 TRP CB C 64 29.635 29.635 29.956 -0.321 19168 286 1 . 1 1 65 65 THR N N 65 109.483 109.483 112.426 -2.943 19168 287 1 . 1 1 65 65 THR HA H 65 3.744 3.744 3.837 -0.093 19168 288 1 . 1 1 65 65 THR C C 65 176.224 176.224 175.885 0.339 19168 289 1 . 1 1 65 65 THR CA C 65 65.568 65.568 64.923 0.645 19168 290 1 . 1 1 65 65 THR CB C 65 69.308 69.308 68.432 0.876 19168 291 1 . 1 1 66 66 MET N N 66 117.791 117.791 118.090 -0.299 19168 292 1 . 1 1 66 66 MET HA H 66 4.110 4.110 4.306 -0.196 19168 293 1 . 1 1 66 66 MET C C 66 177.782 177.782 177.629 0.153 19168 294 1 . 1 1 66 66 MET CA C 66 58.304 58.304 57.695 0.609 19168 295 1 . 1 1 66 66 MET CB C 66 34.040 34.040 33.341 0.699 19168 296 1 . 1 1 67 67 ILE N N 67 109.871 109.871 112.622 -2.751 19168 297 1 . 1 1 67 67 ILE HA H 67 4.642 4.642 4.389 0.253 19168 298 1 . 1 1 67 67 ILE C C 67 176.713 176.713 176.404 0.309 19168 299 1 . 1 1 67 67 ILE CA C 67 61.174 61.174 61.307 -0.133 19168 300 1 . 1 1 67 67 ILE CB C 67 39.813 39.813 38.319 1.494 19168 301 1 . 1 1 68 68 GLU N N 68 121.972 121.972 120.970 1.001 19168 302 1 . 1 1 68 68 GLU HA H 68 2.748 2.748 3.194 -0.446 19168 303 1 . 1 1 68 68 GLU C C 68 175.855 175.855 177.061 -1.206 19168 304 1 . 1 1 68 68 GLU CA C 68 58.291 58.291 58.194 0.097 19168 305 1 . 1 1 68 68 GLU CB C 68 28.492 28.492 27.839 0.653 19168 306 1 . 1 1 69 69 ASN N N 69 114.338 114.338 116.203 -1.865 19168 307 1 . 1 1 69 69 ASN HA H 69 4.580 4.580 4.432 0.148 19168 308 1 . 1 1 69 69 ASN C C 69 175.904 175.904 176.626 -0.722 19168 309 1 . 1 1 69 69 ASN CA C 69 54.597 54.597 55.073 -0.476 19168 310 1 . 1 1 69 69 ASN CB C 69 38.323 38.323 38.243 0.080 19168 311 1 . 1 1 70 70 GLU N N 70 116.936 116.936 116.902 0.034 19168 312 1 . 1 1 70 70 GLU HA H 70 4.548 4.548 4.488 0.060 19168 313 1 . 1 1 70 70 GLU C C 70 174.941 174.941 174.735 0.206 19168 314 1 . 1 1 70 70 GLU CA C 70 55.983 55.983 56.037 -0.054 19168 315 1 . 1 1 70 70 GLU CB C 70 31.348 31.348 30.886 0.462 19168 316 1 . 1 1 71 71 ALA N N 71 122.966 122.966 121.602 1.364 19168 317 1 . 1 1 71 71 ALA HA H 71 5.246 5.246 5.025 0.221 19168 318 1 . 1 1 71 71 ALA C C 71 173.907 173.907 175.567 -1.660 19168 319 1 . 1 1 71 71 ALA CA C 71 50.818 50.818 50.528 0.290 19168 320 1 . 1 1 71 71 ALA CB C 71 24.060 24.060 22.328 1.732 19168 321 1 . 1 1 72 72 ASN N N 72 115.820 115.820 119.154 -3.334 19168 322 1 . 1 1 72 72 ASN HA H 72 5.441 5.441 5.359 0.082 19168 323 1 . 1 1 72 72 ASN C C 72 174.137 174.137 174.517 -0.380 19168 324 1 . 1 1 72 72 ASN CA C 72 51.659 51.659 52.057 -0.399 19168 325 1 . 1 1 72 72 ASN CB C 72 42.186 42.186 41.877 0.309 19168 326 1 . 1 1 73 73 ARG N N 73 118.340 118.340 123.312 -4.972 19168 327 1 . 1 1 73 73 ARG HA H 73 4.778 4.778 3.966 0.812 19168 328 1 . 1 1 73 73 ARG C C 73 174.674 174.674 175.484 -0.810 19168 329 1 . 1 1 73 73 ARG CA C 73 54.869 54.869 56.451 -1.582 19168 330 1 . 1 1 73 73 ARG CB C 73 32.125 32.125 29.741 2.384 19168 331 1 . 1 1 74 74 ASP N N 74 124.007 124.007 127.086 -3.079 19168 332 1 . 1 1 74 74 ASP HA H 74 4.542 4.542 4.525 0.017 19168 333 1 . 1 1 74 74 ASP C C 74 175.935 175.935 176.050 -0.115 19168 334 1 . 1 1 74 74 ASP CA C 74 55.397 55.397 56.187 -0.790 19168 335 1 . 1 1 74 74 ASP CB C 74 42.220 42.220 41.852 0.368 19168 336 1 . 1 1 75 75 LYS N N 75 116.482 116.482 117.329 -0.847 19168 337 1 . 1 1 75 75 LYS HA H 75 4.445 4.445 4.489 -0.044 19168 338 1 . 1 1 75 75 LYS C C 75 175.135 175.135 174.549 0.586 19168 339 1 . 1 1 75 75 LYS CA C 75 54.785 54.785 55.248 -0.463 19168 340 1 . 1 1 75 75 LYS CB C 75 35.475 35.475 34.842 0.633 19168 341 1 . 1 1 76 76 GLU N N 76 120.126 120.126 122.640 -2.514 19168 342 1 . 1 1 76 76 GLU HA H 76 3.908 3.908 4.349 -0.441 19168 343 1 . 1 1 76 76 GLU C C 76 173.204 173.204 175.136 -1.932 19168 344 1 . 1 1 76 76 GLU CA C 76 55.524 55.524 54.422 1.102 19168 345 1 . 1 1 76 76 GLU CB C 76 27.511 27.511 29.116 -1.605 19168 346 1 . 1 1 77 77 PRO HA H 77 4.777 4.777 4.686 0.091 19168 347 1 . 1 1 77 77 PRO C C 77 174.933 174.933 176.002 -1.068 19168 348 1 . 1 1 77 77 PRO CA C 77 63.422 63.422 62.929 0.493 19168 349 1 . 1 1 77 77 PRO CB C 77 32.391 32.391 32.084 0.307 19168 350 1 . 1 1 78 78 ASN N N 78 119.292 119.292 121.368 -2.076 19168 351 1 . 1 1 78 78 ASN HA H 78 5.093 5.093 4.959 0.134 19168 352 1 . 1 1 78 78 ASN C C 78 172.876 172.876 173.546 -0.670 19168 353 1 . 1 1 78 78 ASN CA C 78 51.928 51.928 52.112 -0.184 19168 354 1 . 1 1 78 78 ASN CB C 78 42.017 42.017 41.991 0.026 19168 355 1 . 1 1 79 79 PHE N N 79 125.023 125.023 124.616 0.407 19168 356 1 . 1 1 79 79 PHE HA H 79 5.423 5.423 5.152 0.271 19168 357 1 . 1 1 79 79 PHE C C 79 174.552 174.552 174.777 -0.225 19168 358 1 . 1 1 79 79 PHE CA C 79 55.210 55.210 57.441 -2.231 19168 359 1 . 1 1 79 79 PHE CB C 79 40.109 40.109 40.102 0.007 19168 360 1 . 1 1 80 80 GLU N N 80 128.920 128.920 127.816 1.104 19168 361 1 . 1 1 80 80 GLU HA H 80 4.208 4.208 4.443 -0.235 19168 362 1 . 1 1 80 80 GLU C C 80 175.538 175.538 175.963 -0.425 19168 363 1 . 1 1 80 80 GLU CA C 80 55.724 55.724 55.211 0.513 19168 364 1 . 1 1 80 80 GLU CB C 80 32.135 32.135 32.066 0.069 19168 365 1 . 1 1 81 81 GLY N N 81 116.695 116.695 114.609 2.086 19168 366 1 . 1 1 81 81 GLY C C 81 173.950 173.950 174.460 -0.510 19168 367 1 . 1 1 81 81 GLY CA C 81 46.967 46.967 46.474 0.493 19168 368 1 . 1 1 82 82 ARG N N 82 124.481 124.481 118.425 6.056 19168 369 1 . 1 1 82 82 ARG HA H 82 4.539 4.539 4.163 0.376 19168 370 1 . 1 1 82 82 ARG C C 82 173.437 173.437 174.229 -0.792 19168 371 1 . 1 1 82 82 ARG CA C 82 55.156 55.156 56.031 -0.875 19168 372 1 . 1 1 82 82 ARG CB C 82 30.255 30.255 31.027 -0.772 19168 373 1 . 1 1 83 83 TYR N N 83 114.539 114.539 117.612 -3.073 19168 374 1 . 1 1 83 83 TYR HA H 83 5.948 5.948 5.480 0.468 19168 375 1 . 1 1 83 83 TYR C C 83 175.909 175.909 174.792 1.117 19168 376 1 . 1 1 83 83 TYR CA C 83 56.057 56.057 56.540 -0.483 19168 377 1 . 1 1 83 83 TYR CB C 83 42.999 42.999 42.091 0.908 19168 378 1 . 1 1 84 84 VAL N N 84 118.812 118.812 122.965 -4.153 19168 379 1 . 1 1 84 84 VAL HA H 84 4.867 4.867 4.866 0.001 19168 380 1 . 1 1 84 84 VAL C C 84 174.982 174.982 175.204 -0.222 19168 381 1 . 1 1 84 84 VAL CA C 84 61.235 61.235 61.483 -0.248 19168 382 1 . 1 1 84 84 VAL CB C 84 32.491 32.491 32.380 0.111 19168 383 1 . 1 1 85 85 ASN N N 85 124.630 124.630 125.365 -0.735 19168 384 1 . 1 1 85 85 ASN HA H 85 6.004 6.004 6.096 -0.092 19168 385 1 . 1 1 85 85 ASN C C 85 175.392 175.392 173.729 1.663 19168 386 1 . 1 1 85 85 ASN CA C 85 52.596 52.596 51.630 0.966 19168 387 1 . 1 1 85 85 ASN CB C 85 44.206 44.206 42.585 1.621 19168 388 1 . 1 1 86 86 MET N N 86 118.969 118.969 121.011 -2.042 19168 389 1 . 1 1 86 86 MET HA H 86 4.640 4.640 4.860 -0.220 19168 390 1 . 1 1 86 86 MET C C 86 172.378 172.378 173.449 -1.071 19168 391 1 . 1 1 86 86 MET CA C 86 56.158 56.158 54.845 1.313 19168 392 1 . 1 1 86 86 MET CB C 86 39.138 39.138 36.915 2.223 19168 393 1 . 1 1 87 87 LEU N N 87 131.886 131.886 126.650 5.236 19168 394 1 . 1 1 87 87 LEU HA H 87 5.381 5.381 5.218 0.163 19168 395 1 . 1 1 87 87 LEU C C 87 176.003 176.003 175.378 0.625 19168 396 1 . 1 1 87 87 LEU CA C 87 54.130 54.130 53.240 0.890 19168 397 1 . 1 1 87 87 LEU CB C 87 44.473 44.473 44.595 -0.122 19168 398 1 . 1 1 88 88 VAL N N 88 121.165 121.165 120.045 1.120 19168 399 1 . 1 1 88 88 VAL HA H 88 5.510 5.510 5.030 0.480 19168 400 1 . 1 1 88 88 VAL C C 88 173.666 173.666 174.880 -1.214 19168 401 1 . 1 1 88 88 VAL CA C 88 58.600 58.600 59.742 -1.142 19168 402 1 . 1 1 88 88 VAL CB C 88 34.793 34.793 34.516 0.277 19168 403 1 . 1 1 89 89 THR N N 89 111.786 111.786 120.651 -8.865 19168 404 1 . 1 1 89 89 THR HA H 89 4.720 4.720 4.586 0.134 19168 405 1 . 1 1 89 89 THR C C 89 171.898 171.898 172.448 -0.549 19168 406 1 . 1 1 89 89 THR CA C 89 57.985 57.985 59.492 -1.507 19168 407 1 . 1 1 89 89 THR CB C 89 69.113 69.113 69.830 -0.718 19168 408 1 . 1 1 90 90 PRO HA H 90 4.583 4.583 4.538 0.045 19168 409 1 . 1 1 90 90 PRO C C 90 177.403 177.403 176.808 0.595 19168 410 1 . 1 1 90 90 PRO CA C 90 63.531 63.531 62.587 0.944 19168 411 1 . 1 1 90 90 PRO CB C 90 32.043 32.043 32.345 -0.302 19168 412 1 . 1 1 91 91 LYS N N 91 123.696 123.696 123.325 0.371 19168 413 1 . 1 1 91 91 LYS HA H 91 4.111 4.111 4.219 -0.108 19168 414 1 . 1 1 91 91 LYS C C 91 176.568 176.568 176.782 -0.214 19168 415 1 . 1 1 91 91 LYS CA C 91 57.208 57.208 56.995 0.213 19168 416 1 . 1 1 91 91 LYS CB C 91 33.183 33.183 31.965 1.218 19168 417 1 . 1 1 92 92 LYS N N 92 122.054 122.054 122.914 -0.860 19168 418 1 . 1 1 92 92 LYS HA H 92 4.316 4.316 4.256 0.060 19168 419 1 . 1 1 92 92 LYS C C 92 175.956 175.956 176.207 -0.251 19168 420 1 . 1 1 92 92 LYS CA C 92 55.942 55.942 56.642 -0.700 19168 421 1 . 1 1 92 92 LYS CB C 92 33.000 33.000 32.753 0.248 19168 422 1 . 1 1 93 93 ALA N N 93 126.278 126.278 124.283 1.995 19168 423 1 . 1 1 93 93 ALA HA H 93 4.341 4.341 4.307 0.034 19168 424 1 . 1 1 93 93 ALA C C 93 177.592 177.592 177.218 0.374 19168 425 1 . 1 1 93 93 ALA CA C 93 52.279 52.279 52.644 -0.365 19168 426 1 . 1 1 93 93 ALA CB C 93 19.332 19.332 18.764 0.568 19168 427 1 . 1 1 94 94 GLU N N 94 120.522 120.522 120.753 -0.231 19168 428 1 . 1 1 94 94 GLU HA H 94 4.284 4.284 4.291 -0.007 19168 429 1 . 1 1 94 94 GLU C C 94 177.041 177.041 176.503 0.538 19168 430 1 . 1 1 94 94 GLU CA C 94 56.606 56.606 56.381 0.225 19168 431 1 . 1 1 94 94 GLU CB C 94 30.353 30.353 30.185 0.168 19168 432 1 . 1 1 95 95 GLY N N 95 109.755 109.755 110.491 -0.736 19168 433 1 . 1 1 95 95 GLY C C 95 173.939 173.939 174.006 -0.067 19168 434 1 . 1 1 95 95 GLY CA C 95 45.168 45.168 45.005 0.163 19168 stop_ save_