data_18093 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18093 _Entry.PDB_ID 2LLY 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 18093 _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 GLU N N 5 119.627 119.627 118.320 1.307 18093 2 1 1 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.365 -0.157 18093 3 1 1 . 1 1 5 5 GLU C C 5 176.581 176.581 174.957 1.624 18093 4 1 1 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.614 0.431 18093 5 1 1 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.363 0.675 18093 6 1 1 . 1 1 5 5 GLU H H 5 8.003 8.003 8.246 -0.243 18093 7 1 1 . 1 1 6 6 LEU N N 6 121.267 121.267 122.837 -1.570 18093 8 1 1 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.716 -0.291 18093 9 1 1 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.373 2.262 18093 10 1 1 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.679 -0.383 18093 11 1 1 . 1 1 6 6 LEU H H 6 8.104 8.104 7.907 0.197 18093 12 1 1 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.568 -0.169 18093 13 1 1 . 1 1 7 7 PRO C C 7 178.408 178.408 178.002 0.406 18093 14 1 1 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.117 2.595 18093 15 1 1 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.727 -0.810 18093 16 1 1 . 1 1 8 8 LEU N N 8 121.835 121.835 120.052 1.783 18093 17 1 1 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.244 -0.155 18093 18 1 1 . 1 1 8 8 LEU C C 8 177.902 177.902 178.259 -0.357 18093 19 1 1 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.437 0.668 18093 20 1 1 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.249 0.358 18093 21 1 1 . 1 1 8 8 LEU H H 8 8.162 8.162 8.450 -0.288 18093 22 1 1 . 1 1 9 9 PHE N N 9 118.342 118.342 119.493 -1.151 18093 23 1 1 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.115 0.074 18093 24 1 1 . 1 1 9 9 PHE C C 9 177.596 177.596 177.207 0.389 18093 25 1 1 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.850 -0.736 18093 26 1 1 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.447 0.281 18093 27 1 1 . 1 1 9 9 PHE H H 9 8.318 8.318 8.157 0.161 18093 28 1 1 . 1 1 10 10 TYR N N 10 117.584 117.584 118.399 -0.815 18093 29 1 1 . 1 1 10 10 TYR HA H 10 4.154 4.154 4.216 -0.062 18093 30 1 1 . 1 1 10 10 TYR C C 10 177.630 177.630 177.948 -0.318 18093 31 1 1 . 1 1 10 10 TYR CA C 10 61.036 61.036 61.854 -0.818 18093 32 1 1 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.329 0.331 18093 33 1 1 . 1 1 10 10 TYR H H 10 8.105 8.105 8.285 -0.180 18093 34 1 1 . 1 1 11 11 THR N N 11 115.563 115.563 114.889 0.674 18093 35 1 1 . 1 1 11 11 THR HA H 11 3.871 3.871 4.095 -0.224 18093 36 1 1 . 1 1 11 11 THR C C 11 175.955 175.955 176.368 -0.413 18093 37 1 1 . 1 1 11 11 THR CA C 11 67.290 67.290 66.684 0.606 18093 38 1 1 . 1 1 11 11 THR CB C 11 68.201 68.201 68.880 -0.679 18093 39 1 1 . 1 1 11 11 THR H H 11 7.915 7.915 7.924 -0.009 18093 40 1 1 . 1 1 12 12 ILE N N 12 119.727 119.727 121.653 -1.926 18093 41 1 1 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.742 -0.043 18093 42 1 1 . 1 1 12 12 ILE C C 12 175.773 175.773 177.788 -2.015 18093 43 1 1 . 1 1 12 12 ILE CA C 12 64.699 64.699 62.982 1.717 18093 44 1 1 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.564 1.532 18093 45 1 1 . 1 1 12 12 ILE H H 12 8.186 8.186 7.374 0.812 18093 46 1 1 . 1 1 13 13 ASN N N 13 114.190 114.190 118.262 -4.072 18093 47 1 1 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.428 -0.006 18093 48 1 1 . 1 1 13 13 ASN C C 13 174.786 174.786 176.622 -1.836 18093 49 1 1 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.298 0.257 18093 50 1 1 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.806 0.553 18093 51 1 1 . 1 1 13 13 ASN H H 13 7.601 7.601 7.902 -0.301 18093 52 1 1 . 1 1 14 14 LEU N N 14 115.031 115.031 119.245 -4.214 18093 53 1 1 . 1 1 14 14 LEU HA H 14 4.196 4.196 3.912 0.284 18093 54 1 1 . 1 1 14 14 LEU C C 14 177.540 177.540 177.909 -0.369 18093 55 1 1 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.798 -0.391 18093 56 1 1 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.523 -0.681 18093 57 1 1 . 1 1 14 14 LEU H H 14 7.390 7.390 7.243 0.147 18093 58 1 1 . 1 1 15 15 ILE N N 15 118.223 118.223 120.587 -2.364 18093 59 1 1 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.663 -0.050 18093 60 1 1 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.630 3.090 18093 61 1 1 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.186 -0.574 18093 62 1 1 . 1 1 15 15 ILE H H 15 8.123 8.123 8.037 0.086 18093 63 1 1 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.225 -0.156 18093 64 1 1 . 1 1 17 17 PRO C C 17 177.721 177.721 178.531 -0.810 18093 65 1 1 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.426 1.335 18093 66 1 1 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.605 0.137 18093 67 1 1 . 1 1 18 18 CYS N N 18 113.538 113.538 116.846 -3.308 18093 68 1 1 . 1 1 18 18 CYS HA H 18 4.008 4.008 3.982 0.026 18093 69 1 1 . 1 1 18 18 CYS C C 18 177.683 177.683 176.916 0.767 18093 70 1 1 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.546 0.954 18093 71 1 1 . 1 1 18 18 CYS CB C 18 26.873 26.873 27.097 -0.224 18093 72 1 1 . 1 1 18 18 CYS H H 18 7.410 7.410 7.385 0.025 18093 73 1 1 . 1 1 19 19 LEU N N 19 122.545 122.545 119.390 3.155 18093 74 1 1 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.152 -0.153 18093 75 1 1 . 1 1 19 19 LEU C C 19 178.608 178.608 178.844 -0.236 18093 76 1 1 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.200 1.221 18093 77 1 1 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.459 0.385 18093 78 1 1 . 1 1 19 19 LEU H H 19 8.635 8.635 7.415 1.220 18093 79 1 1 . 1 1 20 20 LEU N N 20 119.404 119.404 121.254 -1.850 18093 80 1 1 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.955 0.051 18093 81 1 1 . 1 1 20 20 LEU C C 20 178.540 178.540 178.970 -0.430 18093 82 1 1 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.378 0.421 18093 83 1 1 . 1 1 20 20 LEU CB C 20 41.999 41.999 42.081 -0.082 18093 84 1 1 . 1 1 20 20 LEU H H 20 8.392 8.392 7.505 0.887 18093 85 1 1 . 1 1 21 21 ILE N N 21 117.335 117.335 113.637 3.698 18093 86 1 1 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.907 -0.256 18093 87 1 1 . 1 1 21 21 ILE C C 21 177.249 177.249 177.487 -0.238 18093 88 1 1 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.496 0.765 18093 89 1 1 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.256 0.704 18093 90 1 1 . 1 1 21 21 ILE H H 21 8.403 8.403 8.332 0.070 18093 91 1 1 . 1 1 22 22 SER N N 22 116.385 116.385 118.498 -2.113 18093 92 1 1 . 1 1 22 22 SER HA H 22 4.056 4.056 4.254 -0.198 18093 93 1 1 . 1 1 22 22 SER C C 22 176.813 176.813 176.421 0.392 18093 94 1 1 . 1 1 22 22 SER CA C 22 63.866 63.866 62.172 1.694 18093 95 1 1 . 1 1 22 22 SER CB C 22 62.898 62.898 63.173 -0.275 18093 96 1 1 . 1 1 22 22 SER H H 22 8.271 8.271 7.617 0.654 18093 97 1 1 . 1 1 23 23 CYS N N 23 119.001 119.001 121.081 -2.080 18093 98 1 1 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.057 -0.067 18093 99 1 1 . 1 1 23 23 CYS C C 23 177.594 177.594 176.531 1.063 18093 100 1 1 . 1 1 23 23 CYS CA C 23 64.429 64.429 62.577 1.852 18093 101 1 1 . 1 1 23 23 CYS CB C 23 26.940 26.940 27.428 -0.488 18093 102 1 1 . 1 1 23 23 CYS H H 23 8.161 8.161 8.477 -0.316 18093 103 1 1 . 1 1 24 24 LEU N N 24 117.814 117.814 120.473 -2.659 18093 104 1 1 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.810 0.167 18093 105 1 1 . 1 1 24 24 LEU C C 24 177.944 177.944 178.450 -0.506 18093 106 1 1 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.281 0.006 18093 107 1 1 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.887 0.016 18093 108 1 1 . 1 1 24 24 LEU H H 24 8.106 8.106 7.560 0.546 18093 109 1 1 . 1 1 25 25 THR N N 25 115.670 115.670 114.443 1.227 18093 110 1 1 . 1 1 25 25 THR HA H 25 3.687 3.687 4.024 -0.337 18093 111 1 1 . 1 1 25 25 THR C C 25 175.845 175.845 176.728 -0.883 18093 112 1 1 . 1 1 25 25 THR CA C 25 68.306 68.306 67.413 0.893 18093 113 1 1 . 1 1 25 25 THR H H 25 7.924 7.924 7.569 0.355 18093 114 1 1 . 1 1 26 26 VAL N N 26 118.809 118.809 121.109 -2.300 18093 115 1 1 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.774 -0.259 18093 116 1 1 . 1 1 26 26 VAL C C 26 177.530 177.530 177.539 -0.009 18093 117 1 1 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.582 0.699 18093 118 1 1 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.424 0.300 18093 119 1 1 . 1 1 26 26 VAL H H 26 7.764 7.764 7.236 0.528 18093 120 1 1 . 1 1 27 27 LEU N N 27 117.958 117.958 121.254 -3.296 18093 121 1 1 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.027 0.009 18093 122 1 1 . 1 1 27 27 LEU C C 27 178.163 178.163 178.650 -0.487 18093 123 1 1 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.174 0.335 18093 124 1 1 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.878 1.041 18093 125 1 1 . 1 1 27 27 LEU H H 27 7.912 7.912 8.129 -0.217 18093 126 1 1 . 1 1 28 28 VAL N N 28 114.472 114.472 114.769 -0.297 18093 127 1 1 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.745 -0.210 18093 128 1 1 . 1 1 28 28 VAL C C 28 176.871 176.871 177.713 -0.842 18093 129 1 1 . 1 1 28 28 VAL CA C 28 65.977 65.977 65.595 0.382 18093 130 1 1 . 1 1 28 28 VAL CB C 28 31.934 31.934 30.713 1.221 18093 131 1 1 . 1 1 28 28 VAL H H 28 7.892 7.892 7.570 0.322 18093 132 1 1 . 1 1 29 29 PHE N N 29 115.206 115.206 117.676 -2.470 18093 133 1 1 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.238 -0.035 18093 134 1 1 . 1 1 29 29 PHE C C 29 176.614 176.614 177.033 -0.419 18093 135 1 1 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.813 0.151 18093 136 1 1 . 1 1 29 29 PHE CB C 29 39.752 39.752 39.122 0.630 18093 137 1 1 . 1 1 29 29 PHE H H 29 7.748 7.748 7.722 0.026 18093 138 1 1 . 1 1 30 30 TYR N N 30 115.975 115.975 120.387 -4.412 18093 139 1 1 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.518 -0.196 18093 140 1 1 . 1 1 30 30 TYR C C 30 175.553 175.553 176.063 -0.510 18093 141 1 1 . 1 1 30 30 TYR CA C 30 59.598 59.598 60.389 -0.791 18093 142 1 1 . 1 1 30 30 TYR CB C 30 39.763 39.763 40.140 -0.377 18093 143 1 1 . 1 1 30 30 TYR H H 30 7.985 7.985 7.677 0.308 18093 144 1 1 . 1 1 31 31 LEU N N 31 120.780 120.780 120.055 0.725 18093 145 1 1 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.767 -0.340 18093 146 1 1 . 1 1 31 31 LEU CA C 31 54.665 54.665 51.784 2.881 18093 147 1 1 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.991 -1.603 18093 148 1 1 . 1 1 31 31 LEU H H 31 7.643 7.643 7.924 -0.281 18093 149 1 1 . 1 1 34 34 GLU C C 34 176.271 176.271 177.680 -1.409 18093 150 1 1 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.063 2.527 18093 151 1 1 . 1 1 35 35 CYS N N 35 116.430 116.430 122.047 -5.617 18093 152 1 1 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.359 0.008 18093 153 1 1 . 1 1 35 35 CYS C C 35 175.198 175.198 175.888 -0.690 18093 154 1 1 . 1 1 35 35 CYS CA C 35 60.293 60.293 59.828 0.465 18093 155 1 1 . 1 1 35 35 CYS CB C 35 28.130 28.130 27.402 0.728 18093 156 1 1 . 1 1 35 35 CYS H H 35 7.970 7.970 8.908 -0.938 18093 157 1 1 . 1 1 36 36 GLY N N 36 108.315 108.315 107.295 1.020 18093 158 1 1 . 1 1 36 36 GLY C C 36 174.610 174.610 175.002 -0.392 18093 159 1 1 . 1 1 36 36 GLY CA C 36 46.004 46.004 45.258 0.746 18093 160 1 1 . 1 1 36 36 GLY H H 36 8.120 8.120 8.050 0.070 18093 161 1 1 . 1 1 37 37 GLU N N 37 121.347 121.347 121.157 0.190 18093 162 1 1 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.009 0.038 18093 163 1 1 . 1 1 37 37 GLU C C 37 177.338 177.338 177.946 -0.608 18093 164 1 1 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.404 -0.897 18093 165 1 1 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.647 -0.077 18093 166 1 1 . 1 1 37 37 GLU H H 37 8.423 8.423 7.498 0.925 18093 167 1 1 . 1 1 38 38 LYS N N 38 123.788 123.788 119.415 4.373 18093 168 1 1 . 1 1 38 38 LYS HA H 38 4.196 4.196 3.949 0.247 18093 169 1 1 . 1 1 38 38 LYS C C 38 177.976 177.976 178.601 -0.625 18093 170 1 1 . 1 1 38 38 LYS CA C 38 58.273 58.273 59.132 -0.859 18093 171 1 1 . 1 1 38 38 LYS CB C 38 31.649 31.649 31.746 -0.097 18093 172 1 1 . 1 1 38 38 LYS H H 38 8.211 8.211 8.100 0.111 18093 173 1 1 . 1 1 39 39 ILE N N 39 115.675 115.675 118.030 -2.355 18093 174 1 1 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.796 -0.188 18093 175 1 1 . 1 1 39 39 ILE C C 39 177.204 177.204 177.949 -0.745 18093 176 1 1 . 1 1 39 39 ILE CA C 39 65.501 65.501 64.711 0.790 18093 177 1 1 . 1 1 39 39 ILE H H 39 7.933 7.933 7.614 0.319 18093 178 1 1 . 1 1 40 40 THR N N 40 117.411 117.411 117.099 0.312 18093 179 1 1 . 1 1 40 40 THR HA H 40 3.844 3.844 3.971 -0.127 18093 180 1 1 . 1 1 40 40 THR C C 40 175.983 175.983 176.829 -0.846 18093 181 1 1 . 1 1 40 40 THR CA C 40 67.360 67.360 66.273 1.087 18093 182 1 1 . 1 1 40 40 THR H H 40 8.362 8.362 7.484 0.878 18093 183 1 1 . 1 1 41 41 LEU N N 41 123.059 123.059 122.519 0.540 18093 184 1 1 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.292 -0.276 18093 185 1 1 . 1 1 41 41 LEU C C 41 178.914 178.914 178.238 0.676 18093 186 1 1 . 1 1 41 41 LEU CA C 41 58.366 58.366 57.381 0.985 18093 187 1 1 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.066 0.984 18093 188 1 1 . 1 1 41 41 LEU H H 41 8.282 8.282 8.054 0.228 18093 189 1 1 . 1 1 42 42 CYS N N 42 118.762 118.762 119.454 -0.692 18093 190 1 1 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.009 -0.073 18093 191 1 1 . 1 1 42 42 CYS C C 42 176.607 176.607 176.873 -0.266 18093 192 1 1 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.645 0.672 18093 193 1 1 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.600 -0.681 18093 194 1 1 . 1 1 42 42 CYS H H 42 8.195 8.195 7.795 0.400 18093 195 1 1 . 1 1 43 43 ILE N N 43 117.589 117.589 119.771 -2.182 18093 196 1 1 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.605 0.002 18093 197 1 1 . 1 1 43 43 ILE C C 43 177.323 177.323 177.634 -0.311 18093 198 1 1 . 1 1 43 43 ILE CA C 43 65.249 65.249 65.330 -0.081 18093 199 1 1 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.852 0.186 18093 200 1 1 . 1 1 43 43 ILE H H 43 8.428 8.428 8.014 0.414 18093 201 1 1 . 1 1 44 44 SER N N 44 115.950 115.950 116.778 -0.828 18093 202 1 1 . 1 1 44 44 SER HA H 44 4.012 4.012 4.123 -0.111 18093 203 1 1 . 1 1 44 44 SER C C 44 176.965 176.965 176.671 0.294 18093 204 1 1 . 1 1 44 44 SER CA C 44 63.575 63.575 62.132 1.443 18093 205 1 1 . 1 1 44 44 SER H H 44 7.984 7.984 7.508 0.476 18093 206 1 1 . 1 1 45 45 VAL N N 45 123.544 123.544 121.576 1.968 18093 207 1 1 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.662 -0.114 18093 208 1 1 . 1 1 45 45 VAL C C 45 177.139 177.139 177.630 -0.491 18093 209 1 1 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.466 0.767 18093 210 1 1 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.486 0.156 18093 211 1 1 . 1 1 45 45 VAL H H 45 8.280 8.280 8.015 0.265 18093 212 1 1 . 1 1 46 46 LEU N N 46 119.883 119.883 120.721 -0.838 18093 213 1 1 . 1 1 46 46 LEU HA H 46 3.943 3.943 3.949 -0.006 18093 214 1 1 . 1 1 46 46 LEU C C 46 180.125 180.125 179.242 0.883 18093 215 1 1 . 1 1 46 46 LEU CA C 46 58.600 58.600 58.233 0.367 18093 216 1 1 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.819 0.194 18093 217 1 1 . 1 1 46 46 LEU H H 46 8.117 8.117 7.359 0.758 18093 218 1 1 . 1 1 47 47 LEU N N 47 120.193 120.193 119.210 0.983 18093 219 1 1 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.819 0.185 18093 220 1 1 . 1 1 47 47 LEU C C 47 178.370 178.370 179.068 -0.698 18093 221 1 1 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.810 -0.384 18093 222 1 1 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.694 0.361 18093 223 1 1 . 1 1 47 47 LEU H H 47 8.933 8.933 7.809 1.124 18093 224 1 1 . 1 1 48 48 SER N N 48 115.861 115.861 114.754 1.107 18093 225 1 1 . 1 1 48 48 SER HA H 48 4.013 4.013 4.168 -0.155 18093 226 1 1 . 1 1 48 48 SER C C 48 175.642 175.642 176.830 -1.188 18093 227 1 1 . 1 1 48 48 SER CA C 48 63.571 63.571 61.959 1.612 18093 228 1 1 . 1 1 48 48 SER CB C 48 62.879 62.879 63.141 -0.262 18093 229 1 1 . 1 1 48 48 SER H H 48 7.996 7.996 7.693 0.303 18093 230 1 1 . 1 1 49 49 LEU N N 49 120.673 120.673 122.293 -1.620 18093 231 1 1 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.130 -0.095 18093 232 1 1 . 1 1 49 49 LEU C C 49 178.229 178.229 179.488 -1.259 18093 233 1 1 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.066 0.217 18093 234 1 1 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.054 -0.108 18093 235 1 1 . 1 1 49 49 LEU H H 49 8.352 8.352 8.665 -0.313 18093 236 1 1 . 1 1 50 50 THR N N 50 115.582 115.582 113.871 1.711 18093 237 1 1 . 1 1 50 50 THR HA H 50 3.672 3.672 4.114 -0.442 18093 238 1 1 . 1 1 50 50 THR C C 50 175.877 175.877 176.340 -0.463 18093 239 1 1 . 1 1 50 50 THR CA C 50 68.628 68.628 65.789 2.839 18093 240 1 1 . 1 1 50 50 THR H H 50 7.937 7.937 8.389 -0.452 18093 241 1 1 . 1 1 51 51 VAL N N 51 119.774 119.774 122.856 -3.082 18093 242 1 1 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.835 -0.337 18093 243 1 1 . 1 1 51 51 VAL C C 51 177.162 177.162 177.644 -0.482 18093 244 1 1 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.675 0.910 18093 245 1 1 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.585 -0.064 18093 246 1 1 . 1 1 51 51 VAL H H 51 8.115 8.115 7.920 0.195 18093 247 1 1 . 1 1 52 52 PHE N N 52 118.808 118.808 120.527 -1.719 18093 248 1 1 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.300 -0.178 18093 249 1 1 . 1 1 52 52 PHE C C 52 176.697 176.697 176.871 -0.174 18093 250 1 1 . 1 1 52 52 PHE CA C 52 61.771 61.771 61.028 0.743 18093 251 1 1 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.047 0.214 18093 252 1 1 . 1 1 52 52 PHE H H 52 8.256 8.256 8.682 -0.426 18093 253 1 1 . 1 1 53 53 LEU N N 53 117.267 117.267 121.871 -4.604 18093 254 1 1 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.511 0.382 18093 255 1 1 . 1 1 53 53 LEU C C 53 179.319 179.319 177.702 1.617 18093 256 1 1 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.964 0.021 18093 257 1 1 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.436 0.391 18093 258 1 1 . 1 1 53 53 LEU H H 53 8.443 8.443 7.495 0.948 18093 259 1 1 . 1 1 54 54 LEU N N 54 119.762 119.762 119.187 0.575 18093 260 1 1 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.963 0.091 18093 261 1 1 . 1 1 54 54 LEU C C 54 178.827 178.827 179.572 -0.745 18093 262 1 1 . 1 1 54 54 LEU CA C 54 58.105 58.105 57.492 0.613 18093 263 1 1 . 1 1 54 54 LEU CB C 54 41.947 41.947 40.551 1.396 18093 264 1 1 . 1 1 54 54 LEU H H 54 8.205 8.205 7.434 0.771 18093 265 1 1 . 1 1 55 55 LEU N N 55 118.585 118.585 119.166 -0.581 18093 266 1 1 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.907 0.170 18093 267 1 1 . 1 1 55 55 LEU C C 55 178.909 178.909 178.545 0.364 18093 268 1 1 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.914 0.194 18093 269 1 1 . 1 1 55 55 LEU CB C 55 41.979 41.979 41.739 0.240 18093 270 1 1 . 1 1 55 55 LEU H H 55 8.179 8.179 7.494 0.685 18093 271 1 1 . 1 1 56 56 ILE N N 56 116.079 116.079 115.680 0.399 18093 272 1 1 . 1 1 56 56 ILE HA H 56 3.729 3.729 3.884 -0.155 18093 273 1 1 . 1 1 56 56 ILE C C 56 176.988 176.988 177.959 -0.971 18093 274 1 1 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.563 0.694 18093 275 1 1 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.563 0.854 18093 276 1 1 . 1 1 56 56 ILE H H 56 8.040 8.040 7.396 0.644 18093 277 1 1 . 1 1 57 57 THR N N 57 110.105 110.105 109.190 0.915 18093 278 1 1 . 1 1 57 57 THR HA H 57 4.015 4.015 4.205 -0.190 18093 279 1 1 . 1 1 57 57 THR C C 57 175.435 175.435 175.707 -0.272 18093 280 1 1 . 1 1 57 57 THR CA C 57 65.067 65.067 64.205 0.862 18093 281 1 1 . 1 1 57 57 THR CB C 57 69.179 69.179 68.754 0.425 18093 282 1 1 . 1 1 57 57 THR H H 57 7.655 7.655 7.777 -0.122 18093 283 1 1 . 1 1 58 58 GLU N N 58 117.313 117.313 121.445 -4.132 18093 284 1 1 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.293 0.040 18093 285 1 1 . 1 1 58 58 GLU C C 58 176.940 176.940 178.129 -1.189 18093 286 1 1 . 1 1 58 58 GLU CA C 58 57.068 57.068 58.128 -1.060 18093 287 1 1 . 1 1 58 58 GLU CB C 58 29.396 29.396 30.332 -0.936 18093 288 1 1 . 1 1 58 58 GLU H H 58 7.521 7.521 7.845 -0.324 18093 289 1 1 . 1 1 59 59 ILE N N 59 114.870 114.870 113.894 0.976 18093 290 1 1 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.096 -0.007 18093 291 1 1 . 1 1 59 59 ILE C C 59 175.456 175.456 176.249 -0.793 18093 292 1 1 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.221 0.213 18093 293 1 1 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.722 -0.065 18093 294 1 1 . 1 1 59 59 ILE H H 59 7.579 7.579 7.353 0.226 18093 295 1 1 . 1 1 60 60 ILE N N 60 119.354 119.354 117.847 1.507 18093 296 1 1 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.866 0.438 18093 297 1 1 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.397 -1.780 18093 298 1 1 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.617 2.245 18093 299 1 1 . 1 1 60 60 ILE H H 60 7.629 7.629 7.557 0.072 18093 300 1 1 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.314 0.086 18093 301 1 1 . 1 1 61 61 PRO C C 61 177.144 177.144 176.197 0.947 18093 302 1 1 . 1 1 61 61 PRO CA C 61 63.808 63.808 63.857 -0.049 18093 303 1 1 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.461 -0.578 18093 304 1 1 . 1 1 62 62 SER N N 62 114.474 114.474 113.118 1.356 18093 305 1 1 . 1 1 62 62 SER HA H 62 4.434 4.434 4.583 -0.149 18093 306 1 1 . 1 1 62 62 SER C C 62 175.161 175.161 173.888 1.273 18093 307 1 1 . 1 1 62 62 SER CA C 62 59.047 59.047 57.311 1.736 18093 308 1 1 . 1 1 62 62 SER CB C 62 63.704 63.704 64.603 -0.899 18093 309 1 1 . 1 1 62 62 SER H H 62 8.186 8.186 7.757 0.429 18093 310 1 1 . 1 1 63 63 THR N N 63 113.573 113.573 117.897 -4.324 18093 311 1 1 . 1 1 63 63 THR HA H 63 4.319 4.319 4.375 -0.056 18093 312 1 1 . 1 1 63 63 THR C C 63 174.834 174.834 174.789 0.045 18093 313 1 1 . 1 1 63 63 THR CA C 63 62.377 62.377 61.058 1.319 18093 314 1 1 . 1 1 63 63 THR CB C 63 69.422 69.422 68.922 0.500 18093 315 1 1 . 1 1 63 63 THR H H 63 7.963 7.963 8.355 -0.392 18093 316 1 1 . 1 1 64 64 SER N N 64 116.598 116.598 116.202 0.396 18093 317 1 1 . 1 1 64 64 SER HA H 64 4.428 4.428 4.593 -0.165 18093 318 1 1 . 1 1 64 64 SER C C 64 174.618 174.618 174.777 -0.159 18093 319 1 1 . 1 1 64 64 SER CA C 64 59.045 59.045 57.898 1.147 18093 320 1 1 . 1 1 64 64 SER CB C 64 63.700 63.700 64.225 -0.525 18093 321 1 1 . 1 1 64 64 SER H H 64 8.052 8.052 7.695 0.357 18093 322 1 1 . 1 1 65 65 SER N N 65 116.673 116.673 115.719 0.954 18093 323 1 1 . 1 1 65 65 SER HA H 65 4.432 4.432 4.263 0.169 18093 324 1 1 . 1 1 65 65 SER C C 65 174.335 174.335 174.474 -0.139 18093 325 1 1 . 1 1 65 65 SER CA C 65 58.927 58.927 59.892 -0.965 18093 326 1 1 . 1 1 65 65 SER CB C 65 63.621 63.621 63.264 0.357 18093 327 1 1 . 1 1 65 65 SER H H 65 8.114 8.114 8.326 -0.212 18093 328 1 1 . 1 1 66 66 VAL N N 66 119.054 119.054 116.758 2.296 18093 329 1 1 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.274 -0.104 18093 330 1 1 . 1 1 66 66 VAL C C 66 175.278 175.278 174.957 0.321 18093 331 1 1 . 1 1 66 66 VAL CA C 66 62.062 62.062 61.040 1.022 18093 332 1 1 . 1 1 66 66 VAL CB C 66 32.629 32.629 33.015 -0.386 18093 333 1 1 . 1 1 66 66 VAL H H 66 7.740 7.740 7.578 0.162 18093 334 1 1 . 1 1 67 67 SER N N 67 118.882 118.882 117.013 1.869 18093 335 1 1 . 1 1 67 67 SER HA H 67 4.704 4.704 4.369 0.335 18093 336 1 1 . 1 1 67 67 SER CA C 67 56.715 56.715 57.979 -1.264 18093 337 1 1 . 1 1 67 67 SER CB C 67 63.624 63.624 62.906 0.718 18093 338 1 1 . 1 1 67 67 SER H H 67 8.060 8.060 8.445 -0.385 18093 339 1 1 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.584 -0.184 18093 340 1 1 . 1 1 68 68 PRO C C 68 176.925 176.925 176.494 0.431 18093 341 1 1 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.730 1.018 18093 342 1 1 . 1 1 68 68 PRO CB C 68 32.005 32.005 32.402 -0.397 18093 343 1 1 . 1 1 69 69 SER N N 69 114.930 114.930 114.054 0.876 18093 344 1 1 . 1 1 69 69 SER HA H 69 4.422 4.422 4.340 0.082 18093 345 1 1 . 1 1 69 69 SER C C 69 175.617 175.617 176.075 -0.458 18093 346 1 1 . 1 1 69 69 SER CA C 69 58.697 58.697 60.071 -1.374 18093 347 1 1 . 1 1 69 69 SER CB C 69 63.804 63.804 63.524 0.280 18093 348 1 1 . 1 1 69 69 SER H H 69 8.205 8.205 8.680 -0.475 18093 349 1 1 . 1 1 70 70 ILE N N 70 120.840 120.840 123.157 -2.317 18093 350 1 1 . 1 1 70 70 ILE HA H 70 3.992 3.992 3.915 0.077 18093 351 1 1 . 1 1 70 70 ILE C C 70 177.524 177.524 176.560 0.964 18093 352 1 1 . 1 1 70 70 ILE CA C 70 64.335 64.335 61.783 2.552 18093 353 1 1 . 1 1 70 70 ILE CB C 70 37.460 37.460 37.912 -0.452 18093 354 1 1 . 1 1 70 70 ILE H H 70 8.283 8.283 8.259 0.024 18093 355 1 1 . 1 1 71 71 GLY N N 71 107.823 107.823 107.437 0.386 18093 356 1 1 . 1 1 71 71 GLY C C 71 175.296 175.296 175.919 -0.623 18093 357 1 1 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.078 0.377 18093 358 1 1 . 1 1 71 71 GLY H H 71 8.557 8.557 8.619 -0.062 18093 359 1 1 . 1 1 72 72 GLU N N 72 120.835 120.835 120.797 0.038 18093 360 1 1 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.189 -0.342 18093 361 1 1 . 1 1 72 72 GLU C C 72 178.198 178.198 178.678 -0.480 18093 362 1 1 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.330 1.787 18093 363 1 1 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.443 -0.050 18093 364 1 1 . 1 1 72 72 GLU H H 72 7.922 7.922 7.487 0.435 18093 365 1 1 . 1 1 73 73 TYR N N 73 117.375 117.375 120.227 -2.852 18093 366 1 1 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.326 -0.164 18093 367 1 1 . 1 1 73 73 TYR C C 73 179.912 179.912 178.055 1.857 18093 368 1 1 . 1 1 73 73 TYR CA C 73 62.155 62.155 58.948 3.207 18093 369 1 1 . 1 1 73 73 TYR CB C 73 38.766 38.766 37.825 0.940 18093 370 1 1 . 1 1 73 73 TYR H H 73 8.062 8.062 7.437 0.625 18093 371 1 1 . 1 1 74 74 LEU N N 74 121.493 121.493 119.363 2.130 18093 372 1 1 . 1 1 74 74 LEU HA H 74 4.049 4.049 4.156 -0.107 18093 373 1 1 . 1 1 74 74 LEU C C 74 178.063 178.063 179.215 -1.152 18093 374 1 1 . 1 1 74 74 LEU CA C 74 58.495 58.495 58.469 0.026 18093 375 1 1 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.814 0.033 18093 376 1 1 . 1 1 74 74 LEU H H 74 8.552 8.552 8.731 -0.179 18093 377 1 1 . 1 1 75 75 LEU N N 75 120.375 120.375 119.020 1.355 18093 378 1 1 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.110 -0.070 18093 379 1 1 . 1 1 75 75 LEU C C 75 178.515 178.515 179.248 -0.733 18093 380 1 1 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.116 0.522 18093 381 1 1 . 1 1 75 75 LEU CB C 75 42.039 42.039 41.148 0.891 18093 382 1 1 . 1 1 75 75 LEU H H 75 8.276 8.276 7.594 0.682 18093 383 1 1 . 1 1 76 76 PHE N N 76 116.626 116.626 119.802 -3.176 18093 384 1 1 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.174 -0.095 18093 385 1 1 . 1 1 76 76 PHE C C 76 177.399 177.399 178.320 -0.921 18093 386 1 1 . 1 1 76 76 PHE CA C 76 61.734 61.734 62.256 -0.522 18093 387 1 1 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.527 0.214 18093 388 1 1 . 1 1 76 76 PHE H H 76 8.454 8.454 8.139 0.315 18093 389 1 1 . 1 1 77 77 THR N N 77 116.080 116.080 115.907 0.173 18093 390 1 1 . 1 1 77 77 THR HA H 77 3.687 3.687 3.959 -0.272 18093 391 1 1 . 1 1 77 77 THR C C 77 176.018 176.018 176.939 -0.921 18093 392 1 1 . 1 1 77 77 THR CA C 77 68.640 68.640 67.051 1.589 18093 393 1 1 . 1 1 77 77 THR H H 77 8.224 8.224 8.698 -0.474 18093 394 1 1 . 1 1 78 78 MET N N 78 119.394 119.394 120.868 -1.474 18093 395 1 1 . 1 1 78 78 MET HA H 78 4.129 4.129 4.116 0.013 18093 396 1 1 . 1 1 78 78 MET C C 78 179.608 179.608 178.831 0.777 18093 397 1 1 . 1 1 78 78 MET CA C 78 58.831 58.831 59.774 -0.943 18093 398 1 1 . 1 1 78 78 MET CB C 78 31.590 31.590 32.507 -0.917 18093 399 1 1 . 1 1 78 78 MET H H 78 8.372 8.372 7.851 0.521 18093 400 1 1 . 1 1 79 79 ILE N N 79 121.819 121.819 119.202 2.617 18093 401 1 1 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.773 -0.223 18093 402 1 1 . 1 1 79 79 ILE C C 79 176.426 176.426 177.897 -1.471 18093 403 1 1 . 1 1 79 79 ILE CA C 79 65.876 65.876 64.515 1.361 18093 404 1 1 . 1 1 79 79 ILE CB C 79 37.673 37.673 37.001 0.672 18093 405 1 1 . 1 1 79 79 ILE H H 79 8.391 8.391 8.441 -0.050 18093 406 1 1 . 1 1 80 80 PHE N N 80 119.916 119.916 121.777 -1.861 18093 407 1 1 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.151 -0.098 18093 408 1 1 . 1 1 80 80 PHE C C 80 178.568 178.568 177.535 1.033 18093 409 1 1 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.612 -0.305 18093 410 1 1 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.318 -0.544 18093 411 1 1 . 1 1 80 80 PHE H H 80 8.479 8.479 8.336 0.143 18093 412 1 1 . 1 1 81 81 VAL N N 81 120.191 120.191 116.051 4.140 18093 413 1 1 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.736 -0.283 18093 414 1 1 . 1 1 81 81 VAL C C 81 178.225 178.225 177.782 0.443 18093 415 1 1 . 1 1 81 81 VAL CA C 81 67.408 67.408 65.837 1.571 18093 416 1 1 . 1 1 81 81 VAL CB C 81 31.556 31.556 30.481 1.075 18093 417 1 1 . 1 1 81 81 VAL H H 81 8.928 8.928 8.756 0.172 18093 418 1 1 . 1 1 82 82 THR N N 82 115.930 115.930 117.840 -1.910 18093 419 1 1 . 1 1 82 82 THR HA H 82 3.636 3.636 4.062 -0.426 18093 420 1 1 . 1 1 82 82 THR C C 82 176.420 176.420 176.670 -0.250 18093 421 1 1 . 1 1 82 82 THR CA C 82 68.570 68.570 66.863 1.707 18093 422 1 1 . 1 1 82 82 THR CB C 82 68.202 68.202 68.653 -0.451 18093 423 1 1 . 1 1 82 82 THR H H 82 7.969 7.969 7.392 0.577 18093 424 1 1 . 1 1 83 83 LEU N N 83 119.780 119.780 120.803 -1.023 18093 425 1 1 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.910 -0.063 18093 426 1 1 . 1 1 83 83 LEU C C 83 178.214 178.214 178.572 -0.358 18093 427 1 1 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.824 0.413 18093 428 1 1 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.267 0.525 18093 429 1 1 . 1 1 83 83 LEU H H 83 8.483 8.483 7.610 0.873 18093 430 1 1 . 1 1 84 84 SER N N 84 114.559 114.559 115.715 -1.156 18093 431 1 1 . 1 1 84 84 SER HA H 84 4.099 4.099 3.995 0.104 18093 432 1 1 . 1 1 84 84 SER C C 84 176.799 176.799 176.597 0.202 18093 433 1 1 . 1 1 84 84 SER CA C 84 63.609 63.609 62.243 1.366 18093 434 1 1 . 1 1 84 84 SER CB C 84 63.110 63.110 62.918 0.192 18093 435 1 1 . 1 1 84 84 SER H H 84 8.023 8.023 7.773 0.250 18093 436 1 1 . 1 1 85 85 ILE N N 85 123.962 123.962 121.417 2.545 18093 437 1 1 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.857 -0.253 18093 438 1 1 . 1 1 85 85 ILE C C 85 177.487 177.487 178.243 -0.756 18093 439 1 1 . 1 1 85 85 ILE CA C 85 65.759 65.759 64.794 0.965 18093 440 1 1 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.874 0.013 18093 441 1 1 . 1 1 85 85 ILE H H 85 8.054 8.054 7.673 0.381 18093 442 1 1 . 1 1 86 86 VAL N N 86 118.744 118.744 120.596 -1.852 18093 443 1 1 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.602 -0.083 18093 444 1 1 . 1 1 86 86 VAL C C 86 177.557 177.557 177.979 -0.422 18093 445 1 1 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.516 1.019 18093 446 1 1 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.606 -0.140 18093 447 1 1 . 1 1 86 86 VAL H H 86 8.158 8.158 7.264 0.894 18093 448 1 1 . 1 1 87 87 ILE N N 87 117.206 117.206 120.581 -3.375 18093 449 1 1 . 1 1 87 87 ILE HA H 87 3.604 3.604 4.025 -0.421 18093 450 1 1 . 1 1 87 87 ILE C C 87 177.283 177.283 178.531 -1.248 18093 451 1 1 . 1 1 87 87 ILE CA C 87 65.676 65.676 64.300 1.376 18093 452 1 1 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.701 0.888 18093 453 1 1 . 1 1 87 87 ILE H H 87 8.459 8.459 8.371 0.088 18093 454 1 1 . 1 1 88 88 THR N N 88 116.158 116.158 116.700 -0.542 18093 455 1 1 . 1 1 88 88 THR HA H 88 3.672 3.672 4.156 -0.484 18093 456 1 1 . 1 1 88 88 THR C C 88 175.485 175.485 177.247 -1.762 18093 457 1 1 . 1 1 88 88 THR CA C 88 68.549 68.549 67.027 1.522 18093 458 1 1 . 1 1 88 88 THR CB C 88 68.127 68.127 68.358 -0.231 18093 459 1 1 . 1 1 88 88 THR H H 88 7.776 7.776 8.710 -0.934 18093 460 1 1 . 1 1 89 89 VAL N N 89 117.985 117.985 121.114 -3.129 18093 461 1 1 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.821 -0.278 18093 462 1 1 . 1 1 89 89 VAL C C 89 177.393 177.393 177.691 -0.298 18093 463 1 1 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.984 0.606 18093 464 1 1 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.496 0.282 18093 465 1 1 . 1 1 89 89 VAL H H 89 8.206 8.206 7.499 0.707 18093 466 1 1 . 1 1 90 90 PHE N N 90 116.709 116.709 119.374 -2.665 18093 467 1 1 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.252 0.126 18093 468 1 1 . 1 1 90 90 PHE C C 90 177.305 177.305 177.887 -0.582 18093 469 1 1 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.576 -0.457 18093 470 1 1 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.205 1.181 18093 471 1 1 . 1 1 90 90 PHE H H 90 7.956 7.956 7.568 0.388 18093 472 1 1 . 1 1 91 91 VAL N N 91 116.565 116.565 120.015 -3.450 18093 473 1 1 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.794 0.041 18093 474 1 1 . 1 1 91 91 VAL C C 91 176.927 176.927 176.870 0.057 18093 475 1 1 . 1 1 91 91 VAL CA C 91 65.347 65.347 66.447 -1.100 18093 476 1 1 . 1 1 91 91 VAL CB C 91 31.867 31.867 32.240 -0.373 18093 477 1 1 . 1 1 91 91 VAL H H 91 8.239 8.239 8.720 -0.481 18093 478 1 1 . 1 1 92 92 LEU N N 92 117.443 117.443 116.598 0.845 18093 479 1 1 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.352 -0.158 18093 480 1 1 . 1 1 92 92 LEU C C 92 177.180 177.180 177.866 -0.686 18093 481 1 1 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.124 0.060 18093 482 1 1 . 1 1 92 92 LEU CB C 92 41.944 41.944 41.842 0.102 18093 483 1 1 . 1 1 92 92 LEU H H 92 7.967 7.967 7.544 0.423 18093 484 1 1 . 1 1 93 93 ASN N N 93 116.705 116.705 117.076 -0.371 18093 485 1 1 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.573 0.074 18093 486 1 1 . 1 1 93 93 ASN C C 93 175.129 175.129 175.370 -0.241 18093 487 1 1 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.221 -1.367 18093 488 1 1 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.817 -0.422 18093 489 1 1 . 1 1 93 93 ASN H H 93 7.683 7.683 7.498 0.185 18093 490 1 1 . 1 1 94 94 VAL N N 94 118.224 118.224 115.484 2.740 18093 491 1 1 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.848 0.113 18093 492 1 1 . 1 1 94 94 VAL C C 94 175.600 175.600 173.578 2.022 18093 493 1 1 . 1 1 94 94 VAL CA C 94 62.825 62.825 61.013 1.812 18093 494 1 1 . 1 1 94 94 VAL CB C 94 32.214 32.214 34.130 -1.916 18093 495 1 1 . 1 1 94 94 VAL H H 94 7.627 7.627 7.781 -0.154 18093 496 1 1 . 1 1 95 95 HIS N N 95 120.999 120.999 123.459 -2.460 18093 497 1 1 . 1 1 95 95 HIS HA H 95 4.593 4.593 5.095 -0.502 18093 498 1 1 . 1 1 95 95 HIS C C 95 174.146 174.146 174.188 -0.042 18093 499 1 1 . 1 1 95 95 HIS CA C 95 55.666 55.666 55.325 0.341 18093 500 1 1 . 1 1 95 95 HIS CB C 95 29.736 29.736 29.160 0.576 18093 501 1 1 . 1 1 95 95 HIS H H 95 8.263 8.263 8.081 0.182 18093 502 1 1 . 1 1 96 96 HIS N N 96 122.740 122.740 122.903 -0.163 18093 503 1 1 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.483 0.150 18093 504 1 1 . 1 1 96 96 HIS CA C 96 55.895 55.895 57.118 -1.223 18093 505 1 1 . 1 1 96 96 HIS CB C 96 29.750 29.750 30.842 -1.092 18093 506 1 1 . 1 1 96 96 HIS H H 96 8.298 8.298 9.088 -0.790 18093 507 1 1 . 1 1 97 97 ARG N N 97 118.503 118.503 120.309 -1.806 18093 508 1 1 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.698 -0.386 18093 509 1 1 . 1 1 97 97 ARG C C 97 175.776 175.776 174.978 0.798 18093 510 1 1 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.239 0.986 18093 511 1 1 . 1 1 97 97 ARG CB C 97 30.912 30.912 31.601 -0.689 18093 512 1 1 . 1 1 97 97 ARG H H 97 8.250 8.250 8.236 0.014 18093 513 1 1 . 1 1 98 98 SER N N 98 118.482 118.482 115.018 3.464 18093 514 1 1 . 1 1 98 98 SER HA H 98 4.722 4.722 4.922 -0.200 18093 515 1 1 . 1 1 98 98 SER CA C 98 56.547 56.547 56.319 0.228 18093 516 1 1 . 1 1 98 98 SER CB C 98 63.624 63.624 64.692 -1.068 18093 517 1 1 . 1 1 98 98 SER H H 98 8.254 8.254 8.320 -0.066 18093 518 1 1 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.509 -0.106 18093 519 1 1 . 1 1 99 99 PRO C C 99 176.899 176.899 176.962 -0.063 18093 520 1 1 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.445 -0.744 18093 521 1 1 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.556 -0.607 18093 522 1 1 . 1 1 100 100 GLU N N 100 120.187 120.187 113.935 6.252 18093 523 1 1 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.399 -0.111 18093 524 1 1 . 1 1 100 100 GLU C C 100 176.593 176.593 175.460 1.133 18093 525 1 1 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.642 0.080 18093 526 1 1 . 1 1 100 100 GLU CB C 100 29.999 29.999 30.460 -0.461 18093 527 1 1 . 1 1 100 100 GLU H H 100 8.401 8.401 8.201 0.200 18093 528 1 1 . 1 1 101 101 THR N N 101 113.968 113.968 113.691 0.277 18093 529 1 1 . 1 1 101 101 THR HA H 101 4.286 4.286 4.461 -0.175 18093 530 1 1 . 1 1 101 101 THR C C 101 174.525 174.525 173.969 0.556 18093 531 1 1 . 1 1 101 101 THR CA C 101 61.956 61.956 62.227 -0.271 18093 532 1 1 . 1 1 101 101 THR CB C 101 69.697 69.697 69.613 0.084 18093 533 1 1 . 1 1 101 101 THR H H 101 7.945 7.945 7.842 0.103 18093 534 1 1 . 1 1 102 102 HIS N N 102 120.322 120.322 121.544 -1.222 18093 535 1 1 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.651 0.090 18093 536 1 1 . 1 1 102 102 HIS C C 102 174.783 174.783 175.331 -0.548 18093 537 1 1 . 1 1 102 102 HIS CA C 102 55.701 55.701 56.245 -0.544 18093 538 1 1 . 1 1 102 102 HIS CB C 102 29.093 29.093 31.150 -2.057 18093 539 1 1 . 1 1 102 102 HIS H H 102 8.455 8.455 8.362 0.093 18093 540 1 1 . 1 1 103 103 THR N N 103 114.282 114.282 116.021 -1.739 18093 541 1 1 . 1 1 103 103 THR HA H 103 4.352 4.352 4.275 0.077 18093 542 1 1 . 1 1 103 103 THR C C 103 175.104 175.104 174.715 0.389 18093 543 1 1 . 1 1 103 103 THR CA C 103 62.057 62.057 62.301 -0.244 18093 544 1 1 . 1 1 103 103 THR CB C 103 69.966 69.966 69.326 0.640 18093 545 1 1 . 1 1 103 103 THR H H 103 8.069 8.069 7.934 0.135 18093 546 1 1 . 1 1 104 104 GLY N N 104 111.159 111.159 109.710 1.449 18093 547 1 1 . 1 1 104 104 GLY C C 104 174.776 174.776 174.329 0.447 18093 548 1 1 . 1 1 104 104 GLY CA C 104 45.588 45.588 44.826 0.762 18093 549 1 1 . 1 1 104 104 GLY H H 104 8.393 8.393 8.451 -0.058 18093 550 1 1 . 1 1 105 105 GLY N N 105 108.657 108.657 108.992 -0.335 18093 551 1 1 . 1 1 105 105 GLY C C 105 174.957 174.957 174.928 0.029 18093 552 1 1 . 1 1 105 105 GLY CA C 105 45.612 45.612 44.621 0.991 18093 553 1 1 . 1 1 105 105 GLY H H 105 8.275 8.275 9.701 -1.427 18093 554 1 1 . 1 1 106 106 GLY N N 106 108.870 108.870 107.502 1.368 18093 555 1 1 . 1 1 106 106 GLY C C 106 174.877 174.877 175.084 -0.207 18093 556 1 1 . 1 1 106 106 GLY CA C 106 45.665 45.665 45.583 0.082 18093 557 1 1 . 1 1 106 106 GLY H H 106 8.357 8.357 9.378 -1.021 18093 558 1 1 . 1 1 107 107 GLY N N 107 108.476 108.476 108.736 -0.260 18093 559 1 1 . 1 1 107 107 GLY C C 107 174.877 174.877 175.516 -0.639 18093 560 1 1 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.717 -0.021 18093 561 1 1 . 1 1 107 107 GLY H H 107 8.330 8.330 8.125 0.205 18093 562 1 1 . 1 1 108 108 GLY N N 108 108.486 108.486 109.530 -1.044 18093 563 1 1 . 1 1 108 108 GLY C C 108 175.345 175.345 175.507 -0.162 18093 564 1 1 . 1 1 108 108 GLY CA C 108 45.763 45.763 44.512 1.251 18093 565 1 1 . 1 1 108 108 GLY H H 108 8.328 8.328 8.413 -0.085 18093 566 1 1 . 1 1 109 109 ILE N N 109 120.433 120.433 120.216 0.217 18093 567 1 1 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.989 -0.021 18093 568 1 1 . 1 1 109 109 ILE C C 109 176.127 176.127 177.039 -0.912 18093 569 1 1 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.312 -0.577 18093 570 1 1 . 1 1 109 109 ILE CB C 109 38.125 38.125 37.824 0.301 18093 571 1 1 . 1 1 109 109 ILE H H 109 8.192 8.192 7.911 0.281 18093 572 1 1 . 1 1 110 110 ASP N N 110 121.148 121.148 119.417 1.731 18093 573 1 1 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.601 -0.295 18093 574 1 1 . 1 1 110 110 ASP C C 110 177.651 177.651 178.276 -0.625 18093 575 1 1 . 1 1 110 110 ASP CA C 110 56.776 56.776 57.874 -1.098 18093 576 1 1 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.987 0.110 18093 577 1 1 . 1 1 110 110 ASP H H 110 8.427 8.427 8.563 -0.136 18093 578 1 1 . 1 1 111 111 ARG N N 111 119.228 119.228 119.177 0.051 18093 579 1 1 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.275 -0.279 18093 580 1 1 . 1 1 111 111 ARG C C 111 177.786 177.786 178.990 -1.204 18093 581 1 1 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.052 -0.110 18093 582 1 1 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.996 0.200 18093 583 1 1 . 1 1 111 111 ARG H H 111 7.850 7.850 8.400 -0.550 18093 584 1 1 . 1 1 112 112 ILE N N 112 118.000 118.000 119.604 -1.604 18093 585 1 1 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.107 -0.294 18093 586 1 1 . 1 1 112 112 ILE C C 112 177.496 177.496 177.871 -0.375 18093 587 1 1 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.245 2.567 18093 588 1 1 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.861 0.866 18093 589 1 1 . 1 1 112 112 ILE H H 112 7.764 7.764 7.863 -0.099 18093 590 1 1 . 1 1 113 113 PHE N N 113 118.367 118.367 122.057 -3.690 18093 591 1 1 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.260 -0.005 18093 592 1 1 . 1 1 113 113 PHE C C 113 177.218 177.218 177.293 -0.075 18093 593 1 1 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.298 -0.865 18093 594 1 1 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.151 -0.344 18093 595 1 1 . 1 1 113 113 PHE H H 113 7.963 7.963 7.819 0.144 18093 596 1 1 . 1 1 114 114 LEU N N 114 118.921 118.921 118.090 0.831 18093 597 1 1 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.931 0.066 18093 598 1 1 . 1 1 114 114 LEU C C 114 178.297 178.297 178.351 -0.054 18093 599 1 1 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.235 0.376 18093 600 1 1 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.209 0.743 18093 601 1 1 . 1 1 114 114 LEU H H 114 7.939 7.939 7.934 0.005 18093 602 1 1 . 1 1 115 115 TRP N N 115 117.464 117.464 119.460 -1.996 18093 603 1 1 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.365 0.009 18093 604 1 1 . 1 1 115 115 TRP C C 115 178.572 178.572 178.255 0.317 18093 605 1 1 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.798 1.124 18093 606 1 1 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.756 -1.249 18093 607 1 1 . 1 1 115 115 TRP H H 115 7.969 7.969 7.607 0.362 18093 608 1 1 . 1 1 116 116 MET N N 116 117.069 117.069 118.876 -1.807 18093 609 1 1 . 1 1 116 116 MET HA H 116 4.065 4.065 4.214 -0.149 18093 610 1 1 . 1 1 116 116 MET C C 116 177.425 177.425 178.187 -0.762 18093 611 1 1 . 1 1 116 116 MET CA C 116 59.289 59.289 59.098 0.191 18093 612 1 1 . 1 1 116 116 MET CB C 116 31.692 31.692 32.509 -0.817 18093 613 1 1 . 1 1 116 116 MET H H 116 8.465 8.465 7.703 0.762 18093 614 1 1 . 1 1 117 117 PHE N N 117 118.755 118.755 117.711 1.044 18093 615 1 1 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.090 0.009 18093 616 1 1 . 1 1 117 117 PHE C C 117 177.965 177.965 178.299 -0.334 18093 617 1 1 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.230 -0.522 18093 618 1 1 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.239 0.946 18093 619 1 1 . 1 1 117 117 PHE H H 117 8.418 8.418 7.827 0.591 18093 620 1 1 . 1 1 118 118 ILE N N 118 119.133 119.133 115.246 3.887 18093 621 1 1 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.912 -0.568 18093 622 1 1 . 1 1 118 118 ILE C C 118 177.244 177.244 177.463 -0.219 18093 623 1 1 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.062 1.763 18093 624 1 1 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.842 -0.294 18093 625 1 1 . 1 1 118 118 ILE H H 118 8.266 8.266 7.666 0.600 18093 626 1 1 . 1 1 119 119 ILE N N 119 118.846 118.846 121.476 -2.630 18093 627 1 1 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.935 -0.363 18093 628 1 1 . 1 1 119 119 ILE C C 119 177.523 177.523 177.409 0.114 18093 629 1 1 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.198 0.691 18093 630 1 1 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.273 -0.709 18093 631 1 1 . 1 1 119 119 ILE H H 119 8.308 8.308 7.287 1.021 18093 632 1 1 . 1 1 120 120 VAL N N 120 119.228 119.228 117.956 1.272 18093 633 1 1 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.851 -0.343 18093 634 1 1 . 1 1 120 120 VAL C C 120 177.651 177.651 177.171 0.480 18093 635 1 1 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.072 2.529 18093 636 1 1 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.694 0.712 18093 637 1 1 . 1 1 120 120 VAL H H 120 8.399 8.399 7.959 0.440 18093 638 1 1 . 1 1 121 121 CYS N N 121 117.151 117.151 119.254 -2.103 18093 639 1 1 . 1 1 121 121 CYS HA H 121 3.903 3.903 3.968 -0.065 18093 640 1 1 . 1 1 121 121 CYS C C 121 177.719 177.719 176.999 0.720 18093 641 1 1 . 1 1 121 121 CYS CA C 121 64.298 64.298 63.844 0.454 18093 642 1 1 . 1 1 121 121 CYS CB C 121 26.677 26.677 27.182 -0.505 18093 643 1 1 . 1 1 121 121 CYS H H 121 8.008 8.008 7.430 0.578 18093 644 1 1 . 1 1 122 122 LEU N N 122 121.402 121.402 120.347 1.055 18093 645 1 1 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.166 -0.183 18093 646 1 1 . 1 1 122 122 LEU C C 122 178.282 178.282 178.752 -0.470 18093 647 1 1 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.797 0.748 18093 648 1 1 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.348 0.618 18093 649 1 1 . 1 1 122 122 LEU H H 122 8.417 8.417 7.552 0.865 18093 650 1 1 . 1 1 123 123 LEU N N 123 118.543 118.543 120.021 -1.478 18093 651 1 1 . 1 1 123 123 LEU HA H 123 3.920 3.920 3.992 -0.072 18093 652 1 1 . 1 1 123 123 LEU C C 123 179.028 179.028 178.753 0.275 18093 653 1 1 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.562 -0.445 18093 654 1 1 . 1 1 123 123 LEU CB C 123 42.056 42.056 40.919 1.137 18093 655 1 1 . 1 1 123 123 LEU H H 123 8.590 8.590 7.748 0.842 18093 656 1 1 . 1 1 124 124 GLY N N 124 104.896 104.896 105.040 -0.144 18093 657 1 1 . 1 1 124 124 GLY C C 124 173.932 173.932 175.907 -1.975 18093 658 1 1 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.395 -0.168 18093 659 1 1 . 1 1 124 124 GLY H H 124 8.601 8.601 8.244 0.357 18093 660 1 1 . 1 1 125 125 THR N N 125 115.403 115.403 119.271 -3.868 18093 661 1 1 . 1 1 125 125 THR HA H 125 3.686 3.686 3.772 -0.086 18093 662 1 1 . 1 1 125 125 THR C C 125 176.407 176.407 176.469 -0.062 18093 663 1 1 . 1 1 125 125 THR CA C 125 67.565 67.565 66.896 0.669 18093 664 1 1 . 1 1 125 125 THR CB C 125 68.143 68.143 68.783 -0.640 18093 665 1 1 . 1 1 125 125 THR H H 125 7.734 7.734 7.358 0.376 18093 666 1 1 . 1 1 126 126 VAL N N 126 119.056 119.056 121.545 -2.489 18093 667 1 1 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.776 -0.237 18093 668 1 1 . 1 1 126 126 VAL C C 126 177.628 177.628 178.222 -0.594 18093 669 1 1 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.754 -0.153 18093 670 1 1 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.352 0.142 18093 671 1 1 . 1 1 126 126 VAL H H 126 8.015 8.015 8.392 -0.377 18093 672 1 1 . 1 1 127 127 GLY N N 127 104.644 104.644 106.983 -2.339 18093 673 1 1 . 1 1 127 127 GLY C C 127 173.933 173.933 176.029 -2.096 18093 674 1 1 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.265 0.016 18093 675 1 1 . 1 1 127 127 GLY H H 127 8.248 8.248 8.522 -0.274 18093 676 1 1 . 1 1 128 128 LEU N N 128 117.354 117.354 120.482 -3.128 18093 677 1 1 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.126 -0.114 18093 678 1 1 . 1 1 128 128 LEU C C 128 177.443 177.443 177.733 -0.290 18093 679 1 1 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.529 0.097 18093 680 1 1 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.518 0.742 18093 681 1 1 . 1 1 128 128 LEU H H 128 7.568 7.568 7.506 0.062 18093 682 1 1 . 1 1 129 129 PHE N N 129 113.971 113.971 115.759 -1.788 18093 683 1 1 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.305 0.153 18093 684 1 1 . 1 1 129 129 PHE C C 129 176.216 176.216 176.291 -0.075 18093 685 1 1 . 1 1 129 129 PHE CA C 129 58.385 58.385 59.625 -1.240 18093 686 1 1 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.694 0.025 18093 687 1 1 . 1 1 129 129 PHE H H 129 7.639 7.639 7.447 0.192 18093 688 1 1 . 1 1 130 130 LEU N N 130 117.752 117.752 119.486 -1.734 18093 689 1 1 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.148 0.285 18093 690 1 1 . 1 1 130 130 LEU CA C 130 54.156 54.156 54.587 -0.431 18093 691 1 1 . 1 1 130 130 LEU H H 130 8.099 8.099 7.553 0.546 18093 692 1 1 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.824 -0.374 18093 693 1 1 . 1 1 131 131 PRO CA C 131 63.899 63.899 62.037 1.862 18093 694 1 1 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.430 -0.168 18093 695 1 1 . 1 1 132 132 PRO C C 132 177.616 177.616 177.991 -0.375 18093 696 1 1 . 1 1 132 132 PRO CA C 132 64.980 64.980 64.955 0.025 18093 697 1 1 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.357 -0.732 18093 698 1 1 . 1 1 133 133 TRP N N 133 115.508 115.508 119.509 -4.001 18093 699 1 1 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.534 0.058 18093 700 1 1 . 1 1 133 133 TRP C C 133 176.842 176.842 176.501 0.341 18093 701 1 1 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.513 -2.230 18093 702 1 1 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.577 -0.981 18093 703 1 1 . 1 1 133 133 TRP H H 133 7.311 7.311 8.328 -1.017 18093 704 1 1 . 1 1 134 134 LEU N N 134 119.570 119.570 114.924 4.646 18093 705 1 1 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.636 -0.459 18093 706 1 1 . 1 1 134 134 LEU C C 134 175.768 175.768 176.437 -0.669 18093 707 1 1 . 1 1 134 134 LEU CA C 134 55.621 55.621 53.723 1.898 18093 708 1 1 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.734 0.914 18093 709 1 1 . 1 1 134 134 LEU H H 134 7.453 7.453 7.629 -0.176 18093 710 1 1 . 1 1 135 135 ALA N N 135 119.004 119.004 122.777 -3.773 18093 711 1 1 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.240 -0.017 18093 712 1 1 . 1 1 135 135 ALA C C 135 177.170 177.170 178.081 -0.911 18093 713 1 1 . 1 1 135 135 ALA CA C 135 52.456 52.456 54.320 -1.864 18093 714 1 1 . 1 1 135 135 ALA CB C 135 19.736 19.736 19.437 0.299 18093 715 1 1 . 1 1 135 135 ALA H H 135 7.541 7.541 7.449 0.092 18093 716 1 1 . 1 1 136 136 GLY N N 136 105.879 105.879 106.673 -0.794 18093 717 1 1 . 1 1 136 136 GLY C C 136 173.042 173.042 174.674 -1.632 18093 718 1 1 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.393 0.300 18093 719 1 1 . 1 1 136 136 GLY H H 136 7.846 7.846 8.181 -0.335 18093 720 1 2 . 1 1 5 5 GLU N N 5 119.627 119.627 120.115 -0.488 18093 721 1 2 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.380 -0.172 18093 722 1 2 . 1 1 5 5 GLU C C 5 176.581 176.581 175.179 1.402 18093 723 1 2 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.301 0.744 18093 724 1 2 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.963 0.075 18093 725 1 2 . 1 1 5 5 GLU H H 5 8.003 8.003 8.265 -0.262 18093 726 1 2 . 1 1 6 6 LEU N N 6 121.267 121.267 122.150 -0.883 18093 727 1 2 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.643 -0.218 18093 728 1 2 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.355 2.280 18093 729 1 2 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.785 -0.489 18093 730 1 2 . 1 1 6 6 LEU H H 6 8.104 8.104 7.868 0.236 18093 731 1 2 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.561 -0.162 18093 732 1 2 . 1 1 7 7 PRO C C 7 178.408 178.408 177.994 0.414 18093 733 1 2 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.087 2.624 18093 734 1 2 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.805 -0.888 18093 735 1 2 . 1 1 8 8 LEU N N 8 121.835 121.835 121.060 0.775 18093 736 1 2 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.097 -0.008 18093 737 1 2 . 1 1 8 8 LEU C C 8 177.902 177.902 178.349 -0.447 18093 738 1 2 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.690 0.416 18093 739 1 2 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.159 0.448 18093 740 1 2 . 1 1 8 8 LEU H H 8 8.162 8.162 8.549 -0.387 18093 741 1 2 . 1 1 9 9 PHE N N 9 118.342 118.342 118.792 -0.450 18093 742 1 2 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.147 0.042 18093 743 1 2 . 1 1 9 9 PHE C C 9 177.596 177.596 177.090 0.506 18093 744 1 2 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.263 -0.149 18093 745 1 2 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.333 0.394 18093 746 1 2 . 1 1 9 9 PHE H H 9 8.318 8.318 8.207 0.111 18093 747 1 2 . 1 1 10 10 TYR N N 10 117.584 117.584 118.930 -1.346 18093 748 1 2 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.905 0.249 18093 749 1 2 . 1 1 10 10 TYR C C 10 177.630 177.630 177.346 0.284 18093 750 1 2 . 1 1 10 10 TYR CA C 10 61.036 61.036 60.297 0.739 18093 751 1 2 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.316 0.344 18093 752 1 2 . 1 1 10 10 TYR H H 10 8.105 8.105 8.521 -0.416 18093 753 1 2 . 1 1 11 11 THR N N 11 115.563 115.563 116.680 -1.117 18093 754 1 2 . 1 1 11 11 THR HA H 11 3.871 3.871 3.941 -0.070 18093 755 1 2 . 1 1 11 11 THR C C 11 175.955 175.955 176.589 -0.634 18093 756 1 2 . 1 1 11 11 THR CA C 11 67.290 67.290 66.680 0.610 18093 757 1 2 . 1 1 11 11 THR CB C 11 68.201 68.201 68.684 -0.483 18093 758 1 2 . 1 1 11 11 THR H H 11 7.915 7.915 7.757 0.158 18093 759 1 2 . 1 1 12 12 ILE N N 12 119.727 119.727 119.757 -0.030 18093 760 1 2 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.894 -0.195 18093 761 1 2 . 1 1 12 12 ILE C C 12 175.773 175.773 177.161 -1.388 18093 762 1 2 . 1 1 12 12 ILE CA C 12 64.699 64.699 62.307 2.392 18093 763 1 2 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.827 1.269 18093 764 1 2 . 1 1 12 12 ILE H H 12 8.186 8.186 7.844 0.342 18093 765 1 2 . 1 1 13 13 ASN N N 13 114.190 114.190 118.365 -4.175 18093 766 1 2 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.465 -0.043 18093 767 1 2 . 1 1 13 13 ASN C C 13 174.786 174.786 176.616 -1.830 18093 768 1 2 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.325 0.230 18093 769 1 2 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.708 0.650 18093 770 1 2 . 1 1 13 13 ASN H H 13 7.601 7.601 7.277 0.324 18093 771 1 2 . 1 1 14 14 LEU N N 14 115.031 115.031 118.838 -3.807 18093 772 1 2 . 1 1 14 14 LEU HA H 14 4.196 4.196 3.945 0.251 18093 773 1 2 . 1 1 14 14 LEU C C 14 177.540 177.540 177.938 -0.398 18093 774 1 2 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.313 0.094 18093 775 1 2 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.318 -0.476 18093 776 1 2 . 1 1 14 14 LEU H H 14 7.390 7.390 7.386 0.004 18093 777 1 2 . 1 1 15 15 ILE N N 15 118.223 118.223 119.988 -1.765 18093 778 1 2 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.670 -0.057 18093 779 1 2 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.456 3.264 18093 780 1 2 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.188 -0.576 18093 781 1 2 . 1 1 15 15 ILE H H 15 8.123 8.123 7.446 0.677 18093 782 1 2 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.309 -0.240 18093 783 1 2 . 1 1 17 17 PRO C C 17 177.721 177.721 178.921 -1.200 18093 784 1 2 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.419 1.342 18093 785 1 2 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.703 0.039 18093 786 1 2 . 1 1 18 18 CYS N N 18 113.538 113.538 117.510 -3.972 18093 787 1 2 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.036 -0.028 18093 788 1 2 . 1 1 18 18 CYS C C 18 177.683 177.683 176.883 0.800 18093 789 1 2 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.179 1.321 18093 790 1 2 . 1 1 18 18 CYS CB C 18 26.873 26.873 26.755 0.118 18093 791 1 2 . 1 1 18 18 CYS H H 18 7.410 7.410 7.414 -0.004 18093 792 1 2 . 1 1 19 19 LEU N N 19 122.545 122.545 119.023 3.522 18093 793 1 2 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.094 -0.095 18093 794 1 2 . 1 1 19 19 LEU C C 19 178.608 178.608 178.863 -0.255 18093 795 1 2 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.435 0.986 18093 796 1 2 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.251 0.593 18093 797 1 2 . 1 1 19 19 LEU H H 19 8.635 8.635 7.348 1.287 18093 798 1 2 . 1 1 20 20 LEU N N 20 119.404 119.404 120.404 -1.000 18093 799 1 2 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.891 0.115 18093 800 1 2 . 1 1 20 20 LEU C C 20 178.540 178.540 179.375 -0.835 18093 801 1 2 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.699 0.100 18093 802 1 2 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.813 0.186 18093 803 1 2 . 1 1 20 20 LEU H H 20 8.392 8.392 7.495 0.897 18093 804 1 2 . 1 1 21 21 ILE N N 21 117.335 117.335 114.163 3.172 18093 805 1 2 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.795 -0.144 18093 806 1 2 . 1 1 21 21 ILE C C 21 177.249 177.249 177.544 -0.295 18093 807 1 2 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.684 0.577 18093 808 1 2 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.252 0.708 18093 809 1 2 . 1 1 21 21 ILE H H 21 8.403 8.403 8.525 -0.122 18093 810 1 2 . 1 1 22 22 SER N N 22 116.385 116.385 118.255 -1.870 18093 811 1 2 . 1 1 22 22 SER HA H 22 4.056 4.056 4.189 -0.133 18093 812 1 2 . 1 1 22 22 SER C C 22 176.813 176.813 176.538 0.275 18093 813 1 2 . 1 1 22 22 SER CA C 22 63.866 63.866 62.242 1.624 18093 814 1 2 . 1 1 22 22 SER CB C 22 62.898 62.898 63.073 -0.175 18093 815 1 2 . 1 1 22 22 SER H H 22 8.271 8.271 7.541 0.730 18093 816 1 2 . 1 1 23 23 CYS N N 23 119.001 119.001 120.893 -1.892 18093 817 1 2 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.021 -0.031 18093 818 1 2 . 1 1 23 23 CYS C C 23 177.594 177.594 176.550 1.044 18093 819 1 2 . 1 1 23 23 CYS CA C 23 64.429 64.429 63.855 0.574 18093 820 1 2 . 1 1 23 23 CYS CB C 23 26.940 26.940 27.453 -0.513 18093 821 1 2 . 1 1 23 23 CYS H H 23 8.161 8.161 8.639 -0.478 18093 822 1 2 . 1 1 24 24 LEU N N 24 117.814 117.814 120.867 -3.053 18093 823 1 2 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.880 0.097 18093 824 1 2 . 1 1 24 24 LEU C C 24 177.944 177.944 177.948 -0.004 18093 825 1 2 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.771 -0.484 18093 826 1 2 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.895 0.007 18093 827 1 2 . 1 1 24 24 LEU H H 24 8.106 8.106 7.589 0.517 18093 828 1 2 . 1 1 25 25 THR N N 25 115.670 115.670 114.888 0.782 18093 829 1 2 . 1 1 25 25 THR HA H 25 3.687 3.687 3.999 -0.312 18093 830 1 2 . 1 1 25 25 THR C C 25 175.845 175.845 177.129 -1.284 18093 831 1 2 . 1 1 25 25 THR CA C 25 68.306 68.306 67.344 0.962 18093 832 1 2 . 1 1 25 25 THR H H 25 7.924 7.924 7.588 0.336 18093 833 1 2 . 1 1 26 26 VAL N N 26 118.809 118.809 120.765 -1.956 18093 834 1 2 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.590 -0.075 18093 835 1 2 . 1 1 26 26 VAL C C 26 177.530 177.530 177.714 -0.184 18093 836 1 2 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.082 1.199 18093 837 1 2 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.084 0.640 18093 838 1 2 . 1 1 26 26 VAL H H 26 7.764 7.764 7.301 0.463 18093 839 1 2 . 1 1 27 27 LEU N N 27 117.958 117.958 121.119 -3.161 18093 840 1 2 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.082 -0.046 18093 841 1 2 . 1 1 27 27 LEU C C 27 178.163 178.163 179.715 -1.552 18093 842 1 2 . 1 1 27 27 LEU CA C 27 58.509 58.509 57.932 0.577 18093 843 1 2 . 1 1 27 27 LEU CB C 27 41.919 41.919 41.010 0.909 18093 844 1 2 . 1 1 27 27 LEU H H 27 7.912 7.912 8.133 -0.221 18093 845 1 2 . 1 1 28 28 VAL N N 28 114.472 114.472 114.592 -0.120 18093 846 1 2 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.693 -0.158 18093 847 1 2 . 1 1 28 28 VAL C C 28 176.871 176.871 177.690 -0.819 18093 848 1 2 . 1 1 28 28 VAL CA C 28 65.977 65.977 65.739 0.238 18093 849 1 2 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.359 0.575 18093 850 1 2 . 1 1 28 28 VAL H H 28 7.892 7.892 7.695 0.197 18093 851 1 2 . 1 1 29 29 PHE N N 29 115.206 115.206 116.382 -1.176 18093 852 1 2 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.225 -0.022 18093 853 1 2 . 1 1 29 29 PHE C C 29 176.614 176.614 176.473 0.141 18093 854 1 2 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.462 0.502 18093 855 1 2 . 1 1 29 29 PHE CB C 29 39.752 39.752 39.321 0.431 18093 856 1 2 . 1 1 29 29 PHE H H 29 7.748 7.748 7.644 0.104 18093 857 1 2 . 1 1 30 30 TYR N N 30 115.975 115.975 118.785 -2.810 18093 858 1 2 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.355 -0.033 18093 859 1 2 . 1 1 30 30 TYR C C 30 175.553 175.553 175.054 0.499 18093 860 1 2 . 1 1 30 30 TYR CA C 30 59.598 59.598 59.012 0.586 18093 861 1 2 . 1 1 30 30 TYR CB C 30 39.763 39.763 40.814 -1.051 18093 862 1 2 . 1 1 30 30 TYR H H 30 7.985 7.985 7.816 0.169 18093 863 1 2 . 1 1 31 31 LEU N N 31 120.780 120.780 119.102 1.678 18093 864 1 2 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.652 -0.225 18093 865 1 2 . 1 1 31 31 LEU CA C 31 54.665 54.665 51.957 2.708 18093 866 1 2 . 1 1 31 31 LEU CB C 31 42.388 42.388 44.046 -1.658 18093 867 1 2 . 1 1 31 31 LEU H H 31 7.643 7.643 7.475 0.168 18093 868 1 2 . 1 1 34 34 GLU C C 34 176.271 176.271 175.691 0.580 18093 869 1 2 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.749 1.841 18093 870 1 2 . 1 1 35 35 CYS N N 35 116.430 116.430 119.342 -2.912 18093 871 1 2 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.661 -0.294 18093 872 1 2 . 1 1 35 35 CYS C C 35 175.198 175.198 175.603 -0.405 18093 873 1 2 . 1 1 35 35 CYS CA C 35 60.293 60.293 59.366 0.927 18093 874 1 2 . 1 1 35 35 CYS CB C 35 28.130 28.130 28.127 0.003 18093 875 1 2 . 1 1 35 35 CYS H H 35 7.970 7.970 8.608 -0.638 18093 876 1 2 . 1 1 36 36 GLY N N 36 108.315 108.315 109.230 -0.915 18093 877 1 2 . 1 1 36 36 GLY C C 36 174.610 174.610 175.132 -0.522 18093 878 1 2 . 1 1 36 36 GLY CA C 36 46.004 46.004 45.897 0.107 18093 879 1 2 . 1 1 36 36 GLY H H 36 8.120 8.120 7.909 0.211 18093 880 1 2 . 1 1 37 37 GLU N N 37 121.347 121.347 121.616 -0.269 18093 881 1 2 . 1 1 37 37 GLU HA H 37 4.047 4.047 3.954 0.093 18093 882 1 2 . 1 1 37 37 GLU C C 37 177.338 177.338 178.567 -1.229 18093 883 1 2 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.690 -1.183 18093 884 1 2 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.361 0.209 18093 885 1 2 . 1 1 37 37 GLU H H 37 8.423 8.423 8.770 -0.347 18093 886 1 2 . 1 1 38 38 LYS N N 38 123.788 123.788 118.741 5.047 18093 887 1 2 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.005 0.191 18093 888 1 2 . 1 1 38 38 LYS C C 38 177.976 177.976 179.080 -1.104 18093 889 1 2 . 1 1 38 38 LYS CA C 38 58.273 58.273 59.557 -1.284 18093 890 1 2 . 1 1 38 38 LYS CB C 38 31.649 31.649 31.899 -0.251 18093 891 1 2 . 1 1 38 38 LYS H H 38 8.211 8.211 7.933 0.278 18093 892 1 2 . 1 1 39 39 ILE N N 39 115.675 115.675 119.136 -3.461 18093 893 1 2 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.806 -0.198 18093 894 1 2 . 1 1 39 39 ILE C C 39 177.204 177.204 178.246 -1.042 18093 895 1 2 . 1 1 39 39 ILE CA C 39 65.501 65.501 64.959 0.542 18093 896 1 2 . 1 1 39 39 ILE H H 39 7.933 7.933 7.576 0.357 18093 897 1 2 . 1 1 40 40 THR N N 40 117.411 117.411 116.744 0.667 18093 898 1 2 . 1 1 40 40 THR HA H 40 3.844 3.844 4.034 -0.190 18093 899 1 2 . 1 1 40 40 THR C C 40 175.983 175.983 176.817 -0.834 18093 900 1 2 . 1 1 40 40 THR CA C 40 67.360 67.360 66.834 0.526 18093 901 1 2 . 1 1 40 40 THR H H 40 8.362 8.362 7.674 0.688 18093 902 1 2 . 1 1 41 41 LEU N N 41 123.059 123.059 121.802 1.257 18093 903 1 2 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.040 -0.024 18093 904 1 2 . 1 1 41 41 LEU C C 41 178.914 178.914 178.438 0.476 18093 905 1 2 . 1 1 41 41 LEU CA C 41 58.366 58.366 58.091 0.275 18093 906 1 2 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.628 0.422 18093 907 1 2 . 1 1 41 41 LEU H H 41 8.282 8.282 8.419 -0.137 18093 908 1 2 . 1 1 42 42 CYS N N 42 118.762 118.762 119.423 -0.661 18093 909 1 2 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.074 -0.138 18093 910 1 2 . 1 1 42 42 CYS C C 42 176.607 176.607 177.029 -0.422 18093 911 1 2 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.773 0.544 18093 912 1 2 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.553 -0.634 18093 913 1 2 . 1 1 42 42 CYS H H 42 8.195 8.195 8.423 -0.228 18093 914 1 2 . 1 1 43 43 ILE N N 43 117.589 117.589 119.403 -1.814 18093 915 1 2 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.746 -0.139 18093 916 1 2 . 1 1 43 43 ILE C C 43 177.323 177.323 178.208 -0.885 18093 917 1 2 . 1 1 43 43 ILE CA C 43 65.249 65.249 64.805 0.444 18093 918 1 2 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.818 0.220 18093 919 1 2 . 1 1 43 43 ILE H H 43 8.428 8.428 7.835 0.593 18093 920 1 2 . 1 1 44 44 SER N N 44 115.950 115.950 116.848 -0.898 18093 921 1 2 . 1 1 44 44 SER HA H 44 4.012 4.012 4.240 -0.228 18093 922 1 2 . 1 1 44 44 SER C C 44 176.965 176.965 176.764 0.201 18093 923 1 2 . 1 1 44 44 SER CA C 44 63.575 63.575 62.557 1.018 18093 924 1 2 . 1 1 44 44 SER H H 44 7.984 7.984 7.595 0.389 18093 925 1 2 . 1 1 45 45 VAL N N 45 123.544 123.544 121.799 1.745 18093 926 1 2 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.629 -0.081 18093 927 1 2 . 1 1 45 45 VAL C C 45 177.139 177.139 177.947 -0.808 18093 928 1 2 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.493 0.740 18093 929 1 2 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.879 -0.237 18093 930 1 2 . 1 1 45 45 VAL H H 45 8.280 8.280 8.267 0.013 18093 931 1 2 . 1 1 46 46 LEU N N 46 119.883 119.883 119.642 0.241 18093 932 1 2 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.009 -0.066 18093 933 1 2 . 1 1 46 46 LEU C C 46 180.125 180.125 178.582 1.543 18093 934 1 2 . 1 1 46 46 LEU CA C 46 58.600 58.600 58.199 0.401 18093 935 1 2 . 1 1 46 46 LEU CB C 46 42.012 42.012 42.017 -0.005 18093 936 1 2 . 1 1 46 46 LEU H H 46 8.117 8.117 7.548 0.569 18093 937 1 2 . 1 1 47 47 LEU N N 47 120.193 120.193 118.189 2.004 18093 938 1 2 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.961 0.043 18093 939 1 2 . 1 1 47 47 LEU C C 47 178.370 178.370 178.889 -0.519 18093 940 1 2 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.336 0.090 18093 941 1 2 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.531 0.524 18093 942 1 2 . 1 1 47 47 LEU H H 47 8.933 8.933 7.444 1.489 18093 943 1 2 . 1 1 48 48 SER N N 48 115.861 115.861 114.246 1.615 18093 944 1 2 . 1 1 48 48 SER HA H 48 4.013 4.013 4.217 -0.204 18093 945 1 2 . 1 1 48 48 SER C C 48 175.642 175.642 176.927 -1.285 18093 946 1 2 . 1 1 48 48 SER CA C 48 63.571 63.571 61.342 2.229 18093 947 1 2 . 1 1 48 48 SER CB C 48 62.879 62.879 62.942 -0.063 18093 948 1 2 . 1 1 48 48 SER H H 48 7.996 7.996 7.678 0.318 18093 949 1 2 . 1 1 49 49 LEU N N 49 120.673 120.673 120.233 0.440 18093 950 1 2 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.478 -0.443 18093 951 1 2 . 1 1 49 49 LEU C C 49 178.229 178.229 178.437 -0.208 18093 952 1 2 . 1 1 49 49 LEU CA C 49 58.283 58.283 57.251 1.032 18093 953 1 2 . 1 1 49 49 LEU CB C 49 41.946 41.946 41.278 0.668 18093 954 1 2 . 1 1 49 49 LEU H H 49 8.352 8.352 7.564 0.788 18093 955 1 2 . 1 1 50 50 THR N N 50 115.582 115.582 116.341 -0.759 18093 956 1 2 . 1 1 50 50 THR HA H 50 3.672 3.672 4.113 -0.441 18093 957 1 2 . 1 1 50 50 THR C C 50 175.877 175.877 176.359 -0.482 18093 958 1 2 . 1 1 50 50 THR CA C 50 68.628 68.628 66.694 1.934 18093 959 1 2 . 1 1 50 50 THR H H 50 7.937 7.937 7.695 0.242 18093 960 1 2 . 1 1 51 51 VAL N N 51 119.774 119.774 120.533 -0.759 18093 961 1 2 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.669 -0.171 18093 962 1 2 . 1 1 51 51 VAL C C 51 177.162 177.162 177.398 -0.236 18093 963 1 2 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.414 1.171 18093 964 1 2 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.391 0.130 18093 965 1 2 . 1 1 51 51 VAL H H 51 8.115 8.115 8.285 -0.170 18093 966 1 2 . 1 1 52 52 PHE N N 52 118.808 118.808 119.637 -0.829 18093 967 1 2 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.379 -0.257 18093 968 1 2 . 1 1 52 52 PHE C C 52 176.697 176.697 176.293 0.404 18093 969 1 2 . 1 1 52 52 PHE CA C 52 61.771 61.771 59.779 1.992 18093 970 1 2 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.538 -0.276 18093 971 1 2 . 1 1 52 52 PHE H H 52 8.256 8.256 7.601 0.655 18093 972 1 2 . 1 1 53 53 LEU N N 53 117.267 117.267 121.496 -4.229 18093 973 1 2 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.540 0.353 18093 974 1 2 . 1 1 53 53 LEU C C 53 179.319 179.319 178.066 1.253 18093 975 1 2 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.614 0.371 18093 976 1 2 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.327 0.500 18093 977 1 2 . 1 1 53 53 LEU H H 53 8.443 8.443 7.366 1.077 18093 978 1 2 . 1 1 54 54 LEU N N 54 119.762 119.762 119.493 0.269 18093 979 1 2 . 1 1 54 54 LEU HA H 54 4.054 4.054 4.043 0.011 18093 980 1 2 . 1 1 54 54 LEU C C 54 178.827 178.827 179.051 -0.224 18093 981 1 2 . 1 1 54 54 LEU CA C 54 58.105 58.105 58.120 -0.015 18093 982 1 2 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.668 0.279 18093 983 1 2 . 1 1 54 54 LEU H H 54 8.205 8.205 8.245 -0.040 18093 984 1 2 . 1 1 55 55 LEU N N 55 118.585 118.585 118.576 0.009 18093 985 1 2 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.959 0.118 18093 986 1 2 . 1 1 55 55 LEU C C 55 178.909 178.909 179.050 -0.141 18093 987 1 2 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.773 0.335 18093 988 1 2 . 1 1 55 55 LEU CB C 55 41.979 41.979 40.949 1.030 18093 989 1 2 . 1 1 55 55 LEU H H 55 8.179 8.179 7.452 0.727 18093 990 1 2 . 1 1 56 56 ILE N N 56 116.079 116.079 116.639 -0.560 18093 991 1 2 . 1 1 56 56 ILE HA H 56 3.729 3.729 3.977 -0.248 18093 992 1 2 . 1 1 56 56 ILE C C 56 176.988 176.988 177.923 -0.935 18093 993 1 2 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.841 0.416 18093 994 1 2 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.811 0.606 18093 995 1 2 . 1 1 56 56 ILE H H 56 8.040 8.040 7.415 0.625 18093 996 1 2 . 1 1 57 57 THR N N 57 110.105 110.105 110.717 -0.612 18093 997 1 2 . 1 1 57 57 THR HA H 57 4.015 4.015 4.158 -0.143 18093 998 1 2 . 1 1 57 57 THR C C 57 175.435 175.435 176.061 -0.626 18093 999 1 2 . 1 1 57 57 THR CA C 57 65.067 65.067 64.927 0.140 18093 1000 1 2 . 1 1 57 57 THR CB C 57 69.179 69.179 68.797 0.382 18093 1001 1 2 . 1 1 57 57 THR H H 57 7.655 7.655 7.677 -0.022 18093 1002 1 2 . 1 1 58 58 GLU N N 58 117.313 117.313 120.909 -3.596 18093 1003 1 2 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.341 -0.008 18093 1004 1 2 . 1 1 58 58 GLU C C 58 176.940 176.940 178.130 -1.190 18093 1005 1 2 . 1 1 58 58 GLU CA C 58 57.068 57.068 57.876 -0.808 18093 1006 1 2 . 1 1 58 58 GLU CB C 58 29.396 29.396 29.952 -0.556 18093 1007 1 2 . 1 1 58 58 GLU H H 58 7.521 7.521 7.890 -0.369 18093 1008 1 2 . 1 1 59 59 ILE N N 59 114.870 114.870 113.992 0.878 18093 1009 1 2 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.070 0.019 18093 1010 1 2 . 1 1 59 59 ILE C C 59 175.456 175.456 176.165 -0.709 18093 1011 1 2 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.117 0.317 18093 1012 1 2 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.747 -0.090 18093 1013 1 2 . 1 1 59 59 ILE H H 59 7.579 7.579 7.211 0.368 18093 1014 1 2 . 1 1 60 60 ILE N N 60 119.354 119.354 117.612 1.742 18093 1015 1 2 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.892 0.412 18093 1016 1 2 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.508 -1.891 18093 1017 1 2 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.514 2.348 18093 1018 1 2 . 1 1 60 60 ILE H H 60 7.629 7.629 7.688 -0.059 18093 1019 1 2 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.371 0.029 18093 1020 1 2 . 1 1 61 61 PRO C C 61 177.144 177.144 177.032 0.112 18093 1021 1 2 . 1 1 61 61 PRO CA C 61 63.808 63.808 63.787 0.021 18093 1022 1 2 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.247 -0.365 18093 1023 1 2 . 1 1 62 62 SER N N 62 114.474 114.474 114.459 0.015 18093 1024 1 2 . 1 1 62 62 SER HA H 62 4.434 4.434 4.468 -0.034 18093 1025 1 2 . 1 1 62 62 SER C C 62 175.161 175.161 174.359 0.802 18093 1026 1 2 . 1 1 62 62 SER CA C 62 59.047 59.047 59.019 0.028 18093 1027 1 2 . 1 1 62 62 SER CB C 62 63.704 63.704 62.046 1.658 18093 1028 1 2 . 1 1 62 62 SER H H 62 8.186 8.186 8.053 0.133 18093 1029 1 2 . 1 1 63 63 THR N N 63 113.573 113.573 117.479 -3.906 18093 1030 1 2 . 1 1 63 63 THR HA H 63 4.319 4.319 4.359 -0.040 18093 1031 1 2 . 1 1 63 63 THR C C 63 174.834 174.834 173.449 1.385 18093 1032 1 2 . 1 1 63 63 THR CA C 63 62.377 62.377 62.346 0.031 18093 1033 1 2 . 1 1 63 63 THR CB C 63 69.422 69.422 69.199 0.223 18093 1034 1 2 . 1 1 63 63 THR H H 63 7.963 7.963 8.246 -0.283 18093 1035 1 2 . 1 1 64 64 SER N N 64 116.598 116.598 117.114 -0.516 18093 1036 1 2 . 1 1 64 64 SER HA H 64 4.428 4.428 4.662 -0.234 18093 1037 1 2 . 1 1 64 64 SER C C 64 174.618 174.618 174.420 0.198 18093 1038 1 2 . 1 1 64 64 SER CA C 64 59.045 59.045 57.158 1.887 18093 1039 1 2 . 1 1 64 64 SER CB C 64 63.700 63.700 64.288 -0.588 18093 1040 1 2 . 1 1 64 64 SER H H 64 8.052 8.052 8.149 -0.097 18093 1041 1 2 . 1 1 65 65 SER N N 65 116.673 116.673 122.580 -5.907 18093 1042 1 2 . 1 1 65 65 SER HA H 65 4.432 4.432 4.638 -0.206 18093 1043 1 2 . 1 1 65 65 SER C C 65 174.335 174.335 174.991 -0.656 18093 1044 1 2 . 1 1 65 65 SER CA C 65 58.927 58.927 58.732 0.195 18093 1045 1 2 . 1 1 65 65 SER CB C 65 63.621 63.621 63.293 0.328 18093 1046 1 2 . 1 1 65 65 SER H H 65 8.114 8.114 8.832 -0.718 18093 1047 1 2 . 1 1 66 66 VAL N N 66 119.054 119.054 116.227 2.827 18093 1048 1 2 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.331 -0.161 18093 1049 1 2 . 1 1 66 66 VAL C C 66 175.278 175.278 175.725 -0.447 18093 1050 1 2 . 1 1 66 66 VAL CA C 66 62.062 62.062 63.023 -0.961 18093 1051 1 2 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.805 -0.176 18093 1052 1 2 . 1 1 66 66 VAL H H 66 7.740 7.740 7.513 0.227 18093 1053 1 2 . 1 1 67 67 SER N N 67 118.882 118.882 114.586 4.296 18093 1054 1 2 . 1 1 67 67 SER HA H 67 4.704 4.704 4.694 0.010 18093 1055 1 2 . 1 1 67 67 SER CA C 67 56.715 56.715 57.304 -0.589 18093 1056 1 2 . 1 1 67 67 SER CB C 67 63.624 63.624 64.518 -0.894 18093 1057 1 2 . 1 1 67 67 SER H H 67 8.060 8.060 7.542 0.518 18093 1058 1 2 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.616 -0.216 18093 1059 1 2 . 1 1 68 68 PRO C C 68 176.925 176.925 176.410 0.515 18093 1060 1 2 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.596 1.152 18093 1061 1 2 . 1 1 68 68 PRO CB C 68 32.005 32.005 32.207 -0.202 18093 1062 1 2 . 1 1 69 69 SER N N 69 114.930 114.930 115.595 -0.665 18093 1063 1 2 . 1 1 69 69 SER HA H 69 4.422 4.422 4.561 -0.139 18093 1064 1 2 . 1 1 69 69 SER C C 69 175.617 175.617 176.300 -0.683 18093 1065 1 2 . 1 1 69 69 SER CA C 69 58.697 58.697 57.032 1.665 18093 1066 1 2 . 1 1 69 69 SER CB C 69 63.804 63.804 65.377 -1.573 18093 1067 1 2 . 1 1 69 69 SER H H 69 8.205 8.205 8.093 0.112 18093 1068 1 2 . 1 1 70 70 ILE N N 70 120.840 120.840 122.210 -1.370 18093 1069 1 2 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.225 -0.233 18093 1070 1 2 . 1 1 70 70 ILE C C 70 177.524 177.524 176.864 0.660 18093 1071 1 2 . 1 1 70 70 ILE CA C 70 64.335 64.335 61.736 2.599 18093 1072 1 2 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.223 -0.763 18093 1073 1 2 . 1 1 70 70 ILE H H 70 8.283 8.283 8.654 -0.371 18093 1074 1 2 . 1 1 71 71 GLY N N 71 107.823 107.823 108.464 -0.641 18093 1075 1 2 . 1 1 71 71 GLY C C 71 175.296 175.296 175.956 -0.660 18093 1076 1 2 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.325 0.131 18093 1077 1 2 . 1 1 71 71 GLY H H 71 8.557 8.557 8.736 -0.179 18093 1078 1 2 . 1 1 72 72 GLU N N 72 120.835 120.835 120.323 0.512 18093 1079 1 2 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.251 -0.404 18093 1080 1 2 . 1 1 72 72 GLU C C 72 178.198 178.198 178.129 0.069 18093 1081 1 2 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.282 1.835 18093 1082 1 2 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.682 -0.289 18093 1083 1 2 . 1 1 72 72 GLU H H 72 7.922 7.922 7.756 0.166 18093 1084 1 2 . 1 1 73 73 TYR N N 73 117.375 117.375 122.442 -5.067 18093 1085 1 2 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.291 -0.129 18093 1086 1 2 . 1 1 73 73 TYR C C 73 179.912 179.912 177.869 2.043 18093 1087 1 2 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.325 0.830 18093 1088 1 2 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.682 0.083 18093 1089 1 2 . 1 1 73 73 TYR H H 73 8.062 8.062 7.860 0.202 18093 1090 1 2 . 1 1 74 74 LEU N N 74 121.493 121.493 119.093 2.400 18093 1091 1 2 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.731 0.318 18093 1092 1 2 . 1 1 74 74 LEU C C 74 178.063 178.063 178.622 -0.559 18093 1093 1 2 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.365 1.130 18093 1094 1 2 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.774 0.073 18093 1095 1 2 . 1 1 74 74 LEU H H 74 8.552 8.552 8.912 -0.360 18093 1096 1 2 . 1 1 75 75 LEU N N 75 120.375 120.375 120.087 0.288 18093 1097 1 2 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.050 -0.010 18093 1098 1 2 . 1 1 75 75 LEU C C 75 178.515 178.515 178.968 -0.453 18093 1099 1 2 . 1 1 75 75 LEU CA C 75 58.638 58.638 57.927 0.711 18093 1100 1 2 . 1 1 75 75 LEU CB C 75 42.039 42.039 40.955 1.084 18093 1101 1 2 . 1 1 75 75 LEU H H 75 8.276 8.276 7.442 0.834 18093 1102 1 2 . 1 1 76 76 PHE N N 76 116.626 116.626 118.802 -2.176 18093 1103 1 2 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.134 -0.055 18093 1104 1 2 . 1 1 76 76 PHE C C 76 177.399 177.399 178.403 -1.004 18093 1105 1 2 . 1 1 76 76 PHE CA C 76 61.734 61.734 61.659 0.075 18093 1106 1 2 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.531 0.210 18093 1107 1 2 . 1 1 76 76 PHE H H 76 8.454 8.454 8.012 0.442 18093 1108 1 2 . 1 1 77 77 THR N N 77 116.080 116.080 115.097 0.983 18093 1109 1 2 . 1 1 77 77 THR HA H 77 3.687 3.687 3.812 -0.125 18093 1110 1 2 . 1 1 77 77 THR C C 77 176.018 176.018 176.725 -0.707 18093 1111 1 2 . 1 1 77 77 THR CA C 77 68.640 68.640 66.682 1.958 18093 1112 1 2 . 1 1 77 77 THR H H 77 8.224 8.224 8.512 -0.288 18093 1113 1 2 . 1 1 78 78 MET N N 78 119.394 119.394 120.637 -1.243 18093 1114 1 2 . 1 1 78 78 MET HA H 78 4.129 4.129 4.091 0.038 18093 1115 1 2 . 1 1 78 78 MET C C 78 179.608 179.608 178.310 1.298 18093 1116 1 2 . 1 1 78 78 MET CA C 78 58.831 58.831 58.504 0.327 18093 1117 1 2 . 1 1 78 78 MET CB C 78 31.590 31.590 31.859 -0.269 18093 1118 1 2 . 1 1 78 78 MET H H 78 8.372 8.372 7.519 0.853 18093 1119 1 2 . 1 1 79 79 ILE N N 79 121.819 121.819 117.589 4.230 18093 1120 1 2 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.758 -0.208 18093 1121 1 2 . 1 1 79 79 ILE C C 79 176.426 176.426 178.315 -1.889 18093 1122 1 2 . 1 1 79 79 ILE CA C 79 65.876 65.876 63.368 2.508 18093 1123 1 2 . 1 1 79 79 ILE CB C 79 37.673 37.673 36.284 1.389 18093 1124 1 2 . 1 1 79 79 ILE H H 79 8.391 8.391 7.580 0.811 18093 1125 1 2 . 1 1 80 80 PHE N N 80 119.916 119.916 122.105 -2.189 18093 1126 1 2 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.120 -0.067 18093 1127 1 2 . 1 1 80 80 PHE C C 80 178.568 178.568 177.300 1.268 18093 1128 1 2 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.745 -0.438 18093 1129 1 2 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.452 -0.678 18093 1130 1 2 . 1 1 80 80 PHE H H 80 8.479 8.479 7.795 0.684 18093 1131 1 2 . 1 1 81 81 VAL N N 81 120.191 120.191 115.705 4.486 18093 1132 1 2 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.610 -0.157 18093 1133 1 2 . 1 1 81 81 VAL C C 81 178.225 178.225 177.601 0.624 18093 1134 1 2 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.742 0.666 18093 1135 1 2 . 1 1 81 81 VAL CB C 81 31.556 31.556 31.485 0.071 18093 1136 1 2 . 1 1 81 81 VAL H H 81 8.928 8.928 8.730 0.198 18093 1137 1 2 . 1 1 82 82 THR N N 82 115.930 115.930 117.415 -1.485 18093 1138 1 2 . 1 1 82 82 THR HA H 82 3.636 3.636 3.924 -0.288 18093 1139 1 2 . 1 1 82 82 THR C C 82 176.420 176.420 176.325 0.095 18093 1140 1 2 . 1 1 82 82 THR CA C 82 68.570 68.570 67.406 1.165 18093 1141 1 2 . 1 1 82 82 THR CB C 82 68.202 68.202 68.918 -0.716 18093 1142 1 2 . 1 1 82 82 THR H H 82 7.969 7.969 7.374 0.595 18093 1143 1 2 . 1 1 83 83 LEU N N 83 119.780 119.780 121.033 -1.253 18093 1144 1 2 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.816 0.031 18093 1145 1 2 . 1 1 83 83 LEU C C 83 178.214 178.214 178.748 -0.534 18093 1146 1 2 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.726 0.511 18093 1147 1 2 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.315 0.476 18093 1148 1 2 . 1 1 83 83 LEU H H 83 8.483 8.483 7.509 0.974 18093 1149 1 2 . 1 1 84 84 SER N N 84 114.559 114.559 115.925 -1.366 18093 1150 1 2 . 1 1 84 84 SER HA H 84 4.099 4.099 4.107 -0.008 18093 1151 1 2 . 1 1 84 84 SER C C 84 176.799 176.799 176.694 0.105 18093 1152 1 2 . 1 1 84 84 SER CA C 84 63.609 63.609 62.117 1.492 18093 1153 1 2 . 1 1 84 84 SER CB C 84 63.110 63.110 62.519 0.591 18093 1154 1 2 . 1 1 84 84 SER H H 84 8.023 8.023 7.684 0.339 18093 1155 1 2 . 1 1 85 85 ILE N N 85 123.962 123.962 121.364 2.598 18093 1156 1 2 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.874 -0.270 18093 1157 1 2 . 1 1 85 85 ILE C C 85 177.487 177.487 178.089 -0.602 18093 1158 1 2 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.204 0.555 18093 1159 1 2 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.923 -0.036 18093 1160 1 2 . 1 1 85 85 ILE H H 85 8.054 8.054 7.671 0.383 18093 1161 1 2 . 1 1 86 86 VAL N N 86 118.744 118.744 120.759 -2.015 18093 1162 1 2 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.868 -0.349 18093 1163 1 2 . 1 1 86 86 VAL C C 86 177.557 177.557 177.712 -0.155 18093 1164 1 2 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.630 0.905 18093 1165 1 2 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.933 -0.467 18093 1166 1 2 . 1 1 86 86 VAL H H 86 8.158 8.158 7.430 0.728 18093 1167 1 2 . 1 1 87 87 ILE N N 87 117.206 117.206 119.562 -2.356 18093 1168 1 2 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.725 -0.121 18093 1169 1 2 . 1 1 87 87 ILE C C 87 177.283 177.283 178.424 -1.141 18093 1170 1 2 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.613 2.063 18093 1171 1 2 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.404 1.185 18093 1172 1 2 . 1 1 87 87 ILE H H 87 8.459 8.459 8.537 -0.078 18093 1173 1 2 . 1 1 88 88 THR N N 88 116.158 116.158 117.058 -0.900 18093 1174 1 2 . 1 1 88 88 THR HA H 88 3.672 3.672 4.309 -0.637 18093 1175 1 2 . 1 1 88 88 THR C C 88 175.485 175.485 176.833 -1.348 18093 1176 1 2 . 1 1 88 88 THR CA C 88 68.549 68.549 67.223 1.326 18093 1177 1 2 . 1 1 88 88 THR CB C 88 68.127 68.127 68.826 -0.699 18093 1178 1 2 . 1 1 88 88 THR H H 88 7.776 7.776 8.505 -0.729 18093 1179 1 2 . 1 1 89 89 VAL N N 89 117.985 117.985 121.353 -3.368 18093 1180 1 2 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.900 -0.357 18093 1181 1 2 . 1 1 89 89 VAL C C 89 177.393 177.393 177.655 -0.262 18093 1182 1 2 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.267 1.323 18093 1183 1 2 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.464 0.314 18093 1184 1 2 . 1 1 89 89 VAL H H 89 8.206 8.206 7.631 0.575 18093 1185 1 2 . 1 1 90 90 PHE N N 90 116.709 116.709 120.492 -3.783 18093 1186 1 2 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.256 0.122 18093 1187 1 2 . 1 1 90 90 PHE C C 90 177.305 177.305 177.733 -0.428 18093 1188 1 2 . 1 1 90 90 PHE CA C 90 61.119 61.119 62.416 -1.297 18093 1189 1 2 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.637 0.748 18093 1190 1 2 . 1 1 90 90 PHE H H 90 7.956 7.956 7.763 0.193 18093 1191 1 2 . 1 1 91 91 VAL N N 91 116.565 116.565 119.281 -2.716 18093 1192 1 2 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.678 0.157 18093 1193 1 2 . 1 1 91 91 VAL C C 91 176.927 176.927 177.295 -0.368 18093 1194 1 2 . 1 1 91 91 VAL CA C 91 65.347 65.347 66.240 -0.893 18093 1195 1 2 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.904 -0.037 18093 1196 1 2 . 1 1 91 91 VAL H H 91 8.239 8.239 7.705 0.534 18093 1197 1 2 . 1 1 92 92 LEU N N 92 117.443 117.443 116.936 0.507 18093 1198 1 2 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.263 -0.069 18093 1199 1 2 . 1 1 92 92 LEU C C 92 177.180 177.180 177.311 -0.131 18093 1200 1 2 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.617 -0.433 18093 1201 1 2 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.303 -0.359 18093 1202 1 2 . 1 1 92 92 LEU H H 92 7.967 7.967 7.707 0.260 18093 1203 1 2 . 1 1 93 93 ASN N N 93 116.705 116.705 116.634 0.071 18093 1204 1 2 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.563 0.084 18093 1205 1 2 . 1 1 93 93 ASN C C 93 175.129 175.129 177.253 -2.124 18093 1206 1 2 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.767 -1.913 18093 1207 1 2 . 1 1 93 93 ASN CB C 93 39.395 39.395 38.456 0.939 18093 1208 1 2 . 1 1 93 93 ASN H H 93 7.683 7.683 7.761 -0.078 18093 1209 1 2 . 1 1 94 94 VAL N N 94 118.224 118.224 118.281 -0.057 18093 1210 1 2 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.975 -0.014 18093 1211 1 2 . 1 1 94 94 VAL C C 94 175.600 175.600 175.200 0.400 18093 1212 1 2 . 1 1 94 94 VAL CA C 94 62.825 62.825 63.487 -0.662 18093 1213 1 2 . 1 1 94 94 VAL CB C 94 32.214 32.214 32.544 -0.329 18093 1214 1 2 . 1 1 94 94 VAL H H 94 7.627 7.627 7.705 -0.078 18093 1215 1 2 . 1 1 95 95 HIS N N 95 120.999 120.999 119.658 1.341 18093 1216 1 2 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.684 -0.091 18093 1217 1 2 . 1 1 95 95 HIS C C 95 174.146 174.146 174.387 -0.241 18093 1218 1 2 . 1 1 95 95 HIS CA C 95 55.666 55.666 55.695 -0.029 18093 1219 1 2 . 1 1 95 95 HIS CB C 95 29.736 29.736 29.456 0.280 18093 1220 1 2 . 1 1 95 95 HIS H H 95 8.263 8.263 7.671 0.592 18093 1221 1 2 . 1 1 96 96 HIS N N 96 122.740 122.740 121.906 0.834 18093 1222 1 2 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.791 -0.158 18093 1223 1 2 . 1 1 96 96 HIS CA C 96 55.895 55.895 54.889 1.006 18093 1224 1 2 . 1 1 96 96 HIS CB C 96 29.750 29.750 30.011 -0.261 18093 1225 1 2 . 1 1 96 96 HIS H H 96 8.298 8.298 7.946 0.352 18093 1226 1 2 . 1 1 97 97 ARG N N 97 118.503 118.503 121.672 -3.169 18093 1227 1 2 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.295 0.017 18093 1228 1 2 . 1 1 97 97 ARG C C 97 175.776 175.776 175.286 0.490 18093 1229 1 2 . 1 1 97 97 ARG CA C 97 56.225 56.225 56.054 0.171 18093 1230 1 2 . 1 1 97 97 ARG CB C 97 30.912 30.912 30.808 0.104 18093 1231 1 2 . 1 1 97 97 ARG H H 97 8.250 8.250 7.896 0.354 18093 1232 1 2 . 1 1 98 98 SER N N 98 118.482 118.482 117.585 0.897 18093 1233 1 2 . 1 1 98 98 SER HA H 98 4.722 4.722 4.738 -0.016 18093 1234 1 2 . 1 1 98 98 SER CA C 98 56.547 56.547 56.824 -0.277 18093 1235 1 2 . 1 1 98 98 SER CB C 98 63.624 63.624 64.375 -0.751 18093 1236 1 2 . 1 1 98 98 SER H H 98 8.254 8.254 8.169 0.085 18093 1237 1 2 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.408 -0.005 18093 1238 1 2 . 1 1 99 99 PRO C C 99 176.899 176.899 176.571 0.328 18093 1239 1 2 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.910 -1.209 18093 1240 1 2 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.196 -0.247 18093 1241 1 2 . 1 1 100 100 GLU N N 100 120.187 120.187 115.568 4.619 18093 1242 1 2 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.281 0.007 18093 1243 1 2 . 1 1 100 100 GLU C C 100 176.593 176.593 175.167 1.426 18093 1244 1 2 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.734 -0.012 18093 1245 1 2 . 1 1 100 100 GLU CB C 100 29.999 29.999 29.574 0.425 18093 1246 1 2 . 1 1 100 100 GLU H H 100 8.401 8.401 8.420 -0.019 18093 1247 1 2 . 1 1 101 101 THR N N 101 113.968 113.968 114.803 -0.835 18093 1248 1 2 . 1 1 101 101 THR HA H 101 4.286 4.286 4.446 -0.160 18093 1249 1 2 . 1 1 101 101 THR C C 101 174.525 174.525 174.457 0.068 18093 1250 1 2 . 1 1 101 101 THR CA C 101 61.956 61.956 61.624 0.332 18093 1251 1 2 . 1 1 101 101 THR CB C 101 69.697 69.697 70.119 -0.422 18093 1252 1 2 . 1 1 101 101 THR H H 101 7.945 7.945 7.975 -0.030 18093 1253 1 2 . 1 1 102 102 HIS N N 102 120.322 120.322 119.428 0.894 18093 1254 1 2 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.785 -0.044 18093 1255 1 2 . 1 1 102 102 HIS C C 102 174.783 174.783 175.012 -0.229 18093 1256 1 2 . 1 1 102 102 HIS CA C 102 55.701 55.701 54.863 0.838 18093 1257 1 2 . 1 1 102 102 HIS CB C 102 29.093 29.093 29.262 -0.169 18093 1258 1 2 . 1 1 102 102 HIS H H 102 8.455 8.455 8.602 -0.147 18093 1259 1 2 . 1 1 103 103 THR N N 103 114.282 114.282 113.988 0.294 18093 1260 1 2 . 1 1 103 103 THR HA H 103 4.352 4.352 4.402 -0.050 18093 1261 1 2 . 1 1 103 103 THR C C 103 175.104 175.104 174.916 0.188 18093 1262 1 2 . 1 1 103 103 THR CA C 103 62.057 62.057 61.814 0.243 18093 1263 1 2 . 1 1 103 103 THR CB C 103 69.966 69.966 68.838 1.128 18093 1264 1 2 . 1 1 103 103 THR H H 103 8.069 8.069 7.691 0.378 18093 1265 1 2 . 1 1 104 104 GLY N N 104 111.159 111.159 115.517 -4.358 18093 1266 1 2 . 1 1 104 104 GLY C C 104 174.776 174.776 173.200 1.576 18093 1267 1 2 . 1 1 104 104 GLY CA C 104 45.588 45.588 45.015 0.573 18093 1268 1 2 . 1 1 104 104 GLY H H 104 8.393 8.393 8.187 0.206 18093 1269 1 2 . 1 1 105 105 GLY N N 105 108.657 108.657 107.821 0.836 18093 1270 1 2 . 1 1 105 105 GLY C C 105 174.957 174.957 173.424 1.533 18093 1271 1 2 . 1 1 105 105 GLY CA C 105 45.612 45.612 44.893 0.719 18093 1272 1 2 . 1 1 105 105 GLY H H 105 8.275 8.275 8.154 0.121 18093 1273 1 2 . 1 1 106 106 GLY N N 106 108.870 108.870 110.355 -1.485 18093 1274 1 2 . 1 1 106 106 GLY C C 106 174.877 174.877 173.528 1.349 18093 1275 1 2 . 1 1 106 106 GLY CA C 106 45.665 45.665 44.644 1.021 18093 1276 1 2 . 1 1 106 106 GLY H H 106 8.357 8.357 8.269 0.088 18093 1277 1 2 . 1 1 107 107 GLY N N 107 108.476 108.476 106.965 1.511 18093 1278 1 2 . 1 1 107 107 GLY C C 107 174.877 174.877 175.482 -0.605 18093 1279 1 2 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.459 0.237 18093 1280 1 2 . 1 1 107 107 GLY H H 107 8.330 8.330 8.362 -0.032 18093 1281 1 2 . 1 1 108 108 GLY N N 108 108.486 108.486 108.815 -0.329 18093 1282 1 2 . 1 1 108 108 GLY C C 108 175.345 175.345 175.897 -0.552 18093 1283 1 2 . 1 1 108 108 GLY CA C 108 45.763 45.763 44.754 1.009 18093 1284 1 2 . 1 1 108 108 GLY H H 108 8.328 8.328 8.451 -0.123 18093 1285 1 2 . 1 1 109 109 ILE N N 109 120.433 120.433 120.525 -0.092 18093 1286 1 2 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.970 -0.002 18093 1287 1 2 . 1 1 109 109 ILE C C 109 176.127 176.127 177.056 -0.929 18093 1288 1 2 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.429 -0.694 18093 1289 1 2 . 1 1 109 109 ILE CB C 109 38.125 38.125 37.869 0.256 18093 1290 1 2 . 1 1 109 109 ILE H H 109 8.192 8.192 7.904 0.288 18093 1291 1 2 . 1 1 110 110 ASP N N 110 121.148 121.148 119.300 1.848 18093 1292 1 2 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.474 -0.168 18093 1293 1 2 . 1 1 110 110 ASP C C 110 177.651 177.651 178.277 -0.626 18093 1294 1 2 . 1 1 110 110 ASP CA C 110 56.776 56.776 58.136 -1.360 18093 1295 1 2 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.939 0.158 18093 1296 1 2 . 1 1 110 110 ASP H H 110 8.427 8.427 8.602 -0.175 18093 1297 1 2 . 1 1 111 111 ARG N N 111 119.228 119.228 118.956 0.272 18093 1298 1 2 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.230 -0.234 18093 1299 1 2 . 1 1 111 111 ARG C C 111 177.786 177.786 179.037 -1.251 18093 1300 1 2 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.069 -0.127 18093 1301 1 2 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.943 0.253 18093 1302 1 2 . 1 1 111 111 ARG H H 111 7.850 7.850 8.334 -0.484 18093 1303 1 2 . 1 1 112 112 ILE N N 112 118.000 118.000 119.720 -1.720 18093 1304 1 2 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.099 -0.286 18093 1305 1 2 . 1 1 112 112 ILE C C 112 177.496 177.496 177.951 -0.455 18093 1306 1 2 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.220 2.592 18093 1307 1 2 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.881 0.846 18093 1308 1 2 . 1 1 112 112 ILE H H 112 7.764 7.764 7.725 0.039 18093 1309 1 2 . 1 1 113 113 PHE N N 113 118.367 118.367 122.112 -3.745 18093 1310 1 2 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.266 -0.011 18093 1311 1 2 . 1 1 113 113 PHE C C 113 177.218 177.218 177.376 -0.158 18093 1312 1 2 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.409 -0.976 18093 1313 1 2 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.188 -0.381 18093 1314 1 2 . 1 1 113 113 PHE H H 113 7.963 7.963 8.025 -0.062 18093 1315 1 2 . 1 1 114 114 LEU N N 114 118.921 118.921 117.166 1.755 18093 1316 1 2 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.926 0.071 18093 1317 1 2 . 1 1 114 114 LEU C C 114 178.297 178.297 178.449 -0.152 18093 1318 1 2 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.190 0.421 18093 1319 1 2 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.262 0.690 18093 1320 1 2 . 1 1 114 114 LEU H H 114 7.939 7.939 7.996 -0.057 18093 1321 1 2 . 1 1 115 115 TRP N N 115 117.464 117.464 119.463 -1.999 18093 1322 1 2 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.367 0.007 18093 1323 1 2 . 1 1 115 115 TRP C C 115 178.572 178.572 178.242 0.330 18093 1324 1 2 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.771 1.151 18093 1325 1 2 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.765 -1.258 18093 1326 1 2 . 1 1 115 115 TRP H H 115 7.969 7.969 7.604 0.365 18093 1327 1 2 . 1 1 116 116 MET N N 116 117.069 117.069 118.916 -1.847 18093 1328 1 2 . 1 1 116 116 MET HA H 116 4.065 4.065 4.216 -0.151 18093 1329 1 2 . 1 1 116 116 MET C C 116 177.425 177.425 178.188 -0.763 18093 1330 1 2 . 1 1 116 116 MET CA C 116 59.289 59.289 59.081 0.208 18093 1331 1 2 . 1 1 116 116 MET CB C 116 31.692 31.692 32.507 -0.815 18093 1332 1 2 . 1 1 116 116 MET H H 116 8.465 8.465 7.712 0.753 18093 1333 1 2 . 1 1 117 117 PHE N N 117 118.755 118.755 117.636 1.119 18093 1334 1 2 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.105 -0.006 18093 1335 1 2 . 1 1 117 117 PHE C C 117 177.965 177.965 178.281 -0.316 18093 1336 1 2 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.171 -0.463 18093 1337 1 2 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.253 0.932 18093 1338 1 2 . 1 1 117 117 PHE H H 117 8.418 8.418 7.848 0.570 18093 1339 1 2 . 1 1 118 118 ILE N N 118 119.133 119.133 115.092 4.041 18093 1340 1 2 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.901 -0.557 18093 1341 1 2 . 1 1 118 118 ILE C C 118 177.244 177.244 177.429 -0.185 18093 1342 1 2 . 1 1 118 118 ILE CA C 118 65.825 65.825 63.980 1.845 18093 1343 1 2 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.836 -0.288 18093 1344 1 2 . 1 1 118 118 ILE H H 118 8.266 8.266 7.660 0.606 18093 1345 1 2 . 1 1 119 119 ILE N N 119 118.846 118.846 121.584 -2.738 18093 1346 1 2 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.938 -0.366 18093 1347 1 2 . 1 1 119 119 ILE C C 119 177.523 177.523 177.460 0.063 18093 1348 1 2 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.221 0.668 18093 1349 1 2 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.240 -0.676 18093 1350 1 2 . 1 1 119 119 ILE H H 119 8.308 8.308 7.296 1.012 18093 1351 1 2 . 1 1 120 120 VAL N N 120 119.228 119.228 118.025 1.203 18093 1352 1 2 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.893 -0.385 18093 1353 1 2 . 1 1 120 120 VAL C C 120 177.651 177.651 177.196 0.455 18093 1354 1 2 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.369 2.232 18093 1355 1 2 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.805 0.601 18093 1356 1 2 . 1 1 120 120 VAL H H 120 8.399 8.399 8.004 0.395 18093 1357 1 2 . 1 1 121 121 CYS N N 121 117.151 117.151 118.863 -1.712 18093 1358 1 2 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.099 -0.196 18093 1359 1 2 . 1 1 121 121 CYS C C 121 177.719 177.719 176.449 1.270 18093 1360 1 2 . 1 1 121 121 CYS CA C 121 64.298 64.298 64.085 0.213 18093 1361 1 2 . 1 1 121 121 CYS CB C 121 26.677 26.677 27.110 -0.433 18093 1362 1 2 . 1 1 121 121 CYS H H 121 8.008 8.008 7.487 0.521 18093 1363 1 2 . 1 1 122 122 LEU N N 122 121.402 121.402 119.771 1.631 18093 1364 1 2 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.169 -0.186 18093 1365 1 2 . 1 1 122 122 LEU C C 122 178.282 178.282 179.228 -0.946 18093 1366 1 2 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.721 0.824 18093 1367 1 2 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.331 0.635 18093 1368 1 2 . 1 1 122 122 LEU H H 122 8.417 8.417 7.695 0.722 18093 1369 1 2 . 1 1 123 123 LEU N N 123 118.543 118.543 120.365 -1.822 18093 1370 1 2 . 1 1 123 123 LEU HA H 123 3.920 3.920 3.989 -0.069 18093 1371 1 2 . 1 1 123 123 LEU C C 123 179.028 179.028 178.674 0.354 18093 1372 1 2 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.539 -0.422 18093 1373 1 2 . 1 1 123 123 LEU CB C 123 42.056 42.056 40.945 1.111 18093 1374 1 2 . 1 1 123 123 LEU H H 123 8.590 8.590 7.732 0.858 18093 1375 1 2 . 1 1 124 124 GLY N N 124 104.896 104.896 105.610 -0.714 18093 1376 1 2 . 1 1 124 124 GLY C C 124 173.932 173.932 176.132 -2.200 18093 1377 1 2 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.461 -0.234 18093 1378 1 2 . 1 1 124 124 GLY H H 124 8.601 8.601 8.216 0.385 18093 1379 1 2 . 1 1 125 125 THR N N 125 115.403 115.403 119.028 -3.625 18093 1380 1 2 . 1 1 125 125 THR HA H 125 3.686 3.686 3.821 -0.135 18093 1381 1 2 . 1 1 125 125 THR C C 125 176.407 176.407 176.799 -0.392 18093 1382 1 2 . 1 1 125 125 THR CA C 125 67.565 67.565 66.717 0.848 18093 1383 1 2 . 1 1 125 125 THR CB C 125 68.143 68.143 68.582 -0.439 18093 1384 1 2 . 1 1 125 125 THR H H 125 7.734 7.734 7.487 0.247 18093 1385 1 2 . 1 1 126 126 VAL N N 126 119.056 119.056 121.381 -2.325 18093 1386 1 2 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.733 -0.194 18093 1387 1 2 . 1 1 126 126 VAL C C 126 177.628 177.628 177.828 -0.200 18093 1388 1 2 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.414 0.187 18093 1389 1 2 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.404 0.090 18093 1390 1 2 . 1 1 126 126 VAL H H 126 8.015 8.015 8.152 -0.137 18093 1391 1 2 . 1 1 127 127 GLY N N 127 104.644 104.644 107.626 -2.982 18093 1392 1 2 . 1 1 127 127 GLY C C 127 173.933 173.933 175.434 -1.501 18093 1393 1 2 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.165 0.116 18093 1394 1 2 . 1 1 127 127 GLY H H 127 8.248 8.248 8.466 -0.218 18093 1395 1 2 . 1 1 128 128 LEU N N 128 117.354 117.354 121.189 -3.835 18093 1396 1 2 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.358 -0.346 18093 1397 1 2 . 1 1 128 128 LEU C C 128 177.443 177.443 177.648 -0.205 18093 1398 1 2 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.788 -0.162 18093 1399 1 2 . 1 1 128 128 LEU CB C 128 42.260 42.260 42.117 0.143 18093 1400 1 2 . 1 1 128 128 LEU H H 128 7.568 7.568 7.530 0.038 18093 1401 1 2 . 1 1 129 129 PHE N N 129 113.971 113.971 117.192 -3.221 18093 1402 1 2 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.317 0.141 18093 1403 1 2 . 1 1 129 129 PHE C C 129 176.216 176.216 176.673 -0.457 18093 1404 1 2 . 1 1 129 129 PHE CA C 129 58.385 58.385 60.158 -1.773 18093 1405 1 2 . 1 1 129 129 PHE CB C 129 39.719 39.719 40.112 -0.393 18093 1406 1 2 . 1 1 129 129 PHE H H 129 7.639 7.639 7.629 0.010 18093 1407 1 2 . 1 1 130 130 LEU N N 130 117.752 117.752 120.018 -2.266 18093 1408 1 2 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.166 0.267 18093 1409 1 2 . 1 1 130 130 LEU CA C 130 54.156 54.156 54.396 -0.240 18093 1410 1 2 . 1 1 130 130 LEU H H 130 8.099 8.099 8.248 -0.149 18093 1411 1 2 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.873 -0.423 18093 1412 1 2 . 1 1 131 131 PRO CA C 131 63.899 63.899 62.130 1.769 18093 1413 1 2 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.438 -0.176 18093 1414 1 2 . 1 1 132 132 PRO C C 132 177.616 177.616 178.510 -0.894 18093 1415 1 2 . 1 1 132 132 PRO CA C 132 64.980 64.980 64.976 0.004 18093 1416 1 2 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.106 -0.481 18093 1417 1 2 . 1 1 133 133 TRP N N 133 115.508 115.508 121.926 -6.418 18093 1418 1 2 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.512 0.080 18093 1419 1 2 . 1 1 133 133 TRP C C 133 176.842 176.842 176.729 0.113 18093 1420 1 2 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.421 -2.138 18093 1421 1 2 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.063 -0.467 18093 1422 1 2 . 1 1 133 133 TRP H H 133 7.311 7.311 8.543 -1.232 18093 1423 1 2 . 1 1 134 134 LEU N N 134 119.570 119.570 114.054 5.516 18093 1424 1 2 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.422 -0.245 18093 1425 1 2 . 1 1 134 134 LEU C C 134 175.768 175.768 175.579 0.189 18093 1426 1 2 . 1 1 134 134 LEU CA C 134 55.621 55.621 53.668 1.953 18093 1427 1 2 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.076 1.572 18093 1428 1 2 . 1 1 134 134 LEU H H 134 7.453 7.453 7.625 -0.172 18093 1429 1 2 . 1 1 135 135 ALA N N 135 119.004 119.004 121.817 -2.813 18093 1430 1 2 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.588 -0.365 18093 1431 1 2 . 1 1 135 135 ALA C C 135 177.170 177.170 177.689 -0.519 18093 1432 1 2 . 1 1 135 135 ALA CA C 135 52.456 52.456 53.283 -0.827 18093 1433 1 2 . 1 1 135 135 ALA CB C 135 19.736 19.736 20.551 -0.815 18093 1434 1 2 . 1 1 135 135 ALA H H 135 7.541 7.541 8.183 -0.642 18093 1435 1 2 . 1 1 136 136 GLY N N 136 105.879 105.879 107.842 -1.963 18093 1436 1 2 . 1 1 136 136 GLY C C 136 173.042 173.042 175.189 -2.147 18093 1437 1 2 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.770 -0.077 18093 1438 1 2 . 1 1 136 136 GLY H H 136 7.846 7.846 7.812 0.034 18093 1439 1 3 . 1 1 5 5 GLU N N 5 119.627 119.627 117.245 2.382 18093 1440 1 3 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.409 -0.201 18093 1441 1 3 . 1 1 5 5 GLU C C 5 176.581 176.581 174.948 1.633 18093 1442 1 3 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.918 0.127 18093 1443 1 3 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.036 1.002 18093 1444 1 3 . 1 1 5 5 GLU H H 5 8.003 8.003 8.421 -0.418 18093 1445 1 3 . 1 1 6 6 LEU N N 6 121.267 121.267 122.169 -0.902 18093 1446 1 3 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.679 -0.254 18093 1447 1 3 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.292 2.342 18093 1448 1 3 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.675 -0.379 18093 1449 1 3 . 1 1 6 6 LEU H H 6 8.104 8.104 8.156 -0.052 18093 1450 1 3 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.588 -0.189 18093 1451 1 3 . 1 1 7 7 PRO C C 7 178.408 178.408 177.981 0.427 18093 1452 1 3 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.083 2.629 18093 1453 1 3 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.802 -0.885 18093 1454 1 3 . 1 1 8 8 LEU N N 8 121.835 121.835 121.094 0.741 18093 1455 1 3 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.149 -0.060 18093 1456 1 3 . 1 1 8 8 LEU C C 8 177.902 177.902 178.352 -0.450 18093 1457 1 3 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.711 0.394 18093 1458 1 3 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.195 0.412 18093 1459 1 3 . 1 1 8 8 LEU H H 8 8.162 8.162 8.585 -0.423 18093 1460 1 3 . 1 1 9 9 PHE N N 9 118.342 118.342 118.428 -0.086 18093 1461 1 3 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.141 0.048 18093 1462 1 3 . 1 1 9 9 PHE C C 9 177.596 177.596 176.753 0.843 18093 1463 1 3 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.025 0.089 18093 1464 1 3 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.350 0.377 18093 1465 1 3 . 1 1 9 9 PHE H H 9 8.318 8.318 8.277 0.041 18093 1466 1 3 . 1 1 10 10 TYR N N 10 117.584 117.584 118.736 -1.152 18093 1467 1 3 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.846 0.308 18093 1468 1 3 . 1 1 10 10 TYR C C 10 177.630 177.630 177.146 0.484 18093 1469 1 3 . 1 1 10 10 TYR CA C 10 61.036 61.036 60.348 0.688 18093 1470 1 3 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.090 0.570 18093 1471 1 3 . 1 1 10 10 TYR H H 10 8.105 8.105 8.464 -0.359 18093 1472 1 3 . 1 1 11 11 THR N N 11 115.563 115.563 116.436 -0.873 18093 1473 1 3 . 1 1 11 11 THR HA H 11 3.871 3.871 3.941 -0.070 18093 1474 1 3 . 1 1 11 11 THR C C 11 175.955 175.955 176.567 -0.612 18093 1475 1 3 . 1 1 11 11 THR CA C 11 67.290 67.290 66.771 0.519 18093 1476 1 3 . 1 1 11 11 THR CB C 11 68.201 68.201 68.475 -0.274 18093 1477 1 3 . 1 1 11 11 THR H H 11 7.915 7.915 7.765 0.150 18093 1478 1 3 . 1 1 12 12 ILE N N 12 119.727 119.727 120.101 -0.374 18093 1479 1 3 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.884 -0.185 18093 1480 1 3 . 1 1 12 12 ILE C C 12 175.773 175.773 177.502 -1.729 18093 1481 1 3 . 1 1 12 12 ILE CA C 12 64.699 64.699 62.752 1.947 18093 1482 1 3 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.794 1.302 18093 1483 1 3 . 1 1 12 12 ILE H H 12 8.186 8.186 7.887 0.299 18093 1484 1 3 . 1 1 13 13 ASN N N 13 114.190 114.190 118.543 -4.353 18093 1485 1 3 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.518 -0.096 18093 1486 1 3 . 1 1 13 13 ASN C C 13 174.786 174.786 176.572 -1.786 18093 1487 1 3 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.487 0.068 18093 1488 1 3 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.426 0.932 18093 1489 1 3 . 1 1 13 13 ASN H H 13 7.601 7.601 7.335 0.266 18093 1490 1 3 . 1 1 14 14 LEU N N 14 115.031 115.031 118.861 -3.830 18093 1491 1 3 . 1 1 14 14 LEU HA H 14 4.196 4.196 3.967 0.229 18093 1492 1 3 . 1 1 14 14 LEU C C 14 177.540 177.540 177.904 -0.364 18093 1493 1 3 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.383 0.024 18093 1494 1 3 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.196 -0.353 18093 1495 1 3 . 1 1 14 14 LEU H H 14 7.390 7.390 7.379 0.011 18093 1496 1 3 . 1 1 15 15 ILE N N 15 118.223 118.223 120.534 -2.311 18093 1497 1 3 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.790 -0.177 18093 1498 1 3 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.430 3.290 18093 1499 1 3 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.256 -0.644 18093 1500 1 3 . 1 1 15 15 ILE H H 15 8.123 8.123 7.442 0.681 18093 1501 1 3 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.296 -0.227 18093 1502 1 3 . 1 1 17 17 PRO C C 17 177.721 177.721 178.567 -0.846 18093 1503 1 3 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.477 1.284 18093 1504 1 3 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.723 0.019 18093 1505 1 3 . 1 1 18 18 CYS N N 18 113.538 113.538 117.534 -3.996 18093 1506 1 3 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.043 -0.035 18093 1507 1 3 . 1 1 18 18 CYS C C 18 177.683 177.683 176.859 0.824 18093 1508 1 3 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.074 1.426 18093 1509 1 3 . 1 1 18 18 CYS CB C 18 26.873 26.873 26.743 0.130 18093 1510 1 3 . 1 1 18 18 CYS H H 18 7.410 7.410 7.434 -0.024 18093 1511 1 3 . 1 1 19 19 LEU N N 19 122.545 122.545 118.934 3.611 18093 1512 1 3 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.107 -0.108 18093 1513 1 3 . 1 1 19 19 LEU C C 19 178.608 178.608 178.886 -0.278 18093 1514 1 3 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.385 1.036 18093 1515 1 3 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.313 0.531 18093 1516 1 3 . 1 1 19 19 LEU H H 19 8.635 8.635 7.396 1.239 18093 1517 1 3 . 1 1 20 20 LEU N N 20 119.404 119.404 120.256 -0.852 18093 1518 1 3 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.880 0.126 18093 1519 1 3 . 1 1 20 20 LEU C C 20 178.540 178.540 179.439 -0.899 18093 1520 1 3 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.111 0.688 18093 1521 1 3 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.661 0.338 18093 1522 1 3 . 1 1 20 20 LEU H H 20 8.392 8.392 7.472 0.920 18093 1523 1 3 . 1 1 21 21 ILE N N 21 117.335 117.335 114.191 3.144 18093 1524 1 3 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.756 -0.105 18093 1525 1 3 . 1 1 21 21 ILE C C 21 177.249 177.249 177.527 -0.278 18093 1526 1 3 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.505 0.756 18093 1527 1 3 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.251 0.709 18093 1528 1 3 . 1 1 21 21 ILE H H 21 8.403 8.403 8.479 -0.076 18093 1529 1 3 . 1 1 22 22 SER N N 22 116.385 116.385 118.236 -1.851 18093 1530 1 3 . 1 1 22 22 SER HA H 22 4.056 4.056 4.171 -0.115 18093 1531 1 3 . 1 1 22 22 SER C C 22 176.813 176.813 176.682 0.131 18093 1532 1 3 . 1 1 22 22 SER CA C 22 63.866 63.866 61.560 2.306 18093 1533 1 3 . 1 1 22 22 SER CB C 22 62.898 62.898 63.209 -0.311 18093 1534 1 3 . 1 1 22 22 SER H H 22 8.271 8.271 7.509 0.762 18093 1535 1 3 . 1 1 23 23 CYS N N 23 119.001 119.001 120.493 -1.492 18093 1536 1 3 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.025 -0.035 18093 1537 1 3 . 1 1 23 23 CYS C C 23 177.594 177.594 176.914 0.680 18093 1538 1 3 . 1 1 23 23 CYS CA C 23 64.429 64.429 63.691 0.738 18093 1539 1 3 . 1 1 23 23 CYS CB C 23 26.940 26.940 27.546 -0.606 18093 1540 1 3 . 1 1 23 23 CYS H H 23 8.161 8.161 8.679 -0.518 18093 1541 1 3 . 1 1 24 24 LEU N N 24 117.814 117.814 120.903 -3.089 18093 1542 1 3 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.869 0.108 18093 1543 1 3 . 1 1 24 24 LEU C C 24 177.944 177.944 178.238 -0.294 18093 1544 1 3 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.898 -0.611 18093 1545 1 3 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.913 -0.010 18093 1546 1 3 . 1 1 24 24 LEU H H 24 8.106 8.106 7.693 0.413 18093 1547 1 3 . 1 1 25 25 THR N N 25 115.670 115.670 115.229 0.441 18093 1548 1 3 . 1 1 25 25 THR HA H 25 3.687 3.687 3.962 -0.275 18093 1549 1 3 . 1 1 25 25 THR C C 25 175.845 175.845 176.700 -0.855 18093 1550 1 3 . 1 1 25 25 THR CA C 25 68.306 68.306 67.300 1.006 18093 1551 1 3 . 1 1 25 25 THR H H 25 7.924 7.924 7.521 0.403 18093 1552 1 3 . 1 1 26 26 VAL N N 26 118.809 118.809 120.796 -1.987 18093 1553 1 3 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.735 -0.220 18093 1554 1 3 . 1 1 26 26 VAL C C 26 177.530 177.530 177.584 -0.054 18093 1555 1 3 . 1 1 26 26 VAL CA C 26 67.281 67.281 65.577 1.704 18093 1556 1 3 . 1 1 26 26 VAL CB C 26 31.724 31.724 30.763 0.961 18093 1557 1 3 . 1 1 26 26 VAL H H 26 7.764 7.764 7.383 0.381 18093 1558 1 3 . 1 1 27 27 LEU N N 27 117.958 117.958 121.558 -3.600 18093 1559 1 3 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.042 -0.006 18093 1560 1 3 . 1 1 27 27 LEU C C 27 178.163 178.163 178.975 -0.812 18093 1561 1 3 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.353 0.156 18093 1562 1 3 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.936 0.983 18093 1563 1 3 . 1 1 27 27 LEU H H 27 7.912 7.912 8.004 -0.092 18093 1564 1 3 . 1 1 28 28 VAL N N 28 114.472 114.472 117.745 -3.273 18093 1565 1 3 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.789 -0.254 18093 1566 1 3 . 1 1 28 28 VAL C C 28 176.871 176.871 176.871 0.000 18093 1567 1 3 . 1 1 28 28 VAL CA C 28 65.977 65.977 65.839 0.138 18093 1568 1 3 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.950 -0.016 18093 1569 1 3 . 1 1 28 28 VAL H H 28 7.892 7.892 7.656 0.236 18093 1570 1 3 . 1 1 29 29 PHE N N 29 115.206 115.206 115.839 -0.633 18093 1571 1 3 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.307 -0.104 18093 1572 1 3 . 1 1 29 29 PHE C C 29 176.614 176.614 176.178 0.436 18093 1573 1 3 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.389 0.575 18093 1574 1 3 . 1 1 29 29 PHE CB C 29 39.752 39.752 39.192 0.560 18093 1575 1 3 . 1 1 29 29 PHE H H 29 7.748 7.748 7.674 0.074 18093 1576 1 3 . 1 1 30 30 TYR N N 30 115.975 115.975 118.980 -3.005 18093 1577 1 3 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.343 -0.021 18093 1578 1 3 . 1 1 30 30 TYR C C 30 175.553 175.553 176.101 -0.548 18093 1579 1 3 . 1 1 30 30 TYR CA C 30 59.598 59.598 60.136 -0.538 18093 1580 1 3 . 1 1 30 30 TYR CB C 30 39.763 39.763 40.626 -0.863 18093 1581 1 3 . 1 1 30 30 TYR H H 30 7.985 7.985 7.684 0.301 18093 1582 1 3 . 1 1 31 31 LEU N N 31 120.780 120.780 121.637 -0.857 18093 1583 1 3 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.837 -0.410 18093 1584 1 3 . 1 1 31 31 LEU CA C 31 54.665 54.665 51.992 2.673 18093 1585 1 3 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.522 -1.134 18093 1586 1 3 . 1 1 31 31 LEU H H 31 7.643 7.643 7.753 -0.110 18093 1587 1 3 . 1 1 34 34 GLU C C 34 176.271 176.271 175.869 0.402 18093 1588 1 3 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.474 2.116 18093 1589 1 3 . 1 1 35 35 CYS N N 35 116.430 116.430 117.862 -1.432 18093 1590 1 3 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.602 -0.235 18093 1591 1 3 . 1 1 35 35 CYS C C 35 175.198 175.198 176.113 -0.915 18093 1592 1 3 . 1 1 35 35 CYS CA C 35 60.293 60.293 59.067 1.226 18093 1593 1 3 . 1 1 35 35 CYS CB C 35 28.130 28.130 28.417 -0.287 18093 1594 1 3 . 1 1 35 35 CYS H H 35 7.970 7.970 8.585 -0.615 18093 1595 1 3 . 1 1 36 36 GLY N N 36 108.315 108.315 109.138 -0.823 18093 1596 1 3 . 1 1 36 36 GLY C C 36 174.610 174.610 175.530 -0.920 18093 1597 1 3 . 1 1 36 36 GLY CA C 36 46.004 46.004 45.794 0.210 18093 1598 1 3 . 1 1 36 36 GLY H H 36 8.120 8.120 8.260 -0.140 18093 1599 1 3 . 1 1 37 37 GLU N N 37 121.347 121.347 120.611 0.736 18093 1600 1 3 . 1 1 37 37 GLU HA H 37 4.047 4.047 3.995 0.052 18093 1601 1 3 . 1 1 37 37 GLU C C 37 177.338 177.338 178.366 -1.028 18093 1602 1 3 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.463 -0.956 18093 1603 1 3 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.311 0.259 18093 1604 1 3 . 1 1 37 37 GLU H H 37 8.423 8.423 8.733 -0.310 18093 1605 1 3 . 1 1 38 38 LYS N N 38 123.788 123.788 119.942 3.846 18093 1606 1 3 . 1 1 38 38 LYS HA H 38 4.196 4.196 3.943 0.253 18093 1607 1 3 . 1 1 38 38 LYS C C 38 177.976 177.976 178.424 -0.448 18093 1608 1 3 . 1 1 38 38 LYS CA C 38 58.273 58.273 59.873 -1.600 18093 1609 1 3 . 1 1 38 38 LYS CB C 38 31.649 31.649 32.117 -0.468 18093 1610 1 3 . 1 1 38 38 LYS H H 38 8.211 8.211 8.069 0.142 18093 1611 1 3 . 1 1 39 39 ILE N N 39 115.675 115.675 118.444 -2.769 18093 1612 1 3 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.818 -0.210 18093 1613 1 3 . 1 1 39 39 ILE C C 39 177.204 177.204 177.855 -0.651 18093 1614 1 3 . 1 1 39 39 ILE CA C 39 65.501 65.501 64.619 0.882 18093 1615 1 3 . 1 1 39 39 ILE H H 39 7.933 7.933 7.998 -0.065 18093 1616 1 3 . 1 1 40 40 THR N N 40 117.411 117.411 117.122 0.289 18093 1617 1 3 . 1 1 40 40 THR HA H 40 3.844 3.844 3.898 -0.054 18093 1618 1 3 . 1 1 40 40 THR C C 40 175.983 175.983 176.637 -0.654 18093 1619 1 3 . 1 1 40 40 THR CA C 40 67.360 67.360 67.254 0.106 18093 1620 1 3 . 1 1 40 40 THR H H 40 8.362 8.362 7.714 0.648 18093 1621 1 3 . 1 1 41 41 LEU N N 41 123.059 123.059 122.405 0.654 18093 1622 1 3 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.151 -0.135 18093 1623 1 3 . 1 1 41 41 LEU C C 41 178.914 178.914 178.554 0.360 18093 1624 1 3 . 1 1 41 41 LEU CA C 41 58.366 58.366 58.558 -0.192 18093 1625 1 3 . 1 1 41 41 LEU CB C 41 42.050 42.050 42.221 -0.171 18093 1626 1 3 . 1 1 41 41 LEU H H 41 8.282 8.282 8.021 0.261 18093 1627 1 3 . 1 1 42 42 CYS N N 42 118.762 118.762 117.949 0.813 18093 1628 1 3 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.022 -0.086 18093 1629 1 3 . 1 1 42 42 CYS C C 42 176.607 176.607 176.827 -0.220 18093 1630 1 3 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.582 0.735 18093 1631 1 3 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.545 -0.626 18093 1632 1 3 . 1 1 42 42 CYS H H 42 8.195 8.195 7.645 0.550 18093 1633 1 3 . 1 1 43 43 ILE N N 43 117.589 117.589 119.769 -2.180 18093 1634 1 3 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.737 -0.130 18093 1635 1 3 . 1 1 43 43 ILE C C 43 177.323 177.323 177.418 -0.095 18093 1636 1 3 . 1 1 43 43 ILE CA C 43 65.249 65.249 65.116 0.133 18093 1637 1 3 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.827 0.211 18093 1638 1 3 . 1 1 43 43 ILE H H 43 8.428 8.428 7.735 0.693 18093 1639 1 3 . 1 1 44 44 SER N N 44 115.950 115.950 117.322 -1.372 18093 1640 1 3 . 1 1 44 44 SER HA H 44 4.012 4.012 4.175 -0.163 18093 1641 1 3 . 1 1 44 44 SER C C 44 176.965 176.965 176.648 0.317 18093 1642 1 3 . 1 1 44 44 SER CA C 44 63.575 63.575 61.727 1.848 18093 1643 1 3 . 1 1 44 44 SER H H 44 7.984 7.984 7.379 0.605 18093 1644 1 3 . 1 1 45 45 VAL N N 45 123.544 123.544 119.971 3.573 18093 1645 1 3 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.872 -0.324 18093 1646 1 3 . 1 1 45 45 VAL C C 45 177.139 177.139 177.795 -0.656 18093 1647 1 3 . 1 1 45 45 VAL CA C 45 67.233 67.233 64.844 2.389 18093 1648 1 3 . 1 1 45 45 VAL CB C 45 31.642 31.642 30.521 1.121 18093 1649 1 3 . 1 1 45 45 VAL H H 45 8.280 8.280 7.743 0.537 18093 1650 1 3 . 1 1 46 46 LEU N N 46 119.883 119.883 121.093 -1.210 18093 1651 1 3 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.011 -0.068 18093 1652 1 3 . 1 1 46 46 LEU C C 46 180.125 180.125 178.472 1.653 18093 1653 1 3 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.885 0.715 18093 1654 1 3 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.550 0.462 18093 1655 1 3 . 1 1 46 46 LEU H H 46 8.117 8.117 7.383 0.734 18093 1656 1 3 . 1 1 47 47 LEU N N 47 120.193 120.193 119.014 1.179 18093 1657 1 3 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.952 0.052 18093 1658 1 3 . 1 1 47 47 LEU C C 47 178.370 178.370 179.230 -0.860 18093 1659 1 3 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.023 0.403 18093 1660 1 3 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.849 0.206 18093 1661 1 3 . 1 1 47 47 LEU H H 47 8.933 8.933 8.389 0.544 18093 1662 1 3 . 1 1 48 48 SER N N 48 115.861 115.861 115.572 0.289 18093 1663 1 3 . 1 1 48 48 SER HA H 48 4.013 4.013 4.151 -0.138 18093 1664 1 3 . 1 1 48 48 SER C C 48 175.642 175.642 177.303 -1.661 18093 1665 1 3 . 1 1 48 48 SER CA C 48 63.571 63.571 62.290 1.281 18093 1666 1 3 . 1 1 48 48 SER CB C 48 62.879 62.879 62.992 -0.113 18093 1667 1 3 . 1 1 48 48 SER H H 48 7.996 7.996 8.559 -0.562 18093 1668 1 3 . 1 1 49 49 LEU N N 49 120.673 120.673 121.369 -0.696 18093 1669 1 3 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.386 -0.351 18093 1670 1 3 . 1 1 49 49 LEU C C 49 178.229 178.229 178.619 -0.390 18093 1671 1 3 . 1 1 49 49 LEU CA C 49 58.283 58.283 57.194 1.089 18093 1672 1 3 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.109 -0.163 18093 1673 1 3 . 1 1 49 49 LEU H H 49 8.352 8.352 8.115 0.237 18093 1674 1 3 . 1 1 50 50 THR N N 50 115.582 115.582 115.670 -0.088 18093 1675 1 3 . 1 1 50 50 THR HA H 50 3.672 3.672 4.072 -0.400 18093 1676 1 3 . 1 1 50 50 THR C C 50 175.877 175.877 176.375 -0.498 18093 1677 1 3 . 1 1 50 50 THR CA C 50 68.628 68.628 66.782 1.846 18093 1678 1 3 . 1 1 50 50 THR H H 50 7.937 7.937 7.656 0.281 18093 1679 1 3 . 1 1 51 51 VAL N N 51 119.774 119.774 120.896 -1.122 18093 1680 1 3 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.664 -0.166 18093 1681 1 3 . 1 1 51 51 VAL C C 51 177.162 177.162 177.347 -0.185 18093 1682 1 3 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.321 1.264 18093 1683 1 3 . 1 1 51 51 VAL CB C 51 31.521 31.521 30.914 0.607 18093 1684 1 3 . 1 1 51 51 VAL H H 51 8.115 8.115 8.505 -0.390 18093 1685 1 3 . 1 1 52 52 PHE N N 52 118.808 118.808 120.178 -1.370 18093 1686 1 3 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.338 -0.216 18093 1687 1 3 . 1 1 52 52 PHE C C 52 176.697 176.697 176.290 0.407 18093 1688 1 3 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.071 1.700 18093 1689 1 3 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.155 0.107 18093 1690 1 3 . 1 1 52 52 PHE H H 52 8.256 8.256 7.580 0.676 18093 1691 1 3 . 1 1 53 53 LEU N N 53 117.267 117.267 121.548 -4.281 18093 1692 1 3 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.442 0.451 18093 1693 1 3 . 1 1 53 53 LEU C C 53 179.319 179.319 177.943 1.376 18093 1694 1 3 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.586 0.399 18093 1695 1 3 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.343 0.484 18093 1696 1 3 . 1 1 53 53 LEU H H 53 8.443 8.443 7.312 1.131 18093 1697 1 3 . 1 1 54 54 LEU N N 54 119.762 119.762 118.779 0.983 18093 1698 1 3 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.913 0.141 18093 1699 1 3 . 1 1 54 54 LEU C C 54 178.827 178.827 179.067 -0.240 18093 1700 1 3 . 1 1 54 54 LEU CA C 54 58.105 58.105 57.722 0.383 18093 1701 1 3 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.895 0.052 18093 1702 1 3 . 1 1 54 54 LEU H H 54 8.205 8.205 8.126 0.079 18093 1703 1 3 . 1 1 55 55 LEU N N 55 118.585 118.585 117.617 0.968 18093 1704 1 3 . 1 1 55 55 LEU HA H 55 4.077 4.077 4.003 0.074 18093 1705 1 3 . 1 1 55 55 LEU C C 55 178.909 178.909 178.841 0.068 18093 1706 1 3 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.739 0.369 18093 1707 1 3 . 1 1 55 55 LEU CB C 55 41.979 41.979 40.984 0.995 18093 1708 1 3 . 1 1 55 55 LEU H H 55 8.179 8.179 7.480 0.699 18093 1709 1 3 . 1 1 56 56 ILE N N 56 116.079 116.079 116.280 -0.201 18093 1710 1 3 . 1 1 56 56 ILE HA H 56 3.729 3.729 3.980 -0.251 18093 1711 1 3 . 1 1 56 56 ILE C C 56 176.988 176.988 177.910 -0.922 18093 1712 1 3 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.504 0.753 18093 1713 1 3 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.771 0.646 18093 1714 1 3 . 1 1 56 56 ILE H H 56 8.040 8.040 7.432 0.608 18093 1715 1 3 . 1 1 57 57 THR N N 57 110.105 110.105 111.529 -1.424 18093 1716 1 3 . 1 1 57 57 THR HA H 57 4.015 4.015 4.122 -0.107 18093 1717 1 3 . 1 1 57 57 THR C C 57 175.435 175.435 176.068 -0.633 18093 1718 1 3 . 1 1 57 57 THR CA C 57 65.067 65.067 65.264 -0.197 18093 1719 1 3 . 1 1 57 57 THR CB C 57 69.179 69.179 68.938 0.241 18093 1720 1 3 . 1 1 57 57 THR H H 57 7.655 7.655 7.720 -0.065 18093 1721 1 3 . 1 1 58 58 GLU N N 58 117.313 117.313 120.901 -3.588 18093 1722 1 3 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.332 0.001 18093 1723 1 3 . 1 1 58 58 GLU C C 58 176.940 176.940 178.112 -1.172 18093 1724 1 3 . 1 1 58 58 GLU CA C 58 57.068 57.068 57.919 -0.851 18093 1725 1 3 . 1 1 58 58 GLU CB C 58 29.396 29.396 29.973 -0.577 18093 1726 1 3 . 1 1 58 58 GLU H H 58 7.521 7.521 7.881 -0.360 18093 1727 1 3 . 1 1 59 59 ILE N N 59 114.870 114.870 114.106 0.764 18093 1728 1 3 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.063 0.026 18093 1729 1 3 . 1 1 59 59 ILE C C 59 175.456 175.456 176.183 -0.727 18093 1730 1 3 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.255 0.178 18093 1731 1 3 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.810 -0.153 18093 1732 1 3 . 1 1 59 59 ILE H H 59 7.579 7.579 7.207 0.372 18093 1733 1 3 . 1 1 60 60 ILE N N 60 119.354 119.354 117.548 1.806 18093 1734 1 3 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.893 0.411 18093 1735 1 3 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.460 -1.843 18093 1736 1 3 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.524 2.338 18093 1737 1 3 . 1 1 60 60 ILE H H 60 7.629 7.629 7.646 -0.017 18093 1738 1 3 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.325 0.075 18093 1739 1 3 . 1 1 61 61 PRO C C 61 177.144 177.144 177.471 -0.327 18093 1740 1 3 . 1 1 61 61 PRO CA C 61 63.808 63.808 63.793 0.015 18093 1741 1 3 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.250 -0.368 18093 1742 1 3 . 1 1 62 62 SER N N 62 114.474 114.474 114.379 0.095 18093 1743 1 3 . 1 1 62 62 SER HA H 62 4.434 4.434 4.493 -0.059 18093 1744 1 3 . 1 1 62 62 SER C C 62 175.161 175.161 174.020 1.141 18093 1745 1 3 . 1 1 62 62 SER CA C 62 59.047 59.047 58.254 0.793 18093 1746 1 3 . 1 1 62 62 SER CB C 62 63.704 63.704 61.391 2.313 18093 1747 1 3 . 1 1 62 62 SER H H 62 8.186 8.186 8.080 0.106 18093 1748 1 3 . 1 1 63 63 THR N N 63 113.573 113.573 117.566 -3.993 18093 1749 1 3 . 1 1 63 63 THR HA H 63 4.319 4.319 4.566 -0.247 18093 1750 1 3 . 1 1 63 63 THR C C 63 174.834 174.834 174.911 -0.077 18093 1751 1 3 . 1 1 63 63 THR CA C 63 62.377 62.377 62.498 -0.121 18093 1752 1 3 . 1 1 63 63 THR CB C 63 69.422 69.422 69.043 0.379 18093 1753 1 3 . 1 1 63 63 THR H H 63 7.963 7.963 8.102 -0.139 18093 1754 1 3 . 1 1 64 64 SER N N 64 116.598 116.598 117.020 -0.422 18093 1755 1 3 . 1 1 64 64 SER HA H 64 4.428 4.428 4.557 -0.129 18093 1756 1 3 . 1 1 64 64 SER C C 64 174.618 174.618 174.797 -0.179 18093 1757 1 3 . 1 1 64 64 SER CA C 64 59.045 59.045 58.690 0.355 18093 1758 1 3 . 1 1 64 64 SER CB C 64 63.700 63.700 63.858 -0.158 18093 1759 1 3 . 1 1 64 64 SER H H 64 8.052 8.052 8.420 -0.368 18093 1760 1 3 . 1 1 65 65 SER N N 65 116.673 116.673 113.351 3.322 18093 1761 1 3 . 1 1 65 65 SER HA H 65 4.432 4.432 4.110 0.322 18093 1762 1 3 . 1 1 65 65 SER C C 65 174.335 174.335 174.097 0.238 18093 1763 1 3 . 1 1 65 65 SER CA C 65 58.927 58.927 59.745 -0.818 18093 1764 1 3 . 1 1 65 65 SER CB C 65 63.621 63.621 62.465 1.156 18093 1765 1 3 . 1 1 65 65 SER H H 65 8.114 8.114 8.611 -0.497 18093 1766 1 3 . 1 1 66 66 VAL N N 66 119.054 119.054 114.283 4.771 18093 1767 1 3 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.246 -0.076 18093 1768 1 3 . 1 1 66 66 VAL C C 66 175.278 175.278 175.149 0.129 18093 1769 1 3 . 1 1 66 66 VAL CA C 66 62.062 62.062 62.452 -0.390 18093 1770 1 3 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.720 -0.091 18093 1771 1 3 . 1 1 66 66 VAL H H 66 7.740 7.740 7.932 -0.192 18093 1772 1 3 . 1 1 67 67 SER N N 67 118.882 118.882 116.080 2.802 18093 1773 1 3 . 1 1 67 67 SER HA H 67 4.704 4.704 4.677 0.027 18093 1774 1 3 . 1 1 67 67 SER CA C 67 56.715 56.715 56.116 0.599 18093 1775 1 3 . 1 1 67 67 SER CB C 67 63.624 63.624 64.367 -0.743 18093 1776 1 3 . 1 1 67 67 SER H H 67 8.060 8.060 7.617 0.443 18093 1777 1 3 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.622 -0.222 18093 1778 1 3 . 1 1 68 68 PRO C C 68 176.925 176.925 176.506 0.419 18093 1779 1 3 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.678 1.070 18093 1780 1 3 . 1 1 68 68 PRO CB C 68 32.005 32.005 32.362 -0.357 18093 1781 1 3 . 1 1 69 69 SER N N 69 114.930 114.930 114.293 0.637 18093 1782 1 3 . 1 1 69 69 SER HA H 69 4.422 4.422 4.606 -0.184 18093 1783 1 3 . 1 1 69 69 SER C C 69 175.617 175.617 175.633 -0.016 18093 1784 1 3 . 1 1 69 69 SER CA C 69 58.697 58.697 57.218 1.479 18093 1785 1 3 . 1 1 69 69 SER CB C 69 63.804 63.804 64.206 -0.402 18093 1786 1 3 . 1 1 69 69 SER H H 69 8.205 8.205 8.236 -0.031 18093 1787 1 3 . 1 1 70 70 ILE N N 70 120.840 120.840 126.906 -6.066 18093 1788 1 3 . 1 1 70 70 ILE HA H 70 3.992 3.992 3.952 0.040 18093 1789 1 3 . 1 1 70 70 ILE C C 70 177.524 177.524 177.066 0.458 18093 1790 1 3 . 1 1 70 70 ILE CA C 70 64.335 64.335 62.297 2.038 18093 1791 1 3 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.054 -0.594 18093 1792 1 3 . 1 1 70 70 ILE H H 70 8.283 8.283 9.002 -0.719 18093 1793 1 3 . 1 1 71 71 GLY N N 71 107.823 107.823 108.006 -0.183 18093 1794 1 3 . 1 1 71 71 GLY C C 71 175.296 175.296 176.443 -1.147 18093 1795 1 3 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.186 0.269 18093 1796 1 3 . 1 1 71 71 GLY H H 71 8.557 8.557 8.584 -0.027 18093 1797 1 3 . 1 1 72 72 GLU N N 72 120.835 120.835 120.722 0.113 18093 1798 1 3 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.246 -0.399 18093 1799 1 3 . 1 1 72 72 GLU C C 72 178.198 178.198 178.369 -0.171 18093 1800 1 3 . 1 1 72 72 GLU CA C 72 60.117 60.117 57.955 2.162 18093 1801 1 3 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.134 0.259 18093 1802 1 3 . 1 1 72 72 GLU H H 72 7.922 7.922 7.809 0.113 18093 1803 1 3 . 1 1 73 73 TYR N N 73 117.375 117.375 122.649 -5.274 18093 1804 1 3 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.284 -0.122 18093 1805 1 3 . 1 1 73 73 TYR C C 73 179.912 179.912 177.419 2.493 18093 1806 1 3 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.147 1.008 18093 1807 1 3 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.532 0.234 18093 1808 1 3 . 1 1 73 73 TYR H H 73 8.062 8.062 7.870 0.192 18093 1809 1 3 . 1 1 74 74 LEU N N 74 121.493 121.493 119.214 2.279 18093 1810 1 3 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.624 0.425 18093 1811 1 3 . 1 1 74 74 LEU C C 74 178.063 178.063 178.965 -0.902 18093 1812 1 3 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.597 0.898 18093 1813 1 3 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.742 0.105 18093 1814 1 3 . 1 1 74 74 LEU H H 74 8.552 8.552 8.653 -0.101 18093 1815 1 3 . 1 1 75 75 LEU N N 75 120.375 120.375 120.228 0.147 18093 1816 1 3 . 1 1 75 75 LEU HA H 75 4.040 4.040 3.986 0.054 18093 1817 1 3 . 1 1 75 75 LEU C C 75 178.515 178.515 178.358 0.157 18093 1818 1 3 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.031 0.607 18093 1819 1 3 . 1 1 75 75 LEU CB C 75 42.039 42.039 42.024 0.015 18093 1820 1 3 . 1 1 75 75 LEU H H 75 8.276 8.276 7.454 0.822 18093 1821 1 3 . 1 1 76 76 PHE N N 76 116.626 116.626 118.640 -2.014 18093 1822 1 3 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.081 -0.002 18093 1823 1 3 . 1 1 76 76 PHE C C 76 177.399 177.399 177.995 -0.596 18093 1824 1 3 . 1 1 76 76 PHE CA C 76 61.734 61.734 62.209 -0.475 18093 1825 1 3 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.501 0.240 18093 1826 1 3 . 1 1 76 76 PHE H H 76 8.454 8.454 8.226 0.228 18093 1827 1 3 . 1 1 77 77 THR N N 77 116.080 116.080 115.170 0.910 18093 1828 1 3 . 1 1 77 77 THR HA H 77 3.687 3.687 3.918 -0.231 18093 1829 1 3 . 1 1 77 77 THR C C 77 176.018 176.018 176.536 -0.518 18093 1830 1 3 . 1 1 77 77 THR CA C 77 68.640 68.640 67.072 1.568 18093 1831 1 3 . 1 1 77 77 THR H H 77 8.224 8.224 8.532 -0.308 18093 1832 1 3 . 1 1 78 78 MET N N 78 119.394 119.394 120.767 -1.373 18093 1833 1 3 . 1 1 78 78 MET HA H 78 4.129 4.129 4.123 0.006 18093 1834 1 3 . 1 1 78 78 MET C C 78 179.608 179.608 178.302 1.306 18093 1835 1 3 . 1 1 78 78 MET CA C 78 58.831 58.831 59.676 -0.845 18093 1836 1 3 . 1 1 78 78 MET CB C 78 31.590 31.590 32.593 -1.003 18093 1837 1 3 . 1 1 78 78 MET H H 78 8.372 8.372 7.442 0.930 18093 1838 1 3 . 1 1 79 79 ILE N N 79 121.819 121.819 118.674 3.145 18093 1839 1 3 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.780 -0.230 18093 1840 1 3 . 1 1 79 79 ILE C C 79 176.426 176.426 178.137 -1.711 18093 1841 1 3 . 1 1 79 79 ILE CA C 79 65.876 65.876 63.263 2.613 18093 1842 1 3 . 1 1 79 79 ILE CB C 79 37.673 37.673 36.318 1.355 18093 1843 1 3 . 1 1 79 79 ILE H H 79 8.391 8.391 8.440 -0.049 18093 1844 1 3 . 1 1 80 80 PHE N N 80 119.916 119.916 121.527 -1.611 18093 1845 1 3 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.092 -0.039 18093 1846 1 3 . 1 1 80 80 PHE C C 80 178.568 178.568 177.377 1.191 18093 1847 1 3 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.588 -0.281 18093 1848 1 3 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.363 -0.589 18093 1849 1 3 . 1 1 80 80 PHE H H 80 8.479 8.479 7.994 0.485 18093 1850 1 3 . 1 1 81 81 VAL N N 81 120.191 120.191 115.655 4.536 18093 1851 1 3 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.671 -0.218 18093 1852 1 3 . 1 1 81 81 VAL C C 81 178.225 178.225 177.468 0.757 18093 1853 1 3 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.656 0.752 18093 1854 1 3 . 1 1 81 81 VAL CB C 81 31.556 31.556 31.540 0.016 18093 1855 1 3 . 1 1 81 81 VAL H H 81 8.928 8.928 8.173 0.755 18093 1856 1 3 . 1 1 82 82 THR N N 82 115.930 115.930 118.033 -2.103 18093 1857 1 3 . 1 1 82 82 THR HA H 82 3.636 3.636 3.898 -0.262 18093 1858 1 3 . 1 1 82 82 THR C C 82 176.420 176.420 176.442 -0.022 18093 1859 1 3 . 1 1 82 82 THR CA C 82 68.570 68.570 67.540 1.030 18093 1860 1 3 . 1 1 82 82 THR CB C 82 68.202 68.202 68.884 -0.682 18093 1861 1 3 . 1 1 82 82 THR H H 82 7.969 7.969 7.509 0.460 18093 1862 1 3 . 1 1 83 83 LEU N N 83 119.780 119.780 119.548 0.232 18093 1863 1 3 . 1 1 83 83 LEU HA H 83 3.847 3.847 4.031 -0.184 18093 1864 1 3 . 1 1 83 83 LEU C C 83 178.214 178.214 178.428 -0.214 18093 1865 1 3 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.947 0.290 18093 1866 1 3 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.115 0.676 18093 1867 1 3 . 1 1 83 83 LEU H H 83 8.483 8.483 7.343 1.140 18093 1868 1 3 . 1 1 84 84 SER N N 84 114.559 114.559 116.654 -2.095 18093 1869 1 3 . 1 1 84 84 SER HA H 84 4.099 4.099 4.187 -0.088 18093 1870 1 3 . 1 1 84 84 SER C C 84 176.799 176.799 176.991 -0.192 18093 1871 1 3 . 1 1 84 84 SER CA C 84 63.609 63.609 62.145 1.464 18093 1872 1 3 . 1 1 84 84 SER CB C 84 63.110 63.110 62.916 0.194 18093 1873 1 3 . 1 1 84 84 SER H H 84 8.023 8.023 7.517 0.506 18093 1874 1 3 . 1 1 85 85 ILE N N 85 123.962 123.962 121.162 2.800 18093 1875 1 3 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.824 -0.220 18093 1876 1 3 . 1 1 85 85 ILE C C 85 177.487 177.487 178.158 -0.671 18093 1877 1 3 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.168 0.591 18093 1878 1 3 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.862 0.025 18093 1879 1 3 . 1 1 85 85 ILE H H 85 8.054 8.054 8.197 -0.143 18093 1880 1 3 . 1 1 86 86 VAL N N 86 118.744 118.744 120.828 -2.084 18093 1881 1 3 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.810 -0.291 18093 1882 1 3 . 1 1 86 86 VAL C C 86 177.557 177.557 177.931 -0.374 18093 1883 1 3 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.466 1.069 18093 1884 1 3 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.668 -0.202 18093 1885 1 3 . 1 1 86 86 VAL H H 86 8.158 8.158 7.313 0.845 18093 1886 1 3 . 1 1 87 87 ILE N N 87 117.206 117.206 119.744 -2.538 18093 1887 1 3 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.777 -0.173 18093 1888 1 3 . 1 1 87 87 ILE C C 87 177.283 177.283 178.620 -1.337 18093 1889 1 3 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.862 1.813 18093 1890 1 3 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.587 1.002 18093 1891 1 3 . 1 1 87 87 ILE H H 87 8.459 8.459 8.609 -0.150 18093 1892 1 3 . 1 1 88 88 THR N N 88 116.158 116.158 116.890 -0.732 18093 1893 1 3 . 1 1 88 88 THR HA H 88 3.672 3.672 4.266 -0.594 18093 1894 1 3 . 1 1 88 88 THR C C 88 175.485 175.485 176.958 -1.473 18093 1895 1 3 . 1 1 88 88 THR CA C 88 68.549 68.549 67.438 1.111 18093 1896 1 3 . 1 1 88 88 THR CB C 88 68.127 68.127 68.897 -0.770 18093 1897 1 3 . 1 1 88 88 THR H H 88 7.776 7.776 8.540 -0.764 18093 1898 1 3 . 1 1 89 89 VAL N N 89 117.985 117.985 121.257 -3.272 18093 1899 1 3 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.820 -0.277 18093 1900 1 3 . 1 1 89 89 VAL C C 89 177.393 177.393 177.758 -0.365 18093 1901 1 3 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.431 1.159 18093 1902 1 3 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.722 0.056 18093 1903 1 3 . 1 1 89 89 VAL H H 89 8.206 8.206 7.685 0.521 18093 1904 1 3 . 1 1 90 90 PHE N N 90 116.709 116.709 119.911 -3.202 18093 1905 1 3 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.202 0.176 18093 1906 1 3 . 1 1 90 90 PHE C C 90 177.305 177.305 177.491 -0.186 18093 1907 1 3 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.535 -0.416 18093 1908 1 3 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.550 0.835 18093 1909 1 3 . 1 1 90 90 PHE H H 90 7.956 7.956 7.779 0.177 18093 1910 1 3 . 1 1 91 91 VAL N N 91 116.565 116.565 119.447 -2.882 18093 1911 1 3 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.655 0.180 18093 1912 1 3 . 1 1 91 91 VAL C C 91 176.927 176.927 177.081 -0.154 18093 1913 1 3 . 1 1 91 91 VAL CA C 91 65.347 65.347 65.731 -0.384 18093 1914 1 3 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.948 -0.081 18093 1915 1 3 . 1 1 91 91 VAL H H 91 8.239 8.239 7.603 0.636 18093 1916 1 3 . 1 1 92 92 LEU N N 92 117.443 117.443 117.571 -0.128 18093 1917 1 3 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.241 -0.047 18093 1918 1 3 . 1 1 92 92 LEU C C 92 177.180 177.180 177.693 -0.513 18093 1919 1 3 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.260 -0.076 18093 1920 1 3 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.325 -0.381 18093 1921 1 3 . 1 1 92 92 LEU H H 92 7.967 7.967 7.677 0.290 18093 1922 1 3 . 1 1 93 93 ASN N N 93 116.705 116.705 118.306 -1.601 18093 1923 1 3 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.461 0.186 18093 1924 1 3 . 1 1 93 93 ASN C C 93 175.129 175.129 175.998 -0.869 18093 1925 1 3 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.072 -1.218 18093 1926 1 3 . 1 1 93 93 ASN CB C 93 39.395 39.395 38.642 0.754 18093 1927 1 3 . 1 1 93 93 ASN H H 93 7.683 7.683 7.667 0.016 18093 1928 1 3 . 1 1 94 94 VAL N N 94 118.224 118.224 120.855 -2.631 18093 1929 1 3 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.728 0.233 18093 1930 1 3 . 1 1 94 94 VAL C C 94 175.600 175.600 174.671 0.929 18093 1931 1 3 . 1 1 94 94 VAL CA C 94 62.825 62.825 63.358 -0.532 18093 1932 1 3 . 1 1 94 94 VAL CB C 94 32.214 32.214 31.991 0.223 18093 1933 1 3 . 1 1 94 94 VAL H H 94 7.627 7.627 7.686 -0.059 18093 1934 1 3 . 1 1 95 95 HIS N N 95 120.999 120.999 124.024 -3.025 18093 1935 1 3 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.659 -0.066 18093 1936 1 3 . 1 1 95 95 HIS C C 95 174.146 174.146 174.731 -0.585 18093 1937 1 3 . 1 1 95 95 HIS CA C 95 55.666 55.666 56.203 -0.536 18093 1938 1 3 . 1 1 95 95 HIS CB C 95 29.736 29.736 31.179 -1.443 18093 1939 1 3 . 1 1 95 95 HIS H H 95 8.263 8.263 8.492 -0.229 18093 1940 1 3 . 1 1 96 96 HIS N N 96 122.740 122.740 116.436 6.304 18093 1941 1 3 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.766 -0.133 18093 1942 1 3 . 1 1 96 96 HIS CA C 96 55.895 55.895 56.108 -0.212 18093 1943 1 3 . 1 1 96 96 HIS CB C 96 29.750 29.750 30.470 -0.720 18093 1944 1 3 . 1 1 96 96 HIS H H 96 8.298 8.298 7.880 0.418 18093 1945 1 3 . 1 1 97 97 ARG N N 97 118.503 118.503 121.648 -3.145 18093 1946 1 3 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.643 -0.331 18093 1947 1 3 . 1 1 97 97 ARG C C 97 175.776 175.776 175.049 0.727 18093 1948 1 3 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.936 0.289 18093 1949 1 3 . 1 1 97 97 ARG CB C 97 30.912 30.912 30.727 0.185 18093 1950 1 3 . 1 1 97 97 ARG H H 97 8.250 8.250 8.170 0.080 18093 1951 1 3 . 1 1 98 98 SER N N 98 118.482 118.482 117.245 1.237 18093 1952 1 3 . 1 1 98 98 SER HA H 98 4.722 4.722 4.897 -0.175 18093 1953 1 3 . 1 1 98 98 SER CA C 98 56.547 56.547 55.229 1.318 18093 1954 1 3 . 1 1 98 98 SER CB C 98 63.624 63.624 63.749 -0.125 18093 1955 1 3 . 1 1 98 98 SER H H 98 8.254 8.254 7.729 0.525 18093 1956 1 3 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.485 -0.082 18093 1957 1 3 . 1 1 99 99 PRO C C 99 176.899 176.899 177.023 -0.124 18093 1958 1 3 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.421 -0.720 18093 1959 1 3 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.654 -0.705 18093 1960 1 3 . 1 1 100 100 GLU N N 100 120.187 120.187 115.324 4.863 18093 1961 1 3 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.386 -0.098 18093 1962 1 3 . 1 1 100 100 GLU C C 100 176.593 176.593 175.336 1.257 18093 1963 1 3 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.897 -0.175 18093 1964 1 3 . 1 1 100 100 GLU CB C 100 29.999 29.999 30.031 -0.032 18093 1965 1 3 . 1 1 100 100 GLU H H 100 8.401 8.401 8.240 0.161 18093 1966 1 3 . 1 1 101 101 THR N N 101 113.968 113.968 112.117 1.851 18093 1967 1 3 . 1 1 101 101 THR HA H 101 4.286 4.286 4.730 -0.444 18093 1968 1 3 . 1 1 101 101 THR C C 101 174.525 174.525 173.884 0.641 18093 1969 1 3 . 1 1 101 101 THR CA C 101 61.956 61.956 61.866 0.090 18093 1970 1 3 . 1 1 101 101 THR CB C 101 69.697 69.697 69.556 0.141 18093 1971 1 3 . 1 1 101 101 THR H H 101 7.945 7.945 8.122 -0.177 18093 1972 1 3 . 1 1 102 102 HIS N N 102 120.322 120.322 124.006 -3.684 18093 1973 1 3 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.732 0.009 18093 1974 1 3 . 1 1 102 102 HIS C C 102 174.783 174.783 174.169 0.614 18093 1975 1 3 . 1 1 102 102 HIS CA C 102 55.701 55.701 56.391 -0.690 18093 1976 1 3 . 1 1 102 102 HIS CB C 102 29.093 29.093 31.640 -2.547 18093 1977 1 3 . 1 1 102 102 HIS H H 102 8.455 8.455 8.923 -0.468 18093 1978 1 3 . 1 1 103 103 THR N N 103 114.282 114.282 115.688 -1.406 18093 1979 1 3 . 1 1 103 103 THR HA H 103 4.352 4.352 4.728 -0.376 18093 1980 1 3 . 1 1 103 103 THR C C 103 175.104 175.104 174.747 0.357 18093 1981 1 3 . 1 1 103 103 THR CA C 103 62.057 62.057 61.433 0.624 18093 1982 1 3 . 1 1 103 103 THR CB C 103 69.966 69.966 71.096 -1.130 18093 1983 1 3 . 1 1 103 103 THR H H 103 8.069 8.069 7.841 0.228 18093 1984 1 3 . 1 1 104 104 GLY N N 104 111.159 111.159 112.011 -0.852 18093 1985 1 3 . 1 1 104 104 GLY C C 104 174.776 174.776 174.371 0.405 18093 1986 1 3 . 1 1 104 104 GLY CA C 104 45.588 45.588 45.176 0.412 18093 1987 1 3 . 1 1 104 104 GLY H H 104 8.393 8.393 8.709 -0.316 18093 1988 1 3 . 1 1 105 105 GLY N N 105 108.657 108.657 108.763 -0.106 18093 1989 1 3 . 1 1 105 105 GLY C C 105 174.957 174.957 173.797 1.160 18093 1990 1 3 . 1 1 105 105 GLY CA C 105 45.612 45.612 45.118 0.494 18093 1991 1 3 . 1 1 105 105 GLY H H 105 8.275 8.275 8.090 0.185 18093 1992 1 3 . 1 1 106 106 GLY N N 106 108.870 108.870 106.487 2.383 18093 1993 1 3 . 1 1 106 106 GLY C C 106 174.877 174.877 173.522 1.355 18093 1994 1 3 . 1 1 106 106 GLY CA C 106 45.665 45.665 45.223 0.442 18093 1995 1 3 . 1 1 106 106 GLY H H 106 8.357 8.357 8.115 0.242 18093 1996 1 3 . 1 1 107 107 GLY N N 107 108.476 108.476 107.429 1.047 18093 1997 1 3 . 1 1 107 107 GLY C C 107 174.877 174.877 174.818 0.059 18093 1998 1 3 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.533 0.163 18093 1999 1 3 . 1 1 107 107 GLY H H 107 8.330 8.330 8.284 0.046 18093 2000 1 3 . 1 1 108 108 GLY N N 108 108.486 108.486 109.456 -0.970 18093 2001 1 3 . 1 1 108 108 GLY C C 108 175.345 175.345 175.172 0.173 18093 2002 1 3 . 1 1 108 108 GLY CA C 108 45.763 45.763 45.312 0.451 18093 2003 1 3 . 1 1 108 108 GLY H H 108 8.328 8.328 8.250 0.078 18093 2004 1 3 . 1 1 109 109 ILE N N 109 120.433 120.433 119.140 1.293 18093 2005 1 3 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.911 0.057 18093 2006 1 3 . 1 1 109 109 ILE C C 109 176.127 176.127 177.000 -0.873 18093 2007 1 3 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.091 -0.356 18093 2008 1 3 . 1 1 109 109 ILE CB C 109 38.125 38.125 38.114 0.011 18093 2009 1 3 . 1 1 109 109 ILE H H 109 8.192 8.192 8.062 0.130 18093 2010 1 3 . 1 1 110 110 ASP N N 110 121.148 121.148 120.765 0.383 18093 2011 1 3 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.643 -0.337 18093 2012 1 3 . 1 1 110 110 ASP C C 110 177.651 177.651 178.085 -0.434 18093 2013 1 3 . 1 1 110 110 ASP CA C 110 56.776 56.776 57.910 -1.134 18093 2014 1 3 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.123 0.974 18093 2015 1 3 . 1 1 110 110 ASP H H 110 8.427 8.427 8.488 -0.061 18093 2016 1 3 . 1 1 111 111 ARG N N 111 119.228 119.228 119.876 -0.648 18093 2017 1 3 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.297 -0.301 18093 2018 1 3 . 1 1 111 111 ARG C C 111 177.786 177.786 178.886 -1.100 18093 2019 1 3 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.069 -0.127 18093 2020 1 3 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.933 0.263 18093 2021 1 3 . 1 1 111 111 ARG H H 111 7.850 7.850 8.527 -0.677 18093 2022 1 3 . 1 1 112 112 ILE N N 112 118.000 118.000 119.553 -1.553 18093 2023 1 3 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.132 -0.319 18093 2024 1 3 . 1 1 112 112 ILE C C 112 177.496 177.496 177.908 -0.412 18093 2025 1 3 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.227 2.585 18093 2026 1 3 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.919 0.808 18093 2027 1 3 . 1 1 112 112 ILE H H 112 7.764 7.764 7.802 -0.038 18093 2028 1 3 . 1 1 113 113 PHE N N 113 118.367 118.367 122.081 -3.714 18093 2029 1 3 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.296 -0.041 18093 2030 1 3 . 1 1 113 113 PHE C C 113 177.218 177.218 177.409 -0.191 18093 2031 1 3 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.333 -0.900 18093 2032 1 3 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.197 -0.390 18093 2033 1 3 . 1 1 113 113 PHE H H 113 7.963 7.963 7.871 0.092 18093 2034 1 3 . 1 1 114 114 LEU N N 114 118.921 118.921 117.304 1.617 18093 2035 1 3 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.967 0.030 18093 2036 1 3 . 1 1 114 114 LEU C C 114 178.297 178.297 178.472 -0.175 18093 2037 1 3 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.196 0.416 18093 2038 1 3 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.340 0.612 18093 2039 1 3 . 1 1 114 114 LEU H H 114 7.939 7.939 8.095 -0.156 18093 2040 1 3 . 1 1 115 115 TRP N N 115 117.464 117.464 119.491 -2.027 18093 2041 1 3 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.395 -0.021 18093 2042 1 3 . 1 1 115 115 TRP C C 115 178.572 178.572 178.271 0.301 18093 2043 1 3 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.808 1.114 18093 2044 1 3 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.785 -1.278 18093 2045 1 3 . 1 1 115 115 TRP H H 115 7.969 7.969 7.648 0.321 18093 2046 1 3 . 1 1 116 116 MET N N 116 117.069 117.069 118.928 -1.859 18093 2047 1 3 . 1 1 116 116 MET HA H 116 4.065 4.065 4.232 -0.167 18093 2048 1 3 . 1 1 116 116 MET C C 116 177.425 177.425 178.198 -0.773 18093 2049 1 3 . 1 1 116 116 MET CA C 116 59.289 59.289 59.105 0.184 18093 2050 1 3 . 1 1 116 116 MET CB C 116 31.692 31.692 32.538 -0.846 18093 2051 1 3 . 1 1 116 116 MET H H 116 8.465 8.465 7.739 0.726 18093 2052 1 3 . 1 1 117 117 PHE N N 117 118.755 118.755 117.737 1.018 18093 2053 1 3 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.083 0.016 18093 2054 1 3 . 1 1 117 117 PHE C C 117 177.965 177.965 178.317 -0.352 18093 2055 1 3 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.235 -0.527 18093 2056 1 3 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.255 0.930 18093 2057 1 3 . 1 1 117 117 PHE H H 117 8.418 8.418 7.859 0.559 18093 2058 1 3 . 1 1 118 118 ILE N N 118 119.133 119.133 115.319 3.814 18093 2059 1 3 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.866 -0.522 18093 2060 1 3 . 1 1 118 118 ILE C C 118 177.244 177.244 177.332 -0.088 18093 2061 1 3 . 1 1 118 118 ILE CA C 118 65.825 65.825 63.934 1.891 18093 2062 1 3 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.835 -0.287 18093 2063 1 3 . 1 1 118 118 ILE H H 118 8.266 8.266 7.674 0.592 18093 2064 1 3 . 1 1 119 119 ILE N N 119 118.846 118.846 121.475 -2.629 18093 2065 1 3 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.894 -0.322 18093 2066 1 3 . 1 1 119 119 ILE C C 119 177.523 177.523 177.643 -0.120 18093 2067 1 3 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.155 0.734 18093 2068 1 3 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.262 -0.698 18093 2069 1 3 . 1 1 119 119 ILE H H 119 8.308 8.308 7.303 1.005 18093 2070 1 3 . 1 1 120 120 VAL N N 120 119.228 119.228 116.944 2.284 18093 2071 1 3 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.770 -0.262 18093 2072 1 3 . 1 1 120 120 VAL C C 120 177.651 177.651 177.478 0.173 18093 2073 1 3 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.736 1.865 18093 2074 1 3 . 1 1 120 120 VAL CB C 120 31.406 31.406 31.316 0.090 18093 2075 1 3 . 1 1 120 120 VAL H H 120 8.399 8.399 7.954 0.445 18093 2076 1 3 . 1 1 121 121 CYS N N 121 117.151 117.151 119.891 -2.740 18093 2077 1 3 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.106 -0.203 18093 2078 1 3 . 1 1 121 121 CYS C C 121 177.719 177.719 177.164 0.555 18093 2079 1 3 . 1 1 121 121 CYS CA C 121 64.298 64.298 64.509 -0.211 18093 2080 1 3 . 1 1 121 121 CYS CB C 121 26.677 26.677 26.946 -0.269 18093 2081 1 3 . 1 1 121 121 CYS H H 121 8.008 8.008 7.458 0.550 18093 2082 1 3 . 1 1 122 122 LEU N N 122 121.402 121.402 119.718 1.684 18093 2083 1 3 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.118 -0.135 18093 2084 1 3 . 1 1 122 122 LEU C C 122 178.282 178.282 179.155 -0.873 18093 2085 1 3 . 1 1 122 122 LEU CA C 122 58.545 58.545 58.205 0.340 18093 2086 1 3 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.178 0.788 18093 2087 1 3 . 1 1 122 122 LEU H H 122 8.417 8.417 7.694 0.723 18093 2088 1 3 . 1 1 123 123 LEU N N 123 118.543 118.543 120.497 -1.954 18093 2089 1 3 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.052 -0.132 18093 2090 1 3 . 1 1 123 123 LEU C C 123 179.028 179.028 178.801 0.227 18093 2091 1 3 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.424 -0.307 18093 2092 1 3 . 1 1 123 123 LEU CB C 123 42.056 42.056 41.020 1.036 18093 2093 1 3 . 1 1 123 123 LEU H H 123 8.590 8.590 7.665 0.925 18093 2094 1 3 . 1 1 124 124 GLY N N 124 104.896 104.896 105.488 -0.592 18093 2095 1 3 . 1 1 124 124 GLY C C 124 173.932 173.932 176.253 -2.321 18093 2096 1 3 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.624 -0.397 18093 2097 1 3 . 1 1 124 124 GLY H H 124 8.601 8.601 8.618 -0.017 18093 2098 1 3 . 1 1 125 125 THR N N 125 115.403 115.403 119.416 -4.013 18093 2099 1 3 . 1 1 125 125 THR HA H 125 3.686 3.686 3.944 -0.258 18093 2100 1 3 . 1 1 125 125 THR C C 125 176.407 176.407 176.635 -0.228 18093 2101 1 3 . 1 1 125 125 THR CA C 125 67.565 67.565 66.405 1.160 18093 2102 1 3 . 1 1 125 125 THR CB C 125 68.143 68.143 68.410 -0.268 18093 2103 1 3 . 1 1 125 125 THR H H 125 7.734 7.734 7.502 0.232 18093 2104 1 3 . 1 1 126 126 VAL N N 126 119.056 119.056 121.246 -2.190 18093 2105 1 3 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.636 -0.097 18093 2106 1 3 . 1 1 126 126 VAL C C 126 177.628 177.628 178.079 -0.451 18093 2107 1 3 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.942 -0.341 18093 2108 1 3 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.560 -0.066 18093 2109 1 3 . 1 1 126 126 VAL H H 126 8.015 8.015 8.284 -0.269 18093 2110 1 3 . 1 1 127 127 GLY N N 127 104.644 104.644 107.719 -3.075 18093 2111 1 3 . 1 1 127 127 GLY C C 127 173.933 173.933 175.422 -1.489 18093 2112 1 3 . 1 1 127 127 GLY CA C 127 47.281 47.281 46.848 0.433 18093 2113 1 3 . 1 1 127 127 GLY H H 127 8.248 8.248 8.498 -0.250 18093 2114 1 3 . 1 1 128 128 LEU N N 128 117.354 117.354 121.422 -4.068 18093 2115 1 3 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.090 -0.078 18093 2116 1 3 . 1 1 128 128 LEU C C 128 177.443 177.443 178.099 -0.656 18093 2117 1 3 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.840 -0.214 18093 2118 1 3 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.988 0.272 18093 2119 1 3 . 1 1 128 128 LEU H H 128 7.568 7.568 7.714 -0.146 18093 2120 1 3 . 1 1 129 129 PHE N N 129 113.971 113.971 116.849 -2.878 18093 2121 1 3 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.272 0.186 18093 2122 1 3 . 1 1 129 129 PHE C C 129 176.216 176.216 176.385 -0.169 18093 2123 1 3 . 1 1 129 129 PHE CA C 129 58.385 58.385 60.793 -2.408 18093 2124 1 3 . 1 1 129 129 PHE CB C 129 39.719 39.719 40.011 -0.292 18093 2125 1 3 . 1 1 129 129 PHE H H 129 7.639 7.639 7.750 -0.111 18093 2126 1 3 . 1 1 130 130 LEU N N 130 117.752 117.752 119.799 -2.047 18093 2127 1 3 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.162 0.271 18093 2128 1 3 . 1 1 130 130 LEU CA C 130 54.156 54.156 54.299 -0.143 18093 2129 1 3 . 1 1 130 130 LEU H H 130 8.099 8.099 7.818 0.281 18093 2130 1 3 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.850 -0.400 18093 2131 1 3 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.635 2.264 18093 2132 1 3 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.395 -0.133 18093 2133 1 3 . 1 1 132 132 PRO C C 132 177.616 177.616 179.098 -1.482 18093 2134 1 3 . 1 1 132 132 PRO CA C 132 64.980 64.980 65.282 -0.302 18093 2135 1 3 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.035 -0.410 18093 2136 1 3 . 1 1 133 133 TRP N N 133 115.508 115.508 121.367 -5.859 18093 2137 1 3 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.477 0.115 18093 2138 1 3 . 1 1 133 133 TRP C C 133 176.842 176.842 175.936 0.906 18093 2139 1 3 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.462 -2.179 18093 2140 1 3 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.017 -0.421 18093 2141 1 3 . 1 1 133 133 TRP H H 133 7.311 7.311 8.094 -0.783 18093 2142 1 3 . 1 1 134 134 LEU N N 134 119.570 119.570 116.336 3.234 18093 2143 1 3 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.552 -0.375 18093 2144 1 3 . 1 1 134 134 LEU C C 134 175.768 175.768 177.197 -1.429 18093 2145 1 3 . 1 1 134 134 LEU CA C 134 55.621 55.621 54.347 1.274 18093 2146 1 3 . 1 1 134 134 LEU CB C 134 42.648 42.648 40.906 1.742 18093 2147 1 3 . 1 1 134 134 LEU H H 134 7.453 7.453 7.888 -0.435 18093 2148 1 3 . 1 1 135 135 ALA N N 135 119.004 119.004 123.113 -4.109 18093 2149 1 3 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.248 -0.025 18093 2150 1 3 . 1 1 135 135 ALA C C 135 177.170 177.170 178.244 -1.074 18093 2151 1 3 . 1 1 135 135 ALA CA C 135 52.456 52.456 54.376 -1.920 18093 2152 1 3 . 1 1 135 135 ALA CB C 135 19.736 19.736 19.219 0.517 18093 2153 1 3 . 1 1 135 135 ALA H H 135 7.541 7.541 7.568 -0.027 18093 2154 1 3 . 1 1 136 136 GLY N N 136 105.879 105.879 107.448 -1.569 18093 2155 1 3 . 1 1 136 136 GLY C C 136 173.042 173.042 174.715 -1.673 18093 2156 1 3 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.338 0.355 18093 2157 1 3 . 1 1 136 136 GLY H H 136 7.846 7.846 8.710 -0.864 18093 2158 1 4 . 1 1 5 5 GLU N N 5 119.627 119.627 120.330 -0.703 18093 2159 1 4 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.379 -0.171 18093 2160 1 4 . 1 1 5 5 GLU C C 5 176.581 176.581 175.064 1.517 18093 2161 1 4 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.305 0.740 18093 2162 1 4 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.910 0.129 18093 2163 1 4 . 1 1 5 5 GLU H H 5 8.003 8.003 8.229 -0.226 18093 2164 1 4 . 1 1 6 6 LEU N N 6 121.267 121.267 122.142 -0.875 18093 2165 1 4 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.609 -0.184 18093 2166 1 4 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.385 2.250 18093 2167 1 4 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.755 -0.459 18093 2168 1 4 . 1 1 6 6 LEU H H 6 8.104 8.104 7.849 0.255 18093 2169 1 4 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.547 -0.148 18093 2170 1 4 . 1 1 7 7 PRO C C 7 178.408 178.408 177.978 0.430 18093 2171 1 4 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.061 2.651 18093 2172 1 4 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.773 -0.856 18093 2173 1 4 . 1 1 8 8 LEU N N 8 121.835 121.835 120.739 1.096 18093 2174 1 4 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.097 -0.008 18093 2175 1 4 . 1 1 8 8 LEU C C 8 177.902 177.902 178.465 -0.563 18093 2176 1 4 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.623 0.482 18093 2177 1 4 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.184 0.423 18093 2178 1 4 . 1 1 8 8 LEU H H 8 8.162 8.162 8.536 -0.374 18093 2179 1 4 . 1 1 9 9 PHE N N 9 118.342 118.342 118.735 -0.393 18093 2180 1 4 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.128 0.061 18093 2181 1 4 . 1 1 9 9 PHE C C 9 177.596 177.596 177.551 0.045 18093 2182 1 4 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.682 -0.568 18093 2183 1 4 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.545 0.182 18093 2184 1 4 . 1 1 9 9 PHE H H 9 8.318 8.318 8.261 0.057 18093 2185 1 4 . 1 1 10 10 TYR N N 10 117.584 117.584 118.550 -0.966 18093 2186 1 4 . 1 1 10 10 TYR HA H 10 4.154 4.154 4.443 -0.289 18093 2187 1 4 . 1 1 10 10 TYR C C 10 177.630 177.630 177.359 0.271 18093 2188 1 4 . 1 1 10 10 TYR CA C 10 61.036 61.036 60.895 0.141 18093 2189 1 4 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.203 0.457 18093 2190 1 4 . 1 1 10 10 TYR H H 10 8.105 8.105 8.557 -0.452 18093 2191 1 4 . 1 1 11 11 THR N N 11 115.563 115.563 116.560 -0.997 18093 2192 1 4 . 1 1 11 11 THR HA H 11 3.871 3.871 3.960 -0.089 18093 2193 1 4 . 1 1 11 11 THR C C 11 175.955 175.955 176.648 -0.693 18093 2194 1 4 . 1 1 11 11 THR CA C 11 67.290 67.290 66.800 0.490 18093 2195 1 4 . 1 1 11 11 THR CB C 11 68.201 68.201 68.431 -0.230 18093 2196 1 4 . 1 1 11 11 THR H H 11 7.915 7.915 7.828 0.087 18093 2197 1 4 . 1 1 12 12 ILE N N 12 119.727 119.727 120.696 -0.969 18093 2198 1 4 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.831 -0.132 18093 2199 1 4 . 1 1 12 12 ILE C C 12 175.773 175.773 177.456 -1.683 18093 2200 1 4 . 1 1 12 12 ILE CA C 12 64.699 64.699 63.500 1.199 18093 2201 1 4 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.587 1.509 18093 2202 1 4 . 1 1 12 12 ILE H H 12 8.186 8.186 7.941 0.245 18093 2203 1 4 . 1 1 13 13 ASN N N 13 114.190 114.190 118.448 -4.258 18093 2204 1 4 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.515 -0.093 18093 2205 1 4 . 1 1 13 13 ASN C C 13 174.786 174.786 176.741 -1.955 18093 2206 1 4 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.481 0.074 18093 2207 1 4 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.963 0.395 18093 2208 1 4 . 1 1 13 13 ASN H H 13 7.601 7.601 7.434 0.167 18093 2209 1 4 . 1 1 14 14 LEU N N 14 115.031 115.031 119.404 -4.373 18093 2210 1 4 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.043 0.153 18093 2211 1 4 . 1 1 14 14 LEU C C 14 177.540 177.540 178.128 -0.588 18093 2212 1 4 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.047 0.360 18093 2213 1 4 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.192 -0.350 18093 2214 1 4 . 1 1 14 14 LEU H H 14 7.390 7.390 7.475 -0.085 18093 2215 1 4 . 1 1 15 15 ILE N N 15 118.223 118.223 120.209 -1.986 18093 2216 1 4 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.615 -0.002 18093 2217 1 4 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.535 3.185 18093 2218 1 4 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.105 -0.492 18093 2219 1 4 . 1 1 15 15 ILE H H 15 8.123 8.123 7.739 0.384 18093 2220 1 4 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.303 -0.234 18093 2221 1 4 . 1 1 17 17 PRO C C 17 177.721 177.721 178.858 -1.137 18093 2222 1 4 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.538 1.223 18093 2223 1 4 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.757 -0.015 18093 2224 1 4 . 1 1 18 18 CYS N N 18 113.538 113.538 117.014 -3.476 18093 2225 1 4 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.057 -0.049 18093 2226 1 4 . 1 1 18 18 CYS C C 18 177.683 177.683 176.917 0.766 18093 2227 1 4 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.572 0.928 18093 2228 1 4 . 1 1 18 18 CYS CB C 18 26.873 26.873 27.405 -0.532 18093 2229 1 4 . 1 1 18 18 CYS H H 18 7.410 7.410 7.360 0.050 18093 2230 1 4 . 1 1 19 19 LEU N N 19 122.545 122.545 119.666 2.879 18093 2231 1 4 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.121 -0.122 18093 2232 1 4 . 1 1 19 19 LEU C C 19 178.608 178.608 178.570 0.038 18093 2233 1 4 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.403 1.018 18093 2234 1 4 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.435 0.409 18093 2235 1 4 . 1 1 19 19 LEU H H 19 8.635 8.635 7.444 1.191 18093 2236 1 4 . 1 1 20 20 LEU N N 20 119.404 119.404 120.938 -1.534 18093 2237 1 4 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.951 0.055 18093 2238 1 4 . 1 1 20 20 LEU C C 20 178.540 178.540 179.237 -0.697 18093 2239 1 4 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.733 0.066 18093 2240 1 4 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.952 0.047 18093 2241 1 4 . 1 1 20 20 LEU H H 20 8.392 8.392 7.538 0.854 18093 2242 1 4 . 1 1 21 21 ILE N N 21 117.335 117.335 114.430 2.905 18093 2243 1 4 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.865 -0.214 18093 2244 1 4 . 1 1 21 21 ILE C C 21 177.249 177.249 177.734 -0.485 18093 2245 1 4 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.905 0.356 18093 2246 1 4 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.287 0.673 18093 2247 1 4 . 1 1 21 21 ILE H H 21 8.403 8.403 8.407 -0.004 18093 2248 1 4 . 1 1 22 22 SER N N 22 116.385 116.385 117.903 -1.518 18093 2249 1 4 . 1 1 22 22 SER HA H 22 4.056 4.056 4.272 -0.216 18093 2250 1 4 . 1 1 22 22 SER C C 22 176.813 176.813 176.815 -0.002 18093 2251 1 4 . 1 1 22 22 SER CA C 22 63.866 63.866 62.405 1.461 18093 2252 1 4 . 1 1 22 22 SER CB C 22 62.898 62.898 62.872 0.026 18093 2253 1 4 . 1 1 22 22 SER H H 22 8.271 8.271 7.586 0.685 18093 2254 1 4 . 1 1 23 23 CYS N N 23 119.001 119.001 119.843 -0.842 18093 2255 1 4 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.131 -0.141 18093 2256 1 4 . 1 1 23 23 CYS C C 23 177.594 177.594 176.807 0.787 18093 2257 1 4 . 1 1 23 23 CYS CA C 23 64.429 64.429 63.891 0.538 18093 2258 1 4 . 1 1 23 23 CYS CB C 23 26.940 26.940 27.296 -0.356 18093 2259 1 4 . 1 1 23 23 CYS H H 23 8.161 8.161 8.679 -0.518 18093 2260 1 4 . 1 1 24 24 LEU N N 24 117.814 117.814 122.053 -4.239 18093 2261 1 4 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.959 0.018 18093 2262 1 4 . 1 1 24 24 LEU C C 24 177.944 177.944 178.363 -0.419 18093 2263 1 4 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.472 -0.185 18093 2264 1 4 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.509 0.394 18093 2265 1 4 . 1 1 24 24 LEU H H 24 8.106 8.106 7.739 0.367 18093 2266 1 4 . 1 1 25 25 THR N N 25 115.670 115.670 114.761 0.909 18093 2267 1 4 . 1 1 25 25 THR HA H 25 3.687 3.687 3.986 -0.298 18093 2268 1 4 . 1 1 25 25 THR C C 25 175.845 175.845 177.219 -1.374 18093 2269 1 4 . 1 1 25 25 THR CA C 25 68.306 68.306 66.677 1.629 18093 2270 1 4 . 1 1 25 25 THR H H 25 7.924 7.924 7.616 0.308 18093 2271 1 4 . 1 1 26 26 VAL N N 26 118.809 118.809 120.956 -2.147 18093 2272 1 4 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.652 -0.137 18093 2273 1 4 . 1 1 26 26 VAL C C 26 177.530 177.530 177.973 -0.443 18093 2274 1 4 . 1 1 26 26 VAL CA C 26 67.281 67.281 65.700 1.581 18093 2275 1 4 . 1 1 26 26 VAL CB C 26 31.724 31.724 30.767 0.957 18093 2276 1 4 . 1 1 26 26 VAL H H 26 7.764 7.764 7.352 0.412 18093 2277 1 4 . 1 1 27 27 LEU N N 27 117.958 117.958 122.095 -4.137 18093 2278 1 4 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.196 -0.160 18093 2279 1 4 . 1 1 27 27 LEU C C 27 178.163 178.163 179.288 -1.125 18093 2280 1 4 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.353 0.156 18093 2281 1 4 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.883 1.036 18093 2282 1 4 . 1 1 27 27 LEU H H 27 7.912 7.912 7.973 -0.061 18093 2283 1 4 . 1 1 28 28 VAL N N 28 114.472 114.472 118.319 -3.847 18093 2284 1 4 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.873 -0.338 18093 2285 1 4 . 1 1 28 28 VAL C C 28 176.871 176.871 177.423 -0.552 18093 2286 1 4 . 1 1 28 28 VAL CA C 28 65.977 65.977 65.023 0.954 18093 2287 1 4 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.046 0.888 18093 2288 1 4 . 1 1 28 28 VAL H H 28 7.892 7.892 7.661 0.231 18093 2289 1 4 . 1 1 29 29 PHE N N 29 115.206 115.206 117.384 -2.178 18093 2290 1 4 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.279 -0.076 18093 2291 1 4 . 1 1 29 29 PHE C C 29 176.614 176.614 176.469 0.145 18093 2292 1 4 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.512 0.452 18093 2293 1 4 . 1 1 29 29 PHE CB C 29 39.752 39.752 39.199 0.553 18093 2294 1 4 . 1 1 29 29 PHE H H 29 7.748 7.748 7.733 0.015 18093 2295 1 4 . 1 1 30 30 TYR N N 30 115.975 115.975 118.740 -2.765 18093 2296 1 4 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.308 0.014 18093 2297 1 4 . 1 1 30 30 TYR C C 30 175.553 175.553 175.836 -0.283 18093 2298 1 4 . 1 1 30 30 TYR CA C 30 59.598 59.598 59.160 0.438 18093 2299 1 4 . 1 1 30 30 TYR CB C 30 39.763 39.763 40.492 -0.729 18093 2300 1 4 . 1 1 30 30 TYR H H 30 7.985 7.985 7.628 0.357 18093 2301 1 4 . 1 1 31 31 LEU N N 31 120.780 120.780 121.238 -0.458 18093 2302 1 4 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.602 -0.175 18093 2303 1 4 . 1 1 31 31 LEU CA C 31 54.665 54.665 51.520 3.145 18093 2304 1 4 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.059 -0.671 18093 2305 1 4 . 1 1 31 31 LEU H H 31 7.643 7.643 7.825 -0.182 18093 2306 1 4 . 1 1 34 34 GLU C C 34 176.271 176.271 175.832 0.439 18093 2307 1 4 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.357 2.233 18093 2308 1 4 . 1 1 35 35 CYS N N 35 116.430 116.430 121.207 -4.777 18093 2309 1 4 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.363 0.004 18093 2310 1 4 . 1 1 35 35 CYS C C 35 175.198 175.198 176.063 -0.865 18093 2311 1 4 . 1 1 35 35 CYS CA C 35 60.293 60.293 60.230 0.063 18093 2312 1 4 . 1 1 35 35 CYS CB C 35 28.130 28.130 28.296 -0.166 18093 2313 1 4 . 1 1 35 35 CYS H H 35 7.970 7.970 8.809 -0.839 18093 2314 1 4 . 1 1 36 36 GLY N N 36 108.315 108.315 107.826 0.489 18093 2315 1 4 . 1 1 36 36 GLY C C 36 174.610 174.610 175.783 -1.173 18093 2316 1 4 . 1 1 36 36 GLY CA C 36 46.004 46.004 46.364 -0.360 18093 2317 1 4 . 1 1 36 36 GLY H H 36 8.120 8.120 8.059 0.061 18093 2318 1 4 . 1 1 37 37 GLU N N 37 121.347 121.347 120.932 0.415 18093 2319 1 4 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.013 0.034 18093 2320 1 4 . 1 1 37 37 GLU C C 37 177.338 177.338 178.661 -1.323 18093 2321 1 4 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.105 -0.598 18093 2322 1 4 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.184 0.386 18093 2323 1 4 . 1 1 37 37 GLU H H 37 8.423 8.423 8.163 0.260 18093 2324 1 4 . 1 1 38 38 LYS N N 38 123.788 123.788 119.870 3.918 18093 2325 1 4 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.085 0.111 18093 2326 1 4 . 1 1 38 38 LYS C C 38 177.976 177.976 178.967 -0.991 18093 2327 1 4 . 1 1 38 38 LYS CA C 38 58.273 58.273 59.776 -1.503 18093 2328 1 4 . 1 1 38 38 LYS CB C 38 31.649 31.649 32.167 -0.518 18093 2329 1 4 . 1 1 38 38 LYS H H 38 8.211 8.211 7.461 0.750 18093 2330 1 4 . 1 1 39 39 ILE N N 39 115.675 115.675 119.062 -3.387 18093 2331 1 4 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.717 -0.109 18093 2332 1 4 . 1 1 39 39 ILE C C 39 177.204 177.204 178.151 -0.947 18093 2333 1 4 . 1 1 39 39 ILE CA C 39 65.501 65.501 65.121 0.380 18093 2334 1 4 . 1 1 39 39 ILE H H 39 7.933 7.933 7.648 0.285 18093 2335 1 4 . 1 1 40 40 THR N N 40 117.411 117.411 114.998 2.413 18093 2336 1 4 . 1 1 40 40 THR HA H 40 3.844 3.844 3.994 -0.150 18093 2337 1 4 . 1 1 40 40 THR C C 40 175.983 175.983 176.674 -0.691 18093 2338 1 4 . 1 1 40 40 THR CA C 40 67.360 67.360 66.848 0.512 18093 2339 1 4 . 1 1 40 40 THR H H 40 8.362 8.362 7.679 0.683 18093 2340 1 4 . 1 1 41 41 LEU N N 41 123.059 123.059 122.623 0.436 18093 2341 1 4 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.212 -0.196 18093 2342 1 4 . 1 1 41 41 LEU C C 41 178.914 178.914 178.235 0.679 18093 2343 1 4 . 1 1 41 41 LEU CA C 41 58.366 58.366 57.556 0.811 18093 2344 1 4 . 1 1 41 41 LEU CB C 41 42.050 42.050 42.073 -0.023 18093 2345 1 4 . 1 1 41 41 LEU H H 41 8.282 8.282 7.514 0.768 18093 2346 1 4 . 1 1 42 42 CYS N N 42 118.762 118.762 119.027 -0.265 18093 2347 1 4 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.082 -0.145 18093 2348 1 4 . 1 1 42 42 CYS C C 42 176.607 176.607 177.005 -0.398 18093 2349 1 4 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.799 0.518 18093 2350 1 4 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.612 -0.693 18093 2351 1 4 . 1 1 42 42 CYS H H 42 8.195 8.195 8.289 -0.094 18093 2352 1 4 . 1 1 43 43 ILE N N 43 117.589 117.589 120.331 -2.742 18093 2353 1 4 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.660 -0.053 18093 2354 1 4 . 1 1 43 43 ILE C C 43 177.323 177.323 177.728 -0.405 18093 2355 1 4 . 1 1 43 43 ILE CA C 43 65.249 65.249 65.365 -0.116 18093 2356 1 4 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.564 0.474 18093 2357 1 4 . 1 1 43 43 ILE H H 43 8.428 8.428 7.731 0.697 18093 2358 1 4 . 1 1 44 44 SER N N 44 115.950 115.950 116.393 -0.443 18093 2359 1 4 . 1 1 44 44 SER HA H 44 4.012 4.012 4.126 -0.114 18093 2360 1 4 . 1 1 44 44 SER C C 44 176.965 176.965 176.784 0.181 18093 2361 1 4 . 1 1 44 44 SER CA C 44 63.575 63.575 62.123 1.452 18093 2362 1 4 . 1 1 44 44 SER H H 44 7.984 7.984 7.504 0.480 18093 2363 1 4 . 1 1 45 45 VAL N N 45 123.544 123.544 120.906 2.638 18093 2364 1 4 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.781 -0.233 18093 2365 1 4 . 1 1 45 45 VAL C C 45 177.139 177.139 177.862 -0.723 18093 2366 1 4 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.318 0.915 18093 2367 1 4 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.550 0.092 18093 2368 1 4 . 1 1 45 45 VAL H H 45 8.280 8.280 8.109 0.171 18093 2369 1 4 . 1 1 46 46 LEU N N 46 119.883 119.883 120.525 -0.642 18093 2370 1 4 . 1 1 46 46 LEU HA H 46 3.943 3.943 3.958 -0.015 18093 2371 1 4 . 1 1 46 46 LEU C C 46 180.125 180.125 178.757 1.368 18093 2372 1 4 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.854 0.746 18093 2373 1 4 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.822 0.190 18093 2374 1 4 . 1 1 46 46 LEU H H 46 8.117 8.117 7.490 0.627 18093 2375 1 4 . 1 1 47 47 LEU N N 47 120.193 120.193 120.495 -0.302 18093 2376 1 4 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.772 0.232 18093 2377 1 4 . 1 1 47 47 LEU C C 47 178.370 178.370 179.085 -0.715 18093 2378 1 4 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.731 -0.305 18093 2379 1 4 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.748 0.307 18093 2380 1 4 . 1 1 47 47 LEU H H 47 8.933 8.933 8.429 0.504 18093 2381 1 4 . 1 1 48 48 SER N N 48 115.861 115.861 114.380 1.481 18093 2382 1 4 . 1 1 48 48 SER HA H 48 4.013 4.013 4.198 -0.185 18093 2383 1 4 . 1 1 48 48 SER C C 48 175.642 175.642 176.637 -0.995 18093 2384 1 4 . 1 1 48 48 SER CA C 48 63.571 63.571 62.020 1.551 18093 2385 1 4 . 1 1 48 48 SER CB C 48 62.879 62.879 63.103 -0.224 18093 2386 1 4 . 1 1 48 48 SER H H 48 7.996 7.996 7.611 0.385 18093 2387 1 4 . 1 1 49 49 LEU N N 49 120.673 120.673 123.228 -2.555 18093 2388 1 4 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.159 -0.124 18093 2389 1 4 . 1 1 49 49 LEU C C 49 178.229 178.229 178.525 -0.296 18093 2390 1 4 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.291 -0.008 18093 2391 1 4 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.098 -0.152 18093 2392 1 4 . 1 1 49 49 LEU H H 49 8.352 8.352 7.606 0.746 18093 2393 1 4 . 1 1 50 50 THR N N 50 115.582 115.582 114.720 0.862 18093 2394 1 4 . 1 1 50 50 THR HA H 50 3.672 3.672 3.976 -0.304 18093 2395 1 4 . 1 1 50 50 THR C C 50 175.877 175.877 177.201 -1.324 18093 2396 1 4 . 1 1 50 50 THR CA C 50 68.628 68.628 66.646 1.982 18093 2397 1 4 . 1 1 50 50 THR H H 50 7.937 7.937 8.597 -0.660 18093 2398 1 4 . 1 1 51 51 VAL N N 51 119.774 119.774 122.101 -2.327 18093 2399 1 4 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.826 -0.328 18093 2400 1 4 . 1 1 51 51 VAL C C 51 177.162 177.162 177.686 -0.524 18093 2401 1 4 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.612 0.973 18093 2402 1 4 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.538 -0.017 18093 2403 1 4 . 1 1 51 51 VAL H H 51 8.115 8.115 7.618 0.497 18093 2404 1 4 . 1 1 52 52 PHE N N 52 118.808 118.808 120.900 -2.092 18093 2405 1 4 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.247 -0.125 18093 2406 1 4 . 1 1 52 52 PHE C C 52 176.697 176.697 176.941 -0.244 18093 2407 1 4 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.637 1.134 18093 2408 1 4 . 1 1 52 52 PHE CB C 52 39.262 39.262 38.956 0.306 18093 2409 1 4 . 1 1 52 52 PHE H H 52 8.256 8.256 8.354 -0.098 18093 2410 1 4 . 1 1 53 53 LEU N N 53 117.267 117.267 120.961 -3.694 18093 2411 1 4 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.466 0.427 18093 2412 1 4 . 1 1 53 53 LEU C C 53 179.319 179.319 177.974 1.345 18093 2413 1 4 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.811 0.174 18093 2414 1 4 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.308 0.519 18093 2415 1 4 . 1 1 53 53 LEU H H 53 8.443 8.443 8.116 0.327 18093 2416 1 4 . 1 1 54 54 LEU N N 54 119.762 119.762 118.748 1.014 18093 2417 1 4 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.901 0.153 18093 2418 1 4 . 1 1 54 54 LEU C C 54 178.827 178.827 178.943 -0.116 18093 2419 1 4 . 1 1 54 54 LEU CA C 54 58.105 58.105 58.030 0.075 18093 2420 1 4 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.833 0.114 18093 2421 1 4 . 1 1 54 54 LEU H H 54 8.205 8.205 7.350 0.855 18093 2422 1 4 . 1 1 55 55 LEU N N 55 118.585 118.585 118.193 0.392 18093 2423 1 4 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.935 0.142 18093 2424 1 4 . 1 1 55 55 LEU C C 55 178.909 178.909 178.597 0.312 18093 2425 1 4 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.572 0.536 18093 2426 1 4 . 1 1 55 55 LEU CB C 55 41.979 41.979 41.901 0.078 18093 2427 1 4 . 1 1 55 55 LEU H H 55 8.179 8.179 7.419 0.760 18093 2428 1 4 . 1 1 56 56 ILE N N 56 116.079 116.079 115.193 0.886 18093 2429 1 4 . 1 1 56 56 ILE HA H 56 3.729 3.729 4.031 -0.302 18093 2430 1 4 . 1 1 56 56 ILE C C 56 176.988 176.988 177.611 -0.623 18093 2431 1 4 . 1 1 56 56 ILE CA C 56 64.257 64.257 62.966 1.291 18093 2432 1 4 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.648 0.769 18093 2433 1 4 . 1 1 56 56 ILE H H 56 8.040 8.040 7.703 0.337 18093 2434 1 4 . 1 1 57 57 THR N N 57 110.105 110.105 112.447 -2.342 18093 2435 1 4 . 1 1 57 57 THR HA H 57 4.015 4.015 4.170 -0.155 18093 2436 1 4 . 1 1 57 57 THR C C 57 175.435 175.435 176.048 -0.613 18093 2437 1 4 . 1 1 57 57 THR CA C 57 65.067 65.067 65.277 -0.210 18093 2438 1 4 . 1 1 57 57 THR CB C 57 69.179 69.179 68.732 0.447 18093 2439 1 4 . 1 1 57 57 THR H H 57 7.655 7.655 7.744 -0.089 18093 2440 1 4 . 1 1 58 58 GLU N N 58 117.313 117.313 120.599 -3.286 18093 2441 1 4 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.334 -0.001 18093 2442 1 4 . 1 1 58 58 GLU C C 58 176.940 176.940 178.130 -1.190 18093 2443 1 4 . 1 1 58 58 GLU CA C 58 57.068 57.068 57.759 -0.691 18093 2444 1 4 . 1 1 58 58 GLU CB C 58 29.396 29.396 29.892 -0.496 18093 2445 1 4 . 1 1 58 58 GLU H H 58 7.521 7.521 7.803 -0.282 18093 2446 1 4 . 1 1 59 59 ILE N N 59 114.870 114.870 114.694 0.176 18093 2447 1 4 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.055 0.034 18093 2448 1 4 . 1 1 59 59 ILE C C 59 175.456 175.456 176.512 -1.056 18093 2449 1 4 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.550 -0.116 18093 2450 1 4 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.908 -0.251 18093 2451 1 4 . 1 1 59 59 ILE H H 59 7.579 7.579 7.369 0.210 18093 2452 1 4 . 1 1 60 60 ILE N N 60 119.354 119.354 117.348 2.006 18093 2453 1 4 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.915 0.389 18093 2454 1 4 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.346 -1.729 18093 2455 1 4 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.437 2.425 18093 2456 1 4 . 1 1 60 60 ILE H H 60 7.629 7.629 7.635 -0.006 18093 2457 1 4 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.388 0.012 18093 2458 1 4 . 1 1 61 61 PRO C C 61 177.144 177.144 176.681 0.463 18093 2459 1 4 . 1 1 61 61 PRO CA C 61 63.808 63.808 63.448 0.360 18093 2460 1 4 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.114 -0.232 18093 2461 1 4 . 1 1 62 62 SER N N 62 114.474 114.474 113.135 1.339 18093 2462 1 4 . 1 1 62 62 SER HA H 62 4.434 4.434 4.165 0.269 18093 2463 1 4 . 1 1 62 62 SER C C 62 175.161 175.161 173.409 1.752 18093 2464 1 4 . 1 1 62 62 SER CA C 62 59.047 59.047 58.968 0.079 18093 2465 1 4 . 1 1 62 62 SER CB C 62 63.704 63.704 63.554 0.150 18093 2466 1 4 . 1 1 62 62 SER H H 62 8.186 8.186 8.012 0.174 18093 2467 1 4 . 1 1 63 63 THR N N 63 113.573 113.573 117.136 -3.563 18093 2468 1 4 . 1 1 63 63 THR HA H 63 4.319 4.319 4.979 -0.660 18093 2469 1 4 . 1 1 63 63 THR C C 63 174.834 174.834 173.534 1.300 18093 2470 1 4 . 1 1 63 63 THR CA C 63 62.377 62.377 60.749 1.628 18093 2471 1 4 . 1 1 63 63 THR CB C 63 69.422 69.422 71.191 -1.769 18093 2472 1 4 . 1 1 63 63 THR H H 63 7.963 7.963 8.231 -0.268 18093 2473 1 4 . 1 1 64 64 SER N N 64 116.598 116.598 121.128 -4.530 18093 2474 1 4 . 1 1 64 64 SER HA H 64 4.428 4.428 4.728 -0.300 18093 2475 1 4 . 1 1 64 64 SER C C 64 174.618 174.618 173.502 1.116 18093 2476 1 4 . 1 1 64 64 SER CA C 64 59.045 59.045 56.703 2.342 18093 2477 1 4 . 1 1 64 64 SER CB C 64 63.700 63.700 64.061 -0.361 18093 2478 1 4 . 1 1 64 64 SER H H 64 8.052 8.052 8.298 -0.246 18093 2479 1 4 . 1 1 65 65 SER N N 65 116.673 116.673 117.915 -1.242 18093 2480 1 4 . 1 1 65 65 SER HA H 65 4.432 4.432 4.285 0.147 18093 2481 1 4 . 1 1 65 65 SER C C 65 174.335 174.335 175.595 -1.260 18093 2482 1 4 . 1 1 65 65 SER CA C 65 58.927 58.927 61.052 -2.125 18093 2483 1 4 . 1 1 65 65 SER CB C 65 63.621 63.621 63.076 0.545 18093 2484 1 4 . 1 1 65 65 SER H H 65 8.114 8.114 8.701 -0.587 18093 2485 1 4 . 1 1 66 66 VAL N N 66 119.054 119.054 116.854 2.200 18093 2486 1 4 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.068 0.102 18093 2487 1 4 . 1 1 66 66 VAL C C 66 175.278 175.278 176.422 -1.144 18093 2488 1 4 . 1 1 66 66 VAL CA C 66 62.062 62.062 63.982 -1.920 18093 2489 1 4 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.120 0.509 18093 2490 1 4 . 1 1 66 66 VAL H H 66 7.740 7.740 7.747 -0.007 18093 2491 1 4 . 1 1 67 67 SER N N 67 118.882 118.882 115.090 3.792 18093 2492 1 4 . 1 1 67 67 SER HA H 67 4.704 4.704 4.877 -0.173 18093 2493 1 4 . 1 1 67 67 SER CA C 67 56.715 56.715 55.412 1.303 18093 2494 1 4 . 1 1 67 67 SER CB C 67 63.624 63.624 63.516 0.108 18093 2495 1 4 . 1 1 67 67 SER H H 67 8.060 8.060 7.728 0.332 18093 2496 1 4 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.686 -0.286 18093 2497 1 4 . 1 1 68 68 PRO C C 68 176.925 176.925 176.329 0.596 18093 2498 1 4 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.532 1.216 18093 2499 1 4 . 1 1 68 68 PRO CB C 68 32.005 32.005 31.435 0.570 18093 2500 1 4 . 1 1 69 69 SER N N 69 114.930 114.930 118.676 -3.746 18093 2501 1 4 . 1 1 69 69 SER HA H 69 4.422 4.422 4.688 -0.266 18093 2502 1 4 . 1 1 69 69 SER C C 69 175.617 175.617 175.924 -0.307 18093 2503 1 4 . 1 1 69 69 SER CA C 69 58.697 58.697 55.413 3.284 18093 2504 1 4 . 1 1 69 69 SER CB C 69 63.804 63.804 65.883 -2.079 18093 2505 1 4 . 1 1 69 69 SER H H 69 8.205 8.205 7.776 0.429 18093 2506 1 4 . 1 1 70 70 ILE N N 70 120.840 120.840 124.266 -3.426 18093 2507 1 4 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.066 -0.074 18093 2508 1 4 . 1 1 70 70 ILE C C 70 177.524 177.524 176.814 0.710 18093 2509 1 4 . 1 1 70 70 ILE CA C 70 64.335 64.335 62.648 1.687 18093 2510 1 4 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.191 -0.731 18093 2511 1 4 . 1 1 70 70 ILE H H 70 8.283 8.283 8.885 -0.602 18093 2512 1 4 . 1 1 71 71 GLY N N 71 107.823 107.823 107.643 0.180 18093 2513 1 4 . 1 1 71 71 GLY C C 71 175.296 175.296 176.082 -0.786 18093 2514 1 4 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.171 0.284 18093 2515 1 4 . 1 1 71 71 GLY H H 71 8.557 8.557 8.539 0.018 18093 2516 1 4 . 1 1 72 72 GLU N N 72 120.835 120.835 120.587 0.248 18093 2517 1 4 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.317 -0.470 18093 2518 1 4 . 1 1 72 72 GLU C C 72 178.198 178.198 178.163 0.035 18093 2519 1 4 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.508 1.609 18093 2520 1 4 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.934 -0.541 18093 2521 1 4 . 1 1 72 72 GLU H H 72 7.922 7.922 7.756 0.166 18093 2522 1 4 . 1 1 73 73 TYR N N 73 117.375 117.375 122.426 -5.051 18093 2523 1 4 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.305 -0.143 18093 2524 1 4 . 1 1 73 73 TYR C C 73 179.912 179.912 177.360 2.552 18093 2525 1 4 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.565 0.590 18093 2526 1 4 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.680 0.086 18093 2527 1 4 . 1 1 73 73 TYR H H 73 8.062 8.062 7.932 0.130 18093 2528 1 4 . 1 1 74 74 LEU N N 74 121.493 121.493 118.937 2.556 18093 2529 1 4 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.773 0.276 18093 2530 1 4 . 1 1 74 74 LEU C C 74 178.063 178.063 178.789 -0.726 18093 2531 1 4 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.642 0.853 18093 2532 1 4 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.763 0.084 18093 2533 1 4 . 1 1 74 74 LEU H H 74 8.552 8.552 8.959 -0.407 18093 2534 1 4 . 1 1 75 75 LEU N N 75 120.375 120.375 120.389 -0.014 18093 2535 1 4 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.009 0.031 18093 2536 1 4 . 1 1 75 75 LEU C C 75 178.515 178.515 178.377 0.138 18093 2537 1 4 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.283 0.355 18093 2538 1 4 . 1 1 75 75 LEU CB C 75 42.039 42.039 42.173 -0.134 18093 2539 1 4 . 1 1 75 75 LEU H H 75 8.276 8.276 7.476 0.800 18093 2540 1 4 . 1 1 76 76 PHE N N 76 116.626 116.626 117.898 -1.272 18093 2541 1 4 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.070 0.009 18093 2542 1 4 . 1 1 76 76 PHE C C 76 177.399 177.399 178.109 -0.710 18093 2543 1 4 . 1 1 76 76 PHE CA C 76 61.734 61.734 62.200 -0.466 18093 2544 1 4 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.555 0.186 18093 2545 1 4 . 1 1 76 76 PHE H H 76 8.454 8.454 8.153 0.301 18093 2546 1 4 . 1 1 77 77 THR N N 77 116.080 116.080 116.049 0.031 18093 2547 1 4 . 1 1 77 77 THR HA H 77 3.687 3.687 3.878 -0.191 18093 2548 1 4 . 1 1 77 77 THR C C 77 176.018 176.018 176.443 -0.425 18093 2549 1 4 . 1 1 77 77 THR CA C 77 68.640 68.640 67.121 1.519 18093 2550 1 4 . 1 1 77 77 THR H H 77 8.224 8.224 8.443 -0.219 18093 2551 1 4 . 1 1 78 78 MET N N 78 119.394 119.394 120.522 -1.128 18093 2552 1 4 . 1 1 78 78 MET HA H 78 4.129 4.129 4.069 0.060 18093 2553 1 4 . 1 1 78 78 MET C C 78 179.608 179.608 178.786 0.822 18093 2554 1 4 . 1 1 78 78 MET CA C 78 58.831 58.831 58.837 -0.006 18093 2555 1 4 . 1 1 78 78 MET CB C 78 31.590 31.590 32.215 -0.625 18093 2556 1 4 . 1 1 78 78 MET H H 78 8.372 8.372 7.553 0.819 18093 2557 1 4 . 1 1 79 79 ILE N N 79 121.819 121.819 118.873 2.946 18093 2558 1 4 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.686 -0.136 18093 2559 1 4 . 1 1 79 79 ILE C C 79 176.426 176.426 177.603 -1.177 18093 2560 1 4 . 1 1 79 79 ILE CA C 79 65.876 65.876 64.758 1.118 18093 2561 1 4 . 1 1 79 79 ILE CB C 79 37.673 37.673 37.657 0.016 18093 2562 1 4 . 1 1 79 79 ILE H H 79 8.391 8.391 8.035 0.356 18093 2563 1 4 . 1 1 80 80 PHE N N 80 119.916 119.916 121.071 -1.155 18093 2564 1 4 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.157 -0.104 18093 2565 1 4 . 1 1 80 80 PHE C C 80 178.568 178.568 177.074 1.494 18093 2566 1 4 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.070 0.237 18093 2567 1 4 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.675 -0.901 18093 2568 1 4 . 1 1 80 80 PHE H H 80 8.479 8.479 7.699 0.780 18093 2569 1 4 . 1 1 81 81 VAL N N 81 120.191 120.191 116.031 4.160 18093 2570 1 4 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.492 -0.039 18093 2571 1 4 . 1 1 81 81 VAL C C 81 178.225 178.225 177.726 0.499 18093 2572 1 4 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.888 0.520 18093 2573 1 4 . 1 1 81 81 VAL CB C 81 31.556 31.556 31.474 0.082 18093 2574 1 4 . 1 1 81 81 VAL H H 81 8.928 8.928 8.839 0.089 18093 2575 1 4 . 1 1 82 82 THR N N 82 115.930 115.930 116.628 -0.698 18093 2576 1 4 . 1 1 82 82 THR HA H 82 3.636 3.636 4.002 -0.366 18093 2577 1 4 . 1 1 82 82 THR C C 82 176.420 176.420 176.342 0.078 18093 2578 1 4 . 1 1 82 82 THR CA C 82 68.570 68.570 66.893 1.677 18093 2579 1 4 . 1 1 82 82 THR CB C 82 68.202 68.202 68.829 -0.627 18093 2580 1 4 . 1 1 82 82 THR H H 82 7.969 7.969 7.417 0.552 18093 2581 1 4 . 1 1 83 83 LEU N N 83 119.780 119.780 120.577 -0.797 18093 2582 1 4 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.917 -0.070 18093 2583 1 4 . 1 1 83 83 LEU C C 83 178.214 178.214 178.745 -0.531 18093 2584 1 4 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.389 0.848 18093 2585 1 4 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.386 0.405 18093 2586 1 4 . 1 1 83 83 LEU H H 83 8.483 8.483 7.444 1.039 18093 2587 1 4 . 1 1 84 84 SER N N 84 114.559 114.559 116.347 -1.788 18093 2588 1 4 . 1 1 84 84 SER HA H 84 4.099 4.099 4.012 0.087 18093 2589 1 4 . 1 1 84 84 SER C C 84 176.799 176.799 176.499 0.300 18093 2590 1 4 . 1 1 84 84 SER CA C 84 63.609 63.609 62.760 0.849 18093 2591 1 4 . 1 1 84 84 SER CB C 84 63.110 63.110 62.952 0.158 18093 2592 1 4 . 1 1 84 84 SER H H 84 8.023 8.023 8.015 0.008 18093 2593 1 4 . 1 1 85 85 ILE N N 85 123.962 123.962 121.569 2.393 18093 2594 1 4 . 1 1 85 85 ILE HA H 85 3.604 3.604 4.007 -0.403 18093 2595 1 4 . 1 1 85 85 ILE C C 85 177.487 177.487 177.876 -0.389 18093 2596 1 4 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.186 0.574 18093 2597 1 4 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.931 -0.043 18093 2598 1 4 . 1 1 85 85 ILE H H 85 8.054 8.054 7.957 0.097 18093 2599 1 4 . 1 1 86 86 VAL N N 86 118.744 118.744 120.702 -1.958 18093 2600 1 4 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.889 -0.370 18093 2601 1 4 . 1 1 86 86 VAL C C 86 177.557 177.557 177.728 -0.171 18093 2602 1 4 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.638 0.897 18093 2603 1 4 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.948 -0.482 18093 2604 1 4 . 1 1 86 86 VAL H H 86 8.158 8.158 7.378 0.780 18093 2605 1 4 . 1 1 87 87 ILE N N 87 117.206 117.206 119.533 -2.327 18093 2606 1 4 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.803 -0.199 18093 2607 1 4 . 1 1 87 87 ILE C C 87 177.283 177.283 178.457 -1.174 18093 2608 1 4 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.873 1.803 18093 2609 1 4 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.626 0.963 18093 2610 1 4 . 1 1 87 87 ILE H H 87 8.459 8.459 8.463 -0.004 18093 2611 1 4 . 1 1 88 88 THR N N 88 116.158 116.158 116.975 -0.817 18093 2612 1 4 . 1 1 88 88 THR HA H 88 3.672 3.672 4.276 -0.604 18093 2613 1 4 . 1 1 88 88 THR C C 88 175.485 175.485 176.905 -1.420 18093 2614 1 4 . 1 1 88 88 THR CA C 88 68.549 68.549 67.604 0.945 18093 2615 1 4 . 1 1 88 88 THR CB C 88 68.127 68.127 69.147 -1.020 18093 2616 1 4 . 1 1 88 88 THR H H 88 7.776 7.776 8.579 -0.803 18093 2617 1 4 . 1 1 89 89 VAL N N 89 117.985 117.985 121.370 -3.385 18093 2618 1 4 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.856 -0.313 18093 2619 1 4 . 1 1 89 89 VAL C C 89 177.393 177.393 177.740 -0.347 18093 2620 1 4 . 1 1 89 89 VAL CA C 89 66.590 66.590 64.810 1.780 18093 2621 1 4 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.360 0.418 18093 2622 1 4 . 1 1 89 89 VAL H H 89 8.206 8.206 7.727 0.479 18093 2623 1 4 . 1 1 90 90 PHE N N 90 116.709 116.709 120.260 -3.551 18093 2624 1 4 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.255 0.123 18093 2625 1 4 . 1 1 90 90 PHE C C 90 177.305 177.305 177.793 -0.488 18093 2626 1 4 . 1 1 90 90 PHE CA C 90 61.119 61.119 62.358 -1.239 18093 2627 1 4 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.652 0.733 18093 2628 1 4 . 1 1 90 90 PHE H H 90 7.956 7.956 7.761 0.195 18093 2629 1 4 . 1 1 91 91 VAL N N 91 116.565 116.565 119.273 -2.708 18093 2630 1 4 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.786 0.049 18093 2631 1 4 . 1 1 91 91 VAL C C 91 176.927 176.927 177.127 -0.200 18093 2632 1 4 . 1 1 91 91 VAL CA C 91 65.347 65.347 66.013 -0.666 18093 2633 1 4 . 1 1 91 91 VAL CB C 91 31.867 31.867 32.016 -0.149 18093 2634 1 4 . 1 1 91 91 VAL H H 91 8.239 8.239 7.704 0.535 18093 2635 1 4 . 1 1 92 92 LEU N N 92 117.443 117.443 116.473 0.970 18093 2636 1 4 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.334 -0.140 18093 2637 1 4 . 1 1 92 92 LEU C C 92 177.180 177.180 178.116 -0.936 18093 2638 1 4 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.432 -0.248 18093 2639 1 4 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.047 -0.103 18093 2640 1 4 . 1 1 92 92 LEU H H 92 7.967 7.967 7.715 0.252 18093 2641 1 4 . 1 1 93 93 ASN N N 93 116.705 116.705 118.352 -1.647 18093 2642 1 4 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.532 0.115 18093 2643 1 4 . 1 1 93 93 ASN C C 93 175.129 175.129 176.695 -1.566 18093 2644 1 4 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.555 -1.701 18093 2645 1 4 . 1 1 93 93 ASN CB C 93 39.395 39.395 38.208 1.187 18093 2646 1 4 . 1 1 93 93 ASN H H 93 7.683 7.683 7.817 -0.134 18093 2647 1 4 . 1 1 94 94 VAL N N 94 118.224 118.224 117.725 0.499 18093 2648 1 4 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.744 0.217 18093 2649 1 4 . 1 1 94 94 VAL C C 94 175.600 175.600 175.635 -0.035 18093 2650 1 4 . 1 1 94 94 VAL CA C 94 62.825 62.825 63.002 -0.177 18093 2651 1 4 . 1 1 94 94 VAL CB C 94 32.214 32.214 31.774 0.440 18093 2652 1 4 . 1 1 94 94 VAL H H 94 7.627 7.627 7.466 0.161 18093 2653 1 4 . 1 1 95 95 HIS N N 95 120.999 120.999 119.336 1.663 18093 2654 1 4 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.523 0.070 18093 2655 1 4 . 1 1 95 95 HIS C C 95 174.146 174.146 175.095 -0.949 18093 2656 1 4 . 1 1 95 95 HIS CA C 95 55.666 55.666 57.079 -1.413 18093 2657 1 4 . 1 1 95 95 HIS CB C 95 29.736 29.736 28.520 1.216 18093 2658 1 4 . 1 1 95 95 HIS H H 95 8.263 8.263 7.432 0.831 18093 2659 1 4 . 1 1 96 96 HIS N N 96 122.740 122.740 123.719 -0.979 18093 2660 1 4 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.671 -0.038 18093 2661 1 4 . 1 1 96 96 HIS CA C 96 55.895 55.895 55.747 0.148 18093 2662 1 4 . 1 1 96 96 HIS CB C 96 29.750 29.750 30.848 -1.098 18093 2663 1 4 . 1 1 96 96 HIS H H 96 8.298 8.298 8.549 -0.251 18093 2664 1 4 . 1 1 97 97 ARG N N 97 118.503 118.503 119.861 -1.358 18093 2665 1 4 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.506 -0.194 18093 2666 1 4 . 1 1 97 97 ARG C C 97 175.776 175.776 174.176 1.600 18093 2667 1 4 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.687 0.538 18093 2668 1 4 . 1 1 97 97 ARG CB C 97 30.912 30.912 31.231 -0.319 18093 2669 1 4 . 1 1 97 97 ARG H H 97 8.250 8.250 7.723 0.527 18093 2670 1 4 . 1 1 98 98 SER N N 98 118.482 118.482 117.456 1.026 18093 2671 1 4 . 1 1 98 98 SER HA H 98 4.722 4.722 5.067 -0.345 18093 2672 1 4 . 1 1 98 98 SER CA C 98 56.547 56.547 56.037 0.510 18093 2673 1 4 . 1 1 98 98 SER CB C 98 63.624 63.624 64.218 -0.594 18093 2674 1 4 . 1 1 98 98 SER H H 98 8.254 8.254 8.485 -0.231 18093 2675 1 4 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.428 -0.025 18093 2676 1 4 . 1 1 99 99 PRO C C 99 176.899 176.899 176.809 0.090 18093 2677 1 4 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.663 -0.962 18093 2678 1 4 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.473 -0.524 18093 2679 1 4 . 1 1 100 100 GLU N N 100 120.187 120.187 115.539 4.648 18093 2680 1 4 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.335 -0.047 18093 2681 1 4 . 1 1 100 100 GLU C C 100 176.593 176.593 176.372 0.221 18093 2682 1 4 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.915 -0.193 18093 2683 1 4 . 1 1 100 100 GLU CB C 100 29.999 29.999 30.030 -0.031 18093 2684 1 4 . 1 1 100 100 GLU H H 100 8.401 8.401 8.292 0.109 18093 2685 1 4 . 1 1 101 101 THR N N 101 113.968 113.968 112.624 1.344 18093 2686 1 4 . 1 1 101 101 THR HA H 101 4.286 4.286 4.476 -0.190 18093 2687 1 4 . 1 1 101 101 THR C C 101 174.525 174.525 175.246 -0.721 18093 2688 1 4 . 1 1 101 101 THR CA C 101 61.956 61.956 62.449 -0.493 18093 2689 1 4 . 1 1 101 101 THR CB C 101 69.697 69.697 69.739 -0.042 18093 2690 1 4 . 1 1 101 101 THR H H 101 7.945 7.945 7.869 0.076 18093 2691 1 4 . 1 1 102 102 HIS N N 102 120.322 120.322 118.450 1.872 18093 2692 1 4 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.695 0.046 18093 2693 1 4 . 1 1 102 102 HIS C C 102 174.783 174.783 173.748 1.035 18093 2694 1 4 . 1 1 102 102 HIS CA C 102 55.701 55.701 56.815 -1.114 18093 2695 1 4 . 1 1 102 102 HIS CB C 102 29.093 29.093 32.089 -2.996 18093 2696 1 4 . 1 1 102 102 HIS H H 102 8.455 8.455 8.204 0.251 18093 2697 1 4 . 1 1 103 103 THR N N 103 114.282 114.282 113.207 1.075 18093 2698 1 4 . 1 1 103 103 THR HA H 103 4.352 4.352 4.745 -0.393 18093 2699 1 4 . 1 1 103 103 THR C C 103 175.104 175.104 175.194 -0.090 18093 2700 1 4 . 1 1 103 103 THR CA C 103 62.057 62.057 61.268 0.789 18093 2701 1 4 . 1 1 103 103 THR CB C 103 69.966 69.966 70.356 -0.390 18093 2702 1 4 . 1 1 103 103 THR H H 103 8.069 8.069 7.799 0.270 18093 2703 1 4 . 1 1 104 104 GLY N N 104 111.159 111.159 113.012 -1.853 18093 2704 1 4 . 1 1 104 104 GLY C C 104 174.776 174.776 175.066 -0.290 18093 2705 1 4 . 1 1 104 104 GLY CA C 104 45.588 45.588 45.525 0.063 18093 2706 1 4 . 1 1 104 104 GLY H H 104 8.393 8.393 8.667 -0.274 18093 2707 1 4 . 1 1 105 105 GLY N N 105 108.657 108.657 109.609 -0.952 18093 2708 1 4 . 1 1 105 105 GLY C C 105 174.957 174.957 175.198 -0.241 18093 2709 1 4 . 1 1 105 105 GLY CA C 105 45.612 45.612 44.786 0.826 18093 2710 1 4 . 1 1 105 105 GLY H H 105 8.275 8.275 8.170 0.105 18093 2711 1 4 . 1 1 106 106 GLY N N 106 108.870 108.870 108.583 0.287 18093 2712 1 4 . 1 1 106 106 GLY C C 106 174.877 174.877 174.718 0.159 18093 2713 1 4 . 1 1 106 106 GLY CA C 106 45.665 45.665 45.574 0.091 18093 2714 1 4 . 1 1 106 106 GLY H H 106 8.357 8.357 8.605 -0.248 18093 2715 1 4 . 1 1 107 107 GLY N N 107 108.476 108.476 107.154 1.322 18093 2716 1 4 . 1 1 107 107 GLY C C 107 174.877 174.877 174.622 0.255 18093 2717 1 4 . 1 1 107 107 GLY CA C 107 45.696 45.696 44.640 1.056 18093 2718 1 4 . 1 1 107 107 GLY H H 107 8.330 8.330 8.406 -0.076 18093 2719 1 4 . 1 1 108 108 GLY N N 108 108.486 108.486 111.173 -2.687 18093 2720 1 4 . 1 1 108 108 GLY C C 108 175.345 175.345 175.727 -0.382 18093 2721 1 4 . 1 1 108 108 GLY CA C 108 45.763 45.763 45.077 0.686 18093 2722 1 4 . 1 1 108 108 GLY H H 108 8.328 8.328 8.759 -0.431 18093 2723 1 4 . 1 1 109 109 ILE N N 109 120.433 120.433 119.357 1.076 18093 2724 1 4 . 1 1 109 109 ILE HA H 109 3.968 3.968 4.029 -0.061 18093 2725 1 4 . 1 1 109 109 ILE C C 109 176.127 176.127 177.068 -0.941 18093 2726 1 4 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.501 -0.766 18093 2727 1 4 . 1 1 109 109 ILE CB C 109 38.125 38.125 37.593 0.532 18093 2728 1 4 . 1 1 109 109 ILE H H 109 8.192 8.192 7.920 0.272 18093 2729 1 4 . 1 1 110 110 ASP N N 110 121.148 121.148 120.866 0.282 18093 2730 1 4 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.613 -0.307 18093 2731 1 4 . 1 1 110 110 ASP C C 110 177.651 177.651 178.036 -0.385 18093 2732 1 4 . 1 1 110 110 ASP CA C 110 56.776 56.776 58.106 -1.330 18093 2733 1 4 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.704 0.393 18093 2734 1 4 . 1 1 110 110 ASP H H 110 8.427 8.427 8.574 -0.147 18093 2735 1 4 . 1 1 111 111 ARG N N 111 119.228 119.228 119.829 -0.601 18093 2736 1 4 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.180 -0.184 18093 2737 1 4 . 1 1 111 111 ARG C C 111 177.786 177.786 178.928 -1.142 18093 2738 1 4 . 1 1 111 111 ARG CA C 111 58.942 58.942 58.921 0.021 18093 2739 1 4 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.885 0.311 18093 2740 1 4 . 1 1 111 111 ARG H H 111 7.850 7.850 8.495 -0.645 18093 2741 1 4 . 1 1 112 112 ILE N N 112 118.000 118.000 119.469 -1.469 18093 2742 1 4 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.105 -0.292 18093 2743 1 4 . 1 1 112 112 ILE C C 112 177.496 177.496 177.882 -0.386 18093 2744 1 4 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.180 2.632 18093 2745 1 4 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.924 0.803 18093 2746 1 4 . 1 1 112 112 ILE H H 112 7.764 7.764 7.747 0.017 18093 2747 1 4 . 1 1 113 113 PHE N N 113 118.367 118.367 122.072 -3.705 18093 2748 1 4 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.296 -0.041 18093 2749 1 4 . 1 1 113 113 PHE C C 113 177.218 177.218 177.382 -0.164 18093 2750 1 4 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.322 -0.889 18093 2751 1 4 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.201 -0.394 18093 2752 1 4 . 1 1 113 113 PHE H H 113 7.963 7.963 7.838 0.125 18093 2753 1 4 . 1 1 114 114 LEU N N 114 118.921 118.921 117.197 1.724 18093 2754 1 4 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.924 0.073 18093 2755 1 4 . 1 1 114 114 LEU C C 114 178.297 178.297 178.429 -0.132 18093 2756 1 4 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.146 0.465 18093 2757 1 4 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.203 0.749 18093 2758 1 4 . 1 1 114 114 LEU H H 114 7.939 7.939 8.040 -0.101 18093 2759 1 4 . 1 1 115 115 TRP N N 115 117.464 117.464 119.455 -1.991 18093 2760 1 4 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.361 0.013 18093 2761 1 4 . 1 1 115 115 TRP C C 115 178.572 178.572 178.245 0.327 18093 2762 1 4 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.770 1.153 18093 2763 1 4 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.758 -1.251 18093 2764 1 4 . 1 1 115 115 TRP H H 115 7.969 7.969 7.597 0.372 18093 2765 1 4 . 1 1 116 116 MET N N 116 117.069 117.069 118.918 -1.849 18093 2766 1 4 . 1 1 116 116 MET HA H 116 4.065 4.065 4.217 -0.152 18093 2767 1 4 . 1 1 116 116 MET C C 116 177.425 177.425 178.192 -0.767 18093 2768 1 4 . 1 1 116 116 MET CA C 116 59.289 59.289 59.105 0.184 18093 2769 1 4 . 1 1 116 116 MET CB C 116 31.692 31.692 32.542 -0.850 18093 2770 1 4 . 1 1 116 116 MET H H 116 8.465 8.465 7.721 0.744 18093 2771 1 4 . 1 1 117 117 PHE N N 117 118.755 118.755 117.561 1.194 18093 2772 1 4 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.099 0.000 18093 2773 1 4 . 1 1 117 117 PHE C C 117 177.965 177.965 178.185 -0.220 18093 2774 1 4 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.212 -0.503 18093 2775 1 4 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.260 0.925 18093 2776 1 4 . 1 1 117 117 PHE H H 117 8.418 8.418 7.867 0.551 18093 2777 1 4 . 1 1 118 118 ILE N N 118 119.133 119.133 115.230 3.903 18093 2778 1 4 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.892 -0.548 18093 2779 1 4 . 1 1 118 118 ILE C C 118 177.244 177.244 177.387 -0.143 18093 2780 1 4 . 1 1 118 118 ILE CA C 118 65.825 65.825 63.971 1.854 18093 2781 1 4 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.814 -0.266 18093 2782 1 4 . 1 1 118 118 ILE H H 118 8.266 8.266 7.663 0.603 18093 2783 1 4 . 1 1 119 119 ILE N N 119 118.846 118.846 121.516 -2.670 18093 2784 1 4 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.933 -0.361 18093 2785 1 4 . 1 1 119 119 ILE C C 119 177.523 177.523 177.471 0.052 18093 2786 1 4 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.184 0.705 18093 2787 1 4 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.233 -0.669 18093 2788 1 4 . 1 1 119 119 ILE H H 119 8.308 8.308 7.291 1.017 18093 2789 1 4 . 1 1 120 120 VAL N N 120 119.228 119.228 118.125 1.103 18093 2790 1 4 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.875 -0.367 18093 2791 1 4 . 1 1 120 120 VAL C C 120 177.651 177.651 177.335 0.316 18093 2792 1 4 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.401 2.200 18093 2793 1 4 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.655 0.751 18093 2794 1 4 . 1 1 120 120 VAL H H 120 8.399 8.399 7.978 0.421 18093 2795 1 4 . 1 1 121 121 CYS N N 121 117.151 117.151 119.920 -2.769 18093 2796 1 4 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.201 -0.298 18093 2797 1 4 . 1 1 121 121 CYS C C 121 177.719 177.719 177.010 0.709 18093 2798 1 4 . 1 1 121 121 CYS CA C 121 64.298 64.298 63.528 0.770 18093 2799 1 4 . 1 1 121 121 CYS CB C 121 26.677 26.677 26.209 0.468 18093 2800 1 4 . 1 1 121 121 CYS H H 121 8.008 8.008 7.500 0.508 18093 2801 1 4 . 1 1 122 122 LEU N N 122 121.402 121.402 119.663 1.739 18093 2802 1 4 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.134 -0.151 18093 2803 1 4 . 1 1 122 122 LEU C C 122 178.282 178.282 178.875 -0.593 18093 2804 1 4 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.741 0.804 18093 2805 1 4 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.159 0.807 18093 2806 1 4 . 1 1 122 122 LEU H H 122 8.417 8.417 7.634 0.783 18093 2807 1 4 . 1 1 123 123 LEU N N 123 118.543 118.543 120.401 -1.858 18093 2808 1 4 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.020 -0.100 18093 2809 1 4 . 1 1 123 123 LEU C C 123 179.028 179.028 178.744 0.284 18093 2810 1 4 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.426 -0.309 18093 2811 1 4 . 1 1 123 123 LEU CB C 123 42.056 42.056 40.990 1.066 18093 2812 1 4 . 1 1 123 123 LEU H H 123 8.590 8.590 7.659 0.931 18093 2813 1 4 . 1 1 124 124 GLY N N 124 104.896 104.896 105.232 -0.336 18093 2814 1 4 . 1 1 124 124 GLY C C 124 173.932 173.932 176.066 -2.134 18093 2815 1 4 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.647 -0.420 18093 2816 1 4 . 1 1 124 124 GLY H H 124 8.601 8.601 8.584 0.017 18093 2817 1 4 . 1 1 125 125 THR N N 125 115.403 115.403 119.361 -3.958 18093 2818 1 4 . 1 1 125 125 THR HA H 125 3.686 3.686 4.000 -0.314 18093 2819 1 4 . 1 1 125 125 THR C C 125 176.407 176.407 176.626 -0.219 18093 2820 1 4 . 1 1 125 125 THR CA C 125 67.565 67.565 67.309 0.256 18093 2821 1 4 . 1 1 125 125 THR CB C 125 68.143 68.143 68.735 -0.592 18093 2822 1 4 . 1 1 125 125 THR H H 125 7.734 7.734 7.383 0.351 18093 2823 1 4 . 1 1 126 126 VAL N N 126 119.056 119.056 121.839 -2.783 18093 2824 1 4 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.521 0.018 18093 2825 1 4 . 1 1 126 126 VAL C C 126 177.628 177.628 177.854 -0.226 18093 2826 1 4 . 1 1 126 126 VAL CA C 126 66.601 66.601 67.178 -0.577 18093 2827 1 4 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.645 -0.151 18093 2828 1 4 . 1 1 126 126 VAL H H 126 8.015 8.015 8.237 -0.222 18093 2829 1 4 . 1 1 127 127 GLY N N 127 104.644 104.644 107.642 -2.998 18093 2830 1 4 . 1 1 127 127 GLY C C 127 173.933 173.933 175.550 -1.617 18093 2831 1 4 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.052 0.229 18093 2832 1 4 . 1 1 127 127 GLY H H 127 8.248 8.248 8.338 -0.090 18093 2833 1 4 . 1 1 128 128 LEU N N 128 117.354 117.354 120.228 -2.874 18093 2834 1 4 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.148 -0.136 18093 2835 1 4 . 1 1 128 128 LEU C C 128 177.443 177.443 178.092 -0.649 18093 2836 1 4 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.825 -0.200 18093 2837 1 4 . 1 1 128 128 LEU CB C 128 42.260 42.260 42.044 0.216 18093 2838 1 4 . 1 1 128 128 LEU H H 128 7.568 7.568 7.848 -0.280 18093 2839 1 4 . 1 1 129 129 PHE N N 129 113.971 113.971 117.664 -3.693 18093 2840 1 4 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.377 0.081 18093 2841 1 4 . 1 1 129 129 PHE C C 129 176.216 176.216 176.285 -0.069 18093 2842 1 4 . 1 1 129 129 PHE CA C 129 58.385 58.385 60.618 -2.233 18093 2843 1 4 . 1 1 129 129 PHE CB C 129 39.719 39.719 40.266 -0.547 18093 2844 1 4 . 1 1 129 129 PHE H H 129 7.639 7.639 7.707 -0.068 18093 2845 1 4 . 1 1 130 130 LEU N N 130 117.752 117.752 119.864 -2.112 18093 2846 1 4 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.180 0.253 18093 2847 1 4 . 1 1 130 130 LEU CA C 130 54.156 54.156 54.609 -0.453 18093 2848 1 4 . 1 1 130 130 LEU H H 130 8.099 8.099 8.254 -0.155 18093 2849 1 4 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.890 -0.440 18093 2850 1 4 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.856 2.043 18093 2851 1 4 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.429 -0.167 18093 2852 1 4 . 1 1 132 132 PRO C C 132 177.616 177.616 178.060 -0.444 18093 2853 1 4 . 1 1 132 132 PRO CA C 132 64.980 64.980 65.014 -0.034 18093 2854 1 4 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.297 -0.672 18093 2855 1 4 . 1 1 133 133 TRP N N 133 115.508 115.508 118.966 -3.458 18093 2856 1 4 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.495 0.097 18093 2857 1 4 . 1 1 133 133 TRP C C 133 176.842 176.842 176.297 0.545 18093 2858 1 4 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.423 -2.140 18093 2859 1 4 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.676 -1.080 18093 2860 1 4 . 1 1 133 133 TRP H H 133 7.311 7.311 8.090 -0.779 18093 2861 1 4 . 1 1 134 134 LEU N N 134 119.570 119.570 115.335 4.235 18093 2862 1 4 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.472 -0.295 18093 2863 1 4 . 1 1 134 134 LEU C C 134 175.768 175.768 176.785 -1.017 18093 2864 1 4 . 1 1 134 134 LEU CA C 134 55.621 55.621 54.141 1.480 18093 2865 1 4 . 1 1 134 134 LEU CB C 134 42.648 42.648 40.821 1.827 18093 2866 1 4 . 1 1 134 134 LEU H H 134 7.453 7.453 7.535 -0.082 18093 2867 1 4 . 1 1 135 135 ALA N N 135 119.004 119.004 123.199 -4.195 18093 2868 1 4 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.420 -0.197 18093 2869 1 4 . 1 1 135 135 ALA C C 135 177.170 177.170 177.892 -0.722 18093 2870 1 4 . 1 1 135 135 ALA CA C 135 52.456 52.456 53.508 -1.052 18093 2871 1 4 . 1 1 135 135 ALA CB C 135 19.736 19.736 20.413 -0.677 18093 2872 1 4 . 1 1 135 135 ALA H H 135 7.541 7.541 7.384 0.157 18093 2873 1 4 . 1 1 136 136 GLY N N 136 105.879 105.879 107.698 -1.819 18093 2874 1 4 . 1 1 136 136 GLY C C 136 173.042 173.042 173.625 -0.583 18093 2875 1 4 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.619 0.074 18093 2876 1 4 . 1 1 136 136 GLY H H 136 7.846 7.846 8.195 -0.349 18093 2877 1 5 . 1 1 5 5 GLU N N 5 119.627 119.627 118.916 0.711 18093 2878 1 5 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.473 -0.265 18093 2879 1 5 . 1 1 5 5 GLU C C 5 176.581 176.581 174.973 1.608 18093 2880 1 5 . 1 1 5 5 GLU CA C 5 57.045 57.045 57.111 -0.066 18093 2881 1 5 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.334 0.704 18093 2882 1 5 . 1 1 5 5 GLU H H 5 8.003 8.003 8.477 -0.474 18093 2883 1 5 . 1 1 6 6 LEU N N 6 121.267 121.267 122.367 -1.100 18093 2884 1 5 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.712 -0.287 18093 2885 1 5 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.158 2.477 18093 2886 1 5 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.975 -0.679 18093 2887 1 5 . 1 1 6 6 LEU H H 6 8.104 8.104 7.920 0.184 18093 2888 1 5 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.587 -0.188 18093 2889 1 5 . 1 1 7 7 PRO C C 7 178.408 178.408 178.002 0.406 18093 2890 1 5 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.097 2.615 18093 2891 1 5 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.851 -0.934 18093 2892 1 5 . 1 1 8 8 LEU N N 8 121.835 121.835 121.040 0.795 18093 2893 1 5 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.144 -0.055 18093 2894 1 5 . 1 1 8 8 LEU C C 8 177.902 177.902 178.344 -0.442 18093 2895 1 5 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.671 0.434 18093 2896 1 5 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.184 0.423 18093 2897 1 5 . 1 1 8 8 LEU H H 8 8.162 8.162 8.591 -0.429 18093 2898 1 5 . 1 1 9 9 PHE N N 9 118.342 118.342 119.087 -0.745 18093 2899 1 5 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.144 0.045 18093 2900 1 5 . 1 1 9 9 PHE C C 9 177.596 177.596 177.102 0.494 18093 2901 1 5 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.176 -0.062 18093 2902 1 5 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.222 0.505 18093 2903 1 5 . 1 1 9 9 PHE H H 9 8.318 8.318 8.202 0.116 18093 2904 1 5 . 1 1 10 10 TYR N N 10 117.584 117.584 118.773 -1.189 18093 2905 1 5 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.803 0.351 18093 2906 1 5 . 1 1 10 10 TYR C C 10 177.630 177.630 177.075 0.555 18093 2907 1 5 . 1 1 10 10 TYR CA C 10 61.036 61.036 59.977 1.059 18093 2908 1 5 . 1 1 10 10 TYR CB C 10 38.660 38.660 37.978 0.681 18093 2909 1 5 . 1 1 10 10 TYR H H 10 8.105 8.105 8.404 -0.299 18093 2910 1 5 . 1 1 11 11 THR N N 11 115.563 115.563 116.354 -0.791 18093 2911 1 5 . 1 1 11 11 THR HA H 11 3.871 3.871 3.888 -0.017 18093 2912 1 5 . 1 1 11 11 THR C C 11 175.955 175.955 176.512 -0.557 18093 2913 1 5 . 1 1 11 11 THR CA C 11 67.290 67.290 66.708 0.582 18093 2914 1 5 . 1 1 11 11 THR CB C 11 68.201 68.201 68.482 -0.281 18093 2915 1 5 . 1 1 11 11 THR H H 11 7.915 7.915 7.676 0.239 18093 2916 1 5 . 1 1 12 12 ILE N N 12 119.727 119.727 119.960 -0.233 18093 2917 1 5 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.851 -0.152 18093 2918 1 5 . 1 1 12 12 ILE C C 12 175.773 175.773 177.273 -1.500 18093 2919 1 5 . 1 1 12 12 ILE CA C 12 64.699 64.699 62.438 2.261 18093 2920 1 5 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.785 1.310 18093 2921 1 5 . 1 1 12 12 ILE H H 12 8.186 8.186 7.873 0.313 18093 2922 1 5 . 1 1 13 13 ASN N N 13 114.190 114.190 118.790 -4.600 18093 2923 1 5 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.515 -0.093 18093 2924 1 5 . 1 1 13 13 ASN C C 13 174.786 174.786 176.540 -1.754 18093 2925 1 5 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.126 0.429 18093 2926 1 5 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.642 0.716 18093 2927 1 5 . 1 1 13 13 ASN H H 13 7.601 7.601 7.323 0.278 18093 2928 1 5 . 1 1 14 14 LEU N N 14 115.031 115.031 118.724 -3.693 18093 2929 1 5 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.006 0.190 18093 2930 1 5 . 1 1 14 14 LEU C C 14 177.540 177.540 177.994 -0.454 18093 2931 1 5 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.279 0.128 18093 2932 1 5 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.169 -0.327 18093 2933 1 5 . 1 1 14 14 LEU H H 14 7.390 7.390 7.266 0.124 18093 2934 1 5 . 1 1 15 15 ILE N N 15 118.223 118.223 120.406 -2.183 18093 2935 1 5 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.710 -0.097 18093 2936 1 5 . 1 1 15 15 ILE CA C 15 65.720 65.720 63.236 2.484 18093 2937 1 5 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.207 -0.595 18093 2938 1 5 . 1 1 15 15 ILE H H 15 8.123 8.123 7.377 0.746 18093 2939 1 5 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.292 -0.223 18093 2940 1 5 . 1 1 17 17 PRO C C 17 177.721 177.721 178.908 -1.187 18093 2941 1 5 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.396 1.365 18093 2942 1 5 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.708 0.034 18093 2943 1 5 . 1 1 18 18 CYS N N 18 113.538 113.538 117.163 -3.625 18093 2944 1 5 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.001 0.007 18093 2945 1 5 . 1 1 18 18 CYS C C 18 177.683 177.683 176.683 1.000 18093 2946 1 5 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.795 0.705 18093 2947 1 5 . 1 1 18 18 CYS CB C 18 26.873 26.873 27.023 -0.150 18093 2948 1 5 . 1 1 18 18 CYS H H 18 7.410 7.410 7.379 0.031 18093 2949 1 5 . 1 1 19 19 LEU N N 19 122.545 122.545 118.727 3.818 18093 2950 1 5 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.185 -0.186 18093 2951 1 5 . 1 1 19 19 LEU C C 19 178.608 178.608 179.218 -0.610 18093 2952 1 5 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.285 1.136 18093 2953 1 5 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.392 0.453 18093 2954 1 5 . 1 1 19 19 LEU H H 19 8.635 8.635 7.433 1.202 18093 2955 1 5 . 1 1 20 20 LEU N N 20 119.404 119.404 120.885 -1.481 18093 2956 1 5 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.929 0.077 18093 2957 1 5 . 1 1 20 20 LEU C C 20 178.540 178.540 179.228 -0.688 18093 2958 1 5 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.800 -0.001 18093 2959 1 5 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.840 0.160 18093 2960 1 5 . 1 1 20 20 LEU H H 20 8.392 8.392 7.529 0.863 18093 2961 1 5 . 1 1 21 21 ILE N N 21 117.335 117.335 114.552 2.783 18093 2962 1 5 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.773 -0.122 18093 2963 1 5 . 1 1 21 21 ILE C C 21 177.249 177.249 177.683 -0.434 18093 2964 1 5 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.838 0.423 18093 2965 1 5 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.180 0.780 18093 2966 1 5 . 1 1 21 21 ILE H H 21 8.403 8.403 8.450 -0.047 18093 2967 1 5 . 1 1 22 22 SER N N 22 116.385 116.385 117.631 -1.246 18093 2968 1 5 . 1 1 22 22 SER HA H 22 4.056 4.056 4.244 -0.188 18093 2969 1 5 . 1 1 22 22 SER C C 22 176.813 176.813 176.692 0.121 18093 2970 1 5 . 1 1 22 22 SER CA C 22 63.866 63.866 62.676 1.190 18093 2971 1 5 . 1 1 22 22 SER CB C 22 62.898 62.898 63.135 -0.237 18093 2972 1 5 . 1 1 22 22 SER H H 22 8.271 8.271 7.575 0.696 18093 2973 1 5 . 1 1 23 23 CYS N N 23 119.001 119.001 120.464 -1.463 18093 2974 1 5 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.033 -0.043 18093 2975 1 5 . 1 1 23 23 CYS C C 23 177.594 177.594 176.437 1.157 18093 2976 1 5 . 1 1 23 23 CYS CA C 23 64.429 64.429 64.430 -0.000 18093 2977 1 5 . 1 1 23 23 CYS CB C 23 26.940 26.940 26.739 0.201 18093 2978 1 5 . 1 1 23 23 CYS H H 23 8.161 8.161 8.683 -0.522 18093 2979 1 5 . 1 1 24 24 LEU N N 24 117.814 117.814 121.143 -3.329 18093 2980 1 5 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.825 0.152 18093 2981 1 5 . 1 1 24 24 LEU C C 24 177.944 177.944 178.539 -0.595 18093 2982 1 5 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.655 -0.368 18093 2983 1 5 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.923 -0.020 18093 2984 1 5 . 1 1 24 24 LEU H H 24 8.106 8.106 7.776 0.330 18093 2985 1 5 . 1 1 25 25 THR N N 25 115.670 115.670 112.987 2.683 18093 2986 1 5 . 1 1 25 25 THR HA H 25 3.687 3.687 3.995 -0.308 18093 2987 1 5 . 1 1 25 25 THR C C 25 175.845 175.845 176.602 -0.757 18093 2988 1 5 . 1 1 25 25 THR CA C 25 68.306 68.306 65.690 2.616 18093 2989 1 5 . 1 1 25 25 THR H H 25 7.924 7.924 7.615 0.309 18093 2990 1 5 . 1 1 26 26 VAL N N 26 118.809 118.809 122.283 -3.474 18093 2991 1 5 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.763 -0.248 18093 2992 1 5 . 1 1 26 26 VAL C C 26 177.530 177.530 178.131 -0.601 18093 2993 1 5 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.115 1.165 18093 2994 1 5 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.019 0.705 18093 2995 1 5 . 1 1 26 26 VAL H H 26 7.764 7.764 7.346 0.418 18093 2996 1 5 . 1 1 27 27 LEU N N 27 117.958 117.958 120.935 -2.977 18093 2997 1 5 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.011 0.025 18093 2998 1 5 . 1 1 27 27 LEU C C 27 178.163 178.163 179.396 -1.233 18093 2999 1 5 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.158 0.351 18093 3000 1 5 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.913 1.006 18093 3001 1 5 . 1 1 27 27 LEU H H 27 7.912 7.912 8.199 -0.287 18093 3002 1 5 . 1 1 28 28 VAL N N 28 114.472 114.472 118.166 -3.694 18093 3003 1 5 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.764 -0.229 18093 3004 1 5 . 1 1 28 28 VAL C C 28 176.871 176.871 179.269 -2.398 18093 3005 1 5 . 1 1 28 28 VAL CA C 28 65.977 65.977 66.438 -0.461 18093 3006 1 5 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.451 0.483 18093 3007 1 5 . 1 1 28 28 VAL H H 28 7.892 7.892 7.631 0.261 18093 3008 1 5 . 1 1 29 29 PHE N N 29 115.206 115.206 119.560 -4.354 18093 3009 1 5 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.235 -0.032 18093 3010 1 5 . 1 1 29 29 PHE C C 29 176.614 176.614 176.327 0.287 18093 3011 1 5 . 1 1 29 29 PHE CA C 29 60.964 60.964 61.301 -0.337 18093 3012 1 5 . 1 1 29 29 PHE CB C 29 39.752 39.752 39.048 0.704 18093 3013 1 5 . 1 1 29 29 PHE H H 29 7.748 7.748 7.787 -0.039 18093 3014 1 5 . 1 1 30 30 TYR N N 30 115.975 115.975 117.940 -1.965 18093 3015 1 5 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.447 -0.125 18093 3016 1 5 . 1 1 30 30 TYR C C 30 175.553 175.553 175.064 0.489 18093 3017 1 5 . 1 1 30 30 TYR CA C 30 59.598 59.598 58.894 0.704 18093 3018 1 5 . 1 1 30 30 TYR CB C 30 39.763 39.763 39.899 -0.136 18093 3019 1 5 . 1 1 30 30 TYR H H 30 7.985 7.985 7.548 0.437 18093 3020 1 5 . 1 1 31 31 LEU N N 31 120.780 120.780 120.705 0.075 18093 3021 1 5 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.625 -0.198 18093 3022 1 5 . 1 1 31 31 LEU CA C 31 54.665 54.665 52.958 1.707 18093 3023 1 5 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.458 -1.070 18093 3024 1 5 . 1 1 31 31 LEU H H 31 7.643 7.643 7.449 0.194 18093 3025 1 5 . 1 1 34 34 GLU C C 34 176.271 176.271 176.210 0.061 18093 3026 1 5 . 1 1 34 34 GLU CA C 34 57.590 57.590 56.143 1.447 18093 3027 1 5 . 1 1 35 35 CYS N N 35 116.430 116.430 116.717 -0.287 18093 3028 1 5 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.718 -0.351 18093 3029 1 5 . 1 1 35 35 CYS C C 35 175.198 175.198 176.620 -1.422 18093 3030 1 5 . 1 1 35 35 CYS CA C 35 60.293 60.293 58.744 1.549 18093 3031 1 5 . 1 1 35 35 CYS CB C 35 28.130 28.130 28.349 -0.219 18093 3032 1 5 . 1 1 35 35 CYS H H 35 7.970 7.970 8.568 -0.598 18093 3033 1 5 . 1 1 36 36 GLY N N 36 108.315 108.315 108.861 -0.546 18093 3034 1 5 . 1 1 36 36 GLY C C 36 174.610 174.610 175.232 -0.622 18093 3035 1 5 . 1 1 36 36 GLY CA C 36 46.004 46.004 45.989 0.015 18093 3036 1 5 . 1 1 36 36 GLY H H 36 8.120 8.120 8.222 -0.102 18093 3037 1 5 . 1 1 37 37 GLU N N 37 121.347 121.347 121.058 0.289 18093 3038 1 5 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.109 -0.062 18093 3039 1 5 . 1 1 37 37 GLU C C 37 177.338 177.338 178.692 -1.354 18093 3040 1 5 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.852 -1.345 18093 3041 1 5 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.482 0.088 18093 3042 1 5 . 1 1 37 37 GLU H H 37 8.423 8.423 8.649 -0.226 18093 3043 1 5 . 1 1 38 38 LYS N N 38 123.788 123.788 118.247 5.541 18093 3044 1 5 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.154 0.042 18093 3045 1 5 . 1 1 38 38 LYS C C 38 177.976 177.976 178.644 -0.668 18093 3046 1 5 . 1 1 38 38 LYS CA C 38 58.273 58.273 59.340 -1.067 18093 3047 1 5 . 1 1 38 38 LYS CB C 38 31.649 31.649 32.130 -0.481 18093 3048 1 5 . 1 1 38 38 LYS H H 38 8.211 8.211 8.352 -0.141 18093 3049 1 5 . 1 1 39 39 ILE N N 39 115.675 115.675 120.224 -4.549 18093 3050 1 5 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.698 -0.090 18093 3051 1 5 . 1 1 39 39 ILE C C 39 177.204 177.204 177.997 -0.793 18093 3052 1 5 . 1 1 39 39 ILE CA C 39 65.501 65.501 65.343 0.158 18093 3053 1 5 . 1 1 39 39 ILE H H 39 7.933 7.933 8.005 -0.072 18093 3054 1 5 . 1 1 40 40 THR N N 40 117.411 117.411 115.568 1.843 18093 3055 1 5 . 1 1 40 40 THR HA H 40 3.844 3.844 3.935 -0.091 18093 3056 1 5 . 1 1 40 40 THR C C 40 175.983 175.983 176.646 -0.663 18093 3057 1 5 . 1 1 40 40 THR CA C 40 67.360 67.360 66.667 0.693 18093 3058 1 5 . 1 1 40 40 THR H H 40 8.362 8.362 8.275 0.087 18093 3059 1 5 . 1 1 41 41 LEU N N 41 123.059 123.059 122.804 0.255 18093 3060 1 5 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.062 -0.046 18093 3061 1 5 . 1 1 41 41 LEU C C 41 178.914 178.914 178.061 0.853 18093 3062 1 5 . 1 1 41 41 LEU CA C 41 58.366 58.366 58.191 0.175 18093 3063 1 5 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.923 0.127 18093 3064 1 5 . 1 1 41 41 LEU H H 41 8.282 8.282 7.538 0.744 18093 3065 1 5 . 1 1 42 42 CYS N N 42 118.762 118.762 117.686 1.076 18093 3066 1 5 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.021 -0.085 18093 3067 1 5 . 1 1 42 42 CYS C C 42 176.607 176.607 177.058 -0.451 18093 3068 1 5 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.632 0.685 18093 3069 1 5 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.661 -0.742 18093 3070 1 5 . 1 1 42 42 CYS H H 42 8.195 8.195 7.809 0.386 18093 3071 1 5 . 1 1 43 43 ILE N N 43 117.589 117.589 120.095 -2.506 18093 3072 1 5 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.716 -0.109 18093 3073 1 5 . 1 1 43 43 ILE C C 43 177.323 177.323 177.636 -0.313 18093 3074 1 5 . 1 1 43 43 ILE CA C 43 65.249 65.249 64.832 0.417 18093 3075 1 5 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.755 0.283 18093 3076 1 5 . 1 1 43 43 ILE H H 43 8.428 8.428 7.481 0.947 18093 3077 1 5 . 1 1 44 44 SER N N 44 115.950 115.950 116.615 -0.665 18093 3078 1 5 . 1 1 44 44 SER HA H 44 4.012 4.012 4.188 -0.176 18093 3079 1 5 . 1 1 44 44 SER C C 44 176.965 176.965 176.610 0.355 18093 3080 1 5 . 1 1 44 44 SER CA C 44 63.575 63.575 62.881 0.694 18093 3081 1 5 . 1 1 44 44 SER H H 44 7.984 7.984 8.204 -0.220 18093 3082 1 5 . 1 1 45 45 VAL N N 45 123.544 123.544 119.080 4.464 18093 3083 1 5 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.836 -0.288 18093 3084 1 5 . 1 1 45 45 VAL C C 45 177.139 177.139 177.477 -0.338 18093 3085 1 5 . 1 1 45 45 VAL CA C 45 67.233 67.233 65.592 1.641 18093 3086 1 5 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.407 0.235 18093 3087 1 5 . 1 1 45 45 VAL H H 45 8.280 8.280 7.754 0.526 18093 3088 1 5 . 1 1 46 46 LEU N N 46 119.883 119.883 122.703 -2.820 18093 3089 1 5 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.045 -0.102 18093 3090 1 5 . 1 1 46 46 LEU C C 46 180.125 180.125 178.313 1.812 18093 3091 1 5 . 1 1 46 46 LEU CA C 46 58.600 58.600 58.038 0.562 18093 3092 1 5 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.407 0.605 18093 3093 1 5 . 1 1 46 46 LEU H H 46 8.117 8.117 7.436 0.681 18093 3094 1 5 . 1 1 47 47 LEU N N 47 120.193 120.193 118.730 1.463 18093 3095 1 5 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.814 0.190 18093 3096 1 5 . 1 1 47 47 LEU C C 47 178.370 178.370 178.778 -0.408 18093 3097 1 5 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.806 -0.380 18093 3098 1 5 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.751 0.305 18093 3099 1 5 . 1 1 47 47 LEU H H 47 8.933 8.933 8.264 0.669 18093 3100 1 5 . 1 1 48 48 SER N N 48 115.861 115.861 114.922 0.939 18093 3101 1 5 . 1 1 48 48 SER HA H 48 4.013 4.013 4.167 -0.154 18093 3102 1 5 . 1 1 48 48 SER C C 48 175.642 175.642 176.868 -1.226 18093 3103 1 5 . 1 1 48 48 SER CA C 48 63.571 63.571 61.605 1.966 18093 3104 1 5 . 1 1 48 48 SER CB C 48 62.879 62.879 63.326 -0.447 18093 3105 1 5 . 1 1 48 48 SER H H 48 7.996 7.996 7.740 0.256 18093 3106 1 5 . 1 1 49 49 LEU N N 49 120.673 120.673 123.276 -2.603 18093 3107 1 5 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.308 -0.273 18093 3108 1 5 . 1 1 49 49 LEU C C 49 178.229 178.229 179.151 -0.922 18093 3109 1 5 . 1 1 49 49 LEU CA C 49 58.283 58.283 57.885 0.398 18093 3110 1 5 . 1 1 49 49 LEU CB C 49 41.946 41.946 41.308 0.638 18093 3111 1 5 . 1 1 49 49 LEU H H 49 8.352 8.352 8.554 -0.202 18093 3112 1 5 . 1 1 50 50 THR N N 50 115.582 115.582 114.785 0.797 18093 3113 1 5 . 1 1 50 50 THR HA H 50 3.672 3.672 4.091 -0.419 18093 3114 1 5 . 1 1 50 50 THR C C 50 175.877 175.877 177.261 -1.384 18093 3115 1 5 . 1 1 50 50 THR CA C 50 68.628 68.628 66.523 2.105 18093 3116 1 5 . 1 1 50 50 THR H H 50 7.937 7.937 8.353 -0.416 18093 3117 1 5 . 1 1 51 51 VAL N N 51 119.774 119.774 122.521 -2.747 18093 3118 1 5 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.835 -0.337 18093 3119 1 5 . 1 1 51 51 VAL C C 51 177.162 177.162 177.634 -0.472 18093 3120 1 5 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.673 0.912 18093 3121 1 5 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.590 -0.069 18093 3122 1 5 . 1 1 51 51 VAL H H 51 8.115 8.115 7.988 0.127 18093 3123 1 5 . 1 1 52 52 PHE N N 52 118.808 118.808 120.503 -1.695 18093 3124 1 5 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.306 -0.184 18093 3125 1 5 . 1 1 52 52 PHE C C 52 176.697 176.697 176.784 -0.087 18093 3126 1 5 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.566 1.205 18093 3127 1 5 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.213 0.049 18093 3128 1 5 . 1 1 52 52 PHE H H 52 8.256 8.256 8.516 -0.260 18093 3129 1 5 . 1 1 53 53 LEU N N 53 117.267 117.267 121.024 -3.757 18093 3130 1 5 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.537 0.356 18093 3131 1 5 . 1 1 53 53 LEU C C 53 179.319 179.319 177.871 1.448 18093 3132 1 5 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.726 0.259 18093 3133 1 5 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.367 0.460 18093 3134 1 5 . 1 1 53 53 LEU H H 53 8.443 8.443 7.662 0.781 18093 3135 1 5 . 1 1 54 54 LEU N N 54 119.762 119.762 118.999 0.763 18093 3136 1 5 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.979 0.075 18093 3137 1 5 . 1 1 54 54 LEU C C 54 178.827 178.827 178.892 -0.065 18093 3138 1 5 . 1 1 54 54 LEU CA C 54 58.105 58.105 57.944 0.161 18093 3139 1 5 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.949 -0.002 18093 3140 1 5 . 1 1 54 54 LEU H H 54 8.205 8.205 7.338 0.867 18093 3141 1 5 . 1 1 55 55 LEU N N 55 118.585 118.585 118.017 0.568 18093 3142 1 5 . 1 1 55 55 LEU HA H 55 4.077 4.077 4.112 -0.035 18093 3143 1 5 . 1 1 55 55 LEU C C 55 178.909 178.909 178.553 0.356 18093 3144 1 5 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.748 0.360 18093 3145 1 5 . 1 1 55 55 LEU CB C 55 41.979 41.979 41.965 0.014 18093 3146 1 5 . 1 1 55 55 LEU H H 55 8.179 8.179 7.483 0.696 18093 3147 1 5 . 1 1 56 56 ILE N N 56 116.079 116.079 115.859 0.220 18093 3148 1 5 . 1 1 56 56 ILE HA H 56 3.729 3.729 4.040 -0.311 18093 3149 1 5 . 1 1 56 56 ILE C C 56 176.988 176.988 177.577 -0.589 18093 3150 1 5 . 1 1 56 56 ILE CA C 56 64.257 64.257 62.479 1.778 18093 3151 1 5 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.704 0.713 18093 3152 1 5 . 1 1 56 56 ILE H H 56 8.040 8.040 7.312 0.728 18093 3153 1 5 . 1 1 57 57 THR N N 57 110.105 110.105 111.387 -1.282 18093 3154 1 5 . 1 1 57 57 THR HA H 57 4.015 4.015 4.192 -0.177 18093 3155 1 5 . 1 1 57 57 THR C C 57 175.435 175.435 175.784 -0.349 18093 3156 1 5 . 1 1 57 57 THR CA C 57 65.067 65.067 65.049 0.018 18093 3157 1 5 . 1 1 57 57 THR CB C 57 69.179 69.179 69.200 -0.021 18093 3158 1 5 . 1 1 57 57 THR H H 57 7.655 7.655 7.724 -0.069 18093 3159 1 5 . 1 1 58 58 GLU N N 58 117.313 117.313 121.171 -3.858 18093 3160 1 5 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.263 0.070 18093 3161 1 5 . 1 1 58 58 GLU C C 58 176.940 176.940 178.190 -1.250 18093 3162 1 5 . 1 1 58 58 GLU CA C 58 57.068 57.068 57.683 -0.615 18093 3163 1 5 . 1 1 58 58 GLU CB C 58 29.396 29.396 29.706 -0.310 18093 3164 1 5 . 1 1 58 58 GLU H H 58 7.521 7.521 8.276 -0.755 18093 3165 1 5 . 1 1 59 59 ILE N N 59 114.870 114.870 114.345 0.525 18093 3166 1 5 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.112 -0.023 18093 3167 1 5 . 1 1 59 59 ILE C C 59 175.456 175.456 176.089 -0.633 18093 3168 1 5 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.085 0.349 18093 3169 1 5 . 1 1 59 59 ILE CB C 59 38.657 38.657 39.112 -0.455 18093 3170 1 5 . 1 1 59 59 ILE H H 59 7.579 7.579 7.380 0.199 18093 3171 1 5 . 1 1 60 60 ILE N N 60 119.354 119.354 119.636 -0.282 18093 3172 1 5 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.906 0.398 18093 3173 1 5 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.785 -2.168 18093 3174 1 5 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.521 2.341 18093 3175 1 5 . 1 1 60 60 ILE H H 60 7.629 7.629 7.581 0.048 18093 3176 1 5 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.292 0.108 18093 3177 1 5 . 1 1 61 61 PRO C C 61 177.144 177.144 176.953 0.191 18093 3178 1 5 . 1 1 61 61 PRO CA C 61 63.808 63.808 64.159 -0.351 18093 3179 1 5 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.214 -0.332 18093 3180 1 5 . 1 1 62 62 SER N N 62 114.474 114.474 114.550 -0.076 18093 3181 1 5 . 1 1 62 62 SER HA H 62 4.434 4.434 4.511 -0.077 18093 3182 1 5 . 1 1 62 62 SER C C 62 175.161 175.161 174.104 1.057 18093 3183 1 5 . 1 1 62 62 SER CA C 62 59.047 59.047 58.439 0.608 18093 3184 1 5 . 1 1 62 62 SER CB C 62 63.704 63.704 61.795 1.909 18093 3185 1 5 . 1 1 62 62 SER H H 62 8.186 8.186 7.941 0.245 18093 3186 1 5 . 1 1 63 63 THR N N 63 113.573 113.573 120.129 -6.556 18093 3187 1 5 . 1 1 63 63 THR HA H 63 4.319 4.319 4.510 -0.191 18093 3188 1 5 . 1 1 63 63 THR C C 63 174.834 174.834 173.648 1.186 18093 3189 1 5 . 1 1 63 63 THR CA C 63 62.377 62.377 61.944 0.433 18093 3190 1 5 . 1 1 63 63 THR CB C 63 69.422 69.422 69.018 0.404 18093 3191 1 5 . 1 1 63 63 THR H H 63 7.963 7.963 8.284 -0.321 18093 3192 1 5 . 1 1 64 64 SER N N 64 116.598 116.598 116.302 0.296 18093 3193 1 5 . 1 1 64 64 SER HA H 64 4.428 4.428 4.619 -0.191 18093 3194 1 5 . 1 1 64 64 SER C C 64 174.618 174.618 174.905 -0.287 18093 3195 1 5 . 1 1 64 64 SER CA C 64 59.045 59.045 57.966 1.079 18093 3196 1 5 . 1 1 64 64 SER CB C 64 63.700 63.700 64.026 -0.326 18093 3197 1 5 . 1 1 64 64 SER H H 64 8.052 8.052 7.563 0.489 18093 3198 1 5 . 1 1 65 65 SER N N 65 116.673 116.673 123.280 -6.607 18093 3199 1 5 . 1 1 65 65 SER HA H 65 4.432 4.432 4.457 -0.025 18093 3200 1 5 . 1 1 65 65 SER C C 65 174.335 174.335 175.482 -1.147 18093 3201 1 5 . 1 1 65 65 SER CA C 65 58.927 58.927 59.644 -0.717 18093 3202 1 5 . 1 1 65 65 SER CB C 65 63.621 63.621 63.413 0.208 18093 3203 1 5 . 1 1 65 65 SER H H 65 8.114 8.114 8.761 -0.647 18093 3204 1 5 . 1 1 66 66 VAL N N 66 119.054 119.054 117.328 1.726 18093 3205 1 5 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.023 0.147 18093 3206 1 5 . 1 1 66 66 VAL C C 66 175.278 175.278 175.931 -0.653 18093 3207 1 5 . 1 1 66 66 VAL CA C 66 62.062 62.062 63.214 -1.152 18093 3208 1 5 . 1 1 66 66 VAL CB C 66 32.629 32.629 31.602 1.027 18093 3209 1 5 . 1 1 66 66 VAL H H 66 7.740 7.740 7.870 -0.130 18093 3210 1 5 . 1 1 67 67 SER N N 67 118.882 118.882 115.921 2.961 18093 3211 1 5 . 1 1 67 67 SER HA H 67 4.704 4.704 4.871 -0.167 18093 3212 1 5 . 1 1 67 67 SER CA C 67 56.715 56.715 55.759 0.956 18093 3213 1 5 . 1 1 67 67 SER CB C 67 63.624 63.624 64.734 -1.110 18093 3214 1 5 . 1 1 67 67 SER H H 67 8.060 8.060 7.548 0.512 18093 3215 1 5 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.488 -0.088 18093 3216 1 5 . 1 1 68 68 PRO C C 68 176.925 176.925 176.545 0.380 18093 3217 1 5 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.663 1.085 18093 3218 1 5 . 1 1 68 68 PRO CB C 68 32.005 32.005 32.145 -0.140 18093 3219 1 5 . 1 1 69 69 SER N N 69 114.930 114.930 113.477 1.453 18093 3220 1 5 . 1 1 69 69 SER HA H 69 4.422 4.422 4.725 -0.303 18093 3221 1 5 . 1 1 69 69 SER C C 69 175.617 175.617 174.991 0.626 18093 3222 1 5 . 1 1 69 69 SER CA C 69 58.697 58.697 57.141 1.556 18093 3223 1 5 . 1 1 69 69 SER CB C 69 63.804 63.804 65.839 -2.035 18093 3224 1 5 . 1 1 69 69 SER H H 69 8.205 8.205 8.325 -0.120 18093 3225 1 5 . 1 1 70 70 ILE N N 70 120.840 120.840 122.883 -2.043 18093 3226 1 5 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.096 -0.104 18093 3227 1 5 . 1 1 70 70 ILE C C 70 177.524 177.524 177.077 0.447 18093 3228 1 5 . 1 1 70 70 ILE CA C 70 64.335 64.335 61.742 2.593 18093 3229 1 5 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.318 -0.858 18093 3230 1 5 . 1 1 70 70 ILE H H 70 8.283 8.283 8.718 -0.435 18093 3231 1 5 . 1 1 71 71 GLY N N 71 107.823 107.823 107.779 0.044 18093 3232 1 5 . 1 1 71 71 GLY C C 71 175.296 175.296 176.175 -0.879 18093 3233 1 5 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.060 0.395 18093 3234 1 5 . 1 1 71 71 GLY H H 71 8.557 8.557 8.648 -0.091 18093 3235 1 5 . 1 1 72 72 GLU N N 72 120.835 120.835 120.999 -0.164 18093 3236 1 5 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.135 -0.288 18093 3237 1 5 . 1 1 72 72 GLU C C 72 178.198 178.198 178.162 0.036 18093 3238 1 5 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.087 2.030 18093 3239 1 5 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.704 -0.311 18093 3240 1 5 . 1 1 72 72 GLU H H 72 7.922 7.922 7.705 0.217 18093 3241 1 5 . 1 1 73 73 TYR N N 73 117.375 117.375 122.033 -4.658 18093 3242 1 5 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.245 -0.083 18093 3243 1 5 . 1 1 73 73 TYR C C 73 179.912 179.912 177.037 2.875 18093 3244 1 5 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.318 0.837 18093 3245 1 5 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.703 0.063 18093 3246 1 5 . 1 1 73 73 TYR H H 73 8.062 8.062 7.848 0.214 18093 3247 1 5 . 1 1 74 74 LEU N N 74 121.493 121.493 118.656 2.837 18093 3248 1 5 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.694 0.355 18093 3249 1 5 . 1 1 74 74 LEU C C 74 178.063 178.063 178.916 -0.853 18093 3250 1 5 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.434 1.061 18093 3251 1 5 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.801 0.046 18093 3252 1 5 . 1 1 74 74 LEU H H 74 8.552 8.552 8.827 -0.275 18093 3253 1 5 . 1 1 75 75 LEU N N 75 120.375 120.375 120.657 -0.282 18093 3254 1 5 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.057 -0.017 18093 3255 1 5 . 1 1 75 75 LEU C C 75 178.515 178.515 178.146 0.369 18093 3256 1 5 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.067 0.571 18093 3257 1 5 . 1 1 75 75 LEU CB C 75 42.039 42.039 41.706 0.333 18093 3258 1 5 . 1 1 75 75 LEU H H 75 8.276 8.276 7.429 0.847 18093 3259 1 5 . 1 1 76 76 PHE N N 76 116.626 116.626 117.695 -1.069 18093 3260 1 5 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.158 -0.079 18093 3261 1 5 . 1 1 76 76 PHE C C 76 177.399 177.399 178.079 -0.680 18093 3262 1 5 . 1 1 76 76 PHE CA C 76 61.734 61.734 61.182 0.552 18093 3263 1 5 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.383 0.358 18093 3264 1 5 . 1 1 76 76 PHE H H 76 8.454 8.454 7.856 0.598 18093 3265 1 5 . 1 1 77 77 THR N N 77 116.080 116.080 116.252 -0.172 18093 3266 1 5 . 1 1 77 77 THR HA H 77 3.687 3.687 3.729 -0.042 18093 3267 1 5 . 1 1 77 77 THR C C 77 176.018 176.018 176.644 -0.626 18093 3268 1 5 . 1 1 77 77 THR CA C 77 68.640 68.640 66.858 1.782 18093 3269 1 5 . 1 1 77 77 THR H H 77 8.224 8.224 8.459 -0.235 18093 3270 1 5 . 1 1 78 78 MET N N 78 119.394 119.394 120.713 -1.319 18093 3271 1 5 . 1 1 78 78 MET HA H 78 4.129 4.129 3.962 0.167 18093 3272 1 5 . 1 1 78 78 MET C C 78 179.608 179.608 178.147 1.461 18093 3273 1 5 . 1 1 78 78 MET CA C 78 58.831 58.831 59.981 -1.150 18093 3274 1 5 . 1 1 78 78 MET CB C 78 31.590 31.590 32.492 -0.902 18093 3275 1 5 . 1 1 78 78 MET H H 78 8.372 8.372 7.690 0.682 18093 3276 1 5 . 1 1 79 79 ILE N N 79 121.819 121.819 117.757 4.062 18093 3277 1 5 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.772 -0.222 18093 3278 1 5 . 1 1 79 79 ILE C C 79 176.426 176.426 178.249 -1.823 18093 3279 1 5 . 1 1 79 79 ILE CA C 79 65.876 65.876 62.275 3.601 18093 3280 1 5 . 1 1 79 79 ILE CB C 79 37.673 37.673 36.030 1.643 18093 3281 1 5 . 1 1 79 79 ILE H H 79 8.391 8.391 7.539 0.852 18093 3282 1 5 . 1 1 80 80 PHE N N 80 119.916 119.916 121.877 -1.961 18093 3283 1 5 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.064 -0.011 18093 3284 1 5 . 1 1 80 80 PHE C C 80 178.568 178.568 177.132 1.436 18093 3285 1 5 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.246 0.061 18093 3286 1 5 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.582 -0.808 18093 3287 1 5 . 1 1 80 80 PHE H H 80 8.479 8.479 8.093 0.386 18093 3288 1 5 . 1 1 81 81 VAL N N 81 120.191 120.191 116.152 4.039 18093 3289 1 5 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.690 -0.237 18093 3290 1 5 . 1 1 81 81 VAL C C 81 178.225 178.225 177.857 0.368 18093 3291 1 5 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.350 1.058 18093 3292 1 5 . 1 1 81 81 VAL CB C 81 31.556 31.556 30.677 0.878 18093 3293 1 5 . 1 1 81 81 VAL H H 81 8.928 8.928 8.777 0.151 18093 3294 1 5 . 1 1 82 82 THR N N 82 115.930 115.930 118.026 -2.096 18093 3295 1 5 . 1 1 82 82 THR HA H 82 3.636 3.636 3.942 -0.306 18093 3296 1 5 . 1 1 82 82 THR C C 82 176.420 176.420 176.658 -0.238 18093 3297 1 5 . 1 1 82 82 THR CA C 82 68.570 68.570 67.016 1.554 18093 3298 1 5 . 1 1 82 82 THR CB C 82 68.202 68.202 68.651 -0.449 18093 3299 1 5 . 1 1 82 82 THR H H 82 7.969 7.969 7.622 0.347 18093 3300 1 5 . 1 1 83 83 LEU N N 83 119.780 119.780 120.404 -0.624 18093 3301 1 5 . 1 1 83 83 LEU HA H 83 3.847 3.847 4.045 -0.198 18093 3302 1 5 . 1 1 83 83 LEU C C 83 178.214 178.214 178.906 -0.692 18093 3303 1 5 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.380 0.857 18093 3304 1 5 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.524 0.267 18093 3305 1 5 . 1 1 83 83 LEU H H 83 8.483 8.483 7.416 1.067 18093 3306 1 5 . 1 1 84 84 SER N N 84 114.559 114.559 115.573 -1.014 18093 3307 1 5 . 1 1 84 84 SER HA H 84 4.099 4.099 4.244 -0.145 18093 3308 1 5 . 1 1 84 84 SER C C 84 176.799 176.799 176.741 0.058 18093 3309 1 5 . 1 1 84 84 SER CA C 84 63.609 63.609 61.633 1.976 18093 3310 1 5 . 1 1 84 84 SER CB C 84 63.110 63.110 62.608 0.502 18093 3311 1 5 . 1 1 84 84 SER H H 84 8.023 8.023 7.641 0.382 18093 3312 1 5 . 1 1 85 85 ILE N N 85 123.962 123.962 121.999 1.963 18093 3313 1 5 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.833 -0.229 18093 3314 1 5 . 1 1 85 85 ILE C C 85 177.487 177.487 177.159 0.328 18093 3315 1 5 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.396 0.363 18093 3316 1 5 . 1 1 85 85 ILE CB C 85 37.887 37.887 38.348 -0.461 18093 3317 1 5 . 1 1 85 85 ILE H H 85 8.054 8.054 7.492 0.562 18093 3318 1 5 . 1 1 86 86 VAL N N 86 118.744 118.744 118.183 0.561 18093 3319 1 5 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.530 -0.011 18093 3320 1 5 . 1 1 86 86 VAL C C 86 177.557 177.557 177.865 -0.308 18093 3321 1 5 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.428 1.107 18093 3322 1 5 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.488 -0.022 18093 3323 1 5 . 1 1 86 86 VAL H H 86 8.158 8.158 7.512 0.646 18093 3324 1 5 . 1 1 87 87 ILE N N 87 117.206 117.206 119.949 -2.743 18093 3325 1 5 . 1 1 87 87 ILE HA H 87 3.604 3.604 4.102 -0.498 18093 3326 1 5 . 1 1 87 87 ILE C C 87 177.283 177.283 178.127 -0.844 18093 3327 1 5 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.414 2.262 18093 3328 1 5 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.510 1.079 18093 3329 1 5 . 1 1 87 87 ILE H H 87 8.459 8.459 7.780 0.679 18093 3330 1 5 . 1 1 88 88 THR N N 88 116.158 116.158 116.865 -0.707 18093 3331 1 5 . 1 1 88 88 THR HA H 88 3.672 3.672 4.103 -0.431 18093 3332 1 5 . 1 1 88 88 THR C C 88 175.485 175.485 177.249 -1.764 18093 3333 1 5 . 1 1 88 88 THR CA C 88 68.549 68.549 67.008 1.541 18093 3334 1 5 . 1 1 88 88 THR CB C 88 68.127 68.127 68.361 -0.234 18093 3335 1 5 . 1 1 88 88 THR H H 88 7.776 7.776 7.886 -0.110 18093 3336 1 5 . 1 1 89 89 VAL N N 89 117.985 117.985 120.505 -2.520 18093 3337 1 5 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.748 -0.205 18093 3338 1 5 . 1 1 89 89 VAL C C 89 177.393 177.393 177.627 -0.234 18093 3339 1 5 . 1 1 89 89 VAL CA C 89 66.590 66.590 66.400 0.190 18093 3340 1 5 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.285 0.493 18093 3341 1 5 . 1 1 89 89 VAL H H 89 8.206 8.206 7.571 0.635 18093 3342 1 5 . 1 1 90 90 PHE N N 90 116.709 116.709 119.591 -2.882 18093 3343 1 5 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.212 0.166 18093 3344 1 5 . 1 1 90 90 PHE C C 90 177.305 177.305 178.121 -0.816 18093 3345 1 5 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.407 -0.288 18093 3346 1 5 . 1 1 90 90 PHE CB C 90 39.385 39.385 37.971 1.414 18093 3347 1 5 . 1 1 90 90 PHE H H 90 7.956 7.956 7.294 0.662 18093 3348 1 5 . 1 1 91 91 VAL N N 91 116.565 116.565 119.150 -2.585 18093 3349 1 5 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.703 0.132 18093 3350 1 5 . 1 1 91 91 VAL C C 91 176.927 176.927 177.004 -0.077 18093 3351 1 5 . 1 1 91 91 VAL CA C 91 65.347 65.347 66.059 -0.712 18093 3352 1 5 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.662 0.205 18093 3353 1 5 . 1 1 91 91 VAL H H 91 8.239 8.239 8.516 -0.277 18093 3354 1 5 . 1 1 92 92 LEU N N 92 117.443 117.443 115.573 1.870 18093 3355 1 5 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.189 0.005 18093 3356 1 5 . 1 1 92 92 LEU C C 92 177.180 177.180 177.994 -0.814 18093 3357 1 5 . 1 1 92 92 LEU CA C 92 56.184 56.184 55.614 0.570 18093 3358 1 5 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.097 -0.153 18093 3359 1 5 . 1 1 92 92 LEU H H 92 7.967 7.967 7.451 0.516 18093 3360 1 5 . 1 1 93 93 ASN N N 93 116.705 116.705 117.632 -0.927 18093 3361 1 5 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.505 0.142 18093 3362 1 5 . 1 1 93 93 ASN C C 93 175.129 175.129 175.553 -0.424 18093 3363 1 5 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.429 -1.575 18093 3364 1 5 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.249 0.146 18093 3365 1 5 . 1 1 93 93 ASN H H 93 7.683 7.683 7.523 0.160 18093 3366 1 5 . 1 1 94 94 VAL N N 94 118.224 118.224 113.830 4.394 18093 3367 1 5 . 1 1 94 94 VAL HA H 94 3.961 3.961 4.097 -0.136 18093 3368 1 5 . 1 1 94 94 VAL C C 94 175.600 175.600 173.960 1.640 18093 3369 1 5 . 1 1 94 94 VAL CA C 94 62.825 62.825 61.039 1.786 18093 3370 1 5 . 1 1 94 94 VAL CB C 94 32.214 32.214 34.621 -2.407 18093 3371 1 5 . 1 1 94 94 VAL H H 94 7.627 7.627 7.361 0.266 18093 3372 1 5 . 1 1 95 95 HIS N N 95 120.999 120.999 117.502 3.497 18093 3373 1 5 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.831 -0.238 18093 3374 1 5 . 1 1 95 95 HIS C C 95 174.146 174.146 174.168 -0.022 18093 3375 1 5 . 1 1 95 95 HIS CA C 95 55.666 55.666 55.375 0.291 18093 3376 1 5 . 1 1 95 95 HIS CB C 95 29.736 29.736 30.142 -0.406 18093 3377 1 5 . 1 1 95 95 HIS H H 95 8.263 8.263 8.139 0.124 18093 3378 1 5 . 1 1 96 96 HIS N N 96 122.740 122.740 118.136 4.604 18093 3379 1 5 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.607 0.026 18093 3380 1 5 . 1 1 96 96 HIS CA C 96 55.895 55.895 55.934 -0.039 18093 3381 1 5 . 1 1 96 96 HIS CB C 96 29.750 29.750 30.114 -0.364 18093 3382 1 5 . 1 1 96 96 HIS H H 96 8.298 8.298 7.930 0.368 18093 3383 1 5 . 1 1 97 97 ARG N N 97 118.503 118.503 121.723 -3.220 18093 3384 1 5 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.521 -0.209 18093 3385 1 5 . 1 1 97 97 ARG C C 97 175.776 175.776 175.456 0.320 18093 3386 1 5 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.852 0.373 18093 3387 1 5 . 1 1 97 97 ARG CB C 97 30.912 30.912 29.316 1.596 18093 3388 1 5 . 1 1 97 97 ARG H H 97 8.250 8.250 8.177 0.073 18093 3389 1 5 . 1 1 98 98 SER N N 98 118.482 118.482 120.562 -2.080 18093 3390 1 5 . 1 1 98 98 SER HA H 98 4.722 4.722 4.914 -0.192 18093 3391 1 5 . 1 1 98 98 SER CA C 98 56.547 56.547 55.857 0.690 18093 3392 1 5 . 1 1 98 98 SER CB C 98 63.624 63.624 64.059 -0.436 18093 3393 1 5 . 1 1 98 98 SER H H 98 8.254 8.254 8.075 0.179 18093 3394 1 5 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.415 -0.012 18093 3395 1 5 . 1 1 99 99 PRO C C 99 176.899 176.899 176.875 0.024 18093 3396 1 5 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.799 -1.098 18093 3397 1 5 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.192 -0.243 18093 3398 1 5 . 1 1 100 100 GLU N N 100 120.187 120.187 114.988 5.199 18093 3399 1 5 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.327 -0.039 18093 3400 1 5 . 1 1 100 100 GLU C C 100 176.593 176.593 174.820 1.773 18093 3401 1 5 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.421 0.301 18093 3402 1 5 . 1 1 100 100 GLU CB C 100 29.999 29.999 30.113 -0.114 18093 3403 1 5 . 1 1 100 100 GLU H H 100 8.401 8.401 8.349 0.052 18093 3404 1 5 . 1 1 101 101 THR N N 101 113.968 113.968 114.501 -0.533 18093 3405 1 5 . 1 1 101 101 THR HA H 101 4.286 4.286 4.332 -0.046 18093 3406 1 5 . 1 1 101 101 THR C C 101 174.525 174.525 174.705 -0.180 18093 3407 1 5 . 1 1 101 101 THR CA C 101 61.956 61.956 62.681 -0.725 18093 3408 1 5 . 1 1 101 101 THR CB C 101 69.697 69.697 69.130 0.566 18093 3409 1 5 . 1 1 101 101 THR H H 101 7.945 7.945 7.903 0.042 18093 3410 1 5 . 1 1 102 102 HIS N N 102 120.322 120.322 121.935 -1.613 18093 3411 1 5 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.567 0.174 18093 3412 1 5 . 1 1 102 102 HIS C C 102 174.783 174.783 175.803 -1.020 18093 3413 1 5 . 1 1 102 102 HIS CA C 102 55.701 55.701 57.009 -1.308 18093 3414 1 5 . 1 1 102 102 HIS CB C 102 29.093 29.093 30.370 -1.277 18093 3415 1 5 . 1 1 102 102 HIS H H 102 8.455 8.455 8.797 -0.342 18093 3416 1 5 . 1 1 103 103 THR N N 103 114.282 114.282 115.723 -1.441 18093 3417 1 5 . 1 1 103 103 THR HA H 103 4.352 4.352 4.516 -0.164 18093 3418 1 5 . 1 1 103 103 THR C C 103 175.104 175.104 175.105 -0.001 18093 3419 1 5 . 1 1 103 103 THR CA C 103 62.057 62.057 61.641 0.416 18093 3420 1 5 . 1 1 103 103 THR CB C 103 69.966 69.966 69.476 0.490 18093 3421 1 5 . 1 1 103 103 THR H H 103 8.069 8.069 7.709 0.360 18093 3422 1 5 . 1 1 104 104 GLY N N 104 111.159 111.159 108.753 2.406 18093 3423 1 5 . 1 1 104 104 GLY C C 104 174.776 174.776 174.747 0.029 18093 3424 1 5 . 1 1 104 104 GLY CA C 104 45.588 45.588 44.824 0.764 18093 3425 1 5 . 1 1 104 104 GLY H H 104 8.393 8.393 8.576 -0.183 18093 3426 1 5 . 1 1 105 105 GLY N N 105 108.657 108.657 107.203 1.454 18093 3427 1 5 . 1 1 105 105 GLY C C 105 174.957 174.957 174.439 0.518 18093 3428 1 5 . 1 1 105 105 GLY CA C 105 45.612 45.612 44.758 0.855 18093 3429 1 5 . 1 1 105 105 GLY H H 105 8.275 8.275 8.409 -0.134 18093 3430 1 5 . 1 1 106 106 GLY N N 106 108.870 108.870 109.961 -1.091 18093 3431 1 5 . 1 1 106 106 GLY C C 106 174.877 174.877 173.309 1.568 18093 3432 1 5 . 1 1 106 106 GLY CA C 106 45.665 45.665 44.659 1.006 18093 3433 1 5 . 1 1 106 106 GLY H H 106 8.357 8.357 8.200 0.157 18093 3434 1 5 . 1 1 107 107 GLY N N 107 108.476 108.476 107.429 1.047 18093 3435 1 5 . 1 1 107 107 GLY C C 107 174.877 174.877 174.823 0.054 18093 3436 1 5 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.230 0.466 18093 3437 1 5 . 1 1 107 107 GLY H H 107 8.330 8.330 8.276 0.054 18093 3438 1 5 . 1 1 108 108 GLY N N 108 108.486 108.486 109.836 -1.350 18093 3439 1 5 . 1 1 108 108 GLY C C 108 175.345 175.345 175.295 0.050 18093 3440 1 5 . 1 1 108 108 GLY CA C 108 45.763 45.763 45.074 0.689 18093 3441 1 5 . 1 1 108 108 GLY H H 108 8.328 8.328 8.609 -0.281 18093 3442 1 5 . 1 1 109 109 ILE N N 109 120.433 120.433 119.503 0.930 18093 3443 1 5 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.960 0.008 18093 3444 1 5 . 1 1 109 109 ILE C C 109 176.127 176.127 176.950 -0.823 18093 3445 1 5 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.364 -0.629 18093 3446 1 5 . 1 1 109 109 ILE CB C 109 38.125 38.125 37.664 0.461 18093 3447 1 5 . 1 1 109 109 ILE H H 109 8.192 8.192 8.051 0.141 18093 3448 1 5 . 1 1 110 110 ASP N N 110 121.148 121.148 119.619 1.529 18093 3449 1 5 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.527 -0.221 18093 3450 1 5 . 1 1 110 110 ASP C C 110 177.651 177.651 178.501 -0.850 18093 3451 1 5 . 1 1 110 110 ASP CA C 110 56.776 56.776 57.822 -1.046 18093 3452 1 5 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.545 0.552 18093 3453 1 5 . 1 1 110 110 ASP H H 110 8.427 8.427 8.797 -0.370 18093 3454 1 5 . 1 1 111 111 ARG N N 111 119.228 119.228 119.252 -0.024 18093 3455 1 5 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.391 -0.395 18093 3456 1 5 . 1 1 111 111 ARG C C 111 177.786 177.786 178.791 -1.005 18093 3457 1 5 . 1 1 111 111 ARG CA C 111 58.942 58.942 58.963 -0.021 18093 3458 1 5 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.665 0.531 18093 3459 1 5 . 1 1 111 111 ARG H H 111 7.850 7.850 8.404 -0.554 18093 3460 1 5 . 1 1 112 112 ILE N N 112 118.000 118.000 119.631 -1.631 18093 3461 1 5 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.135 -0.322 18093 3462 1 5 . 1 1 112 112 ILE C C 112 177.496 177.496 177.928 -0.432 18093 3463 1 5 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.223 2.589 18093 3464 1 5 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.895 0.832 18093 3465 1 5 . 1 1 112 112 ILE H H 112 7.764 7.764 7.783 -0.019 18093 3466 1 5 . 1 1 113 113 PHE N N 113 118.367 118.367 122.100 -3.733 18093 3467 1 5 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.306 -0.051 18093 3468 1 5 . 1 1 113 113 PHE C C 113 177.218 177.218 177.382 -0.164 18093 3469 1 5 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.375 -0.942 18093 3470 1 5 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.231 -0.424 18093 3471 1 5 . 1 1 113 113 PHE H H 113 7.963 7.963 7.927 0.036 18093 3472 1 5 . 1 1 114 114 LEU N N 114 118.921 118.921 117.256 1.665 18093 3473 1 5 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.945 0.052 18093 3474 1 5 . 1 1 114 114 LEU C C 114 178.297 178.297 178.468 -0.171 18093 3475 1 5 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.202 0.409 18093 3476 1 5 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.294 0.658 18093 3477 1 5 . 1 1 114 114 LEU H H 114 7.939 7.939 8.031 -0.092 18093 3478 1 5 . 1 1 115 115 TRP N N 115 117.464 117.464 119.500 -2.036 18093 3479 1 5 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.387 -0.013 18093 3480 1 5 . 1 1 115 115 TRP C C 115 178.572 178.572 178.266 0.306 18093 3481 1 5 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.804 1.118 18093 3482 1 5 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.788 -1.281 18093 3483 1 5 . 1 1 115 115 TRP H H 115 7.969 7.969 7.644 0.325 18093 3484 1 5 . 1 1 116 116 MET N N 116 117.069 117.069 118.932 -1.863 18093 3485 1 5 . 1 1 116 116 MET HA H 116 4.065 4.065 4.234 -0.169 18093 3486 1 5 . 1 1 116 116 MET C C 116 177.425 177.425 178.194 -0.769 18093 3487 1 5 . 1 1 116 116 MET CA C 116 59.289 59.289 59.134 0.155 18093 3488 1 5 . 1 1 116 116 MET CB C 116 31.692 31.692 32.546 -0.854 18093 3489 1 5 . 1 1 116 116 MET H H 116 8.465 8.465 7.735 0.730 18093 3490 1 5 . 1 1 117 117 PHE N N 117 118.755 118.755 117.585 1.170 18093 3491 1 5 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.048 0.051 18093 3492 1 5 . 1 1 117 117 PHE C C 117 177.965 177.965 178.195 -0.230 18093 3493 1 5 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.198 -0.490 18093 3494 1 5 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.246 0.939 18093 3495 1 5 . 1 1 117 117 PHE H H 117 8.418 8.418 7.859 0.559 18093 3496 1 5 . 1 1 118 118 ILE N N 118 119.133 119.133 115.367 3.766 18093 3497 1 5 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.901 -0.557 18093 3498 1 5 . 1 1 118 118 ILE C C 118 177.244 177.244 177.624 -0.380 18093 3499 1 5 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.301 1.524 18093 3500 1 5 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.766 -0.218 18093 3501 1 5 . 1 1 118 118 ILE H H 118 8.266 8.266 7.725 0.541 18093 3502 1 5 . 1 1 119 119 ILE N N 119 118.846 118.846 121.480 -2.634 18093 3503 1 5 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.898 -0.326 18093 3504 1 5 . 1 1 119 119 ILE C C 119 177.523 177.523 177.648 -0.125 18093 3505 1 5 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.146 0.743 18093 3506 1 5 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.272 -0.708 18093 3507 1 5 . 1 1 119 119 ILE H H 119 8.308 8.308 7.311 0.997 18093 3508 1 5 . 1 1 120 120 VAL N N 120 119.228 119.228 117.111 2.117 18093 3509 1 5 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.780 -0.272 18093 3510 1 5 . 1 1 120 120 VAL C C 120 177.651 177.651 177.497 0.154 18093 3511 1 5 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.768 1.833 18093 3512 1 5 . 1 1 120 120 VAL CB C 120 31.406 31.406 31.346 0.060 18093 3513 1 5 . 1 1 120 120 VAL H H 120 8.399 8.399 7.972 0.427 18093 3514 1 5 . 1 1 121 121 CYS N N 121 117.151 117.151 119.532 -2.381 18093 3515 1 5 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.191 -0.288 18093 3516 1 5 . 1 1 121 121 CYS C C 121 177.719 177.719 177.096 0.623 18093 3517 1 5 . 1 1 121 121 CYS CA C 121 64.298 64.298 63.791 0.506 18093 3518 1 5 . 1 1 121 121 CYS CB C 121 26.677 26.677 26.467 0.210 18093 3519 1 5 . 1 1 121 121 CYS H H 121 8.008 8.008 7.566 0.442 18093 3520 1 5 . 1 1 122 122 LEU N N 122 121.402 121.402 120.148 1.254 18093 3521 1 5 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.211 -0.228 18093 3522 1 5 . 1 1 122 122 LEU C C 122 178.282 178.282 178.991 -0.709 18093 3523 1 5 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.560 0.985 18093 3524 1 5 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.287 0.679 18093 3525 1 5 . 1 1 122 122 LEU H H 122 8.417 8.417 7.691 0.726 18093 3526 1 5 . 1 1 123 123 LEU N N 123 118.543 118.543 121.054 -2.511 18093 3527 1 5 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.089 -0.169 18093 3528 1 5 . 1 1 123 123 LEU C C 123 179.028 179.028 178.656 0.372 18093 3529 1 5 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.565 -0.448 18093 3530 1 5 . 1 1 123 123 LEU CB C 123 42.056 42.056 41.043 1.013 18093 3531 1 5 . 1 1 123 123 LEU H H 123 8.590 8.590 7.675 0.915 18093 3532 1 5 . 1 1 124 124 GLY N N 124 104.896 104.896 105.108 -0.212 18093 3533 1 5 . 1 1 124 124 GLY C C 124 173.932 173.932 176.150 -2.218 18093 3534 1 5 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.477 -0.250 18093 3535 1 5 . 1 1 124 124 GLY H H 124 8.601 8.601 8.454 0.147 18093 3536 1 5 . 1 1 125 125 THR N N 125 115.403 115.403 119.192 -3.789 18093 3537 1 5 . 1 1 125 125 THR HA H 125 3.686 3.686 3.909 -0.223 18093 3538 1 5 . 1 1 125 125 THR C C 125 176.407 176.407 176.591 -0.184 18093 3539 1 5 . 1 1 125 125 THR CA C 125 67.565 67.565 66.914 0.651 18093 3540 1 5 . 1 1 125 125 THR CB C 125 68.143 68.143 68.825 -0.682 18093 3541 1 5 . 1 1 125 125 THR H H 125 7.734 7.734 7.434 0.300 18093 3542 1 5 . 1 1 126 126 VAL N N 126 119.056 119.056 121.587 -2.531 18093 3543 1 5 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.610 -0.071 18093 3544 1 5 . 1 1 126 126 VAL C C 126 177.628 177.628 177.864 -0.236 18093 3545 1 5 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.477 0.124 18093 3546 1 5 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.903 -0.409 18093 3547 1 5 . 1 1 126 126 VAL H H 126 8.015 8.015 8.069 -0.054 18093 3548 1 5 . 1 1 127 127 GLY N N 127 104.644 104.644 106.176 -1.532 18093 3549 1 5 . 1 1 127 127 GLY C C 127 173.933 173.933 176.133 -2.200 18093 3550 1 5 . 1 1 127 127 GLY CA C 127 47.281 47.281 46.903 0.378 18093 3551 1 5 . 1 1 127 127 GLY H H 127 8.248 8.248 8.307 -0.059 18093 3552 1 5 . 1 1 128 128 LEU N N 128 117.354 117.354 121.027 -3.673 18093 3553 1 5 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.122 -0.110 18093 3554 1 5 . 1 1 128 128 LEU C C 128 177.443 177.443 176.888 0.555 18093 3555 1 5 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.816 -0.190 18093 3556 1 5 . 1 1 128 128 LEU CB C 128 42.260 42.260 42.094 0.166 18093 3557 1 5 . 1 1 128 128 LEU H H 128 7.568 7.568 7.474 0.094 18093 3558 1 5 . 1 1 129 129 PHE N N 129 113.971 113.971 114.375 -0.404 18093 3559 1 5 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.480 -0.022 18093 3560 1 5 . 1 1 129 129 PHE C C 129 176.216 176.216 174.784 1.432 18093 3561 1 5 . 1 1 129 129 PHE CA C 129 58.385 58.385 57.951 0.434 18093 3562 1 5 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.723 -0.004 18093 3563 1 5 . 1 1 129 129 PHE H H 129 7.639 7.639 7.547 0.092 18093 3564 1 5 . 1 1 130 130 LEU N N 130 117.752 117.752 117.038 0.714 18093 3565 1 5 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.058 0.375 18093 3566 1 5 . 1 1 130 130 LEU CA C 130 54.156 54.156 55.344 -1.188 18093 3567 1 5 . 1 1 130 130 LEU H H 130 8.099 8.099 7.139 0.960 18093 3568 1 5 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.751 -0.301 18093 3569 1 5 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.917 1.982 18093 3570 1 5 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.409 -0.147 18093 3571 1 5 . 1 1 132 132 PRO C C 132 177.616 177.616 178.811 -1.195 18093 3572 1 5 . 1 1 132 132 PRO CA C 132 64.980 64.980 65.347 -0.366 18093 3573 1 5 . 1 1 132 132 PRO CB C 132 31.625 31.625 31.925 -0.300 18093 3574 1 5 . 1 1 133 133 TRP N N 133 115.508 115.508 119.378 -3.870 18093 3575 1 5 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.495 0.097 18093 3576 1 5 . 1 1 133 133 TRP C C 133 176.842 176.842 176.359 0.483 18093 3577 1 5 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.716 -2.433 18093 3578 1 5 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.311 -0.715 18093 3579 1 5 . 1 1 133 133 TRP H H 133 7.311 7.311 8.309 -0.998 18093 3580 1 5 . 1 1 134 134 LEU N N 134 119.570 119.570 117.521 2.049 18093 3581 1 5 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.627 -0.450 18093 3582 1 5 . 1 1 134 134 LEU C C 134 175.768 175.768 176.328 -0.560 18093 3583 1 5 . 1 1 134 134 LEU CA C 134 55.621 55.621 54.285 1.336 18093 3584 1 5 . 1 1 134 134 LEU CB C 134 42.648 42.648 42.187 0.461 18093 3585 1 5 . 1 1 134 134 LEU H H 134 7.453 7.453 7.402 0.050 18093 3586 1 5 . 1 1 135 135 ALA N N 135 119.004 119.004 122.895 -3.891 18093 3587 1 5 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.518 -0.295 18093 3588 1 5 . 1 1 135 135 ALA C C 135 177.170 177.170 178.438 -1.268 18093 3589 1 5 . 1 1 135 135 ALA CA C 135 52.456 52.456 53.063 -0.607 18093 3590 1 5 . 1 1 135 135 ALA CB C 135 19.736 19.736 20.269 -0.533 18093 3591 1 5 . 1 1 135 135 ALA H H 135 7.541 7.541 8.111 -0.570 18093 3592 1 5 . 1 1 136 136 GLY N N 136 105.879 105.879 107.788 -1.909 18093 3593 1 5 . 1 1 136 136 GLY C C 136 173.042 173.042 174.380 -1.338 18093 3594 1 5 . 1 1 136 136 GLY CA C 136 45.693 45.693 44.700 0.993 18093 3595 1 5 . 1 1 136 136 GLY H H 136 7.846 7.846 8.295 -0.449 18093 3596 1 6 . 1 1 5 5 GLU N N 5 119.627 119.627 117.715 1.912 18093 3597 1 6 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.353 -0.145 18093 3598 1 6 . 1 1 5 5 GLU C C 5 176.581 176.581 174.486 2.095 18093 3599 1 6 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.514 0.531 18093 3600 1 6 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.287 0.751 18093 3601 1 6 . 1 1 5 5 GLU H H 5 8.003 8.003 8.205 -0.202 18093 3602 1 6 . 1 1 6 6 LEU N N 6 121.267 121.267 122.412 -1.145 18093 3603 1 6 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.441 -0.016 18093 3604 1 6 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.021 2.614 18093 3605 1 6 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.915 -0.619 18093 3606 1 6 . 1 1 6 6 LEU H H 6 8.104 8.104 7.856 0.248 18093 3607 1 6 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.556 -0.157 18093 3608 1 6 . 1 1 7 7 PRO C C 7 178.408 178.408 177.957 0.451 18093 3609 1 6 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.069 2.643 18093 3610 1 6 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.797 -0.880 18093 3611 1 6 . 1 1 8 8 LEU N N 8 121.835 121.835 120.702 1.133 18093 3612 1 6 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.184 -0.095 18093 3613 1 6 . 1 1 8 8 LEU C C 8 177.902 177.902 178.343 -0.441 18093 3614 1 6 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.448 0.657 18093 3615 1 6 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.037 0.570 18093 3616 1 6 . 1 1 8 8 LEU H H 8 8.162 8.162 8.521 -0.359 18093 3617 1 6 . 1 1 9 9 PHE N N 9 118.342 118.342 119.358 -1.016 18093 3618 1 6 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.147 0.042 18093 3619 1 6 . 1 1 9 9 PHE C C 9 177.596 177.596 177.167 0.429 18093 3620 1 6 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.137 -0.023 18093 3621 1 6 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.226 0.501 18093 3622 1 6 . 1 1 9 9 PHE H H 9 8.318 8.318 8.233 0.085 18093 3623 1 6 . 1 1 10 10 TYR N N 10 117.584 117.584 117.766 -0.182 18093 3624 1 6 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.870 0.284 18093 3625 1 6 . 1 1 10 10 TYR C C 10 177.630 177.630 177.898 -0.268 18093 3626 1 6 . 1 1 10 10 TYR CA C 10 61.036 61.036 60.504 0.532 18093 3627 1 6 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.157 0.503 18093 3628 1 6 . 1 1 10 10 TYR H H 10 8.105 8.105 8.181 -0.076 18093 3629 1 6 . 1 1 11 11 THR N N 11 115.563 115.563 116.877 -1.314 18093 3630 1 6 . 1 1 11 11 THR HA H 11 3.871 3.871 4.005 -0.134 18093 3631 1 6 . 1 1 11 11 THR C C 11 175.955 175.955 176.773 -0.818 18093 3632 1 6 . 1 1 11 11 THR CA C 11 67.290 67.290 66.733 0.557 18093 3633 1 6 . 1 1 11 11 THR CB C 11 68.201 68.201 68.701 -0.500 18093 3634 1 6 . 1 1 11 11 THR H H 11 7.915 7.915 7.563 0.352 18093 3635 1 6 . 1 1 12 12 ILE N N 12 119.727 119.727 120.387 -0.660 18093 3636 1 6 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.926 -0.227 18093 3637 1 6 . 1 1 12 12 ILE C C 12 175.773 175.773 177.276 -1.503 18093 3638 1 6 . 1 1 12 12 ILE CA C 12 64.699 64.699 63.335 1.364 18093 3639 1 6 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.674 1.422 18093 3640 1 6 . 1 1 12 12 ILE H H 12 8.186 8.186 8.027 0.159 18093 3641 1 6 . 1 1 13 13 ASN N N 13 114.190 114.190 118.768 -4.578 18093 3642 1 6 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.464 -0.042 18093 3643 1 6 . 1 1 13 13 ASN C C 13 174.786 174.786 176.610 -1.824 18093 3644 1 6 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.456 0.099 18093 3645 1 6 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.883 0.475 18093 3646 1 6 . 1 1 13 13 ASN H H 13 7.601 7.601 7.328 0.273 18093 3647 1 6 . 1 1 14 14 LEU N N 14 115.031 115.031 119.416 -4.385 18093 3648 1 6 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.085 0.111 18093 3649 1 6 . 1 1 14 14 LEU C C 14 177.540 177.540 178.082 -0.542 18093 3650 1 6 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.071 0.336 18093 3651 1 6 . 1 1 14 14 LEU CB C 14 41.842 41.842 41.938 -0.096 18093 3652 1 6 . 1 1 14 14 LEU H H 14 7.390 7.390 7.620 -0.230 18093 3653 1 6 . 1 1 15 15 ILE N N 15 118.223 118.223 120.528 -2.305 18093 3654 1 6 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.693 -0.080 18093 3655 1 6 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.577 3.143 18093 3656 1 6 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.239 -0.627 18093 3657 1 6 . 1 1 15 15 ILE H H 15 8.123 8.123 7.587 0.536 18093 3658 1 6 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.312 -0.243 18093 3659 1 6 . 1 1 17 17 PRO C C 17 177.721 177.721 178.806 -1.085 18093 3660 1 6 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.528 1.233 18093 3661 1 6 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.787 -0.045 18093 3662 1 6 . 1 1 18 18 CYS N N 18 113.538 113.538 116.915 -3.377 18093 3663 1 6 . 1 1 18 18 CYS HA H 18 4.008 4.008 3.999 0.009 18093 3664 1 6 . 1 1 18 18 CYS C C 18 177.683 177.683 176.496 1.187 18093 3665 1 6 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.383 1.117 18093 3666 1 6 . 1 1 18 18 CYS CB C 18 26.873 26.873 27.367 -0.494 18093 3667 1 6 . 1 1 18 18 CYS H H 18 7.410 7.410 7.374 0.036 18093 3668 1 6 . 1 1 19 19 LEU N N 19 122.545 122.545 119.172 3.373 18093 3669 1 6 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.090 -0.091 18093 3670 1 6 . 1 1 19 19 LEU C C 19 178.608 178.608 178.748 -0.140 18093 3671 1 6 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.541 0.880 18093 3672 1 6 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.393 0.451 18093 3673 1 6 . 1 1 19 19 LEU H H 19 8.635 8.635 7.499 1.136 18093 3674 1 6 . 1 1 20 20 LEU N N 20 119.404 119.404 120.667 -1.263 18093 3675 1 6 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.978 0.028 18093 3676 1 6 . 1 1 20 20 LEU C C 20 178.540 178.540 179.523 -0.983 18093 3677 1 6 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.291 0.508 18093 3678 1 6 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.129 0.870 18093 3679 1 6 . 1 1 20 20 LEU H H 20 8.392 8.392 7.526 0.866 18093 3680 1 6 . 1 1 21 21 ILE N N 21 117.335 117.335 113.639 3.696 18093 3681 1 6 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.816 -0.165 18093 3682 1 6 . 1 1 21 21 ILE C C 21 177.249 177.249 177.520 -0.271 18093 3683 1 6 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.606 0.655 18093 3684 1 6 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.099 0.861 18093 3685 1 6 . 1 1 21 21 ILE H H 21 8.403 8.403 8.435 -0.032 18093 3686 1 6 . 1 1 22 22 SER N N 22 116.385 116.385 118.453 -2.068 18093 3687 1 6 . 1 1 22 22 SER HA H 22 4.056 4.056 4.265 -0.209 18093 3688 1 6 . 1 1 22 22 SER C C 22 176.813 176.813 176.418 0.395 18093 3689 1 6 . 1 1 22 22 SER CA C 22 63.866 63.866 62.616 1.250 18093 3690 1 6 . 1 1 22 22 SER CB C 22 62.898 62.898 63.027 -0.129 18093 3691 1 6 . 1 1 22 22 SER H H 22 8.271 8.271 7.617 0.654 18093 3692 1 6 . 1 1 23 23 CYS N N 23 119.001 119.001 120.475 -1.474 18093 3693 1 6 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.082 -0.092 18093 3694 1 6 . 1 1 23 23 CYS C C 23 177.594 177.594 176.011 1.583 18093 3695 1 6 . 1 1 23 23 CYS CA C 23 64.429 64.429 64.195 0.234 18093 3696 1 6 . 1 1 23 23 CYS CB C 23 26.940 26.940 27.648 -0.708 18093 3697 1 6 . 1 1 23 23 CYS H H 23 8.161 8.161 8.714 -0.553 18093 3698 1 6 . 1 1 24 24 LEU N N 24 117.814 117.814 121.577 -3.763 18093 3699 1 6 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.798 0.179 18093 3700 1 6 . 1 1 24 24 LEU C C 24 177.944 177.944 178.285 -0.341 18093 3701 1 6 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.816 -0.529 18093 3702 1 6 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.993 -0.090 18093 3703 1 6 . 1 1 24 24 LEU H H 24 8.106 8.106 7.627 0.479 18093 3704 1 6 . 1 1 25 25 THR N N 25 115.670 115.670 114.376 1.294 18093 3705 1 6 . 1 1 25 25 THR HA H 25 3.687 3.687 3.952 -0.265 18093 3706 1 6 . 1 1 25 25 THR C C 25 175.845 175.845 176.500 -0.655 18093 3707 1 6 . 1 1 25 25 THR CA C 25 68.306 68.306 66.695 1.611 18093 3708 1 6 . 1 1 25 25 THR H H 25 7.924 7.924 7.476 0.448 18093 3709 1 6 . 1 1 26 26 VAL N N 26 118.809 118.809 121.354 -2.545 18093 3710 1 6 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.810 -0.295 18093 3711 1 6 . 1 1 26 26 VAL C C 26 177.530 177.530 177.851 -0.321 18093 3712 1 6 . 1 1 26 26 VAL CA C 26 67.281 67.281 65.851 1.430 18093 3713 1 6 . 1 1 26 26 VAL CB C 26 31.724 31.724 30.997 0.727 18093 3714 1 6 . 1 1 26 26 VAL H H 26 7.764 7.764 7.330 0.434 18093 3715 1 6 . 1 1 27 27 LEU N N 27 117.958 117.958 121.410 -3.452 18093 3716 1 6 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.098 -0.062 18093 3717 1 6 . 1 1 27 27 LEU C C 27 178.163 178.163 179.039 -0.876 18093 3718 1 6 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.292 0.217 18093 3719 1 6 . 1 1 27 27 LEU CB C 27 41.919 41.919 41.139 0.780 18093 3720 1 6 . 1 1 27 27 LEU H H 27 7.912 7.912 8.061 -0.149 18093 3721 1 6 . 1 1 28 28 VAL N N 28 114.472 114.472 114.362 0.110 18093 3722 1 6 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.699 -0.164 18093 3723 1 6 . 1 1 28 28 VAL C C 28 176.871 176.871 177.744 -0.873 18093 3724 1 6 . 1 1 28 28 VAL CA C 28 65.977 65.977 65.816 0.161 18093 3725 1 6 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.366 0.568 18093 3726 1 6 . 1 1 28 28 VAL H H 28 7.892 7.892 7.518 0.374 18093 3727 1 6 . 1 1 29 29 PHE N N 29 115.206 115.206 117.643 -2.437 18093 3728 1 6 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.353 -0.150 18093 3729 1 6 . 1 1 29 29 PHE C C 29 176.614 176.614 176.538 0.076 18093 3730 1 6 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.234 0.730 18093 3731 1 6 . 1 1 29 29 PHE CB C 29 39.752 39.752 39.758 -0.006 18093 3732 1 6 . 1 1 29 29 PHE H H 29 7.748 7.748 7.721 0.027 18093 3733 1 6 . 1 1 30 30 TYR N N 30 115.975 115.975 120.220 -4.245 18093 3734 1 6 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.616 -0.294 18093 3735 1 6 . 1 1 30 30 TYR C C 30 175.553 175.553 175.676 -0.123 18093 3736 1 6 . 1 1 30 30 TYR CA C 30 59.598 59.598 59.738 -0.140 18093 3737 1 6 . 1 1 30 30 TYR CB C 30 39.763 39.763 40.872 -1.109 18093 3738 1 6 . 1 1 30 30 TYR H H 30 7.985 7.985 7.947 0.038 18093 3739 1 6 . 1 1 31 31 LEU N N 31 120.780 120.780 121.868 -1.088 18093 3740 1 6 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.784 -0.357 18093 3741 1 6 . 1 1 31 31 LEU CA C 31 54.665 54.665 51.728 2.937 18093 3742 1 6 . 1 1 31 31 LEU CB C 31 42.388 42.388 42.879 -0.491 18093 3743 1 6 . 1 1 31 31 LEU H H 31 7.643 7.643 8.116 -0.473 18093 3744 1 6 . 1 1 34 34 GLU C C 34 176.271 176.271 176.105 0.166 18093 3745 1 6 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.007 2.583 18093 3746 1 6 . 1 1 35 35 CYS N N 35 116.430 116.430 123.923 -7.493 18093 3747 1 6 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.309 0.058 18093 3748 1 6 . 1 1 35 35 CYS C C 35 175.198 175.198 176.361 -1.163 18093 3749 1 6 . 1 1 35 35 CYS CA C 35 60.293 60.293 60.149 0.144 18093 3750 1 6 . 1 1 35 35 CYS CB C 35 28.130 28.130 28.033 0.097 18093 3751 1 6 . 1 1 35 35 CYS H H 35 7.970 7.970 9.056 -1.086 18093 3752 1 6 . 1 1 36 36 GLY N N 36 108.315 108.315 108.958 -0.643 18093 3753 1 6 . 1 1 36 36 GLY C C 36 174.610 174.610 175.761 -1.151 18093 3754 1 6 . 1 1 36 36 GLY CA C 36 46.004 46.004 46.860 -0.856 18093 3755 1 6 . 1 1 36 36 GLY H H 36 8.120 8.120 7.926 0.194 18093 3756 1 6 . 1 1 37 37 GLU N N 37 121.347 121.347 121.584 -0.237 18093 3757 1 6 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.101 -0.054 18093 3758 1 6 . 1 1 37 37 GLU C C 37 177.338 177.338 178.802 -1.464 18093 3759 1 6 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.739 -1.232 18093 3760 1 6 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.292 0.278 18093 3761 1 6 . 1 1 37 37 GLU H H 37 8.423 8.423 7.891 0.532 18093 3762 1 6 . 1 1 38 38 LYS N N 38 123.788 123.788 119.789 3.999 18093 3763 1 6 . 1 1 38 38 LYS HA H 38 4.196 4.196 3.949 0.247 18093 3764 1 6 . 1 1 38 38 LYS C C 38 177.976 177.976 178.660 -0.684 18093 3765 1 6 . 1 1 38 38 LYS CA C 38 58.273 58.273 59.932 -1.659 18093 3766 1 6 . 1 1 38 38 LYS CB C 38 31.649 31.649 32.377 -0.728 18093 3767 1 6 . 1 1 38 38 LYS H H 38 8.211 8.211 7.364 0.847 18093 3768 1 6 . 1 1 39 39 ILE N N 39 115.675 115.675 119.107 -3.432 18093 3769 1 6 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.797 -0.189 18093 3770 1 6 . 1 1 39 39 ILE C C 39 177.204 177.204 177.890 -0.686 18093 3771 1 6 . 1 1 39 39 ILE CA C 39 65.501 65.501 64.880 0.621 18093 3772 1 6 . 1 1 39 39 ILE H H 39 7.933 7.933 7.485 0.448 18093 3773 1 6 . 1 1 40 40 THR N N 40 117.411 117.411 116.330 1.081 18093 3774 1 6 . 1 1 40 40 THR HA H 40 3.844 3.844 4.014 -0.170 18093 3775 1 6 . 1 1 40 40 THR C C 40 175.983 175.983 176.611 -0.628 18093 3776 1 6 . 1 1 40 40 THR CA C 40 67.360 67.360 66.593 0.767 18093 3777 1 6 . 1 1 40 40 THR H H 40 8.362 8.362 7.735 0.627 18093 3778 1 6 . 1 1 41 41 LEU N N 41 123.059 123.059 122.404 0.655 18093 3779 1 6 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.235 -0.219 18093 3780 1 6 . 1 1 41 41 LEU C C 41 178.914 178.914 177.850 1.064 18093 3781 1 6 . 1 1 41 41 LEU CA C 41 58.366 58.366 58.398 -0.032 18093 3782 1 6 . 1 1 41 41 LEU CB C 41 42.050 42.050 42.125 -0.075 18093 3783 1 6 . 1 1 41 41 LEU H H 41 8.282 8.282 7.890 0.392 18093 3784 1 6 . 1 1 42 42 CYS N N 42 118.762 118.762 118.809 -0.047 18093 3785 1 6 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.029 -0.093 18093 3786 1 6 . 1 1 42 42 CYS C C 42 176.607 176.607 176.747 -0.140 18093 3787 1 6 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.196 1.121 18093 3788 1 6 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.301 -0.382 18093 3789 1 6 . 1 1 42 42 CYS H H 42 8.195 8.195 7.734 0.461 18093 3790 1 6 . 1 1 43 43 ILE N N 43 117.589 117.589 119.437 -1.848 18093 3791 1 6 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.879 -0.272 18093 3792 1 6 . 1 1 43 43 ILE C C 43 177.323 177.323 178.279 -0.956 18093 3793 1 6 . 1 1 43 43 ILE CA C 43 65.249 65.249 63.530 1.719 18093 3794 1 6 . 1 1 43 43 ILE CB C 43 38.038 38.038 36.865 1.173 18093 3795 1 6 . 1 1 43 43 ILE H H 43 8.428 8.428 7.686 0.742 18093 3796 1 6 . 1 1 44 44 SER N N 44 115.950 115.950 116.823 -0.873 18093 3797 1 6 . 1 1 44 44 SER HA H 44 4.012 4.012 4.206 -0.194 18093 3798 1 6 . 1 1 44 44 SER C C 44 176.965 176.965 177.021 -0.056 18093 3799 1 6 . 1 1 44 44 SER CA C 44 63.575 63.575 62.409 1.166 18093 3800 1 6 . 1 1 44 44 SER H H 44 7.984 7.984 7.463 0.521 18093 3801 1 6 . 1 1 45 45 VAL N N 45 123.544 123.544 121.439 2.105 18093 3802 1 6 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.759 -0.211 18093 3803 1 6 . 1 1 45 45 VAL C C 45 177.139 177.139 178.315 -1.176 18093 3804 1 6 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.917 0.316 18093 3805 1 6 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.543 0.099 18093 3806 1 6 . 1 1 45 45 VAL H H 45 8.280 8.280 8.506 -0.226 18093 3807 1 6 . 1 1 46 46 LEU N N 46 119.883 119.883 119.689 0.194 18093 3808 1 6 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.024 -0.081 18093 3809 1 6 . 1 1 46 46 LEU C C 46 180.125 180.125 179.071 1.054 18093 3810 1 6 . 1 1 46 46 LEU CA C 46 58.600 58.600 58.159 0.441 18093 3811 1 6 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.684 0.329 18093 3812 1 6 . 1 1 46 46 LEU H H 46 8.117 8.117 7.438 0.679 18093 3813 1 6 . 1 1 47 47 LEU N N 47 120.193 120.193 119.987 0.206 18093 3814 1 6 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.818 0.186 18093 3815 1 6 . 1 1 47 47 LEU C C 47 178.370 178.370 178.791 -0.421 18093 3816 1 6 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.562 -0.136 18093 3817 1 6 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.640 0.415 18093 3818 1 6 . 1 1 47 47 LEU H H 47 8.933 8.933 7.717 1.216 18093 3819 1 6 . 1 1 48 48 SER N N 48 115.861 115.861 114.919 0.942 18093 3820 1 6 . 1 1 48 48 SER HA H 48 4.013 4.013 4.150 -0.137 18093 3821 1 6 . 1 1 48 48 SER C C 48 175.642 175.642 176.788 -1.146 18093 3822 1 6 . 1 1 48 48 SER CA C 48 63.571 63.571 61.725 1.846 18093 3823 1 6 . 1 1 48 48 SER CB C 48 62.879 62.879 62.531 0.348 18093 3824 1 6 . 1 1 48 48 SER H H 48 7.996 7.996 7.691 0.305 18093 3825 1 6 . 1 1 49 49 LEU N N 49 120.673 120.673 122.609 -1.936 18093 3826 1 6 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.207 -0.172 18093 3827 1 6 . 1 1 49 49 LEU C C 49 178.229 178.229 178.632 -0.403 18093 3828 1 6 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.269 0.014 18093 3829 1 6 . 1 1 49 49 LEU CB C 49 41.946 41.946 41.813 0.133 18093 3830 1 6 . 1 1 49 49 LEU H H 49 8.352 8.352 7.587 0.765 18093 3831 1 6 . 1 1 50 50 THR N N 50 115.582 115.582 114.321 1.261 18093 3832 1 6 . 1 1 50 50 THR HA H 50 3.672 3.672 4.074 -0.402 18093 3833 1 6 . 1 1 50 50 THR C C 50 175.877 175.877 176.740 -0.863 18093 3834 1 6 . 1 1 50 50 THR CA C 50 68.628 68.628 66.142 2.486 18093 3835 1 6 . 1 1 50 50 THR H H 50 7.937 7.937 7.742 0.195 18093 3836 1 6 . 1 1 51 51 VAL N N 51 119.774 119.774 122.732 -2.958 18093 3837 1 6 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.823 -0.325 18093 3838 1 6 . 1 1 51 51 VAL C C 51 177.162 177.162 177.314 -0.152 18093 3839 1 6 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.689 0.896 18093 3840 1 6 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.596 -0.075 18093 3841 1 6 . 1 1 51 51 VAL H H 51 8.115 8.115 8.013 0.102 18093 3842 1 6 . 1 1 52 52 PHE N N 52 118.808 118.808 120.589 -1.781 18093 3843 1 6 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.281 -0.159 18093 3844 1 6 . 1 1 52 52 PHE C C 52 176.697 176.697 176.867 -0.170 18093 3845 1 6 . 1 1 52 52 PHE CA C 52 61.771 61.771 61.037 0.734 18093 3846 1 6 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.053 0.209 18093 3847 1 6 . 1 1 52 52 PHE H H 52 8.256 8.256 8.719 -0.463 18093 3848 1 6 . 1 1 53 53 LEU N N 53 117.267 117.267 121.164 -3.897 18093 3849 1 6 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.554 0.339 18093 3850 1 6 . 1 1 53 53 LEU C C 53 179.319 179.319 177.895 1.424 18093 3851 1 6 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.729 0.256 18093 3852 1 6 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.286 0.541 18093 3853 1 6 . 1 1 53 53 LEU H H 53 8.443 8.443 7.533 0.910 18093 3854 1 6 . 1 1 54 54 LEU N N 54 119.762 119.762 119.020 0.742 18093 3855 1 6 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.901 0.153 18093 3856 1 6 . 1 1 54 54 LEU C C 54 178.827 178.827 178.977 -0.150 18093 3857 1 6 . 1 1 54 54 LEU CA C 54 58.105 58.105 58.005 0.100 18093 3858 1 6 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.668 0.279 18093 3859 1 6 . 1 1 54 54 LEU H H 54 8.205 8.205 7.340 0.865 18093 3860 1 6 . 1 1 55 55 LEU N N 55 118.585 118.585 118.600 -0.015 18093 3861 1 6 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.836 0.241 18093 3862 1 6 . 1 1 55 55 LEU C C 55 178.909 178.909 178.872 0.037 18093 3863 1 6 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.766 0.342 18093 3864 1 6 . 1 1 55 55 LEU CB C 55 41.979 41.979 41.784 0.195 18093 3865 1 6 . 1 1 55 55 LEU H H 55 8.179 8.179 7.340 0.839 18093 3866 1 6 . 1 1 56 56 ILE N N 56 116.079 116.079 114.864 1.215 18093 3867 1 6 . 1 1 56 56 ILE HA H 56 3.729 3.729 3.941 -0.212 18093 3868 1 6 . 1 1 56 56 ILE C C 56 176.988 176.988 177.765 -0.777 18093 3869 1 6 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.478 0.779 18093 3870 1 6 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.646 0.771 18093 3871 1 6 . 1 1 56 56 ILE H H 56 8.040 8.040 7.491 0.549 18093 3872 1 6 . 1 1 57 57 THR N N 57 110.105 110.105 110.127 -0.022 18093 3873 1 6 . 1 1 57 57 THR HA H 57 4.015 4.015 4.258 -0.243 18093 3874 1 6 . 1 1 57 57 THR C C 57 175.435 175.435 175.750 -0.315 18093 3875 1 6 . 1 1 57 57 THR CA C 57 65.067 65.067 64.295 0.772 18093 3876 1 6 . 1 1 57 57 THR CB C 57 69.179 69.179 68.493 0.687 18093 3877 1 6 . 1 1 57 57 THR H H 57 7.655 7.655 7.749 -0.094 18093 3878 1 6 . 1 1 58 58 GLU N N 58 117.313 117.313 121.193 -3.880 18093 3879 1 6 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.287 0.046 18093 3880 1 6 . 1 1 58 58 GLU C C 58 176.940 176.940 178.188 -1.248 18093 3881 1 6 . 1 1 58 58 GLU CA C 58 57.068 57.068 58.005 -0.937 18093 3882 1 6 . 1 1 58 58 GLU CB C 58 29.396 29.396 30.200 -0.804 18093 3883 1 6 . 1 1 58 58 GLU H H 58 7.521 7.521 7.822 -0.301 18093 3884 1 6 . 1 1 59 59 ILE N N 59 114.870 114.870 113.799 1.071 18093 3885 1 6 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.102 -0.013 18093 3886 1 6 . 1 1 59 59 ILE C C 59 175.456 175.456 176.156 -0.700 18093 3887 1 6 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.243 0.191 18093 3888 1 6 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.750 -0.093 18093 3889 1 6 . 1 1 59 59 ILE H H 59 7.579 7.579 7.368 0.211 18093 3890 1 6 . 1 1 60 60 ILE N N 60 119.354 119.354 117.638 1.716 18093 3891 1 6 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.830 0.474 18093 3892 1 6 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.462 -1.845 18093 3893 1 6 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.486 2.376 18093 3894 1 6 . 1 1 60 60 ILE H H 60 7.629 7.629 7.575 0.054 18093 3895 1 6 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.424 -0.024 18093 3896 1 6 . 1 1 61 61 PRO C C 61 177.144 177.144 176.931 0.213 18093 3897 1 6 . 1 1 61 61 PRO CA C 61 63.808 63.808 64.990 -1.182 18093 3898 1 6 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.514 -0.632 18093 3899 1 6 . 1 1 62 62 SER N N 62 114.474 114.474 109.144 5.330 18093 3900 1 6 . 1 1 62 62 SER HA H 62 4.434 4.434 4.435 -0.001 18093 3901 1 6 . 1 1 62 62 SER C C 62 175.161 175.161 173.842 1.319 18093 3902 1 6 . 1 1 62 62 SER CA C 62 59.047 59.047 58.594 0.452 18093 3903 1 6 . 1 1 62 62 SER CB C 62 63.704 63.704 64.068 -0.364 18093 3904 1 6 . 1 1 62 62 SER H H 62 8.186 8.186 8.108 0.078 18093 3905 1 6 . 1 1 63 63 THR N N 63 113.573 113.573 115.482 -1.909 18093 3906 1 6 . 1 1 63 63 THR HA H 63 4.319 4.319 4.020 0.299 18093 3907 1 6 . 1 1 63 63 THR C C 63 174.834 174.834 174.393 0.441 18093 3908 1 6 . 1 1 63 63 THR CA C 63 62.377 62.377 63.765 -1.388 18093 3909 1 6 . 1 1 63 63 THR CB C 63 69.422 69.422 67.105 2.317 18093 3910 1 6 . 1 1 63 63 THR H H 63 7.963 7.963 8.342 -0.379 18093 3911 1 6 . 1 1 64 64 SER N N 64 116.598 116.598 115.520 1.078 18093 3912 1 6 . 1 1 64 64 SER HA H 64 4.428 4.428 4.769 -0.341 18093 3913 1 6 . 1 1 64 64 SER C C 64 174.618 174.618 173.733 0.885 18093 3914 1 6 . 1 1 64 64 SER CA C 64 59.045 59.045 57.258 1.787 18093 3915 1 6 . 1 1 64 64 SER CB C 64 63.700 63.700 66.080 -2.380 18093 3916 1 6 . 1 1 64 64 SER H H 64 8.052 8.052 7.809 0.243 18093 3917 1 6 . 1 1 65 65 SER N N 65 116.673 116.673 117.281 -0.608 18093 3918 1 6 . 1 1 65 65 SER HA H 65 4.432 4.432 4.685 -0.253 18093 3919 1 6 . 1 1 65 65 SER C C 65 174.335 174.335 174.707 -0.372 18093 3920 1 6 . 1 1 65 65 SER CA C 65 58.927 58.927 58.416 0.511 18093 3921 1 6 . 1 1 65 65 SER CB C 65 63.621 63.621 62.660 0.961 18093 3922 1 6 . 1 1 65 65 SER H H 65 8.114 8.114 8.530 -0.416 18093 3923 1 6 . 1 1 66 66 VAL N N 66 119.054 119.054 115.929 3.125 18093 3924 1 6 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.490 -0.320 18093 3925 1 6 . 1 1 66 66 VAL C C 66 175.278 175.278 175.979 -0.701 18093 3926 1 6 . 1 1 66 66 VAL CA C 66 62.062 62.062 62.324 -0.262 18093 3927 1 6 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.316 0.313 18093 3928 1 6 . 1 1 66 66 VAL H H 66 7.740 7.740 7.843 -0.103 18093 3929 1 6 . 1 1 67 67 SER N N 67 118.882 118.882 117.612 1.270 18093 3930 1 6 . 1 1 67 67 SER HA H 67 4.704 4.704 4.965 -0.261 18093 3931 1 6 . 1 1 67 67 SER CA C 67 56.715 56.715 55.801 0.914 18093 3932 1 6 . 1 1 67 67 SER CB C 67 63.624 63.624 64.503 -0.879 18093 3933 1 6 . 1 1 67 67 SER H H 67 8.060 8.060 7.888 0.172 18093 3934 1 6 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.412 -0.012 18093 3935 1 6 . 1 1 68 68 PRO C C 68 176.925 176.925 176.439 0.486 18093 3936 1 6 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.895 0.853 18093 3937 1 6 . 1 1 68 68 PRO CB C 68 32.005 32.005 31.174 0.831 18093 3938 1 6 . 1 1 69 69 SER N N 69 114.930 114.930 117.937 -3.007 18093 3939 1 6 . 1 1 69 69 SER HA H 69 4.422 4.422 4.799 -0.377 18093 3940 1 6 . 1 1 69 69 SER C C 69 175.617 175.617 175.949 -0.332 18093 3941 1 6 . 1 1 69 69 SER CA C 69 58.697 58.697 56.392 2.305 18093 3942 1 6 . 1 1 69 69 SER CB C 69 63.804 63.804 65.959 -2.155 18093 3943 1 6 . 1 1 69 69 SER H H 69 8.205 8.205 7.841 0.364 18093 3944 1 6 . 1 1 70 70 ILE N N 70 120.840 120.840 123.319 -2.479 18093 3945 1 6 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.046 -0.054 18093 3946 1 6 . 1 1 70 70 ILE C C 70 177.524 177.524 176.443 1.081 18093 3947 1 6 . 1 1 70 70 ILE CA C 70 64.335 64.335 62.719 1.616 18093 3948 1 6 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.252 -0.792 18093 3949 1 6 . 1 1 70 70 ILE H H 70 8.283 8.283 8.882 -0.599 18093 3950 1 6 . 1 1 71 71 GLY N N 71 107.823 107.823 108.162 -0.339 18093 3951 1 6 . 1 1 71 71 GLY C C 71 175.296 175.296 176.010 -0.714 18093 3952 1 6 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.114 0.341 18093 3953 1 6 . 1 1 71 71 GLY H H 71 8.557 8.557 8.579 -0.022 18093 3954 1 6 . 1 1 72 72 GLU N N 72 120.835 120.835 121.438 -0.603 18093 3955 1 6 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.107 -0.260 18093 3956 1 6 . 1 1 72 72 GLU C C 72 178.198 178.198 178.156 0.042 18093 3957 1 6 . 1 1 72 72 GLU CA C 72 60.117 60.117 59.036 1.081 18093 3958 1 6 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.768 -0.376 18093 3959 1 6 . 1 1 72 72 GLU H H 72 7.922 7.922 7.813 0.109 18093 3960 1 6 . 1 1 73 73 TYR N N 73 117.375 117.375 121.709 -4.334 18093 3961 1 6 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.241 -0.079 18093 3962 1 6 . 1 1 73 73 TYR C C 73 179.912 179.912 177.347 2.565 18093 3963 1 6 . 1 1 73 73 TYR CA C 73 62.155 62.155 60.776 1.379 18093 3964 1 6 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.450 0.316 18093 3965 1 6 . 1 1 73 73 TYR H H 73 8.062 8.062 7.944 0.118 18093 3966 1 6 . 1 1 74 74 LEU N N 74 121.493 121.493 119.358 2.135 18093 3967 1 6 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.679 0.370 18093 3968 1 6 . 1 1 74 74 LEU C C 74 178.063 178.063 178.853 -0.790 18093 3969 1 6 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.511 0.984 18093 3970 1 6 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.871 -0.024 18093 3971 1 6 . 1 1 74 74 LEU H H 74 8.552 8.552 8.282 0.270 18093 3972 1 6 . 1 1 75 75 LEU N N 75 120.375 120.375 121.238 -0.863 18093 3973 1 6 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.079 -0.039 18093 3974 1 6 . 1 1 75 75 LEU C C 75 178.515 178.515 178.097 0.418 18093 3975 1 6 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.135 0.503 18093 3976 1 6 . 1 1 75 75 LEU CB C 75 42.039 42.039 41.886 0.153 18093 3977 1 6 . 1 1 75 75 LEU H H 75 8.276 8.276 7.824 0.452 18093 3978 1 6 . 1 1 76 76 PHE N N 76 116.626 116.626 117.125 -0.499 18093 3979 1 6 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.222 -0.143 18093 3980 1 6 . 1 1 76 76 PHE C C 76 177.399 177.399 178.162 -0.763 18093 3981 1 6 . 1 1 76 76 PHE CA C 76 61.734 61.734 61.357 0.377 18093 3982 1 6 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.463 0.278 18093 3983 1 6 . 1 1 76 76 PHE H H 76 8.454 8.454 8.249 0.205 18093 3984 1 6 . 1 1 77 77 THR N N 77 116.080 116.080 116.507 -0.427 18093 3985 1 6 . 1 1 77 77 THR HA H 77 3.687 3.687 3.994 -0.307 18093 3986 1 6 . 1 1 77 77 THR C C 77 176.018 176.018 176.494 -0.476 18093 3987 1 6 . 1 1 77 77 THR CA C 77 68.640 68.640 66.917 1.723 18093 3988 1 6 . 1 1 77 77 THR H H 77 8.224 8.224 8.207 0.017 18093 3989 1 6 . 1 1 78 78 MET N N 78 119.394 119.394 120.955 -1.561 18093 3990 1 6 . 1 1 78 78 MET HA H 78 4.129 4.129 4.055 0.074 18093 3991 1 6 . 1 1 78 78 MET C C 78 179.608 179.608 178.708 0.900 18093 3992 1 6 . 1 1 78 78 MET CA C 78 58.831 58.831 60.068 -1.237 18093 3993 1 6 . 1 1 78 78 MET CB C 78 31.590 31.590 32.597 -1.007 18093 3994 1 6 . 1 1 78 78 MET H H 78 8.372 8.372 7.759 0.613 18093 3995 1 6 . 1 1 79 79 ILE N N 79 121.819 121.819 118.100 3.719 18093 3996 1 6 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.764 -0.214 18093 3997 1 6 . 1 1 79 79 ILE C C 79 176.426 176.426 177.667 -1.241 18093 3998 1 6 . 1 1 79 79 ILE CA C 79 65.876 65.876 64.805 1.071 18093 3999 1 6 . 1 1 79 79 ILE CB C 79 37.673 37.673 37.636 0.037 18093 4000 1 6 . 1 1 79 79 ILE H H 79 8.391 8.391 7.576 0.815 18093 4001 1 6 . 1 1 80 80 PHE N N 80 119.916 119.916 120.941 -1.025 18093 4002 1 6 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.214 -0.161 18093 4003 1 6 . 1 1 80 80 PHE C C 80 178.568 178.568 177.028 1.540 18093 4004 1 6 . 1 1 80 80 PHE CA C 80 62.307 62.307 61.971 0.336 18093 4005 1 6 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.800 -1.026 18093 4006 1 6 . 1 1 80 80 PHE H H 80 8.479 8.479 7.295 1.184 18093 4007 1 6 . 1 1 81 81 VAL N N 81 120.191 120.191 115.772 4.419 18093 4008 1 6 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.584 -0.131 18093 4009 1 6 . 1 1 81 81 VAL C C 81 178.225 178.225 177.641 0.584 18093 4010 1 6 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.505 0.903 18093 4011 1 6 . 1 1 81 81 VAL CB C 81 31.556 31.556 31.263 0.293 18093 4012 1 6 . 1 1 81 81 VAL H H 81 8.928 8.928 8.865 0.063 18093 4013 1 6 . 1 1 82 82 THR N N 82 115.930 115.930 117.218 -1.288 18093 4014 1 6 . 1 1 82 82 THR HA H 82 3.636 3.636 4.043 -0.407 18093 4015 1 6 . 1 1 82 82 THR C C 82 176.420 176.420 176.540 -0.120 18093 4016 1 6 . 1 1 82 82 THR CA C 82 68.570 68.570 66.785 1.784 18093 4017 1 6 . 1 1 82 82 THR CB C 82 68.202 68.202 68.528 -0.326 18093 4018 1 6 . 1 1 82 82 THR H H 82 7.969 7.969 7.510 0.459 18093 4019 1 6 . 1 1 83 83 LEU N N 83 119.780 119.780 120.889 -1.109 18093 4020 1 6 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.901 -0.054 18093 4021 1 6 . 1 1 83 83 LEU C C 83 178.214 178.214 178.485 -0.271 18093 4022 1 6 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.559 0.679 18093 4023 1 6 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.253 0.538 18093 4024 1 6 . 1 1 83 83 LEU H H 83 8.483 8.483 7.419 1.064 18093 4025 1 6 . 1 1 84 84 SER N N 84 114.559 114.559 116.205 -1.646 18093 4026 1 6 . 1 1 84 84 SER HA H 84 4.099 4.099 3.995 0.104 18093 4027 1 6 . 1 1 84 84 SER C C 84 176.799 176.799 176.663 0.136 18093 4028 1 6 . 1 1 84 84 SER CA C 84 63.609 63.609 62.627 0.982 18093 4029 1 6 . 1 1 84 84 SER CB C 84 63.110 63.110 63.052 0.058 18093 4030 1 6 . 1 1 84 84 SER H H 84 8.023 8.023 7.816 0.207 18093 4031 1 6 . 1 1 85 85 ILE N N 85 123.962 123.962 121.428 2.534 18093 4032 1 6 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.850 -0.246 18093 4033 1 6 . 1 1 85 85 ILE C C 85 177.487 177.487 178.043 -0.556 18093 4034 1 6 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.109 0.651 18093 4035 1 6 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.947 -0.060 18093 4036 1 6 . 1 1 85 85 ILE H H 85 8.054 8.054 7.691 0.363 18093 4037 1 6 . 1 1 86 86 VAL N N 86 118.744 118.744 120.708 -1.964 18093 4038 1 6 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.830 -0.311 18093 4039 1 6 . 1 1 86 86 VAL C C 86 177.557 177.557 177.654 -0.097 18093 4040 1 6 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.569 0.966 18093 4041 1 6 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.891 -0.425 18093 4042 1 6 . 1 1 86 86 VAL H H 86 8.158 8.158 7.333 0.825 18093 4043 1 6 . 1 1 87 87 ILE N N 87 117.206 117.206 119.275 -2.069 18093 4044 1 6 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.746 -0.142 18093 4045 1 6 . 1 1 87 87 ILE C C 87 177.283 177.283 178.358 -1.075 18093 4046 1 6 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.477 2.199 18093 4047 1 6 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.563 1.026 18093 4048 1 6 . 1 1 87 87 ILE H H 87 8.459 8.459 8.351 0.108 18093 4049 1 6 . 1 1 88 88 THR N N 88 116.158 116.158 116.795 -0.637 18093 4050 1 6 . 1 1 88 88 THR HA H 88 3.672 3.672 4.208 -0.536 18093 4051 1 6 . 1 1 88 88 THR C C 88 175.485 175.485 176.732 -1.247 18093 4052 1 6 . 1 1 88 88 THR CA C 88 68.549 68.549 67.267 1.282 18093 4053 1 6 . 1 1 88 88 THR CB C 88 68.127 68.127 68.906 -0.779 18093 4054 1 6 . 1 1 88 88 THR H H 88 7.776 7.776 8.350 -0.574 18093 4055 1 6 . 1 1 89 89 VAL N N 89 117.985 117.985 121.373 -3.388 18093 4056 1 6 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.865 -0.322 18093 4057 1 6 . 1 1 89 89 VAL C C 89 177.393 177.393 177.454 -0.061 18093 4058 1 6 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.416 1.174 18093 4059 1 6 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.875 -0.097 18093 4060 1 6 . 1 1 89 89 VAL H H 89 8.206 8.206 7.646 0.560 18093 4061 1 6 . 1 1 90 90 PHE N N 90 116.709 116.709 120.010 -3.301 18093 4062 1 6 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.242 0.136 18093 4063 1 6 . 1 1 90 90 PHE C C 90 177.305 177.305 177.584 -0.279 18093 4064 1 6 . 1 1 90 90 PHE CA C 90 61.119 61.119 62.043 -0.924 18093 4065 1 6 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.468 0.917 18093 4066 1 6 . 1 1 90 90 PHE H H 90 7.956 7.956 7.852 0.104 18093 4067 1 6 . 1 1 91 91 VAL N N 91 116.565 116.565 120.120 -3.555 18093 4068 1 6 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.851 -0.016 18093 4069 1 6 . 1 1 91 91 VAL C C 91 176.927 176.927 177.249 -0.322 18093 4070 1 6 . 1 1 91 91 VAL CA C 91 65.347 65.347 65.573 -0.226 18093 4071 1 6 . 1 1 91 91 VAL CB C 91 31.867 31.867 32.108 -0.241 18093 4072 1 6 . 1 1 91 91 VAL H H 91 8.239 8.239 7.703 0.536 18093 4073 1 6 . 1 1 92 92 LEU N N 92 117.443 117.443 120.175 -2.732 18093 4074 1 6 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.227 -0.033 18093 4075 1 6 . 1 1 92 92 LEU C C 92 177.180 177.180 178.107 -0.927 18093 4076 1 6 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.682 -0.498 18093 4077 1 6 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.494 -0.550 18093 4078 1 6 . 1 1 92 92 LEU H H 92 7.967 7.967 7.822 0.145 18093 4079 1 6 . 1 1 93 93 ASN N N 93 116.705 116.705 117.619 -0.914 18093 4080 1 6 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.624 0.023 18093 4081 1 6 . 1 1 93 93 ASN C C 93 175.129 175.129 175.423 -0.294 18093 4082 1 6 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.164 -1.310 18093 4083 1 6 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.418 -0.023 18093 4084 1 6 . 1 1 93 93 ASN H H 93 7.683 7.683 7.853 -0.170 18093 4085 1 6 . 1 1 94 94 VAL N N 94 118.224 118.224 115.724 2.500 18093 4086 1 6 . 1 1 94 94 VAL HA H 94 3.961 3.961 4.482 -0.521 18093 4087 1 6 . 1 1 94 94 VAL C C 94 175.600 175.600 173.703 1.897 18093 4088 1 6 . 1 1 94 94 VAL CA C 94 62.825 62.825 60.624 2.201 18093 4089 1 6 . 1 1 94 94 VAL CB C 94 32.214 32.214 35.082 -2.868 18093 4090 1 6 . 1 1 94 94 VAL H H 94 7.627 7.627 8.048 -0.421 18093 4091 1 6 . 1 1 95 95 HIS N N 95 120.999 120.999 115.326 5.673 18093 4092 1 6 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.751 -0.158 18093 4093 1 6 . 1 1 95 95 HIS C C 95 174.146 174.146 173.139 1.007 18093 4094 1 6 . 1 1 95 95 HIS CA C 95 55.666 55.666 56.089 -0.423 18093 4095 1 6 . 1 1 95 95 HIS CB C 95 29.736 29.736 31.519 -1.783 18093 4096 1 6 . 1 1 95 95 HIS H H 95 8.263 8.263 8.016 0.247 18093 4097 1 6 . 1 1 96 96 HIS N N 96 122.740 122.740 120.219 2.521 18093 4098 1 6 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.458 0.175 18093 4099 1 6 . 1 1 96 96 HIS CA C 96 55.895 55.895 56.306 -0.411 18093 4100 1 6 . 1 1 96 96 HIS CB C 96 29.750 29.750 31.356 -1.606 18093 4101 1 6 . 1 1 96 96 HIS H H 96 8.298 8.298 8.665 -0.367 18093 4102 1 6 . 1 1 97 97 ARG N N 97 118.503 118.503 122.253 -3.750 18093 4103 1 6 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.754 -0.442 18093 4104 1 6 . 1 1 97 97 ARG C C 97 175.776 175.776 176.044 -0.268 18093 4105 1 6 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.411 0.814 18093 4106 1 6 . 1 1 97 97 ARG CB C 97 30.912 30.912 31.482 -0.570 18093 4107 1 6 . 1 1 97 97 ARG H H 97 8.250 8.250 8.271 -0.021 18093 4108 1 6 . 1 1 98 98 SER N N 98 118.482 118.482 118.182 0.300 18093 4109 1 6 . 1 1 98 98 SER HA H 98 4.722 4.722 4.964 -0.242 18093 4110 1 6 . 1 1 98 98 SER CA C 98 56.547 56.547 56.843 -0.296 18093 4111 1 6 . 1 1 98 98 SER CB C 98 63.624 63.624 64.161 -0.537 18093 4112 1 6 . 1 1 98 98 SER H H 98 8.254 8.254 8.626 -0.372 18093 4113 1 6 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.412 -0.009 18093 4114 1 6 . 1 1 99 99 PRO C C 99 176.899 176.899 176.178 0.721 18093 4115 1 6 . 1 1 99 99 PRO CA C 99 63.701 63.701 63.691 0.010 18093 4116 1 6 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.152 -0.203 18093 4117 1 6 . 1 1 100 100 GLU N N 100 120.187 120.187 117.018 3.169 18093 4118 1 6 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.135 0.153 18093 4119 1 6 . 1 1 100 100 GLU C C 100 176.593 176.593 175.877 0.716 18093 4120 1 6 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.923 -0.201 18093 4121 1 6 . 1 1 100 100 GLU CB C 100 29.999 29.999 28.944 1.055 18093 4122 1 6 . 1 1 100 100 GLU H H 100 8.401 8.401 8.427 -0.026 18093 4123 1 6 . 1 1 101 101 THR N N 101 113.968 113.968 108.857 5.111 18093 4124 1 6 . 1 1 101 101 THR HA H 101 4.286 4.286 4.248 0.038 18093 4125 1 6 . 1 1 101 101 THR C C 101 174.525 174.525 174.290 0.235 18093 4126 1 6 . 1 1 101 101 THR CA C 101 61.956 61.956 63.155 -1.199 18093 4127 1 6 . 1 1 101 101 THR CB C 101 69.697 69.697 69.287 0.410 18093 4128 1 6 . 1 1 101 101 THR H H 101 7.945 7.945 8.015 -0.070 18093 4129 1 6 . 1 1 102 102 HIS N N 102 120.322 120.322 120.069 0.253 18093 4130 1 6 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.762 -0.021 18093 4131 1 6 . 1 1 102 102 HIS C C 102 174.783 174.783 174.779 0.004 18093 4132 1 6 . 1 1 102 102 HIS CA C 102 55.701 55.701 55.366 0.335 18093 4133 1 6 . 1 1 102 102 HIS CB C 102 29.093 29.093 31.810 -2.717 18093 4134 1 6 . 1 1 102 102 HIS H H 102 8.455 8.455 7.732 0.723 18093 4135 1 6 . 1 1 103 103 THR N N 103 114.282 114.282 117.115 -2.833 18093 4136 1 6 . 1 1 103 103 THR HA H 103 4.352 4.352 4.233 0.119 18093 4137 1 6 . 1 1 103 103 THR C C 103 175.104 175.104 176.282 -1.178 18093 4138 1 6 . 1 1 103 103 THR CA C 103 62.057 62.057 62.995 -0.938 18093 4139 1 6 . 1 1 103 103 THR CB C 103 69.966 69.966 69.429 0.537 18093 4140 1 6 . 1 1 103 103 THR H H 103 8.069 8.069 8.453 -0.384 18093 4141 1 6 . 1 1 104 104 GLY N N 104 111.159 111.159 114.870 -3.711 18093 4142 1 6 . 1 1 104 104 GLY C C 104 174.776 174.776 173.865 0.911 18093 4143 1 6 . 1 1 104 104 GLY CA C 104 45.588 45.588 44.618 0.970 18093 4144 1 6 . 1 1 104 104 GLY H H 104 8.393 8.393 8.812 -0.419 18093 4145 1 6 . 1 1 105 105 GLY N N 105 108.657 108.657 109.759 -1.102 18093 4146 1 6 . 1 1 105 105 GLY C C 105 174.957 174.957 173.351 1.606 18093 4147 1 6 . 1 1 105 105 GLY CA C 105 45.612 45.612 44.420 1.192 18093 4148 1 6 . 1 1 105 105 GLY H H 105 8.275 8.275 7.858 0.417 18093 4149 1 6 . 1 1 106 106 GLY N N 106 108.870 108.870 107.965 0.905 18093 4150 1 6 . 1 1 106 106 GLY C C 106 174.877 174.877 174.305 0.572 18093 4151 1 6 . 1 1 106 106 GLY CA C 106 45.665 45.665 45.611 0.054 18093 4152 1 6 . 1 1 106 106 GLY H H 106 8.357 8.357 8.272 0.085 18093 4153 1 6 . 1 1 107 107 GLY N N 107 108.476 108.476 112.230 -3.754 18093 4154 1 6 . 1 1 107 107 GLY C C 107 174.877 174.877 175.113 -0.236 18093 4155 1 6 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.504 0.192 18093 4156 1 6 . 1 1 107 107 GLY H H 107 8.330 8.330 8.165 0.165 18093 4157 1 6 . 1 1 108 108 GLY N N 108 108.486 108.486 109.856 -1.370 18093 4158 1 6 . 1 1 108 108 GLY C C 108 175.345 175.345 174.890 0.455 18093 4159 1 6 . 1 1 108 108 GLY CA C 108 45.763 45.763 44.507 1.256 18093 4160 1 6 . 1 1 108 108 GLY H H 108 8.328 8.328 8.539 -0.211 18093 4161 1 6 . 1 1 109 109 ILE N N 109 120.433 120.433 120.456 -0.023 18093 4162 1 6 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.910 0.057 18093 4163 1 6 . 1 1 109 109 ILE C C 109 176.127 176.127 177.201 -1.074 18093 4164 1 6 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.505 -0.770 18093 4165 1 6 . 1 1 109 109 ILE CB C 109 38.125 38.125 38.071 0.054 18093 4166 1 6 . 1 1 109 109 ILE H H 109 8.192 8.192 7.839 0.353 18093 4167 1 6 . 1 1 110 110 ASP N N 110 121.148 121.148 119.503 1.645 18093 4168 1 6 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.484 -0.178 18093 4169 1 6 . 1 1 110 110 ASP C C 110 177.651 177.651 178.352 -0.701 18093 4170 1 6 . 1 1 110 110 ASP CA C 110 56.776 56.776 58.299 -1.523 18093 4171 1 6 . 1 1 110 110 ASP CB C 110 41.097 41.097 41.015 0.082 18093 4172 1 6 . 1 1 110 110 ASP H H 110 8.427 8.427 8.555 -0.128 18093 4173 1 6 . 1 1 111 111 ARG N N 111 119.228 119.228 118.744 0.484 18093 4174 1 6 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.259 -0.263 18093 4175 1 6 . 1 1 111 111 ARG C C 111 177.786 177.786 179.014 -1.228 18093 4176 1 6 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.060 -0.118 18093 4177 1 6 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.876 0.320 18093 4178 1 6 . 1 1 111 111 ARG H H 111 7.850 7.850 8.486 -0.636 18093 4179 1 6 . 1 1 112 112 ILE N N 112 118.000 118.000 119.607 -1.607 18093 4180 1 6 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.097 -0.284 18093 4181 1 6 . 1 1 112 112 ILE C C 112 177.496 177.496 177.957 -0.461 18093 4182 1 6 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.212 2.600 18093 4183 1 6 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.929 0.798 18093 4184 1 6 . 1 1 112 112 ILE H H 112 7.764 7.764 7.638 0.126 18093 4185 1 6 . 1 1 113 113 PHE N N 113 118.367 118.367 122.132 -3.765 18093 4186 1 6 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.247 0.008 18093 4187 1 6 . 1 1 113 113 PHE C C 113 177.218 177.218 177.414 -0.196 18093 4188 1 6 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.383 -0.950 18093 4189 1 6 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.171 -0.364 18093 4190 1 6 . 1 1 113 113 PHE H H 113 7.963 7.963 8.036 -0.073 18093 4191 1 6 . 1 1 114 114 LEU N N 114 118.921 118.921 117.726 1.195 18093 4192 1 6 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.974 0.023 18093 4193 1 6 . 1 1 114 114 LEU C C 114 178.297 178.297 178.362 -0.065 18093 4194 1 6 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.309 0.302 18093 4195 1 6 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.249 0.703 18093 4196 1 6 . 1 1 114 114 LEU H H 114 7.939 7.939 8.160 -0.221 18093 4197 1 6 . 1 1 115 115 TRP N N 115 117.464 117.464 119.467 -2.003 18093 4198 1 6 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.386 -0.012 18093 4199 1 6 . 1 1 115 115 TRP C C 115 178.572 178.572 178.260 0.312 18093 4200 1 6 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.792 1.130 18093 4201 1 6 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.773 -1.266 18093 4202 1 6 . 1 1 115 115 TRP H H 115 7.969 7.969 7.617 0.352 18093 4203 1 6 . 1 1 116 116 MET N N 116 117.069 117.069 118.921 -1.852 18093 4204 1 6 . 1 1 116 116 MET HA H 116 4.065 4.065 4.229 -0.164 18093 4205 1 6 . 1 1 116 116 MET C C 116 177.425 177.425 178.203 -0.778 18093 4206 1 6 . 1 1 116 116 MET CA C 116 59.289 59.289 59.100 0.189 18093 4207 1 6 . 1 1 116 116 MET CB C 116 31.692 31.692 32.515 -0.823 18093 4208 1 6 . 1 1 116 116 MET H H 116 8.465 8.465 7.718 0.748 18093 4209 1 6 . 1 1 117 117 PHE N N 117 118.755 118.755 117.687 1.068 18093 4210 1 6 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.113 -0.014 18093 4211 1 6 . 1 1 117 117 PHE C C 117 177.965 177.965 178.338 -0.373 18093 4212 1 6 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.216 -0.508 18093 4213 1 6 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.257 0.928 18093 4214 1 6 . 1 1 117 117 PHE H H 117 8.418 8.418 7.848 0.570 18093 4215 1 6 . 1 1 118 118 ILE N N 118 119.133 119.133 115.358 3.775 18093 4216 1 6 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.910 -0.566 18093 4217 1 6 . 1 1 118 118 ILE C C 118 177.244 177.244 177.610 -0.366 18093 4218 1 6 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.319 1.506 18093 4219 1 6 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.776 -0.228 18093 4220 1 6 . 1 1 118 118 ILE H H 118 8.266 8.266 7.728 0.538 18093 4221 1 6 . 1 1 119 119 ILE N N 119 118.846 118.846 121.378 -2.532 18093 4222 1 6 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.970 -0.398 18093 4223 1 6 . 1 1 119 119 ILE C C 119 177.523 177.523 177.686 -0.163 18093 4224 1 6 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.091 0.798 18093 4225 1 6 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.319 -0.755 18093 4226 1 6 . 1 1 119 119 ILE H H 119 8.308 8.308 7.336 0.972 18093 4227 1 6 . 1 1 120 120 VAL N N 120 119.228 119.228 117.577 1.651 18093 4228 1 6 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.819 -0.311 18093 4229 1 6 . 1 1 120 120 VAL C C 120 177.651 177.651 177.279 0.372 18093 4230 1 6 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.608 1.993 18093 4231 1 6 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.492 0.914 18093 4232 1 6 . 1 1 120 120 VAL H H 120 8.399 8.399 8.031 0.368 18093 4233 1 6 . 1 1 121 121 CYS N N 121 117.151 117.151 120.138 -2.987 18093 4234 1 6 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.020 -0.117 18093 4235 1 6 . 1 1 121 121 CYS C C 121 177.719 177.719 177.102 0.617 18093 4236 1 6 . 1 1 121 121 CYS CA C 121 64.298 64.298 64.273 0.025 18093 4237 1 6 . 1 1 121 121 CYS CB C 121 26.677 26.677 27.343 -0.666 18093 4238 1 6 . 1 1 121 121 CYS H H 121 8.008 8.008 7.473 0.535 18093 4239 1 6 . 1 1 122 122 LEU N N 122 121.402 121.402 119.403 1.999 18093 4240 1 6 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.192 -0.209 18093 4241 1 6 . 1 1 122 122 LEU C C 122 178.282 178.282 178.744 -0.462 18093 4242 1 6 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.360 1.185 18093 4243 1 6 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.385 0.581 18093 4244 1 6 . 1 1 122 122 LEU H H 122 8.417 8.417 7.641 0.776 18093 4245 1 6 . 1 1 123 123 LEU N N 123 118.543 118.543 120.557 -2.014 18093 4246 1 6 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.068 -0.148 18093 4247 1 6 . 1 1 123 123 LEU C C 123 179.028 179.028 178.633 0.395 18093 4248 1 6 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.355 -0.237 18093 4249 1 6 . 1 1 123 123 LEU CB C 123 42.056 42.056 41.036 1.020 18093 4250 1 6 . 1 1 123 123 LEU H H 123 8.590 8.590 7.618 0.972 18093 4251 1 6 . 1 1 124 124 GLY N N 124 104.896 104.896 105.605 -0.709 18093 4252 1 6 . 1 1 124 124 GLY C C 124 173.932 173.932 176.020 -2.088 18093 4253 1 6 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.604 -0.377 18093 4254 1 6 . 1 1 124 124 GLY H H 124 8.601 8.601 8.598 0.003 18093 4255 1 6 . 1 1 125 125 THR N N 125 115.403 115.403 118.900 -3.497 18093 4256 1 6 . 1 1 125 125 THR HA H 125 3.686 3.686 3.761 -0.075 18093 4257 1 6 . 1 1 125 125 THR C C 125 176.407 176.407 176.440 -0.033 18093 4258 1 6 . 1 1 125 125 THR CA C 125 67.565 67.565 66.463 1.102 18093 4259 1 6 . 1 1 125 125 THR CB C 125 68.143 68.143 68.240 -0.097 18093 4260 1 6 . 1 1 125 125 THR H H 125 7.734 7.734 7.399 0.335 18093 4261 1 6 . 1 1 126 126 VAL N N 126 119.056 119.056 120.911 -1.855 18093 4262 1 6 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.822 -0.283 18093 4263 1 6 . 1 1 126 126 VAL C C 126 177.628 177.628 178.217 -0.589 18093 4264 1 6 . 1 1 126 126 VAL CA C 126 66.601 66.601 65.858 0.743 18093 4265 1 6 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.198 0.296 18093 4266 1 6 . 1 1 126 126 VAL H H 126 8.015 8.015 7.623 0.392 18093 4267 1 6 . 1 1 127 127 GLY N N 127 104.644 104.644 107.293 -2.649 18093 4268 1 6 . 1 1 127 127 GLY C C 127 173.933 173.933 175.817 -1.884 18093 4269 1 6 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.056 0.225 18093 4270 1 6 . 1 1 127 127 GLY H H 127 8.248 8.248 8.697 -0.449 18093 4271 1 6 . 1 1 128 128 LEU N N 128 117.354 117.354 120.870 -3.516 18093 4272 1 6 . 1 1 128 128 LEU HA H 128 4.012 4.012 3.980 0.032 18093 4273 1 6 . 1 1 128 128 LEU C C 128 177.443 177.443 177.833 -0.390 18093 4274 1 6 . 1 1 128 128 LEU CA C 128 56.626 56.626 57.142 -0.516 18093 4275 1 6 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.549 0.711 18093 4276 1 6 . 1 1 128 128 LEU H H 128 7.568 7.568 7.568 -0.000 18093 4277 1 6 . 1 1 129 129 PHE N N 129 113.971 113.971 116.896 -2.925 18093 4278 1 6 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.381 0.077 18093 4279 1 6 . 1 1 129 129 PHE C C 129 176.216 176.216 176.554 -0.338 18093 4280 1 6 . 1 1 129 129 PHE CA C 129 58.385 58.385 61.282 -2.897 18093 4281 1 6 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.871 -0.152 18093 4282 1 6 . 1 1 129 129 PHE H H 129 7.639 7.639 7.326 0.313 18093 4283 1 6 . 1 1 130 130 LEU N N 130 117.752 117.752 118.638 -0.886 18093 4284 1 6 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.879 -0.446 18093 4285 1 6 . 1 1 130 130 LEU CA C 130 54.156 54.156 52.264 1.892 18093 4286 1 6 . 1 1 130 130 LEU H H 130 8.099 8.099 8.145 -0.046 18093 4287 1 6 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.914 -0.464 18093 4288 1 6 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.585 2.314 18093 4289 1 6 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.398 -0.136 18093 4290 1 6 . 1 1 132 132 PRO C C 132 177.616 177.616 178.714 -1.098 18093 4291 1 6 . 1 1 132 132 PRO CA C 132 64.980 64.980 65.242 -0.262 18093 4292 1 6 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.054 -0.429 18093 4293 1 6 . 1 1 133 133 TRP N N 133 115.508 115.508 120.881 -5.373 18093 4294 1 6 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.451 0.141 18093 4295 1 6 . 1 1 133 133 TRP C C 133 176.842 176.842 176.262 0.580 18093 4296 1 6 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.871 -2.588 18093 4297 1 6 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.439 -0.843 18093 4298 1 6 . 1 1 133 133 TRP H H 133 7.311 7.311 8.569 -1.258 18093 4299 1 6 . 1 1 134 134 LEU N N 134 119.570 119.570 116.375 3.195 18093 4300 1 6 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.565 -0.388 18093 4301 1 6 . 1 1 134 134 LEU C C 134 175.768 175.768 176.436 -0.668 18093 4302 1 6 . 1 1 134 134 LEU CA C 134 55.621 55.621 53.594 2.027 18093 4303 1 6 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.694 0.954 18093 4304 1 6 . 1 1 134 134 LEU H H 134 7.453 7.453 7.405 0.048 18093 4305 1 6 . 1 1 135 135 ALA N N 135 119.004 119.004 122.215 -3.211 18093 4306 1 6 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.229 -0.006 18093 4307 1 6 . 1 1 135 135 ALA C C 135 177.170 177.170 177.784 -0.614 18093 4308 1 6 . 1 1 135 135 ALA CA C 135 52.456 52.456 54.110 -1.654 18093 4309 1 6 . 1 1 135 135 ALA CB C 135 19.736 19.736 19.599 0.137 18093 4310 1 6 . 1 1 135 135 ALA H H 135 7.541 7.541 7.745 -0.204 18093 4311 1 6 . 1 1 136 136 GLY N N 136 105.879 105.879 106.536 -0.657 18093 4312 1 6 . 1 1 136 136 GLY C C 136 173.042 173.042 174.740 -1.698 18093 4313 1 6 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.655 0.038 18093 4314 1 6 . 1 1 136 136 GLY H H 136 7.846 7.846 7.902 -0.057 18093 4315 1 7 . 1 1 5 5 GLU N N 5 119.627 119.627 120.365 -0.738 18093 4316 1 7 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.365 -0.157 18093 4317 1 7 . 1 1 5 5 GLU C C 5 176.581 176.581 175.070 1.511 18093 4318 1 7 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.284 0.761 18093 4319 1 7 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.834 0.204 18093 4320 1 7 . 1 1 5 5 GLU H H 5 8.003 8.003 8.263 -0.260 18093 4321 1 7 . 1 1 6 6 LEU N N 6 121.267 121.267 122.235 -0.968 18093 4322 1 7 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.636 -0.211 18093 4323 1 7 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.377 2.258 18093 4324 1 7 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.798 -0.502 18093 4325 1 7 . 1 1 6 6 LEU H H 6 8.104 8.104 7.850 0.254 18093 4326 1 7 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.642 -0.243 18093 4327 1 7 . 1 1 7 7 PRO C C 7 178.408 178.408 177.819 0.589 18093 4328 1 7 . 1 1 7 7 PRO CA C 7 64.712 64.712 61.965 2.747 18093 4329 1 7 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.909 -0.992 18093 4330 1 7 . 1 1 8 8 LEU N N 8 121.835 121.835 120.723 1.112 18093 4331 1 7 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.060 0.029 18093 4332 1 7 . 1 1 8 8 LEU C C 8 177.902 177.902 178.433 -0.531 18093 4333 1 7 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.579 0.526 18093 4334 1 7 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.088 0.519 18093 4335 1 7 . 1 1 8 8 LEU H H 8 8.162 8.162 8.526 -0.364 18093 4336 1 7 . 1 1 9 9 PHE N N 9 118.342 118.342 118.841 -0.499 18093 4337 1 7 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.106 0.083 18093 4338 1 7 . 1 1 9 9 PHE C C 9 177.596 177.596 177.552 0.044 18093 4339 1 7 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.696 -0.582 18093 4340 1 7 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.534 0.193 18093 4341 1 7 . 1 1 9 9 PHE H H 9 8.318 8.318 8.225 0.093 18093 4342 1 7 . 1 1 10 10 TYR N N 10 117.584 117.584 118.633 -1.049 18093 4343 1 7 . 1 1 10 10 TYR HA H 10 4.154 4.154 4.459 -0.305 18093 4344 1 7 . 1 1 10 10 TYR C C 10 177.630 177.630 177.525 0.105 18093 4345 1 7 . 1 1 10 10 TYR CA C 10 61.036 61.036 60.654 0.383 18093 4346 1 7 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.351 0.309 18093 4347 1 7 . 1 1 10 10 TYR H H 10 8.105 8.105 8.570 -0.465 18093 4348 1 7 . 1 1 11 11 THR N N 11 115.563 115.563 116.033 -0.470 18093 4349 1 7 . 1 1 11 11 THR HA H 11 3.871 3.871 3.860 0.011 18093 4350 1 7 . 1 1 11 11 THR C C 11 175.955 175.955 175.998 -0.043 18093 4351 1 7 . 1 1 11 11 THR CA C 11 67.290 67.290 66.712 0.578 18093 4352 1 7 . 1 1 11 11 THR CB C 11 68.201 68.201 68.703 -0.502 18093 4353 1 7 . 1 1 11 11 THR H H 11 7.915 7.915 7.760 0.155 18093 4354 1 7 . 1 1 12 12 ILE N N 12 119.727 119.727 120.311 -0.584 18093 4355 1 7 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.879 -0.180 18093 4356 1 7 . 1 1 12 12 ILE C C 12 175.773 175.773 177.027 -1.254 18093 4357 1 7 . 1 1 12 12 ILE CA C 12 64.699 64.699 63.347 1.352 18093 4358 1 7 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.643 1.453 18093 4359 1 7 . 1 1 12 12 ILE H H 12 8.186 8.186 7.926 0.260 18093 4360 1 7 . 1 1 13 13 ASN N N 13 114.190 114.190 118.718 -4.528 18093 4361 1 7 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.485 -0.063 18093 4362 1 7 . 1 1 13 13 ASN C C 13 174.786 174.786 176.655 -1.869 18093 4363 1 7 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.505 0.050 18093 4364 1 7 . 1 1 13 13 ASN CB C 13 39.358 39.358 39.124 0.234 18093 4365 1 7 . 1 1 13 13 ASN H H 13 7.601 7.601 7.437 0.164 18093 4366 1 7 . 1 1 14 14 LEU N N 14 115.031 115.031 119.734 -4.703 18093 4367 1 7 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.113 0.083 18093 4368 1 7 . 1 1 14 14 LEU C C 14 177.540 177.540 178.022 -0.482 18093 4369 1 7 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.340 0.067 18093 4370 1 7 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.277 -0.435 18093 4371 1 7 . 1 1 14 14 LEU H H 14 7.390 7.390 7.459 -0.069 18093 4372 1 7 . 1 1 15 15 ILE N N 15 118.223 118.223 120.265 -2.042 18093 4373 1 7 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.626 -0.013 18093 4374 1 7 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.608 3.112 18093 4375 1 7 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.136 -0.524 18093 4376 1 7 . 1 1 15 15 ILE H H 15 8.123 8.123 7.749 0.374 18093 4377 1 7 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.333 -0.264 18093 4378 1 7 . 1 1 17 17 PRO C C 17 177.721 177.721 178.991 -1.270 18093 4379 1 7 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.495 1.266 18093 4380 1 7 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.762 -0.019 18093 4381 1 7 . 1 1 18 18 CYS N N 18 113.538 113.538 116.807 -3.269 18093 4382 1 7 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.165 -0.157 18093 4383 1 7 . 1 1 18 18 CYS C C 18 177.683 177.683 177.164 0.519 18093 4384 1 7 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.606 0.894 18093 4385 1 7 . 1 1 18 18 CYS CB C 18 26.873 26.873 26.639 0.234 18093 4386 1 7 . 1 1 18 18 CYS H H 18 7.410 7.410 7.467 -0.057 18093 4387 1 7 . 1 1 19 19 LEU N N 19 122.545 122.545 119.815 2.730 18093 4388 1 7 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.106 -0.107 18093 4389 1 7 . 1 1 19 19 LEU C C 19 178.608 178.608 178.756 -0.148 18093 4390 1 7 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.420 1.001 18093 4391 1 7 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.359 0.485 18093 4392 1 7 . 1 1 19 19 LEU H H 19 8.635 8.635 7.395 1.240 18093 4393 1 7 . 1 1 20 20 LEU N N 20 119.404 119.404 120.245 -0.841 18093 4394 1 7 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.883 0.123 18093 4395 1 7 . 1 1 20 20 LEU C C 20 178.540 178.540 179.456 -0.916 18093 4396 1 7 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.322 0.477 18093 4397 1 7 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.799 0.200 18093 4398 1 7 . 1 1 20 20 LEU H H 20 8.392 8.392 7.472 0.920 18093 4399 1 7 . 1 1 21 21 ILE N N 21 117.335 117.335 114.055 3.280 18093 4400 1 7 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.793 -0.142 18093 4401 1 7 . 1 1 21 21 ILE C C 21 177.249 177.249 177.587 -0.338 18093 4402 1 7 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.582 0.679 18093 4403 1 7 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.263 0.697 18093 4404 1 7 . 1 1 21 21 ILE H H 21 8.403 8.403 8.431 -0.028 18093 4405 1 7 . 1 1 22 22 SER N N 22 116.385 116.385 118.060 -1.675 18093 4406 1 7 . 1 1 22 22 SER HA H 22 4.056 4.056 4.155 -0.099 18093 4407 1 7 . 1 1 22 22 SER C C 22 176.813 176.813 176.432 0.381 18093 4408 1 7 . 1 1 22 22 SER CA C 22 63.866 63.866 61.940 1.926 18093 4409 1 7 . 1 1 22 22 SER CB C 22 62.898 62.898 63.092 -0.194 18093 4410 1 7 . 1 1 22 22 SER H H 22 8.271 8.271 7.581 0.690 18093 4411 1 7 . 1 1 23 23 CYS N N 23 119.001 119.001 120.577 -1.576 18093 4412 1 7 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.121 -0.131 18093 4413 1 7 . 1 1 23 23 CYS C C 23 177.594 177.594 176.195 1.399 18093 4414 1 7 . 1 1 23 23 CYS CA C 23 64.429 64.429 61.546 2.883 18093 4415 1 7 . 1 1 23 23 CYS CB C 23 26.940 26.940 26.774 0.166 18093 4416 1 7 . 1 1 23 23 CYS H H 23 8.161 8.161 8.574 -0.413 18093 4417 1 7 . 1 1 24 24 LEU N N 24 117.814 117.814 120.789 -2.975 18093 4418 1 7 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.814 0.163 18093 4419 1 7 . 1 1 24 24 LEU C C 24 177.944 177.944 178.301 -0.357 18093 4420 1 7 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.611 -0.324 18093 4421 1 7 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.992 -0.089 18093 4422 1 7 . 1 1 24 24 LEU H H 24 8.106 8.106 7.551 0.555 18093 4423 1 7 . 1 1 25 25 THR N N 25 115.670 115.670 114.205 1.465 18093 4424 1 7 . 1 1 25 25 THR HA H 25 3.687 3.687 3.904 -0.217 18093 4425 1 7 . 1 1 25 25 THR C C 25 175.845 175.845 176.290 -0.445 18093 4426 1 7 . 1 1 25 25 THR CA C 25 68.306 68.306 66.775 1.530 18093 4427 1 7 . 1 1 25 25 THR H H 25 7.924 7.924 7.470 0.454 18093 4428 1 7 . 1 1 26 26 VAL N N 26 118.809 118.809 121.555 -2.746 18093 4429 1 7 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.379 0.136 18093 4430 1 7 . 1 1 26 26 VAL C C 26 177.530 177.530 177.182 0.348 18093 4431 1 7 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.109 1.172 18093 4432 1 7 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.205 0.519 18093 4433 1 7 . 1 1 26 26 VAL H H 26 7.764 7.764 7.250 0.514 18093 4434 1 7 . 1 1 27 27 LEU N N 27 117.958 117.958 121.437 -3.479 18093 4435 1 7 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.160 -0.124 18093 4436 1 7 . 1 1 27 27 LEU C C 27 178.163 178.163 178.557 -0.394 18093 4437 1 7 . 1 1 27 27 LEU CA C 27 58.509 58.509 57.775 0.734 18093 4438 1 7 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.816 1.103 18093 4439 1 7 . 1 1 27 27 LEU H H 27 7.912 7.912 8.042 -0.130 18093 4440 1 7 . 1 1 28 28 VAL N N 28 114.472 114.472 118.934 -4.462 18093 4441 1 7 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.788 -0.253 18093 4442 1 7 . 1 1 28 28 VAL C C 28 176.871 176.871 177.727 -0.856 18093 4443 1 7 . 1 1 28 28 VAL CA C 28 65.977 65.977 65.156 0.821 18093 4444 1 7 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.194 0.740 18093 4445 1 7 . 1 1 28 28 VAL H H 28 7.892 7.892 7.588 0.304 18093 4446 1 7 . 1 1 29 29 PHE N N 29 115.206 115.206 116.535 -1.329 18093 4447 1 7 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.228 -0.025 18093 4448 1 7 . 1 1 29 29 PHE C C 29 176.614 176.614 177.302 -0.688 18093 4449 1 7 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.645 0.319 18093 4450 1 7 . 1 1 29 29 PHE CB C 29 39.752 39.752 38.483 1.269 18093 4451 1 7 . 1 1 29 29 PHE H H 29 7.748 7.748 7.896 -0.148 18093 4452 1 7 . 1 1 30 30 TYR N N 30 115.975 115.975 119.159 -3.184 18093 4453 1 7 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.167 0.155 18093 4454 1 7 . 1 1 30 30 TYR C C 30 175.553 175.553 175.727 -0.174 18093 4455 1 7 . 1 1 30 30 TYR CA C 30 59.598 59.598 60.210 -0.612 18093 4456 1 7 . 1 1 30 30 TYR CB C 30 39.763 39.763 39.758 0.005 18093 4457 1 7 . 1 1 30 30 TYR H H 30 7.985 7.985 7.737 0.248 18093 4458 1 7 . 1 1 31 31 LEU N N 31 120.780 120.780 120.504 0.276 18093 4459 1 7 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.532 -0.105 18093 4460 1 7 . 1 1 31 31 LEU CA C 31 54.665 54.665 51.298 3.367 18093 4461 1 7 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.558 -1.170 18093 4462 1 7 . 1 1 31 31 LEU H H 31 7.643 7.643 7.814 -0.171 18093 4463 1 7 . 1 1 34 34 GLU C C 34 176.271 176.271 176.873 -0.602 18093 4464 1 7 . 1 1 34 34 GLU CA C 34 57.590 57.590 57.513 0.077 18093 4465 1 7 . 1 1 35 35 CYS N N 35 116.430 116.430 119.566 -3.136 18093 4466 1 7 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.350 0.017 18093 4467 1 7 . 1 1 35 35 CYS C C 35 175.198 175.198 175.710 -0.512 18093 4468 1 7 . 1 1 35 35 CYS CA C 35 60.293 60.293 60.230 0.062 18093 4469 1 7 . 1 1 35 35 CYS CB C 35 28.130 28.130 27.898 0.232 18093 4470 1 7 . 1 1 35 35 CYS H H 35 7.970 7.970 8.701 -0.731 18093 4471 1 7 . 1 1 36 36 GLY N N 36 108.315 108.315 106.982 1.333 18093 4472 1 7 . 1 1 36 36 GLY C C 36 174.610 174.610 173.782 0.828 18093 4473 1 7 . 1 1 36 36 GLY CA C 36 46.004 46.004 45.214 0.790 18093 4474 1 7 . 1 1 36 36 GLY H H 36 8.120 8.120 7.831 0.289 18093 4475 1 7 . 1 1 37 37 GLU N N 37 121.347 121.347 122.175 -0.828 18093 4476 1 7 . 1 1 37 37 GLU HA H 37 4.047 4.047 3.960 0.087 18093 4477 1 7 . 1 1 37 37 GLU C C 37 177.338 177.338 177.063 0.275 18093 4478 1 7 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.130 -0.624 18093 4479 1 7 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.724 -0.153 18093 4480 1 7 . 1 1 37 37 GLU H H 37 8.423 8.423 7.991 0.432 18093 4481 1 7 . 1 1 38 38 LYS N N 38 123.788 123.788 119.659 4.129 18093 4482 1 7 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.091 0.105 18093 4483 1 7 . 1 1 38 38 LYS C C 38 177.976 177.976 178.874 -0.898 18093 4484 1 7 . 1 1 38 38 LYS CA C 38 58.273 58.273 59.499 -1.226 18093 4485 1 7 . 1 1 38 38 LYS CB C 38 31.649 31.649 32.060 -0.411 18093 4486 1 7 . 1 1 38 38 LYS H H 38 8.211 8.211 8.072 0.139 18093 4487 1 7 . 1 1 39 39 ILE N N 39 115.675 115.675 119.072 -3.397 18093 4488 1 7 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.771 -0.163 18093 4489 1 7 . 1 1 39 39 ILE C C 39 177.204 177.204 177.921 -0.717 18093 4490 1 7 . 1 1 39 39 ILE CA C 39 65.501 65.501 64.555 0.946 18093 4491 1 7 . 1 1 39 39 ILE H H 39 7.933 7.933 7.571 0.362 18093 4492 1 7 . 1 1 40 40 THR N N 40 117.411 117.411 117.044 0.367 18093 4493 1 7 . 1 1 40 40 THR HA H 40 3.844 3.844 3.971 -0.127 18093 4494 1 7 . 1 1 40 40 THR C C 40 175.983 175.983 176.622 -0.639 18093 4495 1 7 . 1 1 40 40 THR CA C 40 67.360 67.360 66.904 0.456 18093 4496 1 7 . 1 1 40 40 THR H H 40 8.362 8.362 7.431 0.931 18093 4497 1 7 . 1 1 41 41 LEU N N 41 123.059 123.059 121.841 1.218 18093 4498 1 7 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.281 -0.265 18093 4499 1 7 . 1 1 41 41 LEU C C 41 178.914 178.914 178.158 0.756 18093 4500 1 7 . 1 1 41 41 LEU CA C 41 58.366 58.366 57.483 0.884 18093 4501 1 7 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.879 0.171 18093 4502 1 7 . 1 1 41 41 LEU H H 41 8.282 8.282 7.926 0.356 18093 4503 1 7 . 1 1 42 42 CYS N N 42 118.762 118.762 118.911 -0.149 18093 4504 1 7 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.219 -0.283 18093 4505 1 7 . 1 1 42 42 CYS C C 42 176.607 176.607 177.033 -0.426 18093 4506 1 7 . 1 1 42 42 CYS CA C 42 64.317 64.317 62.662 1.655 18093 4507 1 7 . 1 1 42 42 CYS CB C 42 26.919 26.919 26.410 0.509 18093 4508 1 7 . 1 1 42 42 CYS H H 42 8.195 8.195 7.696 0.499 18093 4509 1 7 . 1 1 43 43 ILE N N 43 117.589 117.589 120.649 -3.060 18093 4510 1 7 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.762 -0.155 18093 4511 1 7 . 1 1 43 43 ILE C C 43 177.323 177.323 177.491 -0.168 18093 4512 1 7 . 1 1 43 43 ILE CA C 43 65.249 65.249 65.182 0.067 18093 4513 1 7 . 1 1 43 43 ILE CB C 43 38.038 38.038 38.053 -0.015 18093 4514 1 7 . 1 1 43 43 ILE H H 43 8.428 8.428 7.702 0.726 18093 4515 1 7 . 1 1 44 44 SER N N 44 115.950 115.950 115.997 -0.047 18093 4516 1 7 . 1 1 44 44 SER HA H 44 4.012 4.012 4.172 -0.160 18093 4517 1 7 . 1 1 44 44 SER C C 44 176.965 176.965 176.659 0.306 18093 4518 1 7 . 1 1 44 44 SER CA C 44 63.575 63.575 62.085 1.490 18093 4519 1 7 . 1 1 44 44 SER H H 44 7.984 7.984 7.645 0.339 18093 4520 1 7 . 1 1 45 45 VAL N N 45 123.544 123.544 121.547 1.997 18093 4521 1 7 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.750 -0.202 18093 4522 1 7 . 1 1 45 45 VAL C C 45 177.139 177.139 178.294 -1.155 18093 4523 1 7 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.585 0.648 18093 4524 1 7 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.332 0.310 18093 4525 1 7 . 1 1 45 45 VAL H H 45 8.280 8.280 7.791 0.489 18093 4526 1 7 . 1 1 46 46 LEU N N 46 119.883 119.883 121.137 -1.254 18093 4527 1 7 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.047 -0.104 18093 4528 1 7 . 1 1 46 46 LEU C C 46 180.125 180.125 178.387 1.738 18093 4529 1 7 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.896 0.704 18093 4530 1 7 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.479 0.533 18093 4531 1 7 . 1 1 46 46 LEU H H 46 8.117 8.117 7.492 0.625 18093 4532 1 7 . 1 1 47 47 LEU N N 47 120.193 120.193 119.737 0.456 18093 4533 1 7 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.912 0.092 18093 4534 1 7 . 1 1 47 47 LEU C C 47 178.370 178.370 179.146 -0.776 18093 4535 1 7 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.400 0.026 18093 4536 1 7 . 1 1 47 47 LEU CB C 47 42.055 42.055 40.773 1.282 18093 4537 1 7 . 1 1 47 47 LEU H H 47 8.933 8.933 8.208 0.725 18093 4538 1 7 . 1 1 48 48 SER N N 48 115.861 115.861 114.271 1.590 18093 4539 1 7 . 1 1 48 48 SER HA H 48 4.013 4.013 4.168 -0.155 18093 4540 1 7 . 1 1 48 48 SER C C 48 175.642 175.642 177.173 -1.531 18093 4541 1 7 . 1 1 48 48 SER CA C 48 63.571 63.571 61.587 1.984 18093 4542 1 7 . 1 1 48 48 SER CB C 48 62.879 62.879 63.049 -0.170 18093 4543 1 7 . 1 1 48 48 SER H H 48 7.996 7.996 7.639 0.357 18093 4544 1 7 . 1 1 49 49 LEU N N 49 120.673 120.673 124.129 -3.456 18093 4545 1 7 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.126 -0.091 18093 4546 1 7 . 1 1 49 49 LEU C C 49 178.229 178.229 178.839 -0.610 18093 4547 1 7 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.519 -0.236 18093 4548 1 7 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.179 -0.233 18093 4549 1 7 . 1 1 49 49 LEU H H 49 8.352 8.352 8.653 -0.301 18093 4550 1 7 . 1 1 50 50 THR N N 50 115.582 115.582 114.777 0.805 18093 4551 1 7 . 1 1 50 50 THR HA H 50 3.672 3.672 3.999 -0.327 18093 4552 1 7 . 1 1 50 50 THR C C 50 175.877 175.877 176.777 -0.900 18093 4553 1 7 . 1 1 50 50 THR CA C 50 68.628 68.628 66.744 1.884 18093 4554 1 7 . 1 1 50 50 THR H H 50 7.937 7.937 8.493 -0.556 18093 4555 1 7 . 1 1 51 51 VAL N N 51 119.774 119.774 122.328 -2.554 18093 4556 1 7 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.731 -0.233 18093 4557 1 7 . 1 1 51 51 VAL C C 51 177.162 177.162 177.239 -0.077 18093 4558 1 7 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.551 1.034 18093 4559 1 7 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.963 -0.442 18093 4560 1 7 . 1 1 51 51 VAL H H 51 8.115 8.115 7.427 0.688 18093 4561 1 7 . 1 1 52 52 PHE N N 52 118.808 118.808 120.681 -1.873 18093 4562 1 7 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.279 -0.157 18093 4563 1 7 . 1 1 52 52 PHE C C 52 176.697 176.697 176.735 -0.038 18093 4564 1 7 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.390 1.381 18093 4565 1 7 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.268 -0.006 18093 4566 1 7 . 1 1 52 52 PHE H H 52 8.256 8.256 8.524 -0.268 18093 4567 1 7 . 1 1 53 53 LEU N N 53 117.267 117.267 121.904 -4.637 18093 4568 1 7 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.482 0.411 18093 4569 1 7 . 1 1 53 53 LEU C C 53 179.319 179.319 177.612 1.707 18093 4570 1 7 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.798 0.187 18093 4571 1 7 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.485 0.342 18093 4572 1 7 . 1 1 53 53 LEU H H 53 8.443 8.443 8.287 0.156 18093 4573 1 7 . 1 1 54 54 LEU N N 54 119.762 119.762 119.278 0.484 18093 4574 1 7 . 1 1 54 54 LEU HA H 54 4.054 4.054 4.032 0.022 18093 4575 1 7 . 1 1 54 54 LEU C C 54 178.827 178.827 178.827 0.000 18093 4576 1 7 . 1 1 54 54 LEU CA C 54 58.105 58.105 57.961 0.144 18093 4577 1 7 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.932 0.014 18093 4578 1 7 . 1 1 54 54 LEU H H 54 8.205 8.205 7.370 0.835 18093 4579 1 7 . 1 1 55 55 LEU N N 55 118.585 118.585 119.261 -0.676 18093 4580 1 7 . 1 1 55 55 LEU HA H 55 4.077 4.077 4.154 -0.077 18093 4581 1 7 . 1 1 55 55 LEU C C 55 178.909 178.909 178.774 0.135 18093 4582 1 7 . 1 1 55 55 LEU CA C 55 58.108 58.108 58.008 0.100 18093 4583 1 7 . 1 1 55 55 LEU CB C 55 41.979 41.979 42.005 -0.026 18093 4584 1 7 . 1 1 55 55 LEU H H 55 8.179 8.179 7.411 0.768 18093 4585 1 7 . 1 1 56 56 ILE N N 56 116.079 116.079 115.256 0.823 18093 4586 1 7 . 1 1 56 56 ILE HA H 56 3.729 3.729 4.071 -0.342 18093 4587 1 7 . 1 1 56 56 ILE C C 56 176.988 176.988 177.679 -0.691 18093 4588 1 7 . 1 1 56 56 ILE CA C 56 64.257 64.257 62.961 1.296 18093 4589 1 7 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.520 0.897 18093 4590 1 7 . 1 1 56 56 ILE H H 56 8.040 8.040 7.222 0.818 18093 4591 1 7 . 1 1 57 57 THR N N 57 110.105 110.105 112.374 -2.269 18093 4592 1 7 . 1 1 57 57 THR HA H 57 4.015 4.015 4.286 -0.271 18093 4593 1 7 . 1 1 57 57 THR C C 57 175.435 175.435 175.968 -0.533 18093 4594 1 7 . 1 1 57 57 THR CA C 57 65.067 65.067 64.744 0.323 18093 4595 1 7 . 1 1 57 57 THR CB C 57 69.179 69.179 68.593 0.586 18093 4596 1 7 . 1 1 57 57 THR H H 57 7.655 7.655 7.914 -0.259 18093 4597 1 7 . 1 1 58 58 GLU N N 58 117.313 117.313 121.340 -4.027 18093 4598 1 7 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.304 0.029 18093 4599 1 7 . 1 1 58 58 GLU C C 58 176.940 176.940 178.234 -1.294 18093 4600 1 7 . 1 1 58 58 GLU CA C 58 57.068 57.068 57.471 -0.404 18093 4601 1 7 . 1 1 58 58 GLU CB C 58 29.396 29.396 29.681 -0.285 18093 4602 1 7 . 1 1 58 58 GLU H H 58 7.521 7.521 8.218 -0.697 18093 4603 1 7 . 1 1 59 59 ILE N N 59 114.870 114.870 114.329 0.541 18093 4604 1 7 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.115 -0.026 18093 4605 1 7 . 1 1 59 59 ILE C C 59 175.456 175.456 176.099 -0.643 18093 4606 1 7 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.095 0.339 18093 4607 1 7 . 1 1 59 59 ILE CB C 59 38.657 38.657 39.125 -0.468 18093 4608 1 7 . 1 1 59 59 ILE H H 59 7.579 7.579 7.391 0.188 18093 4609 1 7 . 1 1 60 60 ILE N N 60 119.354 119.354 118.438 0.916 18093 4610 1 7 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.881 0.423 18093 4611 1 7 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.535 -1.918 18093 4612 1 7 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.770 2.092 18093 4613 1 7 . 1 1 60 60 ILE H H 60 7.629 7.629 7.577 0.052 18093 4614 1 7 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.424 -0.024 18093 4615 1 7 . 1 1 61 61 PRO C C 61 177.144 177.144 176.057 1.087 18093 4616 1 7 . 1 1 61 61 PRO CA C 61 63.808 63.808 63.795 0.013 18093 4617 1 7 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.691 -0.809 18093 4618 1 7 . 1 1 62 62 SER N N 62 114.474 114.474 112.508 1.966 18093 4619 1 7 . 1 1 62 62 SER HA H 62 4.434 4.434 4.714 -0.280 18093 4620 1 7 . 1 1 62 62 SER C C 62 175.161 175.161 173.670 1.491 18093 4621 1 7 . 1 1 62 62 SER CA C 62 59.047 59.047 58.143 0.904 18093 4622 1 7 . 1 1 62 62 SER CB C 62 63.704 63.704 65.199 -1.495 18093 4623 1 7 . 1 1 62 62 SER H H 62 8.186 8.186 7.887 0.299 18093 4624 1 7 . 1 1 63 63 THR N N 63 113.573 113.573 117.490 -3.917 18093 4625 1 7 . 1 1 63 63 THR HA H 63 4.319 4.319 4.528 -0.209 18093 4626 1 7 . 1 1 63 63 THR C C 63 174.834 174.834 173.749 1.085 18093 4627 1 7 . 1 1 63 63 THR CA C 63 62.377 62.377 61.975 0.402 18093 4628 1 7 . 1 1 63 63 THR CB C 63 69.422 69.422 68.321 1.101 18093 4629 1 7 . 1 1 63 63 THR H H 63 7.963 7.963 8.489 -0.526 18093 4630 1 7 . 1 1 64 64 SER N N 64 116.598 116.598 116.811 -0.213 18093 4631 1 7 . 1 1 64 64 SER HA H 64 4.428 4.428 4.903 -0.475 18093 4632 1 7 . 1 1 64 64 SER C C 64 174.618 174.618 174.473 0.145 18093 4633 1 7 . 1 1 64 64 SER CA C 64 59.045 59.045 57.129 1.917 18093 4634 1 7 . 1 1 64 64 SER CB C 64 63.700 63.700 65.232 -1.532 18093 4635 1 7 . 1 1 64 64 SER H H 64 8.052 8.052 7.667 0.385 18093 4636 1 7 . 1 1 65 65 SER N N 65 116.673 116.673 116.812 -0.139 18093 4637 1 7 . 1 1 65 65 SER HA H 65 4.432 4.432 4.390 0.042 18093 4638 1 7 . 1 1 65 65 SER C C 65 174.335 174.335 175.066 -0.731 18093 4639 1 7 . 1 1 65 65 SER CA C 65 58.927 58.927 59.394 -0.467 18093 4640 1 7 . 1 1 65 65 SER CB C 65 63.621 63.621 63.475 0.146 18093 4641 1 7 . 1 1 65 65 SER H H 65 8.114 8.114 8.563 -0.449 18093 4642 1 7 . 1 1 66 66 VAL N N 66 119.054 119.054 118.691 0.363 18093 4643 1 7 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.397 -0.227 18093 4644 1 7 . 1 1 66 66 VAL C C 66 175.278 175.278 174.990 0.288 18093 4645 1 7 . 1 1 66 66 VAL CA C 66 62.062 62.062 61.608 0.454 18093 4646 1 7 . 1 1 66 66 VAL CB C 66 32.629 32.629 31.870 0.759 18093 4647 1 7 . 1 1 66 66 VAL H H 66 7.740 7.740 7.526 0.214 18093 4648 1 7 . 1 1 67 67 SER N N 67 118.882 118.882 115.809 3.073 18093 4649 1 7 . 1 1 67 67 SER HA H 67 4.704 4.704 4.306 0.398 18093 4650 1 7 . 1 1 67 67 SER CA C 67 56.715 56.715 57.815 -1.100 18093 4651 1 7 . 1 1 67 67 SER CB C 67 63.624 63.624 63.048 0.576 18093 4652 1 7 . 1 1 67 67 SER H H 67 8.060 8.060 8.242 -0.182 18093 4653 1 7 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.503 -0.103 18093 4654 1 7 . 1 1 68 68 PRO C C 68 176.925 176.925 176.017 0.908 18093 4655 1 7 . 1 1 68 68 PRO CA C 68 63.748 63.748 63.133 0.615 18093 4656 1 7 . 1 1 68 68 PRO CB C 68 32.005 32.005 32.181 -0.176 18093 4657 1 7 . 1 1 69 69 SER N N 69 114.930 114.930 117.242 -2.312 18093 4658 1 7 . 1 1 69 69 SER HA H 69 4.422 4.422 4.725 -0.303 18093 4659 1 7 . 1 1 69 69 SER C C 69 175.617 175.617 174.870 0.747 18093 4660 1 7 . 1 1 69 69 SER CA C 69 58.697 58.697 57.235 1.462 18093 4661 1 7 . 1 1 69 69 SER CB C 69 63.804 63.804 66.159 -2.355 18093 4662 1 7 . 1 1 69 69 SER H H 69 8.205 8.205 8.002 0.203 18093 4663 1 7 . 1 1 70 70 ILE N N 70 120.840 120.840 126.356 -5.516 18093 4664 1 7 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.127 -0.135 18093 4665 1 7 . 1 1 70 70 ILE C C 70 177.524 177.524 176.489 1.035 18093 4666 1 7 . 1 1 70 70 ILE CA C 70 64.335 64.335 61.627 2.708 18093 4667 1 7 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.270 -0.810 18093 4668 1 7 . 1 1 70 70 ILE H H 70 8.283 8.283 9.057 -0.774 18093 4669 1 7 . 1 1 71 71 GLY N N 71 107.823 107.823 107.872 -0.049 18093 4670 1 7 . 1 1 71 71 GLY C C 71 175.296 175.296 175.648 -0.352 18093 4671 1 7 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.194 0.261 18093 4672 1 7 . 1 1 71 71 GLY H H 71 8.557 8.557 8.855 -0.298 18093 4673 1 7 . 1 1 72 72 GLU N N 72 120.835 120.835 120.525 0.310 18093 4674 1 7 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.192 -0.345 18093 4675 1 7 . 1 1 72 72 GLU C C 72 178.198 178.198 178.107 0.091 18093 4676 1 7 . 1 1 72 72 GLU CA C 72 60.117 60.117 57.853 2.264 18093 4677 1 7 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.770 -0.377 18093 4678 1 7 . 1 1 72 72 GLU H H 72 7.922 7.922 7.749 0.173 18093 4679 1 7 . 1 1 73 73 TYR N N 73 117.375 117.375 122.452 -5.077 18093 4680 1 7 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.291 -0.129 18093 4681 1 7 . 1 1 73 73 TYR C C 73 179.912 179.912 177.075 2.837 18093 4682 1 7 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.520 0.635 18093 4683 1 7 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.827 -0.061 18093 4684 1 7 . 1 1 73 73 TYR H H 73 8.062 8.062 7.908 0.154 18093 4685 1 7 . 1 1 74 74 LEU N N 74 121.493 121.493 118.670 2.823 18093 4686 1 7 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.779 0.270 18093 4687 1 7 . 1 1 74 74 LEU C C 74 178.063 178.063 178.790 -0.727 18093 4688 1 7 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.593 0.902 18093 4689 1 7 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.782 0.065 18093 4690 1 7 . 1 1 74 74 LEU H H 74 8.552 8.552 8.837 -0.285 18093 4691 1 7 . 1 1 75 75 LEU N N 75 120.375 120.375 119.704 0.671 18093 4692 1 7 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.113 -0.073 18093 4693 1 7 . 1 1 75 75 LEU C C 75 178.515 178.515 178.985 -0.470 18093 4694 1 7 . 1 1 75 75 LEU CA C 75 58.638 58.638 57.979 0.659 18093 4695 1 7 . 1 1 75 75 LEU CB C 75 42.039 42.039 41.141 0.898 18093 4696 1 7 . 1 1 75 75 LEU H H 75 8.276 8.276 7.446 0.830 18093 4697 1 7 . 1 1 76 76 PHE N N 76 116.626 116.626 119.588 -2.962 18093 4698 1 7 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.133 -0.054 18093 4699 1 7 . 1 1 76 76 PHE C C 76 177.399 177.399 178.181 -0.782 18093 4700 1 7 . 1 1 76 76 PHE CA C 76 61.734 61.734 61.895 -0.161 18093 4701 1 7 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.323 0.418 18093 4702 1 7 . 1 1 76 76 PHE H H 76 8.454 8.454 8.298 0.156 18093 4703 1 7 . 1 1 77 77 THR N N 77 116.080 116.080 115.078 1.002 18093 4704 1 7 . 1 1 77 77 THR HA H 77 3.687 3.687 3.879 -0.192 18093 4705 1 7 . 1 1 77 77 THR C C 77 176.018 176.018 176.575 -0.557 18093 4706 1 7 . 1 1 77 77 THR CA C 77 68.640 68.640 66.987 1.653 18093 4707 1 7 . 1 1 77 77 THR H H 77 8.224 8.224 8.642 -0.418 18093 4708 1 7 . 1 1 78 78 MET N N 78 119.394 119.394 120.138 -0.744 18093 4709 1 7 . 1 1 78 78 MET HA H 78 4.129 4.129 4.088 0.041 18093 4710 1 7 . 1 1 78 78 MET C C 78 179.608 179.608 178.042 1.566 18093 4711 1 7 . 1 1 78 78 MET CA C 78 58.831 58.831 58.203 0.628 18093 4712 1 7 . 1 1 78 78 MET CB C 78 31.590 31.590 32.001 -0.411 18093 4713 1 7 . 1 1 78 78 MET H H 78 8.372 8.372 7.466 0.906 18093 4714 1 7 . 1 1 79 79 ILE N N 79 121.819 121.819 118.139 3.680 18093 4715 1 7 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.695 -0.145 18093 4716 1 7 . 1 1 79 79 ILE C C 79 176.426 176.426 178.067 -1.641 18093 4717 1 7 . 1 1 79 79 ILE CA C 79 65.876 65.876 65.004 0.871 18093 4718 1 7 . 1 1 79 79 ILE CB C 79 37.673 37.673 37.714 -0.041 18093 4719 1 7 . 1 1 79 79 ILE H H 79 8.391 8.391 7.911 0.480 18093 4720 1 7 . 1 1 80 80 PHE N N 80 119.916 119.916 121.326 -1.410 18093 4721 1 7 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.102 -0.049 18093 4722 1 7 . 1 1 80 80 PHE C C 80 178.568 178.568 177.140 1.428 18093 4723 1 7 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.685 -0.378 18093 4724 1 7 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.463 -0.689 18093 4725 1 7 . 1 1 80 80 PHE H H 80 8.479 8.479 8.108 0.371 18093 4726 1 7 . 1 1 81 81 VAL N N 81 120.191 120.191 116.206 3.985 18093 4727 1 7 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.813 -0.360 18093 4728 1 7 . 1 1 81 81 VAL C C 81 178.225 178.225 178.416 -0.191 18093 4729 1 7 . 1 1 81 81 VAL CA C 81 67.408 67.408 65.374 2.034 18093 4730 1 7 . 1 1 81 81 VAL CB C 81 31.556 31.556 30.870 0.686 18093 4731 1 7 . 1 1 81 81 VAL H H 81 8.928 8.928 8.666 0.262 18093 4732 1 7 . 1 1 82 82 THR N N 82 115.930 115.930 118.006 -2.076 18093 4733 1 7 . 1 1 82 82 THR HA H 82 3.636 3.636 4.039 -0.403 18093 4734 1 7 . 1 1 82 82 THR C C 82 176.420 176.420 176.136 0.284 18093 4735 1 7 . 1 1 82 82 THR CA C 82 68.570 68.570 67.626 0.944 18093 4736 1 7 . 1 1 82 82 THR CB C 82 68.202 68.202 69.006 -0.804 18093 4737 1 7 . 1 1 82 82 THR H H 82 7.969 7.969 7.519 0.450 18093 4738 1 7 . 1 1 83 83 LEU N N 83 119.780 119.780 119.021 0.759 18093 4739 1 7 . 1 1 83 83 LEU HA H 83 3.847 3.847 4.252 -0.405 18093 4740 1 7 . 1 1 83 83 LEU C C 83 178.214 178.214 178.619 -0.405 18093 4741 1 7 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.910 0.327 18093 4742 1 7 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.265 0.526 18093 4743 1 7 . 1 1 83 83 LEU H H 83 8.483 8.483 7.479 1.004 18093 4744 1 7 . 1 1 84 84 SER N N 84 114.559 114.559 115.182 -0.623 18093 4745 1 7 . 1 1 84 84 SER HA H 84 4.099 4.099 4.257 -0.158 18093 4746 1 7 . 1 1 84 84 SER C C 84 176.799 176.799 176.589 0.210 18093 4747 1 7 . 1 1 84 84 SER CA C 84 63.609 63.609 61.683 1.926 18093 4748 1 7 . 1 1 84 84 SER CB C 84 63.110 63.110 63.223 -0.113 18093 4749 1 7 . 1 1 84 84 SER H H 84 8.023 8.023 8.267 -0.244 18093 4750 1 7 . 1 1 85 85 ILE N N 85 123.962 123.962 123.067 0.895 18093 4751 1 7 . 1 1 85 85 ILE HA H 85 3.604 3.604 4.239 -0.635 18093 4752 1 7 . 1 1 85 85 ILE C C 85 177.487 177.487 177.491 -0.004 18093 4753 1 7 . 1 1 85 85 ILE CA C 85 65.759 65.759 64.890 0.869 18093 4754 1 7 . 1 1 85 85 ILE CB C 85 37.887 37.887 38.616 -0.729 18093 4755 1 7 . 1 1 85 85 ILE H H 85 8.054 8.054 7.441 0.613 18093 4756 1 7 . 1 1 86 86 VAL N N 86 118.744 118.744 118.715 0.029 18093 4757 1 7 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.662 -0.143 18093 4758 1 7 . 1 1 86 86 VAL C C 86 177.557 177.557 178.325 -0.768 18093 4759 1 7 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.439 1.096 18093 4760 1 7 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.529 -0.063 18093 4761 1 7 . 1 1 86 86 VAL H H 86 8.158 8.158 7.550 0.608 18093 4762 1 7 . 1 1 87 87 ILE N N 87 117.206 117.206 119.094 -1.888 18093 4763 1 7 . 1 1 87 87 ILE HA H 87 3.604 3.604 4.170 -0.566 18093 4764 1 7 . 1 1 87 87 ILE C C 87 177.283 177.283 178.407 -1.124 18093 4765 1 7 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.571 2.105 18093 4766 1 7 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.597 0.992 18093 4767 1 7 . 1 1 87 87 ILE H H 87 8.459 8.459 8.084 0.375 18093 4768 1 7 . 1 1 88 88 THR N N 88 116.158 116.158 117.644 -1.486 18093 4769 1 7 . 1 1 88 88 THR HA H 88 3.672 3.672 4.236 -0.564 18093 4770 1 7 . 1 1 88 88 THR C C 88 175.485 175.485 176.968 -1.483 18093 4771 1 7 . 1 1 88 88 THR CA C 88 68.549 68.549 67.454 1.095 18093 4772 1 7 . 1 1 88 88 THR CB C 88 68.127 68.127 68.789 -0.662 18093 4773 1 7 . 1 1 88 88 THR H H 88 7.776 7.776 7.328 0.448 18093 4774 1 7 . 1 1 89 89 VAL N N 89 117.985 117.985 121.173 -3.188 18093 4775 1 7 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.699 -0.156 18093 4776 1 7 . 1 1 89 89 VAL C C 89 177.393 177.393 177.280 0.113 18093 4777 1 7 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.337 1.253 18093 4778 1 7 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.702 0.076 18093 4779 1 7 . 1 1 89 89 VAL H H 89 8.206 8.206 8.221 -0.015 18093 4780 1 7 . 1 1 90 90 PHE N N 90 116.709 116.709 119.673 -2.964 18093 4781 1 7 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.188 0.190 18093 4782 1 7 . 1 1 90 90 PHE C C 90 177.305 177.305 177.368 -0.063 18093 4783 1 7 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.805 -0.686 18093 4784 1 7 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.981 0.404 18093 4785 1 7 . 1 1 90 90 PHE H H 90 7.956 7.956 7.521 0.435 18093 4786 1 7 . 1 1 91 91 VAL N N 91 116.565 116.565 119.680 -3.115 18093 4787 1 7 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.770 0.065 18093 4788 1 7 . 1 1 91 91 VAL C C 91 176.927 176.927 177.425 -0.498 18093 4789 1 7 . 1 1 91 91 VAL CA C 91 65.347 65.347 65.615 -0.268 18093 4790 1 7 . 1 1 91 91 VAL CB C 91 31.867 31.867 32.056 -0.189 18093 4791 1 7 . 1 1 91 91 VAL H H 91 8.239 8.239 7.824 0.415 18093 4792 1 7 . 1 1 92 92 LEU N N 92 117.443 117.443 118.624 -1.181 18093 4793 1 7 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.260 -0.066 18093 4794 1 7 . 1 1 92 92 LEU C C 92 177.180 177.180 177.899 -0.719 18093 4795 1 7 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.494 -0.310 18093 4796 1 7 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.399 -0.455 18093 4797 1 7 . 1 1 92 92 LEU H H 92 7.967 7.967 7.725 0.242 18093 4798 1 7 . 1 1 93 93 ASN N N 93 116.705 116.705 117.671 -0.966 18093 4799 1 7 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.530 0.117 18093 4800 1 7 . 1 1 93 93 ASN C C 93 175.129 175.129 175.580 -0.451 18093 4801 1 7 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.240 -1.386 18093 4802 1 7 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.339 0.056 18093 4803 1 7 . 1 1 93 93 ASN H H 93 7.683 7.683 7.789 -0.106 18093 4804 1 7 . 1 1 94 94 VAL N N 94 118.224 118.224 114.842 3.382 18093 4805 1 7 . 1 1 94 94 VAL HA H 94 3.961 3.961 4.292 -0.331 18093 4806 1 7 . 1 1 94 94 VAL C C 94 175.600 175.600 174.195 1.405 18093 4807 1 7 . 1 1 94 94 VAL CA C 94 62.825 62.825 60.745 2.079 18093 4808 1 7 . 1 1 94 94 VAL CB C 94 32.214 32.214 33.474 -1.260 18093 4809 1 7 . 1 1 94 94 VAL H H 94 7.627 7.627 7.471 0.156 18093 4810 1 7 . 1 1 95 95 HIS N N 95 120.999 120.999 115.111 5.888 18093 4811 1 7 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.222 0.371 18093 4812 1 7 . 1 1 95 95 HIS C C 95 174.146 174.146 174.103 0.043 18093 4813 1 7 . 1 1 95 95 HIS CA C 95 55.666 55.666 56.651 -0.985 18093 4814 1 7 . 1 1 95 95 HIS CB C 95 29.736 29.736 28.839 0.897 18093 4815 1 7 . 1 1 95 95 HIS H H 95 8.263 8.263 8.195 0.068 18093 4816 1 7 . 1 1 96 96 HIS N N 96 122.740 122.740 114.935 7.805 18093 4817 1 7 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.202 0.431 18093 4818 1 7 . 1 1 96 96 HIS CA C 96 55.895 55.895 56.154 -0.259 18093 4819 1 7 . 1 1 96 96 HIS CB C 96 29.750 29.750 29.276 0.474 18093 4820 1 7 . 1 1 96 96 HIS H H 96 8.298 8.298 8.432 -0.134 18093 4821 1 7 . 1 1 97 97 ARG N N 97 118.503 118.503 122.966 -4.463 18093 4822 1 7 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.543 -0.231 18093 4823 1 7 . 1 1 97 97 ARG C C 97 175.776 175.776 175.778 -0.002 18093 4824 1 7 . 1 1 97 97 ARG CA C 97 56.225 56.225 56.167 0.058 18093 4825 1 7 . 1 1 97 97 ARG CB C 97 30.912 30.912 31.360 -0.448 18093 4826 1 7 . 1 1 97 97 ARG H H 97 8.250 8.250 8.529 -0.279 18093 4827 1 7 . 1 1 98 98 SER N N 98 118.482 118.482 118.846 -0.364 18093 4828 1 7 . 1 1 98 98 SER HA H 98 4.722 4.722 4.743 -0.021 18093 4829 1 7 . 1 1 98 98 SER CA C 98 56.547 56.547 56.863 -0.316 18093 4830 1 7 . 1 1 98 98 SER CB C 98 63.624 63.624 64.505 -0.881 18093 4831 1 7 . 1 1 98 98 SER H H 98 8.254 8.254 8.267 -0.013 18093 4832 1 7 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.465 -0.062 18093 4833 1 7 . 1 1 99 99 PRO C C 99 176.899 176.899 176.916 -0.017 18093 4834 1 7 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.411 -0.710 18093 4835 1 7 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.623 -0.674 18093 4836 1 7 . 1 1 100 100 GLU N N 100 120.187 120.187 115.178 5.009 18093 4837 1 7 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.386 -0.098 18093 4838 1 7 . 1 1 100 100 GLU C C 100 176.593 176.593 175.401 1.192 18093 4839 1 7 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.722 -0.000 18093 4840 1 7 . 1 1 100 100 GLU CB C 100 29.999 29.999 30.003 -0.004 18093 4841 1 7 . 1 1 100 100 GLU H H 100 8.401 8.401 8.202 0.199 18093 4842 1 7 . 1 1 101 101 THR N N 101 113.968 113.968 116.222 -2.254 18093 4843 1 7 . 1 1 101 101 THR HA H 101 4.286 4.286 4.360 -0.074 18093 4844 1 7 . 1 1 101 101 THR C C 101 174.525 174.525 174.129 0.396 18093 4845 1 7 . 1 1 101 101 THR CA C 101 61.956 61.956 62.910 -0.954 18093 4846 1 7 . 1 1 101 101 THR CB C 101 69.697 69.697 69.002 0.695 18093 4847 1 7 . 1 1 101 101 THR H H 101 7.945 7.945 7.810 0.135 18093 4848 1 7 . 1 1 102 102 HIS N N 102 120.322 120.322 125.164 -4.842 18093 4849 1 7 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.754 -0.013 18093 4850 1 7 . 1 1 102 102 HIS C C 102 174.783 174.783 174.309 0.474 18093 4851 1 7 . 1 1 102 102 HIS CA C 102 55.701 55.701 55.515 0.186 18093 4852 1 7 . 1 1 102 102 HIS CB C 102 29.093 29.093 29.486 -0.393 18093 4853 1 7 . 1 1 102 102 HIS H H 102 8.455 8.455 8.585 -0.130 18093 4854 1 7 . 1 1 103 103 THR N N 103 114.282 114.282 116.416 -2.134 18093 4855 1 7 . 1 1 103 103 THR HA H 103 4.352 4.352 4.576 -0.224 18093 4856 1 7 . 1 1 103 103 THR C C 103 175.104 175.104 175.885 -0.781 18093 4857 1 7 . 1 1 103 103 THR CA C 103 62.057 62.057 61.335 0.722 18093 4858 1 7 . 1 1 103 103 THR CB C 103 69.966 69.966 70.917 -0.951 18093 4859 1 7 . 1 1 103 103 THR H H 103 8.069 8.069 8.291 -0.222 18093 4860 1 7 . 1 1 104 104 GLY N N 104 111.159 111.159 112.213 -1.054 18093 4861 1 7 . 1 1 104 104 GLY C C 104 174.776 174.776 175.164 -0.388 18093 4862 1 7 . 1 1 104 104 GLY CA C 104 45.588 45.588 45.185 0.403 18093 4863 1 7 . 1 1 104 104 GLY H H 104 8.393 8.393 8.797 -0.404 18093 4864 1 7 . 1 1 105 105 GLY N N 105 108.657 108.657 112.559 -3.902 18093 4865 1 7 . 1 1 105 105 GLY C C 105 174.957 174.957 174.768 0.189 18093 4866 1 7 . 1 1 105 105 GLY CA C 105 45.612 45.612 45.344 0.268 18093 4867 1 7 . 1 1 105 105 GLY H H 105 8.275 8.275 8.108 0.167 18093 4868 1 7 . 1 1 106 106 GLY N N 106 108.870 108.870 110.843 -1.973 18093 4869 1 7 . 1 1 106 106 GLY C C 106 174.877 174.877 173.000 1.877 18093 4870 1 7 . 1 1 106 106 GLY CA C 106 45.665 45.665 44.997 0.668 18093 4871 1 7 . 1 1 106 106 GLY H H 106 8.357 8.357 7.796 0.561 18093 4872 1 7 . 1 1 107 107 GLY N N 107 108.476 108.476 108.887 -0.411 18093 4873 1 7 . 1 1 107 107 GLY C C 107 174.877 174.877 174.961 -0.084 18093 4874 1 7 . 1 1 107 107 GLY CA C 107 45.696 45.696 44.746 0.950 18093 4875 1 7 . 1 1 107 107 GLY H H 107 8.330 8.330 8.225 0.105 18093 4876 1 7 . 1 1 108 108 GLY N N 108 108.486 108.486 109.188 -0.702 18093 4877 1 7 . 1 1 108 108 GLY C C 108 175.345 175.345 175.290 0.055 18093 4878 1 7 . 1 1 108 108 GLY CA C 108 45.763 45.763 45.502 0.261 18093 4879 1 7 . 1 1 108 108 GLY H H 108 8.328 8.328 8.391 -0.063 18093 4880 1 7 . 1 1 109 109 ILE N N 109 120.433 120.433 119.409 1.024 18093 4881 1 7 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.904 0.064 18093 4882 1 7 . 1 1 109 109 ILE C C 109 176.127 176.127 177.034 -0.907 18093 4883 1 7 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.273 -0.538 18093 4884 1 7 . 1 1 109 109 ILE CB C 109 38.125 38.125 38.149 -0.024 18093 4885 1 7 . 1 1 109 109 ILE H H 109 8.192 8.192 8.114 0.079 18093 4886 1 7 . 1 1 110 110 ASP N N 110 121.148 121.148 120.895 0.253 18093 4887 1 7 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.709 -0.403 18093 4888 1 7 . 1 1 110 110 ASP C C 110 177.651 177.651 178.192 -0.541 18093 4889 1 7 . 1 1 110 110 ASP CA C 110 56.776 56.776 57.810 -1.034 18093 4890 1 7 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.003 1.094 18093 4891 1 7 . 1 1 110 110 ASP H H 110 8.427 8.427 8.579 -0.152 18093 4892 1 7 . 1 1 111 111 ARG N N 111 119.228 119.228 119.763 -0.535 18093 4893 1 7 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.163 -0.167 18093 4894 1 7 . 1 1 111 111 ARG C C 111 177.786 177.786 178.919 -1.133 18093 4895 1 7 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.003 -0.061 18093 4896 1 7 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.850 0.346 18093 4897 1 7 . 1 1 111 111 ARG H H 111 7.850 7.850 8.568 -0.718 18093 4898 1 7 . 1 1 112 112 ILE N N 112 118.000 118.000 119.555 -1.555 18093 4899 1 7 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.115 -0.302 18093 4900 1 7 . 1 1 112 112 ILE C C 112 177.496 177.496 177.990 -0.494 18093 4901 1 7 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.193 2.619 18093 4902 1 7 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.967 0.760 18093 4903 1 7 . 1 1 112 112 ILE H H 112 7.764 7.764 7.724 0.040 18093 4904 1 7 . 1 1 113 113 PHE N N 113 118.367 118.367 122.164 -3.797 18093 4905 1 7 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.302 -0.047 18093 4906 1 7 . 1 1 113 113 PHE C C 113 177.218 177.218 177.472 -0.254 18093 4907 1 7 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.416 -0.983 18093 4908 1 7 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.236 -0.429 18093 4909 1 7 . 1 1 113 113 PHE H H 113 7.963 7.963 8.052 -0.089 18093 4910 1 7 . 1 1 114 114 LEU N N 114 118.921 118.921 117.201 1.720 18093 4911 1 7 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.945 0.052 18093 4912 1 7 . 1 1 114 114 LEU C C 114 178.297 178.297 178.436 -0.139 18093 4913 1 7 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.175 0.436 18093 4914 1 7 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.226 0.726 18093 4915 1 7 . 1 1 114 114 LEU H H 114 7.939 7.939 8.246 -0.307 18093 4916 1 7 . 1 1 115 115 TRP N N 115 117.464 117.464 119.455 -1.991 18093 4917 1 7 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.366 0.008 18093 4918 1 7 . 1 1 115 115 TRP C C 115 178.572 178.572 178.250 0.322 18093 4919 1 7 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.774 1.148 18093 4920 1 7 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.762 -1.254 18093 4921 1 7 . 1 1 115 115 TRP H H 115 7.969 7.969 7.607 0.362 18093 4922 1 7 . 1 1 116 116 MET N N 116 117.069 117.069 118.925 -1.856 18093 4923 1 7 . 1 1 116 116 MET HA H 116 4.065 4.065 4.224 -0.159 18093 4924 1 7 . 1 1 116 116 MET C C 116 177.425 177.425 178.190 -0.765 18093 4925 1 7 . 1 1 116 116 MET CA C 116 59.289 59.289 59.099 0.190 18093 4926 1 7 . 1 1 116 116 MET CB C 116 31.692 31.692 32.544 -0.852 18093 4927 1 7 . 1 1 116 116 MET H H 116 8.465 8.465 7.731 0.734 18093 4928 1 7 . 1 1 117 117 PHE N N 117 118.755 118.755 118.242 0.513 18093 4929 1 7 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.086 0.013 18093 4930 1 7 . 1 1 117 117 PHE C C 117 177.965 177.965 178.165 -0.200 18093 4931 1 7 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.261 -0.553 18093 4932 1 7 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.329 0.856 18093 4933 1 7 . 1 1 117 117 PHE H H 117 8.418 8.418 7.878 0.540 18093 4934 1 7 . 1 1 118 118 ILE N N 118 119.133 119.133 115.359 3.774 18093 4935 1 7 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.886 -0.542 18093 4936 1 7 . 1 1 118 118 ILE C C 118 177.244 177.244 177.607 -0.363 18093 4937 1 7 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.309 1.516 18093 4938 1 7 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.749 -0.201 18093 4939 1 7 . 1 1 118 118 ILE H H 118 8.266 8.266 7.718 0.548 18093 4940 1 7 . 1 1 119 119 ILE N N 119 118.846 118.846 121.453 -2.607 18093 4941 1 7 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.951 -0.379 18093 4942 1 7 . 1 1 119 119 ILE C C 119 177.523 177.523 177.626 -0.103 18093 4943 1 7 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.105 0.784 18093 4944 1 7 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.288 -0.724 18093 4945 1 7 . 1 1 119 119 ILE H H 119 8.308 8.308 7.304 1.004 18093 4946 1 7 . 1 1 120 120 VAL N N 120 119.228 119.228 117.773 1.455 18093 4947 1 7 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.807 -0.299 18093 4948 1 7 . 1 1 120 120 VAL C C 120 177.651 177.651 177.354 0.297 18093 4949 1 7 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.552 2.049 18093 4950 1 7 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.375 1.031 18093 4951 1 7 . 1 1 120 120 VAL H H 120 8.399 8.399 7.949 0.450 18093 4952 1 7 . 1 1 121 121 CYS N N 121 117.151 117.151 119.463 -2.312 18093 4953 1 7 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.041 -0.138 18093 4954 1 7 . 1 1 121 121 CYS C C 121 177.719 177.719 176.687 1.032 18093 4955 1 7 . 1 1 121 121 CYS CA C 121 64.298 64.298 63.778 0.520 18093 4956 1 7 . 1 1 121 121 CYS CB C 121 26.677 26.677 27.456 -0.779 18093 4957 1 7 . 1 1 121 121 CYS H H 121 8.008 8.008 7.481 0.527 18093 4958 1 7 . 1 1 122 122 LEU N N 122 121.402 121.402 119.819 1.583 18093 4959 1 7 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.071 -0.088 18093 4960 1 7 . 1 1 122 122 LEU C C 122 178.282 178.282 178.905 -0.623 18093 4961 1 7 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.822 0.723 18093 4962 1 7 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.330 0.636 18093 4963 1 7 . 1 1 122 122 LEU H H 122 8.417 8.417 7.679 0.738 18093 4964 1 7 . 1 1 123 123 LEU N N 123 118.543 118.543 120.013 -1.470 18093 4965 1 7 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.011 -0.091 18093 4966 1 7 . 1 1 123 123 LEU C C 123 179.028 179.028 178.775 0.253 18093 4967 1 7 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.509 -0.392 18093 4968 1 7 . 1 1 123 123 LEU CB C 123 42.056 42.056 40.952 1.104 18093 4969 1 7 . 1 1 123 123 LEU H H 123 8.590 8.590 7.692 0.898 18093 4970 1 7 . 1 1 124 124 GLY N N 124 104.896 104.896 105.050 -0.154 18093 4971 1 7 . 1 1 124 124 GLY C C 124 173.932 173.932 176.060 -2.128 18093 4972 1 7 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.406 -0.179 18093 4973 1 7 . 1 1 124 124 GLY H H 124 8.601 8.601 8.215 0.386 18093 4974 1 7 . 1 1 125 125 THR N N 125 115.403 115.403 119.264 -3.861 18093 4975 1 7 . 1 1 125 125 THR HA H 125 3.686 3.686 3.850 -0.164 18093 4976 1 7 . 1 1 125 125 THR C C 125 176.407 176.407 176.492 -0.085 18093 4977 1 7 . 1 1 125 125 THR CA C 125 67.565 67.565 66.542 1.023 18093 4978 1 7 . 1 1 125 125 THR CB C 125 68.143 68.143 68.642 -0.499 18093 4979 1 7 . 1 1 125 125 THR H H 125 7.734 7.734 7.488 0.246 18093 4980 1 7 . 1 1 126 126 VAL N N 126 119.056 119.056 121.823 -2.767 18093 4981 1 7 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.540 -0.001 18093 4982 1 7 . 1 1 126 126 VAL C C 126 177.628 177.628 177.778 -0.150 18093 4983 1 7 . 1 1 126 126 VAL CA C 126 66.601 66.601 67.062 -0.461 18093 4984 1 7 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.673 -0.179 18093 4985 1 7 . 1 1 126 126 VAL H H 126 8.015 8.015 8.134 -0.119 18093 4986 1 7 . 1 1 127 127 GLY N N 127 104.644 104.644 107.219 -2.575 18093 4987 1 7 . 1 1 127 127 GLY C C 127 173.933 173.933 175.292 -1.359 18093 4988 1 7 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.024 0.257 18093 4989 1 7 . 1 1 127 127 GLY H H 127 8.248 8.248 8.002 0.246 18093 4990 1 7 . 1 1 128 128 LEU N N 128 117.354 117.354 121.110 -3.756 18093 4991 1 7 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.290 -0.278 18093 4992 1 7 . 1 1 128 128 LEU C C 128 177.443 177.443 178.045 -0.602 18093 4993 1 7 . 1 1 128 128 LEU CA C 128 56.626 56.626 57.133 -0.507 18093 4994 1 7 . 1 1 128 128 LEU CB C 128 42.260 42.260 42.275 -0.015 18093 4995 1 7 . 1 1 128 128 LEU H H 128 7.568 7.568 7.363 0.205 18093 4996 1 7 . 1 1 129 129 PHE N N 129 113.971 113.971 117.002 -3.031 18093 4997 1 7 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.317 0.141 18093 4998 1 7 . 1 1 129 129 PHE C C 129 176.216 176.216 176.838 -0.622 18093 4999 1 7 . 1 1 129 129 PHE CA C 129 58.385 58.385 59.630 -1.245 18093 5000 1 7 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.709 0.010 18093 5001 1 7 . 1 1 129 129 PHE H H 129 7.639 7.639 8.140 -0.501 18093 5002 1 7 . 1 1 130 130 LEU N N 130 117.752 117.752 119.963 -2.211 18093 5003 1 7 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.190 0.243 18093 5004 1 7 . 1 1 130 130 LEU CA C 130 54.156 54.156 54.502 -0.346 18093 5005 1 7 . 1 1 130 130 LEU H H 130 8.099 8.099 7.939 0.160 18093 5006 1 7 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.874 -0.424 18093 5007 1 7 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.621 2.278 18093 5008 1 7 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.405 -0.143 18093 5009 1 7 . 1 1 132 132 PRO C C 132 177.616 177.616 178.861 -1.245 18093 5010 1 7 . 1 1 132 132 PRO CA C 132 64.980 64.980 64.978 0.002 18093 5011 1 7 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.237 -0.612 18093 5012 1 7 . 1 1 133 133 TRP N N 133 115.508 115.508 120.152 -4.644 18093 5013 1 7 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.460 0.132 18093 5014 1 7 . 1 1 133 133 TRP C C 133 176.842 176.842 176.977 -0.135 18093 5015 1 7 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.511 -2.228 18093 5016 1 7 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.371 -0.775 18093 5017 1 7 . 1 1 133 133 TRP H H 133 7.311 7.311 8.306 -0.995 18093 5018 1 7 . 1 1 134 134 LEU N N 134 119.570 119.570 116.607 2.963 18093 5019 1 7 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.433 -0.256 18093 5020 1 7 . 1 1 134 134 LEU C C 134 175.768 175.768 176.171 -0.403 18093 5021 1 7 . 1 1 134 134 LEU CA C 134 55.621 55.621 54.174 1.447 18093 5022 1 7 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.120 1.528 18093 5023 1 7 . 1 1 134 134 LEU H H 134 7.453 7.453 7.726 -0.273 18093 5024 1 7 . 1 1 135 135 ALA N N 135 119.004 119.004 121.555 -2.551 18093 5025 1 7 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.438 -0.215 18093 5026 1 7 . 1 1 135 135 ALA C C 135 177.170 177.170 177.283 -0.113 18093 5027 1 7 . 1 1 135 135 ALA CA C 135 52.456 52.456 53.328 -0.872 18093 5028 1 7 . 1 1 135 135 ALA CB C 135 19.736 19.736 19.794 -0.058 18093 5029 1 7 . 1 1 135 135 ALA H H 135 7.541 7.541 8.094 -0.553 18093 5030 1 7 . 1 1 136 136 GLY N N 136 105.879 105.879 107.708 -1.829 18093 5031 1 7 . 1 1 136 136 GLY C C 136 173.042 173.042 174.998 -1.956 18093 5032 1 7 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.274 0.419 18093 5033 1 7 . 1 1 136 136 GLY H H 136 7.846 7.846 8.139 -0.293 18093 5034 1 8 . 1 1 5 5 GLU N N 5 119.627 119.627 118.586 1.041 18093 5035 1 8 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.394 -0.186 18093 5036 1 8 . 1 1 5 5 GLU C C 5 176.581 176.581 175.048 1.533 18093 5037 1 8 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.502 0.543 18093 5038 1 8 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.403 0.635 18093 5039 1 8 . 1 1 5 5 GLU H H 5 8.003 8.003 8.405 -0.402 18093 5040 1 8 . 1 1 6 6 LEU N N 6 121.267 121.267 121.957 -0.690 18093 5041 1 8 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.394 0.031 18093 5042 1 8 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.245 2.390 18093 5043 1 8 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.632 -0.336 18093 5044 1 8 . 1 1 6 6 LEU H H 6 8.104 8.104 7.823 0.281 18093 5045 1 8 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.550 -0.151 18093 5046 1 8 . 1 1 7 7 PRO C C 7 178.408 178.408 177.931 0.477 18093 5047 1 8 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.121 2.591 18093 5048 1 8 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.753 -0.836 18093 5049 1 8 . 1 1 8 8 LEU N N 8 121.835 121.835 120.311 1.524 18093 5050 1 8 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.221 -0.132 18093 5051 1 8 . 1 1 8 8 LEU C C 8 177.902 177.902 178.323 -0.421 18093 5052 1 8 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.310 0.794 18093 5053 1 8 . 1 1 8 8 LEU CB C 8 41.607 41.607 40.998 0.609 18093 5054 1 8 . 1 1 8 8 LEU H H 8 8.162 8.162 8.503 -0.341 18093 5055 1 8 . 1 1 9 9 PHE N N 9 118.342 118.342 119.287 -0.945 18093 5056 1 8 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.157 0.033 18093 5057 1 8 . 1 1 9 9 PHE C C 9 177.596 177.596 177.087 0.509 18093 5058 1 8 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.189 -0.075 18093 5059 1 8 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.233 0.494 18093 5060 1 8 . 1 1 9 9 PHE H H 9 8.318 8.318 8.285 0.033 18093 5061 1 8 . 1 1 10 10 TYR N N 10 117.584 117.584 117.703 -0.119 18093 5062 1 8 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.888 0.266 18093 5063 1 8 . 1 1 10 10 TYR C C 10 177.630 177.630 177.857 -0.227 18093 5064 1 8 . 1 1 10 10 TYR CA C 10 61.036 61.036 60.477 0.559 18093 5065 1 8 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.171 0.489 18093 5066 1 8 . 1 1 10 10 TYR H H 10 8.105 8.105 7.856 0.249 18093 5067 1 8 . 1 1 11 11 THR N N 11 115.563 115.563 116.894 -1.331 18093 5068 1 8 . 1 1 11 11 THR HA H 11 3.871 3.871 4.011 -0.140 18093 5069 1 8 . 1 1 11 11 THR C C 11 175.955 175.955 176.782 -0.827 18093 5070 1 8 . 1 1 11 11 THR CA C 11 67.290 67.290 66.716 0.574 18093 5071 1 8 . 1 1 11 11 THR CB C 11 68.201 68.201 68.691 -0.490 18093 5072 1 8 . 1 1 11 11 THR H H 11 7.915 7.915 7.566 0.349 18093 5073 1 8 . 1 1 12 12 ILE N N 12 119.727 119.727 120.368 -0.641 18093 5074 1 8 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.909 -0.210 18093 5075 1 8 . 1 1 12 12 ILE C C 12 175.773 175.773 177.588 -1.815 18093 5076 1 8 . 1 1 12 12 ILE CA C 12 64.699 64.699 63.160 1.539 18093 5077 1 8 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.793 1.303 18093 5078 1 8 . 1 1 12 12 ILE H H 12 8.186 8.186 8.052 0.134 18093 5079 1 8 . 1 1 13 13 ASN N N 13 114.190 114.190 118.522 -4.332 18093 5080 1 8 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.551 -0.129 18093 5081 1 8 . 1 1 13 13 ASN C C 13 174.786 174.786 176.734 -1.948 18093 5082 1 8 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.264 0.291 18093 5083 1 8 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.706 0.652 18093 5084 1 8 . 1 1 13 13 ASN H H 13 7.601 7.601 7.369 0.232 18093 5085 1 8 . 1 1 14 14 LEU N N 14 115.031 115.031 119.060 -4.029 18093 5086 1 8 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.060 0.136 18093 5087 1 8 . 1 1 14 14 LEU C C 14 177.540 177.540 177.982 -0.442 18093 5088 1 8 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.669 -0.261 18093 5089 1 8 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.553 -0.711 18093 5090 1 8 . 1 1 14 14 LEU H H 14 7.390 7.390 7.652 -0.262 18093 5091 1 8 . 1 1 15 15 ILE N N 15 118.223 118.223 120.624 -2.401 18093 5092 1 8 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.764 -0.151 18093 5093 1 8 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.670 3.050 18093 5094 1 8 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.335 -0.723 18093 5095 1 8 . 1 1 15 15 ILE H H 15 8.123 8.123 7.626 0.497 18093 5096 1 8 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.318 -0.249 18093 5097 1 8 . 1 1 17 17 PRO C C 17 177.721 177.721 178.500 -0.779 18093 5098 1 8 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.555 1.206 18093 5099 1 8 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.789 -0.047 18093 5100 1 8 . 1 1 18 18 CYS N N 18 113.538 113.538 117.356 -3.818 18093 5101 1 8 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.062 -0.054 18093 5102 1 8 . 1 1 18 18 CYS C C 18 177.683 177.683 177.045 0.638 18093 5103 1 8 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.202 1.298 18093 5104 1 8 . 1 1 18 18 CYS CB C 18 26.873 26.873 27.387 -0.514 18093 5105 1 8 . 1 1 18 18 CYS H H 18 7.410 7.410 7.405 0.005 18093 5106 1 8 . 1 1 19 19 LEU N N 19 122.545 122.545 119.672 2.873 18093 5107 1 8 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.077 -0.078 18093 5108 1 8 . 1 1 19 19 LEU C C 19 178.608 178.608 178.647 -0.039 18093 5109 1 8 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.425 0.996 18093 5110 1 8 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.448 0.396 18093 5111 1 8 . 1 1 19 19 LEU H H 19 8.635 8.635 7.440 1.195 18093 5112 1 8 . 1 1 20 20 LEU N N 20 119.404 119.404 120.347 -0.943 18093 5113 1 8 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.908 0.098 18093 5114 1 8 . 1 1 20 20 LEU C C 20 178.540 178.540 179.414 -0.874 18093 5115 1 8 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.443 0.356 18093 5116 1 8 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.944 0.055 18093 5117 1 8 . 1 1 20 20 LEU H H 20 8.392 8.392 7.503 0.889 18093 5118 1 8 . 1 1 21 21 ILE N N 21 117.335 117.335 113.920 3.415 18093 5119 1 8 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.853 -0.202 18093 5120 1 8 . 1 1 21 21 ILE C C 21 177.249 177.249 177.345 -0.096 18093 5121 1 8 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.346 0.915 18093 5122 1 8 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.328 0.631 18093 5123 1 8 . 1 1 21 21 ILE H H 21 8.403 8.403 8.350 0.053 18093 5124 1 8 . 1 1 22 22 SER N N 22 116.385 116.385 116.977 -0.592 18093 5125 1 8 . 1 1 22 22 SER HA H 22 4.056 4.056 4.190 -0.134 18093 5126 1 8 . 1 1 22 22 SER C C 22 176.813 176.813 176.544 0.269 18093 5127 1 8 . 1 1 22 22 SER CA C 22 63.866 63.866 61.498 2.368 18093 5128 1 8 . 1 1 22 22 SER CB C 22 62.898 62.898 63.098 -0.200 18093 5129 1 8 . 1 1 22 22 SER H H 22 8.271 8.271 7.619 0.652 18093 5130 1 8 . 1 1 23 23 CYS N N 23 119.001 119.001 120.619 -1.618 18093 5131 1 8 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.193 -0.203 18093 5132 1 8 . 1 1 23 23 CYS C C 23 177.594 177.594 176.454 1.140 18093 5133 1 8 . 1 1 23 23 CYS CA C 23 64.429 64.429 63.622 0.807 18093 5134 1 8 . 1 1 23 23 CYS CB C 23 26.940 26.940 26.898 0.042 18093 5135 1 8 . 1 1 23 23 CYS H H 23 8.161 8.161 8.683 -0.522 18093 5136 1 8 . 1 1 24 24 LEU N N 24 117.814 117.814 121.946 -4.132 18093 5137 1 8 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.854 0.123 18093 5138 1 8 . 1 1 24 24 LEU C C 24 177.944 177.944 178.324 -0.380 18093 5139 1 8 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.788 -0.501 18093 5140 1 8 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.995 -0.092 18093 5141 1 8 . 1 1 24 24 LEU H H 24 8.106 8.106 7.596 0.510 18093 5142 1 8 . 1 1 25 25 THR N N 25 115.670 115.670 114.618 1.052 18093 5143 1 8 . 1 1 25 25 THR HA H 25 3.687 3.687 4.057 -0.370 18093 5144 1 8 . 1 1 25 25 THR C C 25 175.845 175.845 177.034 -1.189 18093 5145 1 8 . 1 1 25 25 THR CA C 25 68.306 68.306 66.495 1.811 18093 5146 1 8 . 1 1 25 25 THR H H 25 7.924 7.924 7.609 0.315 18093 5147 1 8 . 1 1 26 26 VAL N N 26 118.809 118.809 121.589 -2.780 18093 5148 1 8 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.843 -0.328 18093 5149 1 8 . 1 1 26 26 VAL C C 26 177.530 177.530 177.920 -0.390 18093 5150 1 8 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.449 0.832 18093 5151 1 8 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.280 0.444 18093 5152 1 8 . 1 1 26 26 VAL H H 26 7.764 7.764 7.375 0.389 18093 5153 1 8 . 1 1 27 27 LEU N N 27 117.958 117.958 120.600 -2.642 18093 5154 1 8 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.039 -0.003 18093 5155 1 8 . 1 1 27 27 LEU C C 27 178.163 178.163 179.412 -1.249 18093 5156 1 8 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.173 0.336 18093 5157 1 8 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.929 0.990 18093 5158 1 8 . 1 1 27 27 LEU H H 27 7.912 7.912 8.342 -0.430 18093 5159 1 8 . 1 1 28 28 VAL N N 28 114.472 114.472 117.862 -3.390 18093 5160 1 8 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.581 -0.046 18093 5161 1 8 . 1 1 28 28 VAL C C 28 176.871 176.871 177.884 -1.013 18093 5162 1 8 . 1 1 28 28 VAL CA C 28 65.977 65.977 66.359 -0.382 18093 5163 1 8 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.131 0.803 18093 5164 1 8 . 1 1 28 28 VAL H H 28 7.892 7.892 7.551 0.341 18093 5165 1 8 . 1 1 29 29 PHE N N 29 115.206 115.206 115.173 0.033 18093 5166 1 8 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.239 -0.036 18093 5167 1 8 . 1 1 29 29 PHE C C 29 176.614 176.614 177.434 -0.820 18093 5168 1 8 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.133 0.831 18093 5169 1 8 . 1 1 29 29 PHE CB C 29 39.752 39.752 38.896 0.856 18093 5170 1 8 . 1 1 29 29 PHE H H 29 7.748 7.748 7.546 0.202 18093 5171 1 8 . 1 1 30 30 TYR N N 30 115.975 115.975 119.855 -3.880 18093 5172 1 8 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.421 -0.099 18093 5173 1 8 . 1 1 30 30 TYR C C 30 175.553 175.553 176.224 -0.671 18093 5174 1 8 . 1 1 30 30 TYR CA C 30 59.598 59.598 60.093 -0.495 18093 5175 1 8 . 1 1 30 30 TYR CB C 30 39.763 39.763 39.791 -0.028 18093 5176 1 8 . 1 1 30 30 TYR H H 30 7.985 7.985 7.381 0.604 18093 5177 1 8 . 1 1 31 31 LEU N N 31 120.780 120.780 119.203 1.577 18093 5178 1 8 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.608 -0.181 18093 5179 1 8 . 1 1 31 31 LEU CA C 31 54.665 54.665 53.179 1.486 18093 5180 1 8 . 1 1 31 31 LEU CB C 31 42.388 42.388 42.770 -0.382 18093 5181 1 8 . 1 1 31 31 LEU H H 31 7.643 7.643 7.574 0.069 18093 5182 1 8 . 1 1 34 34 GLU C C 34 176.271 176.271 175.755 0.516 18093 5183 1 8 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.737 1.853 18093 5184 1 8 . 1 1 35 35 CYS N N 35 116.430 116.430 118.789 -2.359 18093 5185 1 8 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.680 -0.313 18093 5186 1 8 . 1 1 35 35 CYS C C 35 175.198 175.198 176.668 -1.470 18093 5187 1 8 . 1 1 35 35 CYS CA C 35 60.293 60.293 59.010 1.283 18093 5188 1 8 . 1 1 35 35 CYS CB C 35 28.130 28.130 28.739 -0.609 18093 5189 1 8 . 1 1 35 35 CYS H H 35 7.970 7.970 8.591 -0.621 18093 5190 1 8 . 1 1 36 36 GLY N N 36 108.315 108.315 110.036 -1.721 18093 5191 1 8 . 1 1 36 36 GLY C C 36 174.610 174.610 175.853 -1.243 18093 5192 1 8 . 1 1 36 36 GLY CA C 36 46.004 46.004 46.086 -0.082 18093 5193 1 8 . 1 1 36 36 GLY H H 36 8.120 8.120 8.178 -0.058 18093 5194 1 8 . 1 1 37 37 GLU N N 37 121.347 121.347 120.854 0.493 18093 5195 1 8 . 1 1 37 37 GLU HA H 37 4.047 4.047 3.995 0.052 18093 5196 1 8 . 1 1 37 37 GLU C C 37 177.338 177.338 178.276 -0.938 18093 5197 1 8 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.096 -0.589 18093 5198 1 8 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.588 -0.018 18093 5199 1 8 . 1 1 37 37 GLU H H 37 8.423 8.423 8.429 -0.006 18093 5200 1 8 . 1 1 38 38 LYS N N 38 123.788 123.788 119.658 4.130 18093 5201 1 8 . 1 1 38 38 LYS HA H 38 4.196 4.196 3.946 0.250 18093 5202 1 8 . 1 1 38 38 LYS C C 38 177.976 177.976 178.756 -0.780 18093 5203 1 8 . 1 1 38 38 LYS CA C 38 58.273 58.273 58.829 -0.556 18093 5204 1 8 . 1 1 38 38 LYS CB C 38 31.649 31.649 31.581 0.069 18093 5205 1 8 . 1 1 38 38 LYS H H 38 8.211 8.211 7.853 0.358 18093 5206 1 8 . 1 1 39 39 ILE N N 39 115.675 115.675 118.339 -2.664 18093 5207 1 8 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.728 -0.119 18093 5208 1 8 . 1 1 39 39 ILE C C 39 177.204 177.204 178.252 -1.048 18093 5209 1 8 . 1 1 39 39 ILE CA C 39 65.501 65.501 64.181 1.320 18093 5210 1 8 . 1 1 39 39 ILE H H 39 7.933 7.933 7.555 0.378 18093 5211 1 8 . 1 1 40 40 THR N N 40 117.411 117.411 115.894 1.517 18093 5212 1 8 . 1 1 40 40 THR HA H 40 3.844 3.844 3.946 -0.102 18093 5213 1 8 . 1 1 40 40 THR C C 40 175.983 175.983 177.118 -1.135 18093 5214 1 8 . 1 1 40 40 THR CA C 40 67.360 67.360 65.989 1.371 18093 5215 1 8 . 1 1 40 40 THR H H 40 8.362 8.362 7.555 0.807 18093 5216 1 8 . 1 1 41 41 LEU N N 41 123.059 123.059 122.555 0.504 18093 5217 1 8 . 1 1 41 41 LEU HA H 41 4.016 4.016 3.903 0.113 18093 5218 1 8 . 1 1 41 41 LEU C C 41 178.914 178.914 178.595 0.319 18093 5219 1 8 . 1 1 41 41 LEU CA C 41 58.366 58.366 58.583 -0.217 18093 5220 1 8 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.371 0.679 18093 5221 1 8 . 1 1 41 41 LEU H H 41 8.282 8.282 8.031 0.251 18093 5222 1 8 . 1 1 42 42 CYS N N 42 118.762 118.762 118.194 0.568 18093 5223 1 8 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.019 -0.083 18093 5224 1 8 . 1 1 42 42 CYS C C 42 176.607 176.607 177.146 -0.539 18093 5225 1 8 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.310 1.007 18093 5226 1 8 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.061 -0.141 18093 5227 1 8 . 1 1 42 42 CYS H H 42 8.195 8.195 8.189 0.006 18093 5228 1 8 . 1 1 43 43 ILE N N 43 117.589 117.589 119.596 -2.007 18093 5229 1 8 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.702 -0.095 18093 5230 1 8 . 1 1 43 43 ILE C C 43 177.323 177.323 177.486 -0.163 18093 5231 1 8 . 1 1 43 43 ILE CA C 43 65.249 65.249 65.043 0.206 18093 5232 1 8 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.774 0.264 18093 5233 1 8 . 1 1 43 43 ILE H H 43 8.428 8.428 7.672 0.756 18093 5234 1 8 . 1 1 44 44 SER N N 44 115.950 115.950 116.339 -0.389 18093 5235 1 8 . 1 1 44 44 SER HA H 44 4.012 4.012 4.206 -0.194 18093 5236 1 8 . 1 1 44 44 SER C C 44 176.965 176.965 176.461 0.504 18093 5237 1 8 . 1 1 44 44 SER CA C 44 63.575 63.575 62.530 1.045 18093 5238 1 8 . 1 1 44 44 SER H H 44 7.984 7.984 7.641 0.343 18093 5239 1 8 . 1 1 45 45 VAL N N 45 123.544 123.544 120.890 2.654 18093 5240 1 8 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.724 -0.176 18093 5241 1 8 . 1 1 45 45 VAL C C 45 177.139 177.139 177.671 -0.532 18093 5242 1 8 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.457 0.776 18093 5243 1 8 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.495 0.147 18093 5244 1 8 . 1 1 45 45 VAL H H 45 8.280 8.280 7.496 0.784 18093 5245 1 8 . 1 1 46 46 LEU N N 46 119.883 119.883 121.093 -1.210 18093 5246 1 8 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.017 -0.074 18093 5247 1 8 . 1 1 46 46 LEU C C 46 180.125 180.125 178.907 1.218 18093 5248 1 8 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.922 0.678 18093 5249 1 8 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.988 0.024 18093 5250 1 8 . 1 1 46 46 LEU H H 46 8.117 8.117 7.409 0.708 18093 5251 1 8 . 1 1 47 47 LEU N N 47 120.193 120.193 119.165 1.028 18093 5252 1 8 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.939 0.065 18093 5253 1 8 . 1 1 47 47 LEU C C 47 178.370 178.370 179.372 -1.002 18093 5254 1 8 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.155 0.271 18093 5255 1 8 . 1 1 47 47 LEU CB C 47 42.055 42.055 40.813 1.242 18093 5256 1 8 . 1 1 47 47 LEU H H 47 8.933 8.933 8.380 0.553 18093 5257 1 8 . 1 1 48 48 SER N N 48 115.861 115.861 114.509 1.352 18093 5258 1 8 . 1 1 48 48 SER HA H 48 4.013 4.013 4.208 -0.195 18093 5259 1 8 . 1 1 48 48 SER C C 48 175.642 175.642 176.713 -1.071 18093 5260 1 8 . 1 1 48 48 SER CA C 48 63.571 63.571 62.225 1.346 18093 5261 1 8 . 1 1 48 48 SER CB C 48 62.879 62.879 63.011 -0.132 18093 5262 1 8 . 1 1 48 48 SER H H 48 7.996 7.996 7.602 0.394 18093 5263 1 8 . 1 1 49 49 LEU N N 49 120.673 120.673 121.861 -1.188 18093 5264 1 8 . 1 1 49 49 LEU HA H 49 4.035 4.035 3.979 0.056 18093 5265 1 8 . 1 1 49 49 LEU C C 49 178.229 178.229 178.639 -0.410 18093 5266 1 8 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.217 0.066 18093 5267 1 8 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.046 -0.100 18093 5268 1 8 . 1 1 49 49 LEU H H 49 8.352 8.352 7.394 0.958 18093 5269 1 8 . 1 1 50 50 THR N N 50 115.582 115.582 114.466 1.116 18093 5270 1 8 . 1 1 50 50 THR HA H 50 3.672 3.672 4.011 -0.339 18093 5271 1 8 . 1 1 50 50 THR C C 50 175.877 175.877 176.554 -0.677 18093 5272 1 8 . 1 1 50 50 THR CA C 50 68.628 68.628 66.461 2.167 18093 5273 1 8 . 1 1 50 50 THR H H 50 7.937 7.937 7.743 0.194 18093 5274 1 8 . 1 1 51 51 VAL N N 51 119.774 119.774 122.660 -2.886 18093 5275 1 8 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.780 -0.282 18093 5276 1 8 . 1 1 51 51 VAL C C 51 177.162 177.162 177.150 0.012 18093 5277 1 8 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.528 1.056 18093 5278 1 8 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.676 -0.155 18093 5279 1 8 . 1 1 51 51 VAL H H 51 8.115 8.115 7.680 0.435 18093 5280 1 8 . 1 1 52 52 PHE N N 52 118.808 118.808 120.133 -1.325 18093 5281 1 8 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.247 -0.125 18093 5282 1 8 . 1 1 52 52 PHE C C 52 176.697 176.697 177.378 -0.681 18093 5283 1 8 . 1 1 52 52 PHE CA C 52 61.771 61.771 61.442 0.329 18093 5284 1 8 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.239 0.023 18093 5285 1 8 . 1 1 52 52 PHE H H 52 8.256 8.256 8.644 -0.388 18093 5286 1 8 . 1 1 53 53 LEU N N 53 117.267 117.267 121.234 -3.967 18093 5287 1 8 . 1 1 53 53 LEU HA H 53 3.893 3.893 4.173 -0.280 18093 5288 1 8 . 1 1 53 53 LEU C C 53 179.319 179.319 178.066 1.253 18093 5289 1 8 . 1 1 53 53 LEU CA C 53 57.985 57.985 58.313 -0.328 18093 5290 1 8 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.511 0.316 18093 5291 1 8 . 1 1 53 53 LEU H H 53 8.443 8.443 8.116 0.327 18093 5292 1 8 . 1 1 54 54 LEU N N 54 119.762 119.762 119.342 0.420 18093 5293 1 8 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.929 0.125 18093 5294 1 8 . 1 1 54 54 LEU C C 54 178.827 178.827 178.981 -0.154 18093 5295 1 8 . 1 1 54 54 LEU CA C 54 58.105 58.105 58.326 -0.221 18093 5296 1 8 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.775 0.172 18093 5297 1 8 . 1 1 54 54 LEU H H 54 8.205 8.205 7.445 0.760 18093 5298 1 8 . 1 1 55 55 LEU N N 55 118.585 118.585 118.794 -0.209 18093 5299 1 8 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.777 0.300 18093 5300 1 8 . 1 1 55 55 LEU C C 55 178.909 178.909 178.817 0.092 18093 5301 1 8 . 1 1 55 55 LEU CA C 55 58.108 58.108 58.053 0.055 18093 5302 1 8 . 1 1 55 55 LEU CB C 55 41.979 41.979 41.738 0.241 18093 5303 1 8 . 1 1 55 55 LEU H H 55 8.179 8.179 7.373 0.806 18093 5304 1 8 . 1 1 56 56 ILE N N 56 116.079 116.079 114.246 1.833 18093 5305 1 8 . 1 1 56 56 ILE HA H 56 3.729 3.729 3.994 -0.265 18093 5306 1 8 . 1 1 56 56 ILE C C 56 176.988 176.988 177.478 -0.490 18093 5307 1 8 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.712 0.545 18093 5308 1 8 . 1 1 56 56 ILE CB C 56 37.417 37.417 37.015 0.402 18093 5309 1 8 . 1 1 56 56 ILE H H 56 8.040 8.040 7.778 0.262 18093 5310 1 8 . 1 1 57 57 THR N N 57 110.105 110.105 109.643 0.462 18093 5311 1 8 . 1 1 57 57 THR HA H 57 4.015 4.015 4.259 -0.244 18093 5312 1 8 . 1 1 57 57 THR C C 57 175.435 175.435 175.867 -0.432 18093 5313 1 8 . 1 1 57 57 THR CA C 57 65.067 65.067 64.089 0.978 18093 5314 1 8 . 1 1 57 57 THR CB C 57 69.179 69.179 69.377 -0.198 18093 5315 1 8 . 1 1 57 57 THR H H 57 7.655 7.655 7.802 -0.147 18093 5316 1 8 . 1 1 58 58 GLU N N 58 117.313 117.313 121.857 -4.544 18093 5317 1 8 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.202 0.131 18093 5318 1 8 . 1 1 58 58 GLU C C 58 176.940 176.940 178.298 -1.358 18093 5319 1 8 . 1 1 58 58 GLU CA C 58 57.068 57.068 58.174 -1.106 18093 5320 1 8 . 1 1 58 58 GLU CB C 58 29.396 29.396 28.975 0.421 18093 5321 1 8 . 1 1 58 58 GLU H H 58 7.521 7.521 7.922 -0.401 18093 5322 1 8 . 1 1 59 59 ILE N N 59 114.870 114.870 112.940 1.930 18093 5323 1 8 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.057 0.032 18093 5324 1 8 . 1 1 59 59 ILE C C 59 175.456 175.456 175.875 -0.419 18093 5325 1 8 . 1 1 59 59 ILE CA C 59 62.434 62.434 61.777 0.657 18093 5326 1 8 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.218 0.439 18093 5327 1 8 . 1 1 59 59 ILE H H 59 7.579 7.579 7.336 0.243 18093 5328 1 8 . 1 1 60 60 ILE N N 60 119.354 119.354 116.433 2.921 18093 5329 1 8 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.866 0.438 18093 5330 1 8 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.451 -1.834 18093 5331 1 8 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.617 2.245 18093 5332 1 8 . 1 1 60 60 ILE H H 60 7.629 7.629 7.300 0.329 18093 5333 1 8 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.439 -0.039 18093 5334 1 8 . 1 1 61 61 PRO C C 61 177.144 177.144 176.204 0.940 18093 5335 1 8 . 1 1 61 61 PRO CA C 61 63.808 63.808 64.258 -0.450 18093 5336 1 8 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.532 -0.650 18093 5337 1 8 . 1 1 62 62 SER N N 62 114.474 114.474 110.789 3.685 18093 5338 1 8 . 1 1 62 62 SER HA H 62 4.434 4.434 4.560 -0.126 18093 5339 1 8 . 1 1 62 62 SER C C 62 175.161 175.161 173.938 1.223 18093 5340 1 8 . 1 1 62 62 SER CA C 62 59.047 59.047 58.697 0.350 18093 5341 1 8 . 1 1 62 62 SER CB C 62 63.704 63.704 63.977 -0.273 18093 5342 1 8 . 1 1 62 62 SER H H 62 8.186 8.186 7.915 0.271 18093 5343 1 8 . 1 1 63 63 THR N N 63 113.573 113.573 120.078 -6.505 18093 5344 1 8 . 1 1 63 63 THR HA H 63 4.319 4.319 4.531 -0.212 18093 5345 1 8 . 1 1 63 63 THR C C 63 174.834 174.834 174.455 0.379 18093 5346 1 8 . 1 1 63 63 THR CA C 63 62.377 62.377 61.289 1.088 18093 5347 1 8 . 1 1 63 63 THR CB C 63 69.422 69.422 68.448 0.973 18093 5348 1 8 . 1 1 63 63 THR H H 63 7.963 7.963 8.476 -0.513 18093 5349 1 8 . 1 1 64 64 SER N N 64 116.598 116.598 115.725 0.873 18093 5350 1 8 . 1 1 64 64 SER HA H 64 4.428 4.428 4.838 -0.410 18093 5351 1 8 . 1 1 64 64 SER C C 64 174.618 174.618 174.116 0.502 18093 5352 1 8 . 1 1 64 64 SER CA C 64 59.045 59.045 56.953 2.092 18093 5353 1 8 . 1 1 64 64 SER CB C 64 63.700 63.700 65.409 -1.709 18093 5354 1 8 . 1 1 64 64 SER H H 64 8.052 8.052 7.405 0.647 18093 5355 1 8 . 1 1 65 65 SER N N 65 116.673 116.673 116.562 0.111 18093 5356 1 8 . 1 1 65 65 SER HA H 65 4.432 4.432 4.685 -0.253 18093 5357 1 8 . 1 1 65 65 SER C C 65 174.335 174.335 175.123 -0.788 18093 5358 1 8 . 1 1 65 65 SER CA C 65 58.927 58.927 58.463 0.464 18093 5359 1 8 . 1 1 65 65 SER CB C 65 63.621 63.621 63.611 0.010 18093 5360 1 8 . 1 1 65 65 SER H H 65 8.114 8.114 8.535 -0.421 18093 5361 1 8 . 1 1 66 66 VAL N N 66 119.054 119.054 117.726 1.328 18093 5362 1 8 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.423 -0.253 18093 5363 1 8 . 1 1 66 66 VAL C C 66 175.278 175.278 174.833 0.445 18093 5364 1 8 . 1 1 66 66 VAL CA C 66 62.062 62.062 61.266 0.796 18093 5365 1 8 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.906 -0.276 18093 5366 1 8 . 1 1 66 66 VAL H H 66 7.740 7.740 7.413 0.327 18093 5367 1 8 . 1 1 67 67 SER N N 67 118.882 118.882 115.414 3.468 18093 5368 1 8 . 1 1 67 67 SER HA H 67 4.704 4.704 4.351 0.353 18093 5369 1 8 . 1 1 67 67 SER CA C 67 56.715 56.715 58.341 -1.626 18093 5370 1 8 . 1 1 67 67 SER CB C 67 63.624 63.624 63.385 0.240 18093 5371 1 8 . 1 1 67 67 SER H H 67 8.060 8.060 8.348 -0.288 18093 5372 1 8 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.536 -0.136 18093 5373 1 8 . 1 1 68 68 PRO C C 68 176.925 176.925 175.956 0.969 18093 5374 1 8 . 1 1 68 68 PRO CA C 68 63.748 63.748 63.216 0.532 18093 5375 1 8 . 1 1 68 68 PRO CB C 68 32.005 32.005 32.145 -0.140 18093 5376 1 8 . 1 1 69 69 SER N N 69 114.930 114.930 116.541 -1.611 18093 5377 1 8 . 1 1 69 69 SER HA H 69 4.422 4.422 4.741 -0.319 18093 5378 1 8 . 1 1 69 69 SER C C 69 175.617 175.617 175.801 -0.184 18093 5379 1 8 . 1 1 69 69 SER CA C 69 58.697 58.697 57.108 1.589 18093 5380 1 8 . 1 1 69 69 SER CB C 69 63.804 63.804 66.079 -2.275 18093 5381 1 8 . 1 1 69 69 SER H H 69 8.205 8.205 8.102 0.103 18093 5382 1 8 . 1 1 70 70 ILE N N 70 120.840 120.840 126.216 -5.376 18093 5383 1 8 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.104 -0.112 18093 5384 1 8 . 1 1 70 70 ILE C C 70 177.524 177.524 176.677 0.847 18093 5385 1 8 . 1 1 70 70 ILE CA C 70 64.335 64.335 62.440 1.895 18093 5386 1 8 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.212 -0.752 18093 5387 1 8 . 1 1 70 70 ILE H H 70 8.283 8.283 8.892 -0.609 18093 5388 1 8 . 1 1 71 71 GLY N N 71 107.823 107.823 108.057 -0.234 18093 5389 1 8 . 1 1 71 71 GLY C C 71 175.296 175.296 176.416 -1.120 18093 5390 1 8 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.176 0.279 18093 5391 1 8 . 1 1 71 71 GLY H H 71 8.557 8.557 8.648 -0.091 18093 5392 1 8 . 1 1 72 72 GLU N N 72 120.835 120.835 120.533 0.302 18093 5393 1 8 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.293 -0.446 18093 5394 1 8 . 1 1 72 72 GLU C C 72 178.198 178.198 178.271 -0.073 18093 5395 1 8 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.105 2.013 18093 5396 1 8 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.546 -0.153 18093 5397 1 8 . 1 1 72 72 GLU H H 72 7.922 7.922 7.795 0.127 18093 5398 1 8 . 1 1 73 73 TYR N N 73 117.375 117.375 122.371 -4.996 18093 5399 1 8 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.269 -0.107 18093 5400 1 8 . 1 1 73 73 TYR C C 73 179.912 179.912 177.318 2.594 18093 5401 1 8 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.159 0.996 18093 5402 1 8 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.710 0.056 18093 5403 1 8 . 1 1 73 73 TYR H H 73 8.062 8.062 7.732 0.330 18093 5404 1 8 . 1 1 74 74 LEU N N 74 121.493 121.493 118.678 2.815 18093 5405 1 8 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.734 0.315 18093 5406 1 8 . 1 1 74 74 LEU C C 74 178.063 178.063 178.675 -0.612 18093 5407 1 8 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.167 1.328 18093 5408 1 8 . 1 1 74 74 LEU CB C 74 41.847 41.847 42.016 -0.169 18093 5409 1 8 . 1 1 74 74 LEU H H 74 8.552 8.552 8.834 -0.282 18093 5410 1 8 . 1 1 75 75 LEU N N 75 120.375 120.375 120.316 0.059 18093 5411 1 8 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.060 -0.020 18093 5412 1 8 . 1 1 75 75 LEU C C 75 178.515 178.515 178.224 0.291 18093 5413 1 8 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.076 0.562 18093 5414 1 8 . 1 1 75 75 LEU CB C 75 42.039 42.039 42.031 0.008 18093 5415 1 8 . 1 1 75 75 LEU H H 75 8.276 8.276 7.494 0.782 18093 5416 1 8 . 1 1 76 76 PHE N N 76 116.626 116.626 117.970 -1.344 18093 5417 1 8 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.182 -0.103 18093 5418 1 8 . 1 1 76 76 PHE C C 76 177.399 177.399 177.898 -0.499 18093 5419 1 8 . 1 1 76 76 PHE CA C 76 61.734 61.734 61.828 -0.094 18093 5420 1 8 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.499 0.242 18093 5421 1 8 . 1 1 76 76 PHE H H 76 8.454 8.454 7.890 0.564 18093 5422 1 8 . 1 1 77 77 THR N N 77 116.080 116.080 114.526 1.554 18093 5423 1 8 . 1 1 77 77 THR HA H 77 3.687 3.687 3.847 -0.160 18093 5424 1 8 . 1 1 77 77 THR C C 77 176.018 176.018 176.780 -0.762 18093 5425 1 8 . 1 1 77 77 THR CA C 77 68.640 68.640 66.267 2.373 18093 5426 1 8 . 1 1 77 77 THR H H 77 8.224 8.224 7.830 0.394 18093 5427 1 8 . 1 1 78 78 MET N N 78 119.394 119.394 120.060 -0.666 18093 5428 1 8 . 1 1 78 78 MET HA H 78 4.129 4.129 4.032 0.097 18093 5429 1 8 . 1 1 78 78 MET C C 78 179.608 179.608 177.993 1.615 18093 5430 1 8 . 1 1 78 78 MET CA C 78 58.831 58.831 60.005 -1.174 18093 5431 1 8 . 1 1 78 78 MET CB C 78 31.590 31.590 32.573 -0.983 18093 5432 1 8 . 1 1 78 78 MET H H 78 8.372 8.372 7.472 0.900 18093 5433 1 8 . 1 1 79 79 ILE N N 79 121.819 121.819 117.914 3.905 18093 5434 1 8 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.839 -0.289 18093 5435 1 8 . 1 1 79 79 ILE C C 79 176.426 176.426 178.097 -1.671 18093 5436 1 8 . 1 1 79 79 ILE CA C 79 65.876 65.876 61.680 4.196 18093 5437 1 8 . 1 1 79 79 ILE CB C 79 37.673 37.673 36.112 1.561 18093 5438 1 8 . 1 1 79 79 ILE H H 79 8.391 8.391 7.495 0.896 18093 5439 1 8 . 1 1 80 80 PHE N N 80 119.916 119.916 122.155 -2.239 18093 5440 1 8 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.095 -0.042 18093 5441 1 8 . 1 1 80 80 PHE C C 80 178.568 178.568 177.434 1.134 18093 5442 1 8 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.708 -0.401 18093 5443 1 8 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.433 -0.659 18093 5444 1 8 . 1 1 80 80 PHE H H 80 8.479 8.479 8.187 0.292 18093 5445 1 8 . 1 1 81 81 VAL N N 81 120.191 120.191 114.971 5.220 18093 5446 1 8 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.690 -0.237 18093 5447 1 8 . 1 1 81 81 VAL C C 81 178.225 178.225 177.605 0.620 18093 5448 1 8 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.235 1.173 18093 5449 1 8 . 1 1 81 81 VAL CB C 81 31.556 31.556 31.408 0.148 18093 5450 1 8 . 1 1 81 81 VAL H H 81 8.928 8.928 8.484 0.444 18093 5451 1 8 . 1 1 82 82 THR N N 82 115.930 115.930 117.708 -1.778 18093 5452 1 8 . 1 1 82 82 THR HA H 82 3.636 3.636 4.026 -0.390 18093 5453 1 8 . 1 1 82 82 THR C C 82 176.420 176.420 176.587 -0.167 18093 5454 1 8 . 1 1 82 82 THR CA C 82 68.570 68.570 67.142 1.428 18093 5455 1 8 . 1 1 82 82 THR CB C 82 68.202 68.202 68.687 -0.485 18093 5456 1 8 . 1 1 82 82 THR H H 82 7.969 7.969 7.504 0.465 18093 5457 1 8 . 1 1 83 83 LEU N N 83 119.780 119.780 119.651 0.129 18093 5458 1 8 . 1 1 83 83 LEU HA H 83 3.847 3.847 4.165 -0.318 18093 5459 1 8 . 1 1 83 83 LEU C C 83 178.214 178.214 178.334 -0.120 18093 5460 1 8 . 1 1 83 83 LEU CA C 83 58.237 58.237 58.136 0.101 18093 5461 1 8 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.041 0.750 18093 5462 1 8 . 1 1 83 83 LEU H H 83 8.483 8.483 7.631 0.852 18093 5463 1 8 . 1 1 84 84 SER N N 84 114.559 114.559 116.462 -1.903 18093 5464 1 8 . 1 1 84 84 SER HA H 84 4.099 4.099 4.051 0.048 18093 5465 1 8 . 1 1 84 84 SER C C 84 176.799 176.799 176.724 0.075 18093 5466 1 8 . 1 1 84 84 SER CA C 84 63.609 63.609 62.460 1.149 18093 5467 1 8 . 1 1 84 84 SER CB C 84 63.110 63.110 63.014 0.096 18093 5468 1 8 . 1 1 84 84 SER H H 84 8.023 8.023 7.417 0.606 18093 5469 1 8 . 1 1 85 85 ILE N N 85 123.962 123.962 121.843 2.119 18093 5470 1 8 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.800 -0.196 18093 5471 1 8 . 1 1 85 85 ILE C C 85 177.487 177.487 178.010 -0.523 18093 5472 1 8 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.130 0.629 18093 5473 1 8 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.983 -0.095 18093 5474 1 8 . 1 1 85 85 ILE H H 85 8.054 8.054 8.046 0.007 18093 5475 1 8 . 1 1 86 86 VAL N N 86 118.744 118.744 120.427 -1.683 18093 5476 1 8 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.526 -0.007 18093 5477 1 8 . 1 1 86 86 VAL C C 86 177.557 177.557 177.742 -0.185 18093 5478 1 8 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.728 0.807 18093 5479 1 8 . 1 1 86 86 VAL CB C 86 31.466 31.466 32.052 -0.586 18093 5480 1 8 . 1 1 86 86 VAL H H 86 8.158 8.158 7.250 0.908 18093 5481 1 8 . 1 1 87 87 ILE N N 87 117.206 117.206 120.111 -2.905 18093 5482 1 8 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.986 -0.382 18093 5483 1 8 . 1 1 87 87 ILE C C 87 177.283 177.283 178.251 -0.968 18093 5484 1 8 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.779 1.897 18093 5485 1 8 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.846 0.743 18093 5486 1 8 . 1 1 87 87 ILE H H 87 8.459 8.459 8.108 0.351 18093 5487 1 8 . 1 1 88 88 THR N N 88 116.158 116.158 116.343 -0.185 18093 5488 1 8 . 1 1 88 88 THR HA H 88 3.672 3.672 4.003 -0.331 18093 5489 1 8 . 1 1 88 88 THR C C 88 175.485 175.485 177.018 -1.533 18093 5490 1 8 . 1 1 88 88 THR CA C 88 68.549 68.549 67.109 1.440 18093 5491 1 8 . 1 1 88 88 THR CB C 88 68.127 68.127 68.671 -0.544 18093 5492 1 8 . 1 1 88 88 THR H H 88 7.776 7.776 8.626 -0.850 18093 5493 1 8 . 1 1 89 89 VAL N N 89 117.985 117.985 120.698 -2.713 18093 5494 1 8 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.713 -0.170 18093 5495 1 8 . 1 1 89 89 VAL C C 89 177.393 177.393 177.642 -0.249 18093 5496 1 8 . 1 1 89 89 VAL CA C 89 66.590 66.590 66.060 0.530 18093 5497 1 8 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.396 0.382 18093 5498 1 8 . 1 1 89 89 VAL H H 89 8.206 8.206 7.370 0.836 18093 5499 1 8 . 1 1 90 90 PHE N N 90 116.709 116.709 119.769 -3.060 18093 5500 1 8 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.273 0.105 18093 5501 1 8 . 1 1 90 90 PHE C C 90 177.305 177.305 178.115 -0.810 18093 5502 1 8 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.493 -0.374 18093 5503 1 8 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.018 1.367 18093 5504 1 8 . 1 1 90 90 PHE H H 90 7.956 7.956 7.549 0.407 18093 5505 1 8 . 1 1 91 91 VAL N N 91 116.565 116.565 119.476 -2.911 18093 5506 1 8 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.808 0.027 18093 5507 1 8 . 1 1 91 91 VAL C C 91 176.927 176.927 176.750 0.177 18093 5508 1 8 . 1 1 91 91 VAL CA C 91 65.347 65.347 65.739 -0.392 18093 5509 1 8 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.578 0.290 18093 5510 1 8 . 1 1 91 91 VAL H H 91 8.239 8.239 8.543 -0.304 18093 5511 1 8 . 1 1 92 92 LEU N N 92 117.443 117.443 115.905 1.538 18093 5512 1 8 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.274 -0.080 18093 5513 1 8 . 1 1 92 92 LEU C C 92 177.180 177.180 178.142 -0.962 18093 5514 1 8 . 1 1 92 92 LEU CA C 92 56.184 56.184 55.646 0.538 18093 5515 1 8 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.245 -0.301 18093 5516 1 8 . 1 1 92 92 LEU H H 92 7.967 7.967 7.464 0.503 18093 5517 1 8 . 1 1 93 93 ASN N N 93 116.705 116.705 117.211 -0.506 18093 5518 1 8 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.586 0.061 18093 5519 1 8 . 1 1 93 93 ASN C C 93 175.129 175.129 175.507 -0.378 18093 5520 1 8 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.293 -1.439 18093 5521 1 8 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.814 -0.419 18093 5522 1 8 . 1 1 93 93 ASN H H 93 7.683 7.683 7.473 0.210 18093 5523 1 8 . 1 1 94 94 VAL N N 94 118.224 118.224 115.821 2.403 18093 5524 1 8 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.969 -0.008 18093 5525 1 8 . 1 1 94 94 VAL C C 94 175.600 175.600 173.263 2.337 18093 5526 1 8 . 1 1 94 94 VAL CA C 94 62.825 62.825 61.120 1.705 18093 5527 1 8 . 1 1 94 94 VAL CB C 94 32.214 32.214 34.590 -2.376 18093 5528 1 8 . 1 1 94 94 VAL H H 94 7.627 7.627 7.796 -0.169 18093 5529 1 8 . 1 1 95 95 HIS N N 95 120.999 120.999 121.271 -0.272 18093 5530 1 8 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.625 -0.032 18093 5531 1 8 . 1 1 95 95 HIS C C 95 174.146 174.146 173.232 0.914 18093 5532 1 8 . 1 1 95 95 HIS CA C 95 55.666 55.666 54.865 0.801 18093 5533 1 8 . 1 1 95 95 HIS CB C 95 29.736 29.736 32.032 -2.296 18093 5534 1 8 . 1 1 95 95 HIS H H 95 8.263 8.263 7.741 0.522 18093 5535 1 8 . 1 1 96 96 HIS N N 96 122.740 122.740 118.389 4.351 18093 5536 1 8 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.698 -0.065 18093 5537 1 8 . 1 1 96 96 HIS CA C 96 55.895 55.895 56.351 -0.456 18093 5538 1 8 . 1 1 96 96 HIS CB C 96 29.750 29.750 30.958 -1.208 18093 5539 1 8 . 1 1 96 96 HIS H H 96 8.298 8.298 8.373 -0.075 18093 5540 1 8 . 1 1 97 97 ARG N N 97 118.503 118.503 122.626 -4.123 18093 5541 1 8 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.716 -0.404 18093 5542 1 8 . 1 1 97 97 ARG C C 97 175.776 175.776 175.738 0.038 18093 5543 1 8 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.651 0.574 18093 5544 1 8 . 1 1 97 97 ARG CB C 97 30.912 30.912 30.725 0.187 18093 5545 1 8 . 1 1 97 97 ARG H H 97 8.250 8.250 8.426 -0.176 18093 5546 1 8 . 1 1 98 98 SER N N 98 118.482 118.482 120.197 -1.715 18093 5547 1 8 . 1 1 98 98 SER HA H 98 4.722 4.722 4.764 -0.042 18093 5548 1 8 . 1 1 98 98 SER CA C 98 56.547 56.547 56.454 0.093 18093 5549 1 8 . 1 1 98 98 SER CB C 98 63.624 63.624 64.033 -0.409 18093 5550 1 8 . 1 1 98 98 SER H H 98 8.254 8.254 8.477 -0.223 18093 5551 1 8 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.384 0.019 18093 5552 1 8 . 1 1 99 99 PRO C C 99 176.899 176.899 175.881 1.018 18093 5553 1 8 . 1 1 99 99 PRO CA C 99 63.701 63.701 63.543 0.158 18093 5554 1 8 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.297 -0.348 18093 5555 1 8 . 1 1 100 100 GLU N N 100 120.187 120.187 115.640 4.547 18093 5556 1 8 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.088 0.200 18093 5557 1 8 . 1 1 100 100 GLU C C 100 176.593 176.593 175.811 0.782 18093 5558 1 8 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.879 -0.157 18093 5559 1 8 . 1 1 100 100 GLU CB C 100 29.999 29.999 29.034 0.965 18093 5560 1 8 . 1 1 100 100 GLU H H 100 8.401 8.401 8.314 0.087 18093 5561 1 8 . 1 1 101 101 THR N N 101 113.968 113.968 109.778 4.190 18093 5562 1 8 . 1 1 101 101 THR HA H 101 4.286 4.286 4.329 -0.043 18093 5563 1 8 . 1 1 101 101 THR C C 101 174.525 174.525 175.020 -0.495 18093 5564 1 8 . 1 1 101 101 THR CA C 101 61.956 61.956 62.801 -0.845 18093 5565 1 8 . 1 1 101 101 THR CB C 101 69.697 69.697 69.366 0.331 18093 5566 1 8 . 1 1 101 101 THR H H 101 7.945 7.945 7.909 0.036 18093 5567 1 8 . 1 1 102 102 HIS N N 102 120.322 120.322 120.444 -0.122 18093 5568 1 8 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.861 -0.120 18093 5569 1 8 . 1 1 102 102 HIS C C 102 174.783 174.783 174.196 0.587 18093 5570 1 8 . 1 1 102 102 HIS CA C 102 55.701 55.701 55.087 0.614 18093 5571 1 8 . 1 1 102 102 HIS CB C 102 29.093 29.093 32.253 -3.160 18093 5572 1 8 . 1 1 102 102 HIS H H 102 8.455 8.455 7.799 0.656 18093 5573 1 8 . 1 1 103 103 THR N N 103 114.282 114.282 115.214 -0.932 18093 5574 1 8 . 1 1 103 103 THR HA H 103 4.352 4.352 4.404 -0.052 18093 5575 1 8 . 1 1 103 103 THR C C 103 175.104 175.104 174.482 0.622 18093 5576 1 8 . 1 1 103 103 THR CA C 103 62.057 62.057 61.720 0.337 18093 5577 1 8 . 1 1 103 103 THR CB C 103 69.966 69.966 67.818 2.148 18093 5578 1 8 . 1 1 103 103 THR H H 103 8.069 8.069 8.402 -0.333 18093 5579 1 8 . 1 1 104 104 GLY N N 104 111.159 111.159 112.699 -1.540 18093 5580 1 8 . 1 1 104 104 GLY C C 104 174.776 174.776 174.193 0.583 18093 5581 1 8 . 1 1 104 104 GLY CA C 104 45.588 45.588 45.093 0.495 18093 5582 1 8 . 1 1 104 104 GLY H H 104 8.393 8.393 7.912 0.481 18093 5583 1 8 . 1 1 105 105 GLY N N 105 108.657 108.657 110.292 -1.635 18093 5584 1 8 . 1 1 105 105 GLY C C 105 174.957 174.957 174.094 0.863 18093 5585 1 8 . 1 1 105 105 GLY CA C 105 45.612 45.612 44.836 0.776 18093 5586 1 8 . 1 1 105 105 GLY H H 105 8.275 8.275 8.493 -0.218 18093 5587 1 8 . 1 1 106 106 GLY N N 106 108.870 108.870 108.165 0.705 18093 5588 1 8 . 1 1 106 106 GLY C C 106 174.877 174.877 173.456 1.421 18093 5589 1 8 . 1 1 106 106 GLY CA C 106 45.665 45.665 45.191 0.474 18093 5590 1 8 . 1 1 106 106 GLY H H 106 8.357 8.357 7.374 0.983 18093 5591 1 8 . 1 1 107 107 GLY N N 107 108.476 108.476 110.366 -1.890 18093 5592 1 8 . 1 1 107 107 GLY C C 107 174.877 174.877 175.078 -0.201 18093 5593 1 8 . 1 1 107 107 GLY CA C 107 45.696 45.696 46.070 -0.374 18093 5594 1 8 . 1 1 107 107 GLY H H 107 8.330 8.330 7.969 0.361 18093 5595 1 8 . 1 1 108 108 GLY N N 108 108.486 108.486 109.884 -1.398 18093 5596 1 8 . 1 1 108 108 GLY C C 108 175.345 175.345 175.611 -0.266 18093 5597 1 8 . 1 1 108 108 GLY CA C 108 45.763 45.763 44.671 1.092 18093 5598 1 8 . 1 1 108 108 GLY H H 108 8.328 8.328 8.543 -0.215 18093 5599 1 8 . 1 1 109 109 ILE N N 109 120.433 120.433 120.798 -0.365 18093 5600 1 8 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.938 0.030 18093 5601 1 8 . 1 1 109 109 ILE C C 109 176.127 176.127 177.236 -1.109 18093 5602 1 8 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.539 -0.804 18093 5603 1 8 . 1 1 109 109 ILE CB C 109 38.125 38.125 37.931 0.194 18093 5604 1 8 . 1 1 109 109 ILE H H 109 8.192 8.192 7.867 0.325 18093 5605 1 8 . 1 1 110 110 ASP N N 110 121.148 121.148 119.727 1.421 18093 5606 1 8 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.547 -0.241 18093 5607 1 8 . 1 1 110 110 ASP C C 110 177.651 177.651 178.389 -0.738 18093 5608 1 8 . 1 1 110 110 ASP CA C 110 56.776 56.776 57.852 -1.076 18093 5609 1 8 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.893 0.204 18093 5610 1 8 . 1 1 110 110 ASP H H 110 8.427 8.427 8.233 0.194 18093 5611 1 8 . 1 1 111 111 ARG N N 111 119.228 119.228 119.002 0.226 18093 5612 1 8 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.262 -0.266 18093 5613 1 8 . 1 1 111 111 ARG C C 111 177.786 177.786 179.116 -1.330 18093 5614 1 8 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.142 -0.201 18093 5615 1 8 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.943 0.253 18093 5616 1 8 . 1 1 111 111 ARG H H 111 7.850 7.850 8.090 -0.240 18093 5617 1 8 . 1 1 112 112 ILE N N 112 118.000 118.000 119.680 -1.680 18093 5618 1 8 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.109 -0.296 18093 5619 1 8 . 1 1 112 112 ILE C C 112 177.496 177.496 177.952 -0.456 18093 5620 1 8 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.213 2.599 18093 5621 1 8 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.922 0.805 18093 5622 1 8 . 1 1 112 112 ILE H H 112 7.764 7.764 7.700 0.064 18093 5623 1 8 . 1 1 113 113 PHE N N 113 118.367 118.367 122.402 -4.035 18093 5624 1 8 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.215 0.040 18093 5625 1 8 . 1 1 113 113 PHE C C 113 177.218 177.218 177.041 0.177 18093 5626 1 8 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.490 -1.057 18093 5627 1 8 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.130 -0.324 18093 5628 1 8 . 1 1 113 113 PHE H H 113 7.963 7.963 8.074 -0.111 18093 5629 1 8 . 1 1 114 114 LEU N N 114 118.921 118.921 117.924 0.997 18093 5630 1 8 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.961 0.036 18093 5631 1 8 . 1 1 114 114 LEU C C 114 178.297 178.297 178.382 -0.085 18093 5632 1 8 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.331 0.280 18093 5633 1 8 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.269 0.683 18093 5634 1 8 . 1 1 114 114 LEU H H 114 7.939 7.939 8.121 -0.182 18093 5635 1 8 . 1 1 115 115 TRP N N 115 117.464 117.464 119.471 -2.007 18093 5636 1 8 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.385 -0.011 18093 5637 1 8 . 1 1 115 115 TRP C C 115 178.572 178.572 178.256 0.316 18093 5638 1 8 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.787 1.135 18093 5639 1 8 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.774 -1.267 18093 5640 1 8 . 1 1 115 115 TRP H H 115 7.969 7.969 7.619 0.350 18093 5641 1 8 . 1 1 116 116 MET N N 116 117.069 117.069 118.918 -1.849 18093 5642 1 8 . 1 1 116 116 MET HA H 116 4.065 4.065 4.226 -0.161 18093 5643 1 8 . 1 1 116 116 MET C C 116 177.425 177.425 178.197 -0.772 18093 5644 1 8 . 1 1 116 116 MET CA C 116 59.289 59.289 59.098 0.191 18093 5645 1 8 . 1 1 116 116 MET CB C 116 31.692 31.692 32.515 -0.823 18093 5646 1 8 . 1 1 116 116 MET H H 116 8.465 8.465 7.718 0.747 18093 5647 1 8 . 1 1 117 117 PHE N N 117 118.755 118.755 117.667 1.088 18093 5648 1 8 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.100 -0.001 18093 5649 1 8 . 1 1 117 117 PHE C C 117 177.965 177.965 178.278 -0.313 18093 5650 1 8 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.216 -0.508 18093 5651 1 8 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.263 0.922 18093 5652 1 8 . 1 1 117 117 PHE H H 117 8.418 8.418 7.853 0.565 18093 5653 1 8 . 1 1 118 118 ILE N N 118 119.133 119.133 115.153 3.980 18093 5654 1 8 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.909 -0.565 18093 5655 1 8 . 1 1 118 118 ILE C C 118 177.244 177.244 177.470 -0.226 18093 5656 1 8 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.095 1.730 18093 5657 1 8 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.800 -0.252 18093 5658 1 8 . 1 1 118 118 ILE H H 118 8.266 8.266 7.681 0.585 18093 5659 1 8 . 1 1 119 119 ILE N N 119 118.846 118.846 121.619 -2.773 18093 5660 1 8 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.956 -0.384 18093 5661 1 8 . 1 1 119 119 ILE C C 119 177.523 177.523 177.481 0.042 18093 5662 1 8 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.243 0.646 18093 5663 1 8 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.255 -0.691 18093 5664 1 8 . 1 1 119 119 ILE H H 119 8.308 8.308 7.313 0.995 18093 5665 1 8 . 1 1 120 120 VAL N N 120 119.228 119.228 118.124 1.104 18093 5666 1 8 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.905 -0.397 18093 5667 1 8 . 1 1 120 120 VAL C C 120 177.651 177.651 177.399 0.252 18093 5668 1 8 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.449 2.152 18093 5669 1 8 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.735 0.671 18093 5670 1 8 . 1 1 120 120 VAL H H 120 8.399 8.399 8.018 0.381 18093 5671 1 8 . 1 1 121 121 CYS N N 121 117.151 117.151 119.308 -2.157 18093 5672 1 8 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.107 -0.204 18093 5673 1 8 . 1 1 121 121 CYS C C 121 177.719 177.719 176.552 1.167 18093 5674 1 8 . 1 1 121 121 CYS CA C 121 64.298 64.298 63.481 0.816 18093 5675 1 8 . 1 1 121 121 CYS CB C 121 26.677 26.677 26.537 0.140 18093 5676 1 8 . 1 1 121 121 CYS H H 121 8.008 8.008 7.506 0.502 18093 5677 1 8 . 1 1 122 122 LEU N N 122 121.402 121.402 119.736 1.666 18093 5678 1 8 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.177 -0.194 18093 5679 1 8 . 1 1 122 122 LEU C C 122 178.282 178.282 179.191 -0.909 18093 5680 1 8 . 1 1 122 122 LEU CA C 122 58.545 58.545 58.085 0.460 18093 5681 1 8 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.275 0.691 18093 5682 1 8 . 1 1 122 122 LEU H H 122 8.417 8.417 7.730 0.687 18093 5683 1 8 . 1 1 123 123 LEU N N 123 118.543 118.543 120.003 -1.460 18093 5684 1 8 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.041 -0.121 18093 5685 1 8 . 1 1 123 123 LEU C C 123 179.028 179.028 178.763 0.265 18093 5686 1 8 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.463 -0.346 18093 5687 1 8 . 1 1 123 123 LEU CB C 123 42.056 42.056 41.007 1.049 18093 5688 1 8 . 1 1 123 123 LEU H H 123 8.590 8.590 7.716 0.874 18093 5689 1 8 . 1 1 124 124 GLY N N 124 104.896 104.896 105.746 -0.850 18093 5690 1 8 . 1 1 124 124 GLY C C 124 173.932 173.932 176.081 -2.149 18093 5691 1 8 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.644 -0.416 18093 5692 1 8 . 1 1 124 124 GLY H H 124 8.601 8.601 8.442 0.159 18093 5693 1 8 . 1 1 125 125 THR N N 125 115.403 115.403 119.068 -3.665 18093 5694 1 8 . 1 1 125 125 THR HA H 125 3.686 3.686 3.850 -0.164 18093 5695 1 8 . 1 1 125 125 THR C C 125 176.407 176.407 176.584 -0.177 18093 5696 1 8 . 1 1 125 125 THR CA C 125 67.565 67.565 66.778 0.787 18093 5697 1 8 . 1 1 125 125 THR CB C 125 68.143 68.143 68.320 -0.177 18093 5698 1 8 . 1 1 125 125 THR H H 125 7.734 7.734 7.569 0.165 18093 5699 1 8 . 1 1 126 126 VAL N N 126 119.056 119.056 120.699 -1.643 18093 5700 1 8 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.722 -0.183 18093 5701 1 8 . 1 1 126 126 VAL C C 126 177.628 177.628 178.385 -0.757 18093 5702 1 8 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.971 -0.370 18093 5703 1 8 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.305 0.189 18093 5704 1 8 . 1 1 126 126 VAL H H 126 8.015 8.015 7.980 0.035 18093 5705 1 8 . 1 1 127 127 GLY N N 127 104.644 104.644 107.571 -2.927 18093 5706 1 8 . 1 1 127 127 GLY C C 127 173.933 173.933 177.054 -3.121 18093 5707 1 8 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.091 0.190 18093 5708 1 8 . 1 1 127 127 GLY H H 127 8.248 8.248 8.584 -0.336 18093 5709 1 8 . 1 1 128 128 LEU N N 128 117.354 117.354 121.809 -4.455 18093 5710 1 8 . 1 1 128 128 LEU HA H 128 4.012 4.012 3.966 0.046 18093 5711 1 8 . 1 1 128 128 LEU C C 128 177.443 177.443 177.719 -0.276 18093 5712 1 8 . 1 1 128 128 LEU CA C 128 56.626 56.626 57.225 -0.599 18093 5713 1 8 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.685 0.575 18093 5714 1 8 . 1 1 128 128 LEU H H 128 7.568 7.568 8.085 -0.517 18093 5715 1 8 . 1 1 129 129 PHE N N 129 113.971 113.971 116.081 -2.110 18093 5716 1 8 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.393 0.065 18093 5717 1 8 . 1 1 129 129 PHE C C 129 176.216 176.216 176.122 0.094 18093 5718 1 8 . 1 1 129 129 PHE CA C 129 58.385 58.385 59.831 -1.446 18093 5719 1 8 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.588 0.131 18093 5720 1 8 . 1 1 129 129 PHE H H 129 7.639 7.639 7.589 0.050 18093 5721 1 8 . 1 1 130 130 LEU N N 130 117.752 117.752 120.514 -2.762 18093 5722 1 8 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.940 -0.507 18093 5723 1 8 . 1 1 130 130 LEU CA C 130 54.156 54.156 50.975 3.181 18093 5724 1 8 . 1 1 130 130 LEU H H 130 8.099 8.099 7.533 0.566 18093 5725 1 8 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.905 -0.455 18093 5726 1 8 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.514 2.385 18093 5727 1 8 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.430 -0.168 18093 5728 1 8 . 1 1 132 132 PRO C C 132 177.616 177.616 178.139 -0.523 18093 5729 1 8 . 1 1 132 132 PRO CA C 132 64.980 64.980 65.022 -0.042 18093 5730 1 8 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.278 -0.653 18093 5731 1 8 . 1 1 133 133 TRP N N 133 115.508 115.508 119.620 -4.112 18093 5732 1 8 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.477 0.115 18093 5733 1 8 . 1 1 133 133 TRP C C 133 176.842 176.842 176.394 0.448 18093 5734 1 8 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.450 -2.167 18093 5735 1 8 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.852 -1.256 18093 5736 1 8 . 1 1 133 133 TRP H H 133 7.311 7.311 8.107 -0.796 18093 5737 1 8 . 1 1 134 134 LEU N N 134 119.570 119.570 114.877 4.693 18093 5738 1 8 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.328 -0.151 18093 5739 1 8 . 1 1 134 134 LEU C C 134 175.768 175.768 176.392 -0.624 18093 5740 1 8 . 1 1 134 134 LEU CA C 134 55.621 55.621 53.843 1.778 18093 5741 1 8 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.438 1.210 18093 5742 1 8 . 1 1 134 134 LEU H H 134 7.453 7.453 7.389 0.064 18093 5743 1 8 . 1 1 135 135 ALA N N 135 119.004 119.004 122.022 -3.018 18093 5744 1 8 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.386 -0.163 18093 5745 1 8 . 1 1 135 135 ALA C C 135 177.170 177.170 177.991 -0.821 18093 5746 1 8 . 1 1 135 135 ALA CA C 135 52.456 52.456 53.205 -0.748 18093 5747 1 8 . 1 1 135 135 ALA CB C 135 19.736 19.736 20.440 -0.704 18093 5748 1 8 . 1 1 135 135 ALA H H 135 7.541 7.541 7.426 0.115 18093 5749 1 8 . 1 1 136 136 GLY N N 136 105.879 105.879 108.084 -2.205 18093 5750 1 8 . 1 1 136 136 GLY C C 136 173.042 173.042 173.831 -0.789 18093 5751 1 8 . 1 1 136 136 GLY CA C 136 45.693 45.693 44.825 0.868 18093 5752 1 8 . 1 1 136 136 GLY H H 136 7.846 7.846 8.076 -0.230 18093 5753 1 9 . 1 1 5 5 GLU N N 5 119.627 119.627 120.265 -0.638 18093 5754 1 9 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.403 -0.195 18093 5755 1 9 . 1 1 5 5 GLU C C 5 176.581 176.581 175.065 1.516 18093 5756 1 9 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.317 0.728 18093 5757 1 9 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.987 0.051 18093 5758 1 9 . 1 1 5 5 GLU H H 5 8.003 8.003 8.249 -0.246 18093 5759 1 9 . 1 1 6 6 LEU N N 6 121.267 121.267 122.033 -0.766 18093 5760 1 9 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.586 -0.161 18093 5761 1 9 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.336 2.299 18093 5762 1 9 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.710 -0.414 18093 5763 1 9 . 1 1 6 6 LEU H H 6 8.104 8.104 7.868 0.236 18093 5764 1 9 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.546 -0.147 18093 5765 1 9 . 1 1 7 7 PRO C C 7 178.408 178.408 177.928 0.480 18093 5766 1 9 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.149 2.563 18093 5767 1 9 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.749 -0.832 18093 5768 1 9 . 1 1 8 8 LEU N N 8 121.835 121.835 120.374 1.461 18093 5769 1 9 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.186 -0.097 18093 5770 1 9 . 1 1 8 8 LEU C C 8 177.902 177.902 178.325 -0.423 18093 5771 1 9 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.556 0.549 18093 5772 1 9 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.077 0.530 18093 5773 1 9 . 1 1 8 8 LEU H H 8 8.162 8.162 8.500 -0.338 18093 5774 1 9 . 1 1 9 9 PHE N N 9 118.342 118.342 118.320 0.022 18093 5775 1 9 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.168 0.021 18093 5776 1 9 . 1 1 9 9 PHE C C 9 177.596 177.596 176.767 0.829 18093 5777 1 9 . 1 1 9 9 PHE CA C 9 61.114 61.114 60.899 0.215 18093 5778 1 9 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.245 0.482 18093 5779 1 9 . 1 1 9 9 PHE H H 9 8.318 8.318 8.371 -0.053 18093 5780 1 9 . 1 1 10 10 TYR N N 10 117.584 117.584 118.661 -1.077 18093 5781 1 9 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.807 0.347 18093 5782 1 9 . 1 1 10 10 TYR C C 10 177.630 177.630 177.325 0.305 18093 5783 1 9 . 1 1 10 10 TYR CA C 10 61.036 61.036 60.233 0.803 18093 5784 1 9 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.213 0.447 18093 5785 1 9 . 1 1 10 10 TYR H H 10 8.105 8.105 7.849 0.256 18093 5786 1 9 . 1 1 11 11 THR N N 11 115.563 115.563 116.605 -1.042 18093 5787 1 9 . 1 1 11 11 THR HA H 11 3.871 3.871 3.927 -0.056 18093 5788 1 9 . 1 1 11 11 THR C C 11 175.955 175.955 176.542 -0.587 18093 5789 1 9 . 1 1 11 11 THR CA C 11 67.290 67.290 66.624 0.666 18093 5790 1 9 . 1 1 11 11 THR CB C 11 68.201 68.201 68.718 -0.517 18093 5791 1 9 . 1 1 11 11 THR H H 11 7.915 7.915 7.735 0.180 18093 5792 1 9 . 1 1 12 12 ILE N N 12 119.727 119.727 120.027 -0.300 18093 5793 1 9 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.859 -0.160 18093 5794 1 9 . 1 1 12 12 ILE C C 12 175.773 175.773 177.387 -1.614 18093 5795 1 9 . 1 1 12 12 ILE CA C 12 64.699 64.699 62.705 1.994 18093 5796 1 9 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.908 1.188 18093 5797 1 9 . 1 1 12 12 ILE H H 12 8.186 8.186 7.853 0.333 18093 5798 1 9 . 1 1 13 13 ASN N N 13 114.190 114.190 118.566 -4.376 18093 5799 1 9 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.545 -0.123 18093 5800 1 9 . 1 1 13 13 ASN C C 13 174.786 174.786 176.485 -1.699 18093 5801 1 9 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.542 0.013 18093 5802 1 9 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.334 1.024 18093 5803 1 9 . 1 1 13 13 ASN H H 13 7.601 7.601 7.379 0.222 18093 5804 1 9 . 1 1 14 14 LEU N N 14 115.031 115.031 119.296 -4.265 18093 5805 1 9 . 1 1 14 14 LEU HA H 14 4.196 4.196 3.973 0.223 18093 5806 1 9 . 1 1 14 14 LEU C C 14 177.540 177.540 177.737 -0.197 18093 5807 1 9 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.983 -0.576 18093 5808 1 9 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.382 -0.540 18093 5809 1 9 . 1 1 14 14 LEU H H 14 7.390 7.390 7.348 0.042 18093 5810 1 9 . 1 1 15 15 ILE N N 15 118.223 118.223 119.986 -1.763 18093 5811 1 9 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.645 -0.032 18093 5812 1 9 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.423 3.297 18093 5813 1 9 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.081 -0.469 18093 5814 1 9 . 1 1 15 15 ILE H H 15 8.123 8.123 7.375 0.748 18093 5815 1 9 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.327 -0.258 18093 5816 1 9 . 1 1 17 17 PRO C C 17 177.721 177.721 178.943 -1.222 18093 5817 1 9 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.460 1.301 18093 5818 1 9 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.740 0.002 18093 5819 1 9 . 1 1 18 18 CYS N N 18 113.538 113.538 117.409 -3.871 18093 5820 1 9 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.114 -0.106 18093 5821 1 9 . 1 1 18 18 CYS C C 18 177.683 177.683 177.399 0.284 18093 5822 1 9 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.325 1.175 18093 5823 1 9 . 1 1 18 18 CYS CB C 18 26.873 26.873 26.725 0.148 18093 5824 1 9 . 1 1 18 18 CYS H H 18 7.410 7.410 7.427 -0.017 18093 5825 1 9 . 1 1 19 19 LEU N N 19 122.545 122.545 119.697 2.848 18093 5826 1 9 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.106 -0.107 18093 5827 1 9 . 1 1 19 19 LEU C C 19 178.608 178.608 178.766 -0.158 18093 5828 1 9 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.495 0.926 18093 5829 1 9 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.361 0.483 18093 5830 1 9 . 1 1 19 19 LEU H H 19 8.635 8.635 7.391 1.244 18093 5831 1 9 . 1 1 20 20 LEU N N 20 119.404 119.404 120.353 -0.949 18093 5832 1 9 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.914 0.092 18093 5833 1 9 . 1 1 20 20 LEU C C 20 178.540 178.540 179.408 -0.868 18093 5834 1 9 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.767 0.032 18093 5835 1 9 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.836 0.163 18093 5836 1 9 . 1 1 20 20 LEU H H 20 8.392 8.392 7.517 0.875 18093 5837 1 9 . 1 1 21 21 ILE N N 21 117.335 117.335 114.049 3.286 18093 5838 1 9 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.871 -0.220 18093 5839 1 9 . 1 1 21 21 ILE C C 21 177.249 177.249 177.479 -0.230 18093 5840 1 9 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.592 0.669 18093 5841 1 9 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.327 0.633 18093 5842 1 9 . 1 1 21 21 ILE H H 21 8.403 8.403 8.406 -0.003 18093 5843 1 9 . 1 1 22 22 SER N N 22 116.385 116.385 118.249 -1.864 18093 5844 1 9 . 1 1 22 22 SER HA H 22 4.056 4.056 4.225 -0.169 18093 5845 1 9 . 1 1 22 22 SER C C 22 176.813 176.813 176.509 0.304 18093 5846 1 9 . 1 1 22 22 SER CA C 22 63.866 63.866 62.050 1.816 18093 5847 1 9 . 1 1 22 22 SER CB C 22 62.898 62.898 63.120 -0.222 18093 5848 1 9 . 1 1 22 22 SER H H 22 8.271 8.271 7.677 0.594 18093 5849 1 9 . 1 1 23 23 CYS N N 23 119.001 119.001 121.316 -2.315 18093 5850 1 9 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.202 -0.212 18093 5851 1 9 . 1 1 23 23 CYS C C 23 177.594 177.594 176.390 1.204 18093 5852 1 9 . 1 1 23 23 CYS CA C 23 64.429 64.429 62.158 2.271 18093 5853 1 9 . 1 1 23 23 CYS CB C 23 26.940 26.940 27.171 -0.231 18093 5854 1 9 . 1 1 23 23 CYS H H 23 8.161 8.161 8.622 -0.461 18093 5855 1 9 . 1 1 24 24 LEU N N 24 117.814 117.814 121.576 -3.762 18093 5856 1 9 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.859 0.118 18093 5857 1 9 . 1 1 24 24 LEU C C 24 177.944 177.944 178.128 -0.184 18093 5858 1 9 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.453 -0.166 18093 5859 1 9 . 1 1 24 24 LEU CB C 24 41.903 41.903 42.066 -0.164 18093 5860 1 9 . 1 1 24 24 LEU H H 24 8.106 8.106 7.693 0.413 18093 5861 1 9 . 1 1 25 25 THR N N 25 115.670 115.670 115.085 0.585 18093 5862 1 9 . 1 1 25 25 THR HA H 25 3.687 3.687 3.997 -0.310 18093 5863 1 9 . 1 1 25 25 THR C C 25 175.845 175.845 176.768 -0.923 18093 5864 1 9 . 1 1 25 25 THR CA C 25 68.306 68.306 67.398 0.908 18093 5865 1 9 . 1 1 25 25 THR H H 25 7.924 7.924 7.586 0.338 18093 5866 1 9 . 1 1 26 26 VAL N N 26 118.809 118.809 121.866 -3.057 18093 5867 1 9 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.533 -0.018 18093 5868 1 9 . 1 1 26 26 VAL C C 26 177.530 177.530 177.688 -0.158 18093 5869 1 9 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.896 0.385 18093 5870 1 9 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.532 0.192 18093 5871 1 9 . 1 1 26 26 VAL H H 26 7.764 7.764 7.306 0.458 18093 5872 1 9 . 1 1 27 27 LEU N N 27 117.958 117.958 120.172 -2.214 18093 5873 1 9 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.042 -0.006 18093 5874 1 9 . 1 1 27 27 LEU C C 27 178.163 178.163 179.176 -1.013 18093 5875 1 9 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.086 0.423 18093 5876 1 9 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.832 1.087 18093 5877 1 9 . 1 1 27 27 LEU H H 27 7.912 7.912 8.295 -0.383 18093 5878 1 9 . 1 1 28 28 VAL N N 28 114.472 114.472 117.133 -2.661 18093 5879 1 9 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.605 -0.070 18093 5880 1 9 . 1 1 28 28 VAL C C 28 176.871 176.871 178.123 -1.252 18093 5881 1 9 . 1 1 28 28 VAL CA C 28 65.977 65.977 66.620 -0.643 18093 5882 1 9 . 1 1 28 28 VAL CB C 28 31.934 31.934 30.891 1.043 18093 5883 1 9 . 1 1 28 28 VAL H H 28 7.892 7.892 7.692 0.200 18093 5884 1 9 . 1 1 29 29 PHE N N 29 115.206 115.206 117.142 -1.936 18093 5885 1 9 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.233 -0.030 18093 5886 1 9 . 1 1 29 29 PHE C C 29 176.614 176.614 177.512 -0.898 18093 5887 1 9 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.223 0.741 18093 5888 1 9 . 1 1 29 29 PHE CB C 29 39.752 39.752 38.936 0.816 18093 5889 1 9 . 1 1 29 29 PHE H H 29 7.748 7.748 7.540 0.208 18093 5890 1 9 . 1 1 30 30 TYR N N 30 115.975 115.975 119.677 -3.702 18093 5891 1 9 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.194 0.128 18093 5892 1 9 . 1 1 30 30 TYR C C 30 175.553 175.553 175.855 -0.302 18093 5893 1 9 . 1 1 30 30 TYR CA C 30 59.598 59.598 60.051 -0.453 18093 5894 1 9 . 1 1 30 30 TYR CB C 30 39.763 39.763 39.653 0.110 18093 5895 1 9 . 1 1 30 30 TYR H H 30 7.985 7.985 7.746 0.239 18093 5896 1 9 . 1 1 31 31 LEU N N 31 120.780 120.780 119.334 1.446 18093 5897 1 9 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.628 -0.201 18093 5898 1 9 . 1 1 31 31 LEU CA C 31 54.665 54.665 52.188 2.477 18093 5899 1 9 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.633 -1.245 18093 5900 1 9 . 1 1 31 31 LEU H H 31 7.643 7.643 7.593 0.050 18093 5901 1 9 . 1 1 34 34 GLU C C 34 176.271 176.271 175.928 0.343 18093 5902 1 9 . 1 1 34 34 GLU CA C 34 57.590 57.590 56.572 1.018 18093 5903 1 9 . 1 1 35 35 CYS N N 35 116.430 116.430 119.092 -2.662 18093 5904 1 9 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.594 -0.227 18093 5905 1 9 . 1 1 35 35 CYS C C 35 175.198 175.198 175.138 0.060 18093 5906 1 9 . 1 1 35 35 CYS CA C 35 60.293 60.293 59.174 1.119 18093 5907 1 9 . 1 1 35 35 CYS CB C 35 28.130 28.130 27.862 0.268 18093 5908 1 9 . 1 1 35 35 CYS H H 35 7.970 7.970 8.241 -0.271 18093 5909 1 9 . 1 1 36 36 GLY N N 36 108.315 108.315 109.894 -1.579 18093 5910 1 9 . 1 1 36 36 GLY C C 36 174.610 174.610 175.184 -0.574 18093 5911 1 9 . 1 1 36 36 GLY CA C 36 46.004 46.004 45.215 0.790 18093 5912 1 9 . 1 1 36 36 GLY H H 36 8.120 8.120 8.174 -0.054 18093 5913 1 9 . 1 1 37 37 GLU N N 37 121.347 121.347 118.469 2.878 18093 5914 1 9 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.000 0.047 18093 5915 1 9 . 1 1 37 37 GLU C C 37 177.338 177.338 178.065 -0.727 18093 5916 1 9 . 1 1 37 37 GLU CA C 37 58.507 58.507 58.679 -0.173 18093 5917 1 9 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.487 0.083 18093 5918 1 9 . 1 1 37 37 GLU H H 37 8.423 8.423 8.613 -0.190 18093 5919 1 9 . 1 1 38 38 LYS N N 38 123.788 123.788 120.592 3.196 18093 5920 1 9 . 1 1 38 38 LYS HA H 38 4.196 4.196 3.983 0.213 18093 5921 1 9 . 1 1 38 38 LYS C C 38 177.976 177.976 178.572 -0.596 18093 5922 1 9 . 1 1 38 38 LYS CA C 38 58.273 58.273 58.727 -0.454 18093 5923 1 9 . 1 1 38 38 LYS CB C 38 31.649 31.649 31.623 0.025 18093 5924 1 9 . 1 1 38 38 LYS H H 38 8.211 8.211 8.123 0.088 18093 5925 1 9 . 1 1 39 39 ILE N N 39 115.675 115.675 118.295 -2.620 18093 5926 1 9 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.729 -0.121 18093 5927 1 9 . 1 1 39 39 ILE C C 39 177.204 177.204 178.211 -1.007 18093 5928 1 9 . 1 1 39 39 ILE CA C 39 65.501 65.501 64.812 0.689 18093 5929 1 9 . 1 1 39 39 ILE H H 39 7.933 7.933 7.763 0.170 18093 5930 1 9 . 1 1 40 40 THR N N 40 117.411 117.411 116.889 0.522 18093 5931 1 9 . 1 1 40 40 THR HA H 40 3.844 3.844 3.983 -0.139 18093 5932 1 9 . 1 1 40 40 THR C C 40 175.983 175.983 176.611 -0.628 18093 5933 1 9 . 1 1 40 40 THR CA C 40 67.360 67.360 66.897 0.463 18093 5934 1 9 . 1 1 40 40 THR H H 40 8.362 8.362 7.425 0.937 18093 5935 1 9 . 1 1 41 41 LEU N N 41 123.059 123.059 122.263 0.796 18093 5936 1 9 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.149 -0.133 18093 5937 1 9 . 1 1 41 41 LEU C C 41 178.914 178.914 178.646 0.268 18093 5938 1 9 . 1 1 41 41 LEU CA C 41 58.366 58.366 57.597 0.769 18093 5939 1 9 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.354 0.696 18093 5940 1 9 . 1 1 41 41 LEU H H 41 8.282 8.282 8.048 0.234 18093 5941 1 9 . 1 1 42 42 CYS N N 42 118.762 118.762 119.000 -0.238 18093 5942 1 9 . 1 1 42 42 CYS HA H 42 3.936 3.936 3.948 -0.012 18093 5943 1 9 . 1 1 42 42 CYS C C 42 176.607 176.607 176.737 -0.130 18093 5944 1 9 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.836 0.481 18093 5945 1 9 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.405 -0.486 18093 5946 1 9 . 1 1 42 42 CYS H H 42 8.195 8.195 8.480 -0.285 18093 5947 1 9 . 1 1 43 43 ILE N N 43 117.589 117.589 119.725 -2.136 18093 5948 1 9 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.674 -0.067 18093 5949 1 9 . 1 1 43 43 ILE C C 43 177.323 177.323 177.637 -0.314 18093 5950 1 9 . 1 1 43 43 ILE CA C 43 65.249 65.249 65.000 0.249 18093 5951 1 9 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.779 0.259 18093 5952 1 9 . 1 1 43 43 ILE H H 43 8.428 8.428 7.484 0.944 18093 5953 1 9 . 1 1 44 44 SER N N 44 115.950 115.950 116.155 -0.205 18093 5954 1 9 . 1 1 44 44 SER HA H 44 4.012 4.012 4.132 -0.120 18093 5955 1 9 . 1 1 44 44 SER C C 44 176.965 176.965 176.690 0.275 18093 5956 1 9 . 1 1 44 44 SER CA C 44 63.575 63.575 62.233 1.341 18093 5957 1 9 . 1 1 44 44 SER H H 44 7.984 7.984 7.731 0.253 18093 5958 1 9 . 1 1 45 45 VAL N N 45 123.544 123.544 120.757 2.787 18093 5959 1 9 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.709 -0.161 18093 5960 1 9 . 1 1 45 45 VAL C C 45 177.139 177.139 177.977 -0.838 18093 5961 1 9 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.600 0.633 18093 5962 1 9 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.352 0.290 18093 5963 1 9 . 1 1 45 45 VAL H H 45 8.280 8.280 8.133 0.147 18093 5964 1 9 . 1 1 46 46 LEU N N 46 119.883 119.883 120.160 -0.277 18093 5965 1 9 . 1 1 46 46 LEU HA H 46 3.943 3.943 3.982 -0.039 18093 5966 1 9 . 1 1 46 46 LEU C C 46 180.125 180.125 179.442 0.683 18093 5967 1 9 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.842 0.758 18093 5968 1 9 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.550 0.462 18093 5969 1 9 . 1 1 46 46 LEU H H 46 8.117 8.117 7.343 0.774 18093 5970 1 9 . 1 1 47 47 LEU N N 47 120.193 120.193 120.332 -0.139 18093 5971 1 9 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.844 0.160 18093 5972 1 9 . 1 1 47 47 LEU C C 47 178.370 178.370 178.938 -0.568 18093 5973 1 9 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.888 -0.462 18093 5974 1 9 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.877 0.178 18093 5975 1 9 . 1 1 47 47 LEU H H 47 8.933 8.933 8.036 0.897 18093 5976 1 9 . 1 1 48 48 SER N N 48 115.861 115.861 114.185 1.676 18093 5977 1 9 . 1 1 48 48 SER HA H 48 4.013 4.013 4.211 -0.198 18093 5978 1 9 . 1 1 48 48 SER C C 48 175.642 175.642 176.722 -1.080 18093 5979 1 9 . 1 1 48 48 SER CA C 48 63.571 63.571 61.867 1.704 18093 5980 1 9 . 1 1 48 48 SER CB C 48 62.879 62.879 63.162 -0.283 18093 5981 1 9 . 1 1 48 48 SER H H 48 7.996 7.996 7.602 0.394 18093 5982 1 9 . 1 1 49 49 LEU N N 49 120.673 120.673 122.317 -1.644 18093 5983 1 9 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.086 -0.051 18093 5984 1 9 . 1 1 49 49 LEU C C 49 178.229 178.229 178.409 -0.180 18093 5985 1 9 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.288 -0.005 18093 5986 1 9 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.110 -0.164 18093 5987 1 9 . 1 1 49 49 LEU H H 49 8.352 8.352 8.527 -0.175 18093 5988 1 9 . 1 1 50 50 THR N N 50 115.582 115.582 114.464 1.118 18093 5989 1 9 . 1 1 50 50 THR HA H 50 3.672 3.672 4.099 -0.427 18093 5990 1 9 . 1 1 50 50 THR C C 50 175.877 175.877 176.825 -0.948 18093 5991 1 9 . 1 1 50 50 THR CA C 50 68.628 68.628 66.499 2.129 18093 5992 1 9 . 1 1 50 50 THR H H 50 7.937 7.937 8.269 -0.332 18093 5993 1 9 . 1 1 51 51 VAL N N 51 119.774 119.774 122.715 -2.941 18093 5994 1 9 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.732 -0.234 18093 5995 1 9 . 1 1 51 51 VAL C C 51 177.162 177.162 177.478 -0.316 18093 5996 1 9 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.728 0.857 18093 5997 1 9 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.916 -0.395 18093 5998 1 9 . 1 1 51 51 VAL H H 51 8.115 8.115 7.648 0.467 18093 5999 1 9 . 1 1 52 52 PHE N N 52 118.808 118.808 119.787 -0.979 18093 6000 1 9 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.275 -0.153 18093 6001 1 9 . 1 1 52 52 PHE C C 52 176.697 176.697 177.240 -0.543 18093 6002 1 9 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.869 0.902 18093 6003 1 9 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.498 -0.236 18093 6004 1 9 . 1 1 52 52 PHE H H 52 8.256 8.256 8.478 -0.222 18093 6005 1 9 . 1 1 53 53 LEU N N 53 117.267 117.267 121.082 -3.815 18093 6006 1 9 . 1 1 53 53 LEU HA H 53 3.893 3.893 4.154 -0.261 18093 6007 1 9 . 1 1 53 53 LEU C C 53 179.319 179.319 178.127 1.192 18093 6008 1 9 . 1 1 53 53 LEU CA C 53 57.985 57.985 58.253 -0.268 18093 6009 1 9 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.577 0.250 18093 6010 1 9 . 1 1 53 53 LEU H H 53 8.443 8.443 8.062 0.381 18093 6011 1 9 . 1 1 54 54 LEU N N 54 119.762 119.762 119.314 0.448 18093 6012 1 9 . 1 1 54 54 LEU HA H 54 4.054 4.054 4.085 -0.031 18093 6013 1 9 . 1 1 54 54 LEU C C 54 178.827 178.827 178.900 -0.073 18093 6014 1 9 . 1 1 54 54 LEU CA C 54 58.105 58.105 58.028 0.077 18093 6015 1 9 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.959 -0.012 18093 6016 1 9 . 1 1 54 54 LEU H H 54 8.205 8.205 7.468 0.737 18093 6017 1 9 . 1 1 55 55 LEU N N 55 118.585 118.585 118.972 -0.387 18093 6018 1 9 . 1 1 55 55 LEU HA H 55 4.077 4.077 4.083 -0.006 18093 6019 1 9 . 1 1 55 55 LEU C C 55 178.909 178.909 178.781 0.128 18093 6020 1 9 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.811 0.297 18093 6021 1 9 . 1 1 55 55 LEU CB C 55 41.979 41.979 41.730 0.249 18093 6022 1 9 . 1 1 55 55 LEU H H 55 8.179 8.179 7.465 0.714 18093 6023 1 9 . 1 1 56 56 ILE N N 56 116.079 116.079 115.548 0.531 18093 6024 1 9 . 1 1 56 56 ILE HA H 56 3.729 3.729 4.109 -0.380 18093 6025 1 9 . 1 1 56 56 ILE C C 56 176.988 176.988 177.719 -0.731 18093 6026 1 9 . 1 1 56 56 ILE CA C 56 64.257 64.257 62.725 1.532 18093 6027 1 9 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.917 0.500 18093 6028 1 9 . 1 1 56 56 ILE H H 56 8.040 8.040 7.421 0.619 18093 6029 1 9 . 1 1 57 57 THR N N 57 110.105 110.105 111.295 -1.190 18093 6030 1 9 . 1 1 57 57 THR HA H 57 4.015 4.015 4.301 -0.286 18093 6031 1 9 . 1 1 57 57 THR C C 57 175.435 175.435 175.985 -0.550 18093 6032 1 9 . 1 1 57 57 THR CA C 57 65.067 65.067 64.915 0.152 18093 6033 1 9 . 1 1 57 57 THR CB C 57 69.179 69.179 69.025 0.154 18093 6034 1 9 . 1 1 57 57 THR H H 57 7.655 7.655 7.987 -0.332 18093 6035 1 9 . 1 1 58 58 GLU N N 58 117.313 117.313 121.196 -3.883 18093 6036 1 9 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.270 0.063 18093 6037 1 9 . 1 1 58 58 GLU C C 58 176.940 176.940 178.172 -1.232 18093 6038 1 9 . 1 1 58 58 GLU CA C 58 57.068 57.068 57.668 -0.600 18093 6039 1 9 . 1 1 58 58 GLU CB C 58 29.396 29.396 29.687 -0.291 18093 6040 1 9 . 1 1 58 58 GLU H H 58 7.521 7.521 8.294 -0.773 18093 6041 1 9 . 1 1 59 59 ILE N N 59 114.870 114.870 114.328 0.542 18093 6042 1 9 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.097 -0.008 18093 6043 1 9 . 1 1 59 59 ILE C C 59 175.456 175.456 176.086 -0.630 18093 6044 1 9 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.081 0.353 18093 6045 1 9 . 1 1 59 59 ILE CB C 59 38.657 38.657 39.090 -0.433 18093 6046 1 9 . 1 1 59 59 ILE H H 59 7.579 7.579 7.379 0.200 18093 6047 1 9 . 1 1 60 60 ILE N N 60 119.354 119.354 118.623 0.731 18093 6048 1 9 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.868 0.436 18093 6049 1 9 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.476 -1.859 18093 6050 1 9 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.729 2.133 18093 6051 1 9 . 1 1 60 60 ILE H H 60 7.629 7.629 7.583 0.046 18093 6052 1 9 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.386 0.014 18093 6053 1 9 . 1 1 61 61 PRO C C 61 177.144 177.144 176.548 0.596 18093 6054 1 9 . 1 1 61 61 PRO CA C 61 63.808 63.808 63.864 -0.056 18093 6055 1 9 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.505 -0.623 18093 6056 1 9 . 1 1 62 62 SER N N 62 114.474 114.474 112.913 1.561 18093 6057 1 9 . 1 1 62 62 SER HA H 62 4.434 4.434 4.524 -0.090 18093 6058 1 9 . 1 1 62 62 SER C C 62 175.161 175.161 173.125 2.036 18093 6059 1 9 . 1 1 62 62 SER CA C 62 59.047 59.047 58.678 0.369 18093 6060 1 9 . 1 1 62 62 SER CB C 62 63.704 63.704 63.724 -0.020 18093 6061 1 9 . 1 1 62 62 SER H H 62 8.186 8.186 7.771 0.415 18093 6062 1 9 . 1 1 63 63 THR N N 63 113.573 113.573 117.108 -3.535 18093 6063 1 9 . 1 1 63 63 THR HA H 63 4.319 4.319 4.534 -0.215 18093 6064 1 9 . 1 1 63 63 THR C C 63 174.834 174.834 174.079 0.755 18093 6065 1 9 . 1 1 63 63 THR CA C 63 62.377 62.377 61.898 0.479 18093 6066 1 9 . 1 1 63 63 THR CB C 63 69.422 69.422 68.811 0.611 18093 6067 1 9 . 1 1 63 63 THR H H 63 7.963 7.963 8.428 -0.465 18093 6068 1 9 . 1 1 64 64 SER N N 64 116.598 116.598 116.256 0.342 18093 6069 1 9 . 1 1 64 64 SER HA H 64 4.428 4.428 4.778 -0.350 18093 6070 1 9 . 1 1 64 64 SER C C 64 174.618 174.618 174.668 -0.050 18093 6071 1 9 . 1 1 64 64 SER CA C 64 59.045 59.045 57.190 1.855 18093 6072 1 9 . 1 1 64 64 SER CB C 64 63.700 63.700 65.191 -1.491 18093 6073 1 9 . 1 1 64 64 SER H H 64 8.052 8.052 7.802 0.250 18093 6074 1 9 . 1 1 65 65 SER N N 65 116.673 116.673 116.478 0.195 18093 6075 1 9 . 1 1 65 65 SER HA H 65 4.432 4.432 4.275 0.157 18093 6076 1 9 . 1 1 65 65 SER C C 65 174.335 174.335 175.691 -1.356 18093 6077 1 9 . 1 1 65 65 SER CA C 65 58.927 58.927 60.929 -2.002 18093 6078 1 9 . 1 1 65 65 SER CB C 65 63.621 63.621 63.214 0.407 18093 6079 1 9 . 1 1 65 65 SER H H 65 8.114 8.114 8.462 -0.348 18093 6080 1 9 . 1 1 66 66 VAL N N 66 119.054 119.054 116.813 2.241 18093 6081 1 9 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.245 -0.075 18093 6082 1 9 . 1 1 66 66 VAL C C 66 175.278 175.278 175.104 0.174 18093 6083 1 9 . 1 1 66 66 VAL CA C 66 62.062 62.062 61.745 0.317 18093 6084 1 9 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.155 0.474 18093 6085 1 9 . 1 1 66 66 VAL H H 66 7.740 7.740 7.685 0.055 18093 6086 1 9 . 1 1 67 67 SER N N 67 118.882 118.882 113.977 4.905 18093 6087 1 9 . 1 1 67 67 SER HA H 67 4.704 4.704 4.288 0.416 18093 6088 1 9 . 1 1 67 67 SER CA C 67 56.715 56.715 58.172 -1.457 18093 6089 1 9 . 1 1 67 67 SER CB C 67 63.624 63.624 63.028 0.596 18093 6090 1 9 . 1 1 67 67 SER H H 67 8.060 8.060 8.318 -0.258 18093 6091 1 9 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.348 0.052 18093 6092 1 9 . 1 1 68 68 PRO C C 68 176.925 176.925 175.918 1.007 18093 6093 1 9 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.985 0.763 18093 6094 1 9 . 1 1 68 68 PRO CB C 68 32.005 32.005 31.595 0.410 18093 6095 1 9 . 1 1 69 69 SER N N 69 114.930 114.930 119.698 -4.768 18093 6096 1 9 . 1 1 69 69 SER HA H 69 4.422 4.422 4.700 -0.278 18093 6097 1 9 . 1 1 69 69 SER C C 69 175.617 175.617 174.626 0.991 18093 6098 1 9 . 1 1 69 69 SER CA C 69 58.697 58.697 57.183 1.514 18093 6099 1 9 . 1 1 69 69 SER CB C 69 63.804 63.804 65.185 -1.381 18093 6100 1 9 . 1 1 69 69 SER H H 69 8.205 8.205 8.239 -0.034 18093 6101 1 9 . 1 1 70 70 ILE N N 70 120.840 120.840 126.787 -5.947 18093 6102 1 9 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.040 -0.048 18093 6103 1 9 . 1 1 70 70 ILE C C 70 177.524 177.524 176.659 0.865 18093 6104 1 9 . 1 1 70 70 ILE CA C 70 64.335 64.335 61.883 2.452 18093 6105 1 9 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.124 -0.664 18093 6106 1 9 . 1 1 70 70 ILE H H 70 8.283 8.283 8.928 -0.645 18093 6107 1 9 . 1 1 71 71 GLY N N 71 107.823 107.823 107.927 -0.104 18093 6108 1 9 . 1 1 71 71 GLY C C 71 175.296 175.296 176.103 -0.807 18093 6109 1 9 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.220 0.235 18093 6110 1 9 . 1 1 71 71 GLY H H 71 8.557 8.557 8.802 -0.245 18093 6111 1 9 . 1 1 72 72 GLU N N 72 120.835 120.835 120.477 0.358 18093 6112 1 9 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.233 -0.386 18093 6113 1 9 . 1 1 72 72 GLU C C 72 178.198 178.198 178.235 -0.037 18093 6114 1 9 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.136 1.981 18093 6115 1 9 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.717 -0.324 18093 6116 1 9 . 1 1 72 72 GLU H H 72 7.922 7.922 7.804 0.118 18093 6117 1 9 . 1 1 73 73 TYR N N 73 117.375 117.375 122.372 -4.997 18093 6118 1 9 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.326 -0.164 18093 6119 1 9 . 1 1 73 73 TYR C C 73 179.912 179.912 177.183 2.729 18093 6120 1 9 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.146 1.009 18093 6121 1 9 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.857 -0.091 18093 6122 1 9 . 1 1 73 73 TYR H H 73 8.062 8.062 7.783 0.279 18093 6123 1 9 . 1 1 74 74 LEU N N 74 121.493 121.493 120.047 1.446 18093 6124 1 9 . 1 1 74 74 LEU HA H 74 4.049 4.049 4.017 0.032 18093 6125 1 9 . 1 1 74 74 LEU C C 74 178.063 178.063 178.890 -0.827 18093 6126 1 9 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.220 1.275 18093 6127 1 9 . 1 1 74 74 LEU CB C 74 41.847 41.847 42.138 -0.291 18093 6128 1 9 . 1 1 74 74 LEU H H 74 8.552 8.552 8.883 -0.331 18093 6129 1 9 . 1 1 75 75 LEU N N 75 120.375 120.375 119.796 0.579 18093 6130 1 9 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.152 -0.112 18093 6131 1 9 . 1 1 75 75 LEU C C 75 178.515 178.515 178.979 -0.464 18093 6132 1 9 . 1 1 75 75 LEU CA C 75 58.638 58.638 57.683 0.955 18093 6133 1 9 . 1 1 75 75 LEU CB C 75 42.039 42.039 41.220 0.819 18093 6134 1 9 . 1 1 75 75 LEU H H 75 8.276 8.276 7.578 0.698 18093 6135 1 9 . 1 1 76 76 PHE N N 76 116.626 116.626 119.024 -2.398 18093 6136 1 9 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.173 -0.094 18093 6137 1 9 . 1 1 76 76 PHE C C 76 177.399 177.399 177.870 -0.471 18093 6138 1 9 . 1 1 76 76 PHE CA C 76 61.734 61.734 62.238 -0.504 18093 6139 1 9 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.706 0.035 18093 6140 1 9 . 1 1 76 76 PHE H H 76 8.454 8.454 8.195 0.259 18093 6141 1 9 . 1 1 77 77 THR N N 77 116.080 116.080 112.935 3.145 18093 6142 1 9 . 1 1 77 77 THR HA H 77 3.687 3.687 3.818 -0.131 18093 6143 1 9 . 1 1 77 77 THR C C 77 176.018 176.018 176.865 -0.847 18093 6144 1 9 . 1 1 77 77 THR CA C 77 68.640 68.640 66.256 2.384 18093 6145 1 9 . 1 1 77 77 THR H H 77 8.224 8.224 8.204 0.020 18093 6146 1 9 . 1 1 78 78 MET N N 78 119.394 119.394 121.201 -1.807 18093 6147 1 9 . 1 1 78 78 MET HA H 78 4.129 4.129 4.056 0.073 18093 6148 1 9 . 1 1 78 78 MET C C 78 179.608 179.608 178.356 1.252 18093 6149 1 9 . 1 1 78 78 MET CA C 78 58.831 58.831 59.513 -0.682 18093 6150 1 9 . 1 1 78 78 MET CB C 78 31.590 31.590 32.592 -1.002 18093 6151 1 9 . 1 1 78 78 MET H H 78 8.372 8.372 7.440 0.932 18093 6152 1 9 . 1 1 79 79 ILE N N 79 121.819 121.819 118.847 2.972 18093 6153 1 9 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.703 -0.153 18093 6154 1 9 . 1 1 79 79 ILE C C 79 176.426 176.426 177.547 -1.121 18093 6155 1 9 . 1 1 79 79 ILE CA C 79 65.876 65.876 64.582 1.294 18093 6156 1 9 . 1 1 79 79 ILE CB C 79 37.673 37.673 37.714 -0.041 18093 6157 1 9 . 1 1 79 79 ILE H H 79 8.391 8.391 7.668 0.723 18093 6158 1 9 . 1 1 80 80 PHE N N 80 119.916 119.916 121.240 -1.324 18093 6159 1 9 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.062 -0.009 18093 6160 1 9 . 1 1 80 80 PHE C C 80 178.568 178.568 177.396 1.172 18093 6161 1 9 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.281 0.026 18093 6162 1 9 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.470 -0.696 18093 6163 1 9 . 1 1 80 80 PHE H H 80 8.479 8.479 8.196 0.283 18093 6164 1 9 . 1 1 81 81 VAL N N 81 120.191 120.191 114.946 5.245 18093 6165 1 9 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.739 -0.286 18093 6166 1 9 . 1 1 81 81 VAL C C 81 178.225 178.225 177.656 0.569 18093 6167 1 9 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.638 0.770 18093 6168 1 9 . 1 1 81 81 VAL CB C 81 31.556 31.556 30.964 0.592 18093 6169 1 9 . 1 1 81 81 VAL H H 81 8.928 8.928 8.697 0.231 18093 6170 1 9 . 1 1 82 82 THR N N 82 115.930 115.930 118.233 -2.303 18093 6171 1 9 . 1 1 82 82 THR HA H 82 3.636 3.636 3.954 -0.318 18093 6172 1 9 . 1 1 82 82 THR C C 82 176.420 176.420 176.792 -0.372 18093 6173 1 9 . 1 1 82 82 THR CA C 82 68.570 68.570 66.966 1.604 18093 6174 1 9 . 1 1 82 82 THR CB C 82 68.202 68.202 68.713 -0.511 18093 6175 1 9 . 1 1 82 82 THR H H 82 7.969 7.969 7.354 0.615 18093 6176 1 9 . 1 1 83 83 LEU N N 83 119.780 119.780 120.202 -0.422 18093 6177 1 9 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.895 -0.048 18093 6178 1 9 . 1 1 83 83 LEU C C 83 178.214 178.214 178.544 -0.330 18093 6179 1 9 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.483 0.754 18093 6180 1 9 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.153 0.638 18093 6181 1 9 . 1 1 83 83 LEU H H 83 8.483 8.483 7.579 0.904 18093 6182 1 9 . 1 1 84 84 SER N N 84 114.559 114.559 116.164 -1.605 18093 6183 1 9 . 1 1 84 84 SER HA H 84 4.099 4.099 4.054 0.045 18093 6184 1 9 . 1 1 84 84 SER C C 84 176.799 176.799 176.711 0.088 18093 6185 1 9 . 1 1 84 84 SER CA C 84 63.609 63.609 62.122 1.487 18093 6186 1 9 . 1 1 84 84 SER CB C 84 63.110 63.110 63.095 0.015 18093 6187 1 9 . 1 1 84 84 SER H H 84 8.023 8.023 7.593 0.430 18093 6188 1 9 . 1 1 85 85 ILE N N 85 123.962 123.962 121.652 2.310 18093 6189 1 9 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.833 -0.229 18093 6190 1 9 . 1 1 85 85 ILE C C 85 177.487 177.487 177.991 -0.504 18093 6191 1 9 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.195 0.564 18093 6192 1 9 . 1 1 85 85 ILE CB C 85 37.887 37.887 38.062 -0.175 18093 6193 1 9 . 1 1 85 85 ILE H H 85 8.054 8.054 8.208 -0.154 18093 6194 1 9 . 1 1 86 86 VAL N N 86 118.744 118.744 120.695 -1.951 18093 6195 1 9 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.782 -0.263 18093 6196 1 9 . 1 1 86 86 VAL C C 86 177.557 177.557 177.620 -0.063 18093 6197 1 9 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.566 0.969 18093 6198 1 9 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.856 -0.390 18093 6199 1 9 . 1 1 86 86 VAL H H 86 8.158 8.158 7.335 0.823 18093 6200 1 9 . 1 1 87 87 ILE N N 87 117.206 117.206 119.232 -2.026 18093 6201 1 9 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.630 -0.026 18093 6202 1 9 . 1 1 87 87 ILE C C 87 177.283 177.283 178.189 -0.906 18093 6203 1 9 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.608 2.068 18093 6204 1 9 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.302 1.287 18093 6205 1 9 . 1 1 87 87 ILE H H 87 8.459 8.459 8.552 -0.093 18093 6206 1 9 . 1 1 88 88 THR N N 88 116.158 116.158 116.557 -0.399 18093 6207 1 9 . 1 1 88 88 THR HA H 88 3.672 3.672 4.073 -0.401 18093 6208 1 9 . 1 1 88 88 THR C C 88 175.485 175.485 176.844 -1.359 18093 6209 1 9 . 1 1 88 88 THR CA C 88 68.549 68.549 67.272 1.277 18093 6210 1 9 . 1 1 88 88 THR CB C 88 68.127 68.127 68.429 -0.302 18093 6211 1 9 . 1 1 88 88 THR H H 88 7.776 7.776 8.329 -0.553 18093 6212 1 9 . 1 1 89 89 VAL N N 89 117.985 117.985 121.080 -3.095 18093 6213 1 9 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.886 -0.343 18093 6214 1 9 . 1 1 89 89 VAL C C 89 177.393 177.393 177.704 -0.311 18093 6215 1 9 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.316 1.274 18093 6216 1 9 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.753 0.025 18093 6217 1 9 . 1 1 89 89 VAL H H 89 8.206 8.206 7.527 0.679 18093 6218 1 9 . 1 1 90 90 PHE N N 90 116.709 116.709 120.138 -3.429 18093 6219 1 9 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.239 0.139 18093 6220 1 9 . 1 1 90 90 PHE C C 90 177.305 177.305 177.597 -0.292 18093 6221 1 9 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.557 -0.438 18093 6222 1 9 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.362 1.022 18093 6223 1 9 . 1 1 90 90 PHE H H 90 7.956 7.956 7.815 0.141 18093 6224 1 9 . 1 1 91 91 VAL N N 91 116.565 116.565 119.490 -2.925 18093 6225 1 9 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.499 0.336 18093 6226 1 9 . 1 1 91 91 VAL C C 91 176.927 176.927 176.937 -0.010 18093 6227 1 9 . 1 1 91 91 VAL CA C 91 65.347 65.347 65.297 0.050 18093 6228 1 9 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.856 0.011 18093 6229 1 9 . 1 1 91 91 VAL H H 91 8.239 8.239 7.582 0.657 18093 6230 1 9 . 1 1 92 92 LEU N N 92 117.443 117.443 116.221 1.222 18093 6231 1 9 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.229 -0.035 18093 6232 1 9 . 1 1 92 92 LEU C C 92 177.180 177.180 177.649 -0.469 18093 6233 1 9 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.165 0.019 18093 6234 1 9 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.067 -0.123 18093 6235 1 9 . 1 1 92 92 LEU H H 92 7.967 7.967 7.525 0.442 18093 6236 1 9 . 1 1 93 93 ASN N N 93 116.705 116.705 116.789 -0.084 18093 6237 1 9 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.642 0.005 18093 6238 1 9 . 1 1 93 93 ASN C C 93 175.129 175.129 175.213 -0.084 18093 6239 1 9 . 1 1 93 93 ASN CA C 93 53.854 53.854 54.796 -0.942 18093 6240 1 9 . 1 1 93 93 ASN CB C 93 39.395 39.395 40.562 -1.167 18093 6241 1 9 . 1 1 93 93 ASN H H 93 7.683 7.683 7.811 -0.128 18093 6242 1 9 . 1 1 94 94 VAL N N 94 118.224 118.224 116.241 1.983 18093 6243 1 9 . 1 1 94 94 VAL HA H 94 3.961 3.961 4.148 -0.187 18093 6244 1 9 . 1 1 94 94 VAL C C 94 175.600 175.600 173.431 2.169 18093 6245 1 9 . 1 1 94 94 VAL CA C 94 62.825 62.825 61.684 1.141 18093 6246 1 9 . 1 1 94 94 VAL CB C 94 32.214 32.214 34.717 -2.502 18093 6247 1 9 . 1 1 94 94 VAL H H 94 7.627 7.627 8.251 -0.624 18093 6248 1 9 . 1 1 95 95 HIS N N 95 120.999 120.999 123.309 -2.310 18093 6249 1 9 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.512 0.081 18093 6250 1 9 . 1 1 95 95 HIS C C 95 174.146 174.146 174.146 0.000 18093 6251 1 9 . 1 1 95 95 HIS CA C 95 55.666 55.666 55.891 -0.225 18093 6252 1 9 . 1 1 95 95 HIS CB C 95 29.736 29.736 31.867 -2.131 18093 6253 1 9 . 1 1 95 95 HIS H H 95 8.263 8.263 8.446 -0.183 18093 6254 1 9 . 1 1 96 96 HIS N N 96 122.740 122.740 121.058 1.682 18093 6255 1 9 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.815 -0.182 18093 6256 1 9 . 1 1 96 96 HIS CA C 96 55.895 55.895 55.336 0.559 18093 6257 1 9 . 1 1 96 96 HIS CB C 96 29.750 29.750 30.096 -0.346 18093 6258 1 9 . 1 1 96 96 HIS H H 96 8.298 8.298 7.776 0.522 18093 6259 1 9 . 1 1 97 97 ARG N N 97 118.503 118.503 123.611 -5.108 18093 6260 1 9 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.317 -0.005 18093 6261 1 9 . 1 1 97 97 ARG C C 97 175.776 175.776 175.718 0.058 18093 6262 1 9 . 1 1 97 97 ARG CA C 97 56.225 56.225 56.946 -0.721 18093 6263 1 9 . 1 1 97 97 ARG CB C 97 30.912 30.912 30.732 0.180 18093 6264 1 9 . 1 1 97 97 ARG H H 97 8.250 8.250 7.803 0.447 18093 6265 1 9 . 1 1 98 98 SER N N 98 118.482 118.482 116.232 2.250 18093 6266 1 9 . 1 1 98 98 SER HA H 98 4.722 4.722 4.727 -0.005 18093 6267 1 9 . 1 1 98 98 SER CA C 98 56.547 56.547 57.313 -0.766 18093 6268 1 9 . 1 1 98 98 SER CB C 98 63.624 63.624 65.217 -1.593 18093 6269 1 9 . 1 1 98 98 SER H H 98 8.254 8.254 8.167 0.087 18093 6270 1 9 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.529 -0.126 18093 6271 1 9 . 1 1 99 99 PRO C C 99 176.899 176.899 176.881 0.018 18093 6272 1 9 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.315 -0.614 18093 6273 1 9 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.658 -0.709 18093 6274 1 9 . 1 1 100 100 GLU N N 100 120.187 120.187 114.677 5.510 18093 6275 1 9 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.318 -0.030 18093 6276 1 9 . 1 1 100 100 GLU C C 100 176.593 176.593 175.274 1.319 18093 6277 1 9 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.650 0.072 18093 6278 1 9 . 1 1 100 100 GLU CB C 100 29.999 29.999 30.591 -0.592 18093 6279 1 9 . 1 1 100 100 GLU H H 100 8.401 8.401 8.238 0.163 18093 6280 1 9 . 1 1 101 101 THR N N 101 113.968 113.968 113.597 0.371 18093 6281 1 9 . 1 1 101 101 THR HA H 101 4.286 4.286 4.430 -0.144 18093 6282 1 9 . 1 1 101 101 THR C C 101 174.525 174.525 174.200 0.325 18093 6283 1 9 . 1 1 101 101 THR CA C 101 61.956 61.956 61.038 0.918 18093 6284 1 9 . 1 1 101 101 THR CB C 101 69.697 69.697 70.067 -0.370 18093 6285 1 9 . 1 1 101 101 THR H H 101 7.945 7.945 7.674 0.271 18093 6286 1 9 . 1 1 102 102 HIS N N 102 120.322 120.322 124.745 -4.423 18093 6287 1 9 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.572 0.169 18093 6288 1 9 . 1 1 102 102 HIS C C 102 174.783 174.783 175.803 -1.020 18093 6289 1 9 . 1 1 102 102 HIS CA C 102 55.701 55.701 56.956 -1.255 18093 6290 1 9 . 1 1 102 102 HIS CB C 102 29.093 29.093 30.085 -0.992 18093 6291 1 9 . 1 1 102 102 HIS H H 102 8.455 8.455 8.372 0.083 18093 6292 1 9 . 1 1 103 103 THR N N 103 114.282 114.282 117.590 -3.308 18093 6293 1 9 . 1 1 103 103 THR HA H 103 4.352 4.352 4.522 -0.170 18093 6294 1 9 . 1 1 103 103 THR C C 103 175.104 175.104 175.431 -0.327 18093 6295 1 9 . 1 1 103 103 THR CA C 103 62.057 62.057 60.388 1.669 18093 6296 1 9 . 1 1 103 103 THR CB C 103 69.966 69.966 69.803 0.163 18093 6297 1 9 . 1 1 103 103 THR H H 103 8.069 8.069 8.425 -0.356 18093 6298 1 9 . 1 1 104 104 GLY N N 104 111.159 111.159 108.185 2.974 18093 6299 1 9 . 1 1 104 104 GLY C C 104 174.776 174.776 174.891 -0.115 18093 6300 1 9 . 1 1 104 104 GLY CA C 104 45.588 45.588 44.858 0.730 18093 6301 1 9 . 1 1 104 104 GLY H H 104 8.393 8.393 8.162 0.231 18093 6302 1 9 . 1 1 105 105 GLY N N 105 108.657 108.657 107.830 0.827 18093 6303 1 9 . 1 1 105 105 GLY C C 105 174.957 174.957 174.548 0.409 18093 6304 1 9 . 1 1 105 105 GLY CA C 105 45.612 45.612 44.448 1.164 18093 6305 1 9 . 1 1 105 105 GLY H H 105 8.275 8.275 8.267 0.008 18093 6306 1 9 . 1 1 106 106 GLY N N 106 108.870 108.870 107.465 1.405 18093 6307 1 9 . 1 1 106 106 GLY C C 106 174.877 174.877 174.215 0.662 18093 6308 1 9 . 1 1 106 106 GLY CA C 106 45.665 45.665 44.499 1.166 18093 6309 1 9 . 1 1 106 106 GLY H H 106 8.357 8.357 8.321 0.036 18093 6310 1 9 . 1 1 107 107 GLY N N 107 108.476 108.476 109.210 -0.734 18093 6311 1 9 . 1 1 107 107 GLY C C 107 174.877 174.877 174.638 0.239 18093 6312 1 9 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.381 0.315 18093 6313 1 9 . 1 1 107 107 GLY H H 107 8.330 8.330 8.154 0.176 18093 6314 1 9 . 1 1 108 108 GLY N N 108 108.486 108.486 109.662 -1.176 18093 6315 1 9 . 1 1 108 108 GLY C C 108 175.345 175.345 175.177 0.168 18093 6316 1 9 . 1 1 108 108 GLY CA C 108 45.763 45.763 45.059 0.704 18093 6317 1 9 . 1 1 108 108 GLY H H 108 8.328 8.328 8.316 0.012 18093 6318 1 9 . 1 1 109 109 ILE N N 109 120.433 120.433 119.678 0.755 18093 6319 1 9 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.953 0.015 18093 6320 1 9 . 1 1 109 109 ILE C C 109 176.127 176.127 177.196 -1.069 18093 6321 1 9 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.296 -0.561 18093 6322 1 9 . 1 1 109 109 ILE CB C 109 38.125 38.125 38.069 0.056 18093 6323 1 9 . 1 1 109 109 ILE H H 109 8.192 8.192 8.070 0.122 18093 6324 1 9 . 1 1 110 110 ASP N N 110 121.148 121.148 120.706 0.442 18093 6325 1 9 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.616 -0.310 18093 6326 1 9 . 1 1 110 110 ASP C C 110 177.651 177.651 178.137 -0.486 18093 6327 1 9 . 1 1 110 110 ASP CA C 110 56.776 56.776 58.119 -1.343 18093 6328 1 9 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.136 0.961 18093 6329 1 9 . 1 1 110 110 ASP H H 110 8.427 8.427 8.533 -0.106 18093 6330 1 9 . 1 1 111 111 ARG N N 111 119.228 119.228 119.620 -0.392 18093 6331 1 9 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.239 -0.243 18093 6332 1 9 . 1 1 111 111 ARG C C 111 177.786 177.786 178.833 -1.047 18093 6333 1 9 . 1 1 111 111 ARG CA C 111 58.942 58.942 58.980 -0.038 18093 6334 1 9 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.911 0.285 18093 6335 1 9 . 1 1 111 111 ARG H H 111 7.850 7.850 8.463 -0.613 18093 6336 1 9 . 1 1 112 112 ILE N N 112 118.000 118.000 119.789 -1.789 18093 6337 1 9 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.098 -0.285 18093 6338 1 9 . 1 1 112 112 ILE C C 112 177.496 177.496 177.952 -0.456 18093 6339 1 9 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.242 2.570 18093 6340 1 9 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.859 0.868 18093 6341 1 9 . 1 1 112 112 ILE H H 112 7.764 7.764 7.774 -0.010 18093 6342 1 9 . 1 1 113 113 PHE N N 113 118.367 118.367 122.083 -3.716 18093 6343 1 9 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.250 0.005 18093 6344 1 9 . 1 1 113 113 PHE C C 113 177.218 177.218 177.362 -0.144 18093 6345 1 9 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.403 -0.970 18093 6346 1 9 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.159 -0.352 18093 6347 1 9 . 1 1 113 113 PHE H H 113 7.963 7.963 8.001 -0.038 18093 6348 1 9 . 1 1 114 114 LEU N N 114 118.921 118.921 117.244 1.677 18093 6349 1 9 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.954 0.043 18093 6350 1 9 . 1 1 114 114 LEU C C 114 178.297 178.297 178.460 -0.163 18093 6351 1 9 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.186 0.425 18093 6352 1 9 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.278 0.674 18093 6353 1 9 . 1 1 114 114 LEU H H 114 7.939 7.939 7.957 -0.018 18093 6354 1 9 . 1 1 115 115 TRP N N 115 117.464 117.464 119.452 -1.988 18093 6355 1 9 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.373 0.001 18093 6356 1 9 . 1 1 115 115 TRP C C 115 178.572 178.572 178.242 0.330 18093 6357 1 9 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.775 1.147 18093 6358 1 9 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.772 -1.265 18093 6359 1 9 . 1 1 115 115 TRP H H 115 7.969 7.969 7.615 0.354 18093 6360 1 9 . 1 1 116 116 MET N N 116 117.069 117.069 118.958 -1.889 18093 6361 1 9 . 1 1 116 116 MET HA H 116 4.065 4.065 4.208 -0.143 18093 6362 1 9 . 1 1 116 116 MET C C 116 177.425 177.425 178.170 -0.745 18093 6363 1 9 . 1 1 116 116 MET CA C 116 59.289 59.289 59.170 0.119 18093 6364 1 9 . 1 1 116 116 MET CB C 116 31.692 31.692 32.532 -0.840 18093 6365 1 9 . 1 1 116 116 MET H H 116 8.465 8.465 7.714 0.751 18093 6366 1 9 . 1 1 117 117 PHE N N 117 118.755 118.755 117.590 1.165 18093 6367 1 9 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.051 0.048 18093 6368 1 9 . 1 1 117 117 PHE C C 117 177.965 177.965 178.290 -0.325 18093 6369 1 9 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.200 -0.492 18093 6370 1 9 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.265 0.920 18093 6371 1 9 . 1 1 117 117 PHE H H 117 8.418 8.418 7.833 0.585 18093 6372 1 9 . 1 1 118 118 ILE N N 118 119.133 119.133 115.225 3.908 18093 6373 1 9 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.921 -0.577 18093 6374 1 9 . 1 1 118 118 ILE C C 118 177.244 177.244 177.420 -0.176 18093 6375 1 9 . 1 1 118 118 ILE CA C 118 65.825 65.825 63.909 1.916 18093 6376 1 9 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.899 -0.351 18093 6377 1 9 . 1 1 118 118 ILE H H 118 8.266 8.266 7.671 0.595 18093 6378 1 9 . 1 1 119 119 ILE N N 119 118.846 118.846 121.551 -2.705 18093 6379 1 9 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.880 -0.308 18093 6380 1 9 . 1 1 119 119 ILE C C 119 177.523 177.523 177.597 -0.074 18093 6381 1 9 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.239 0.650 18093 6382 1 9 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.283 -0.719 18093 6383 1 9 . 1 1 119 119 ILE H H 119 8.308 8.308 7.341 0.967 18093 6384 1 9 . 1 1 120 120 VAL N N 120 119.228 119.228 117.364 1.864 18093 6385 1 9 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.765 -0.257 18093 6386 1 9 . 1 1 120 120 VAL C C 120 177.651 177.651 177.114 0.537 18093 6387 1 9 . 1 1 120 120 VAL CA C 120 67.601 67.601 66.124 1.477 18093 6388 1 9 . 1 1 120 120 VAL CB C 120 31.406 31.406 31.223 0.183 18093 6389 1 9 . 1 1 120 120 VAL H H 120 8.399 8.399 7.845 0.554 18093 6390 1 9 . 1 1 121 121 CYS N N 121 117.151 117.151 119.389 -2.238 18093 6391 1 9 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.096 -0.193 18093 6392 1 9 . 1 1 121 121 CYS C C 121 177.719 177.719 176.978 0.741 18093 6393 1 9 . 1 1 121 121 CYS CA C 121 64.298 64.298 64.021 0.277 18093 6394 1 9 . 1 1 121 121 CYS CB C 121 26.677 26.677 27.377 -0.700 18093 6395 1 9 . 1 1 121 121 CYS H H 121 8.008 8.008 7.437 0.571 18093 6396 1 9 . 1 1 122 122 LEU N N 122 121.402 121.402 119.417 1.985 18093 6397 1 9 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.191 -0.208 18093 6398 1 9 . 1 1 122 122 LEU C C 122 178.282 178.282 178.926 -0.644 18093 6399 1 9 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.394 1.151 18093 6400 1 9 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.205 0.762 18093 6401 1 9 . 1 1 122 122 LEU H H 122 8.417 8.417 7.710 0.707 18093 6402 1 9 . 1 1 123 123 LEU N N 123 118.543 118.543 121.141 -2.598 18093 6403 1 9 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.134 -0.214 18093 6404 1 9 . 1 1 123 123 LEU C C 123 179.028 179.028 178.615 0.413 18093 6405 1 9 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.292 -0.175 18093 6406 1 9 . 1 1 123 123 LEU CB C 123 42.056 42.056 41.104 0.952 18093 6407 1 9 . 1 1 123 123 LEU H H 123 8.590 8.590 7.706 0.884 18093 6408 1 9 . 1 1 124 124 GLY N N 124 104.896 104.896 106.027 -1.131 18093 6409 1 9 . 1 1 124 124 GLY C C 124 173.932 173.932 175.891 -1.959 18093 6410 1 9 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.598 -0.371 18093 6411 1 9 . 1 1 124 124 GLY H H 124 8.601 8.601 8.571 0.030 18093 6412 1 9 . 1 1 125 125 THR N N 125 115.403 115.403 118.904 -3.501 18093 6413 1 9 . 1 1 125 125 THR HA H 125 3.686 3.686 3.790 -0.104 18093 6414 1 9 . 1 1 125 125 THR C C 125 176.407 176.407 176.735 -0.328 18093 6415 1 9 . 1 1 125 125 THR CA C 125 67.565 67.565 66.926 0.639 18093 6416 1 9 . 1 1 125 125 THR CB C 125 68.143 68.143 68.705 -0.562 18093 6417 1 9 . 1 1 125 125 THR H H 125 7.734 7.734 7.441 0.293 18093 6418 1 9 . 1 1 126 126 VAL N N 126 119.056 119.056 120.998 -1.942 18093 6419 1 9 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.598 -0.059 18093 6420 1 9 . 1 1 126 126 VAL C C 126 177.628 177.628 178.264 -0.636 18093 6421 1 9 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.850 -0.249 18093 6422 1 9 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.425 0.068 18093 6423 1 9 . 1 1 126 126 VAL H H 126 8.015 8.015 7.570 0.445 18093 6424 1 9 . 1 1 127 127 GLY N N 127 104.644 104.644 107.411 -2.767 18093 6425 1 9 . 1 1 127 127 GLY C C 127 173.933 173.933 176.053 -2.120 18093 6426 1 9 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.250 0.031 18093 6427 1 9 . 1 1 127 127 GLY H H 127 8.248 8.248 8.499 -0.251 18093 6428 1 9 . 1 1 128 128 LEU N N 128 117.354 117.354 122.318 -4.964 18093 6429 1 9 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.048 -0.036 18093 6430 1 9 . 1 1 128 128 LEU C C 128 177.443 177.443 178.345 -0.902 18093 6431 1 9 . 1 1 128 128 LEU CA C 128 56.626 56.626 57.292 -0.666 18093 6432 1 9 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.706 0.554 18093 6433 1 9 . 1 1 128 128 LEU H H 128 7.568 7.568 7.888 -0.320 18093 6434 1 9 . 1 1 129 129 PHE N N 129 113.971 113.971 117.054 -3.083 18093 6435 1 9 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.318 0.140 18093 6436 1 9 . 1 1 129 129 PHE C C 129 176.216 176.216 176.032 0.184 18093 6437 1 9 . 1 1 129 129 PHE CA C 129 58.385 58.385 60.664 -2.279 18093 6438 1 9 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.890 -0.171 18093 6439 1 9 . 1 1 129 129 PHE H H 129 7.639 7.639 7.642 -0.003 18093 6440 1 9 . 1 1 130 130 LEU N N 130 117.752 117.752 118.547 -0.795 18093 6441 1 9 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.767 -0.334 18093 6442 1 9 . 1 1 130 130 LEU CA C 130 54.156 54.156 52.127 2.029 18093 6443 1 9 . 1 1 130 130 LEU H H 130 8.099 8.099 7.164 0.935 18093 6444 1 9 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.958 -0.508 18093 6445 1 9 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.516 2.383 18093 6446 1 9 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.429 -0.167 18093 6447 1 9 . 1 1 132 132 PRO C C 132 177.616 177.616 178.247 -0.631 18093 6448 1 9 . 1 1 132 132 PRO CA C 132 64.980 64.980 65.071 -0.091 18093 6449 1 9 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.251 -0.626 18093 6450 1 9 . 1 1 133 133 TRP N N 133 115.508 115.508 119.263 -3.755 18093 6451 1 9 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.491 0.101 18093 6452 1 9 . 1 1 133 133 TRP C C 133 176.842 176.842 176.161 0.681 18093 6453 1 9 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.260 -1.977 18093 6454 1 9 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.815 -1.219 18093 6455 1 9 . 1 1 133 133 TRP H H 133 7.311 7.311 8.048 -0.737 18093 6456 1 9 . 1 1 134 134 LEU N N 134 119.570 119.570 115.459 4.111 18093 6457 1 9 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.470 -0.293 18093 6458 1 9 . 1 1 134 134 LEU C C 134 175.768 175.768 176.090 -0.322 18093 6459 1 9 . 1 1 134 134 LEU CA C 134 55.621 55.621 53.885 1.736 18093 6460 1 9 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.633 1.015 18093 6461 1 9 . 1 1 134 134 LEU H H 134 7.453 7.453 7.280 0.173 18093 6462 1 9 . 1 1 135 135 ALA N N 135 119.004 119.004 121.897 -2.893 18093 6463 1 9 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.493 -0.270 18093 6464 1 9 . 1 1 135 135 ALA C C 135 177.170 177.170 177.761 -0.591 18093 6465 1 9 . 1 1 135 135 ALA CA C 135 52.456 52.456 52.770 -0.314 18093 6466 1 9 . 1 1 135 135 ALA CB C 135 19.736 19.736 20.796 -1.060 18093 6467 1 9 . 1 1 135 135 ALA H H 135 7.541 7.541 7.405 0.136 18093 6468 1 9 . 1 1 136 136 GLY N N 136 105.879 105.879 108.833 -2.954 18093 6469 1 9 . 1 1 136 136 GLY C C 136 173.042 173.042 173.834 -0.792 18093 6470 1 9 . 1 1 136 136 GLY CA C 136 45.693 45.693 44.703 0.990 18093 6471 1 9 . 1 1 136 136 GLY H H 136 7.846 7.846 8.049 -0.203 18093 6472 1 10 . 1 1 5 5 GLU N N 5 119.627 119.627 119.517 0.110 18093 6473 1 10 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.395 -0.187 18093 6474 1 10 . 1 1 5 5 GLU C C 5 176.581 176.581 174.837 1.744 18093 6475 1 10 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.293 0.752 18093 6476 1 10 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.905 0.133 18093 6477 1 10 . 1 1 5 5 GLU H H 5 8.003 8.003 8.178 -0.175 18093 6478 1 10 . 1 1 6 6 LEU N N 6 121.267 121.267 121.432 -0.165 18093 6479 1 10 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.328 0.097 18093 6480 1 10 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.106 2.529 18093 6481 1 10 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.599 -0.303 18093 6482 1 10 . 1 1 6 6 LEU H H 6 8.104 8.104 7.799 0.305 18093 6483 1 10 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.544 -0.145 18093 6484 1 10 . 1 1 7 7 PRO C C 7 178.408 178.408 177.968 0.440 18093 6485 1 10 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.109 2.603 18093 6486 1 10 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.750 -0.833 18093 6487 1 10 . 1 1 8 8 LEU N N 8 121.835 121.835 120.277 1.558 18093 6488 1 10 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.204 -0.115 18093 6489 1 10 . 1 1 8 8 LEU C C 8 177.902 177.902 178.369 -0.467 18093 6490 1 10 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.405 0.700 18093 6491 1 10 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.008 0.599 18093 6492 1 10 . 1 1 8 8 LEU H H 8 8.162 8.162 8.508 -0.346 18093 6493 1 10 . 1 1 9 9 PHE N N 9 118.342 118.342 119.299 -0.957 18093 6494 1 10 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.151 0.038 18093 6495 1 10 . 1 1 9 9 PHE C C 9 177.596 177.596 177.125 0.471 18093 6496 1 10 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.170 -0.056 18093 6497 1 10 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.218 0.509 18093 6498 1 10 . 1 1 9 9 PHE H H 9 8.318 8.318 8.260 0.058 18093 6499 1 10 . 1 1 10 10 TYR N N 10 117.584 117.584 117.751 -0.167 18093 6500 1 10 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.858 0.296 18093 6501 1 10 . 1 1 10 10 TYR C C 10 177.630 177.630 177.866 -0.236 18093 6502 1 10 . 1 1 10 10 TYR CA C 10 61.036 61.036 60.539 0.497 18093 6503 1 10 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.169 0.491 18093 6504 1 10 . 1 1 10 10 TYR H H 10 8.105 8.105 7.987 0.118 18093 6505 1 10 . 1 1 11 11 THR N N 11 115.563 115.563 116.857 -1.294 18093 6506 1 10 . 1 1 11 11 THR HA H 11 3.871 3.871 4.027 -0.156 18093 6507 1 10 . 1 1 11 11 THR C C 11 175.955 175.955 176.784 -0.829 18093 6508 1 10 . 1 1 11 11 THR CA C 11 67.290 67.290 66.737 0.553 18093 6509 1 10 . 1 1 11 11 THR CB C 11 68.201 68.201 68.705 -0.504 18093 6510 1 10 . 1 1 11 11 THR H H 11 7.915 7.915 7.556 0.359 18093 6511 1 10 . 1 1 12 12 ILE N N 12 119.727 119.727 120.676 -0.949 18093 6512 1 10 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.925 -0.226 18093 6513 1 10 . 1 1 12 12 ILE C C 12 175.773 175.773 177.591 -1.818 18093 6514 1 10 . 1 1 12 12 ILE CA C 12 64.699 64.699 63.509 1.190 18093 6515 1 10 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.705 1.391 18093 6516 1 10 . 1 1 12 12 ILE H H 12 8.186 8.186 8.042 0.144 18093 6517 1 10 . 1 1 13 13 ASN N N 13 114.190 114.190 118.492 -4.302 18093 6518 1 10 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.515 -0.093 18093 6519 1 10 . 1 1 13 13 ASN C C 13 174.786 174.786 176.709 -1.923 18093 6520 1 10 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.490 0.065 18093 6521 1 10 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.806 0.552 18093 6522 1 10 . 1 1 13 13 ASN H H 13 7.601 7.601 7.347 0.254 18093 6523 1 10 . 1 1 14 14 LEU N N 14 115.031 115.031 119.202 -4.171 18093 6524 1 10 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.210 -0.014 18093 6525 1 10 . 1 1 14 14 LEU C C 14 177.540 177.540 178.244 -0.704 18093 6526 1 10 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.011 0.396 18093 6527 1 10 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.114 -0.272 18093 6528 1 10 . 1 1 14 14 LEU H H 14 7.390 7.390 7.652 -0.262 18093 6529 1 10 . 1 1 15 15 ILE N N 15 118.223 118.223 120.562 -2.339 18093 6530 1 10 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.708 -0.095 18093 6531 1 10 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.767 2.954 18093 6532 1 10 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.340 -0.728 18093 6533 1 10 . 1 1 15 15 ILE H H 15 8.123 8.123 7.615 0.508 18093 6534 1 10 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.346 -0.277 18093 6535 1 10 . 1 1 17 17 PRO C C 17 177.721 177.721 178.802 -1.081 18093 6536 1 10 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.478 1.283 18093 6537 1 10 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.791 -0.049 18093 6538 1 10 . 1 1 18 18 CYS N N 18 113.538 113.538 117.271 -3.733 18093 6539 1 10 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.038 -0.030 18093 6540 1 10 . 1 1 18 18 CYS C C 18 177.683 177.683 176.714 0.969 18093 6541 1 10 . 1 1 18 18 CYS CA C 18 64.500 64.500 62.595 1.905 18093 6542 1 10 . 1 1 18 18 CYS CB C 18 26.873 26.873 26.944 -0.071 18093 6543 1 10 . 1 1 18 18 CYS H H 18 7.410 7.410 7.403 0.007 18093 6544 1 10 . 1 1 19 19 LEU N N 19 122.545 122.545 119.698 2.847 18093 6545 1 10 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.082 -0.083 18093 6546 1 10 . 1 1 19 19 LEU C C 19 178.608 178.608 178.718 -0.110 18093 6547 1 10 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.441 0.980 18093 6548 1 10 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.434 0.410 18093 6549 1 10 . 1 1 19 19 LEU H H 19 8.635 8.635 7.429 1.206 18093 6550 1 10 . 1 1 20 20 LEU N N 20 119.404 119.404 120.119 -0.715 18093 6551 1 10 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.925 0.081 18093 6552 1 10 . 1 1 20 20 LEU C C 20 178.540 178.540 179.428 -0.888 18093 6553 1 10 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.387 0.412 18093 6554 1 10 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.918 0.081 18093 6555 1 10 . 1 1 20 20 LEU H H 20 8.392 8.392 7.504 0.888 18093 6556 1 10 . 1 1 21 21 ILE N N 21 117.335 117.335 114.139 3.196 18093 6557 1 10 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.936 -0.285 18093 6558 1 10 . 1 1 21 21 ILE C C 21 177.249 177.249 177.632 -0.383 18093 6559 1 10 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.652 0.609 18093 6560 1 10 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.525 0.435 18093 6561 1 10 . 1 1 21 21 ILE H H 21 8.403 8.403 8.282 0.121 18093 6562 1 10 . 1 1 22 22 SER N N 22 116.385 116.385 117.032 -0.647 18093 6563 1 10 . 1 1 22 22 SER HA H 22 4.056 4.056 4.262 -0.206 18093 6564 1 10 . 1 1 22 22 SER C C 22 176.813 176.813 176.480 0.333 18093 6565 1 10 . 1 1 22 22 SER CA C 22 63.866 63.866 62.279 1.587 18093 6566 1 10 . 1 1 22 22 SER CB C 22 62.898 62.898 62.953 -0.055 18093 6567 1 10 . 1 1 22 22 SER H H 22 8.271 8.271 7.719 0.552 18093 6568 1 10 . 1 1 23 23 CYS N N 23 119.001 119.001 120.595 -1.594 18093 6569 1 10 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.280 -0.290 18093 6570 1 10 . 1 1 23 23 CYS C C 23 177.594 177.594 176.303 1.291 18093 6571 1 10 . 1 1 23 23 CYS CA C 23 64.429 64.429 61.706 2.723 18093 6572 1 10 . 1 1 23 23 CYS CB C 23 26.940 26.940 26.570 0.370 18093 6573 1 10 . 1 1 23 23 CYS H H 23 8.161 8.161 8.762 -0.601 18093 6574 1 10 . 1 1 24 24 LEU N N 24 117.814 117.814 121.347 -3.533 18093 6575 1 10 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.929 0.048 18093 6576 1 10 . 1 1 24 24 LEU C C 24 177.944 177.944 179.022 -1.078 18093 6577 1 10 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.621 -0.334 18093 6578 1 10 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.386 0.517 18093 6579 1 10 . 1 1 24 24 LEU H H 24 8.106 8.106 7.609 0.497 18093 6580 1 10 . 1 1 25 25 THR N N 25 115.670 115.670 115.097 0.573 18093 6581 1 10 . 1 1 25 25 THR HA H 25 3.687 3.687 4.038 -0.351 18093 6582 1 10 . 1 1 25 25 THR C C 25 175.845 175.845 176.933 -1.088 18093 6583 1 10 . 1 1 25 25 THR CA C 25 68.306 68.306 67.008 1.298 18093 6584 1 10 . 1 1 25 25 THR H H 25 7.924 7.924 7.542 0.382 18093 6585 1 10 . 1 1 26 26 VAL N N 26 118.809 118.809 121.908 -3.099 18093 6586 1 10 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.891 -0.376 18093 6587 1 10 . 1 1 26 26 VAL C C 26 177.530 177.530 177.709 -0.179 18093 6588 1 10 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.202 1.079 18093 6589 1 10 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.184 0.540 18093 6590 1 10 . 1 1 26 26 VAL H H 26 7.764 7.764 7.387 0.377 18093 6591 1 10 . 1 1 27 27 LEU N N 27 117.958 117.958 121.168 -3.210 18093 6592 1 10 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.026 0.010 18093 6593 1 10 . 1 1 27 27 LEU C C 27 178.163 178.163 178.746 -0.583 18093 6594 1 10 . 1 1 27 27 LEU CA C 27 58.509 58.509 57.897 0.612 18093 6595 1 10 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.853 1.066 18093 6596 1 10 . 1 1 27 27 LEU H H 27 7.912 7.912 8.520 -0.608 18093 6597 1 10 . 1 1 28 28 VAL N N 28 114.472 114.472 117.867 -3.395 18093 6598 1 10 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.501 0.034 18093 6599 1 10 . 1 1 28 28 VAL C C 28 176.871 176.871 177.865 -0.994 18093 6600 1 10 . 1 1 28 28 VAL CA C 28 65.977 65.977 66.557 -0.580 18093 6601 1 10 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.574 0.360 18093 6602 1 10 . 1 1 28 28 VAL H H 28 7.892 7.892 7.476 0.416 18093 6603 1 10 . 1 1 29 29 PHE N N 29 115.206 115.206 117.019 -1.813 18093 6604 1 10 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.227 -0.024 18093 6605 1 10 . 1 1 29 29 PHE C C 29 176.614 176.614 177.223 -0.609 18093 6606 1 10 . 1 1 29 29 PHE CA C 29 60.964 60.964 61.058 -0.094 18093 6607 1 10 . 1 1 29 29 PHE CB C 29 39.752 39.752 39.089 0.663 18093 6608 1 10 . 1 1 29 29 PHE H H 29 7.748 7.748 7.517 0.231 18093 6609 1 10 . 1 1 30 30 TYR N N 30 115.975 115.975 119.912 -3.937 18093 6610 1 10 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.567 -0.245 18093 6611 1 10 . 1 1 30 30 TYR C C 30 175.553 175.553 175.113 0.440 18093 6612 1 10 . 1 1 30 30 TYR CA C 30 59.598 59.598 60.268 -0.670 18093 6613 1 10 . 1 1 30 30 TYR CB C 30 39.763 39.763 40.092 -0.329 18093 6614 1 10 . 1 1 30 30 TYR H H 30 7.985 7.985 7.756 0.229 18093 6615 1 10 . 1 1 31 31 LEU N N 31 120.780 120.780 119.739 1.041 18093 6616 1 10 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.601 -0.174 18093 6617 1 10 . 1 1 31 31 LEU CA C 31 54.665 54.665 52.132 2.533 18093 6618 1 10 . 1 1 31 31 LEU CB C 31 42.388 42.388 44.391 -2.003 18093 6619 1 10 . 1 1 31 31 LEU H H 31 7.643 7.643 7.748 -0.105 18093 6620 1 10 . 1 1 34 34 GLU C C 34 176.271 176.271 175.282 0.989 18093 6621 1 10 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.707 1.883 18093 6622 1 10 . 1 1 35 35 CYS N N 35 116.430 116.430 120.903 -4.473 18093 6623 1 10 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.469 -0.102 18093 6624 1 10 . 1 1 35 35 CYS C C 35 175.198 175.198 175.748 -0.550 18093 6625 1 10 . 1 1 35 35 CYS CA C 35 60.293 60.293 59.690 0.603 18093 6626 1 10 . 1 1 35 35 CYS CB C 35 28.130 28.130 28.025 0.105 18093 6627 1 10 . 1 1 35 35 CYS H H 35 7.970 7.970 8.621 -0.651 18093 6628 1 10 . 1 1 36 36 GLY N N 36 108.315 108.315 108.214 0.101 18093 6629 1 10 . 1 1 36 36 GLY C C 36 174.610 174.610 175.264 -0.654 18093 6630 1 10 . 1 1 36 36 GLY CA C 36 46.004 46.004 45.767 0.237 18093 6631 1 10 . 1 1 36 36 GLY H H 36 8.120 8.120 8.118 0.002 18093 6632 1 10 . 1 1 37 37 GLU N N 37 121.347 121.347 121.347 0.000 18093 6633 1 10 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.115 -0.068 18093 6634 1 10 . 1 1 37 37 GLU C C 37 177.338 177.338 178.808 -1.470 18093 6635 1 10 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.015 -0.508 18093 6636 1 10 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.564 0.006 18093 6637 1 10 . 1 1 37 37 GLU H H 37 8.423 8.423 8.603 -0.180 18093 6638 1 10 . 1 1 38 38 LYS N N 38 123.788 123.788 119.571 4.217 18093 6639 1 10 . 1 1 38 38 LYS HA H 38 4.196 4.196 3.999 0.197 18093 6640 1 10 . 1 1 38 38 LYS C C 38 177.976 177.976 178.380 -0.404 18093 6641 1 10 . 1 1 38 38 LYS CA C 38 58.273 58.273 58.681 -0.408 18093 6642 1 10 . 1 1 38 38 LYS CB C 38 31.649 31.649 31.695 -0.046 18093 6643 1 10 . 1 1 38 38 LYS H H 38 8.211 8.211 7.818 0.393 18093 6644 1 10 . 1 1 39 39 ILE N N 39 115.675 115.675 118.412 -2.737 18093 6645 1 10 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.650 -0.042 18093 6646 1 10 . 1 1 39 39 ILE C C 39 177.204 177.204 177.854 -0.650 18093 6647 1 10 . 1 1 39 39 ILE CA C 39 65.501 65.501 65.024 0.477 18093 6648 1 10 . 1 1 39 39 ILE H H 39 7.933 7.933 8.055 -0.122 18093 6649 1 10 . 1 1 40 40 THR N N 40 117.411 117.411 114.046 3.365 18093 6650 1 10 . 1 1 40 40 THR HA H 40 3.844 3.844 3.914 -0.070 18093 6651 1 10 . 1 1 40 40 THR C C 40 175.983 175.983 176.618 -0.635 18093 6652 1 10 . 1 1 40 40 THR CA C 40 67.360 67.360 65.737 1.623 18093 6653 1 10 . 1 1 40 40 THR H H 40 8.362 8.362 7.720 0.642 18093 6654 1 10 . 1 1 41 41 LEU N N 41 123.059 123.059 122.955 0.104 18093 6655 1 10 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.171 -0.155 18093 6656 1 10 . 1 1 41 41 LEU C C 41 178.914 178.914 178.025 0.889 18093 6657 1 10 . 1 1 41 41 LEU CA C 41 58.366 58.366 57.688 0.679 18093 6658 1 10 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.831 0.219 18093 6659 1 10 . 1 1 41 41 LEU H H 41 8.282 8.282 7.208 1.074 18093 6660 1 10 . 1 1 42 42 CYS N N 42 118.762 118.762 118.371 0.391 18093 6661 1 10 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.060 -0.124 18093 6662 1 10 . 1 1 42 42 CYS C C 42 176.607 176.607 177.117 -0.510 18093 6663 1 10 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.430 0.887 18093 6664 1 10 . 1 1 42 42 CYS CB C 42 26.919 26.919 26.525 0.394 18093 6665 1 10 . 1 1 42 42 CYS H H 42 8.195 8.195 8.143 0.052 18093 6666 1 10 . 1 1 43 43 ILE N N 43 117.589 117.589 119.706 -2.117 18093 6667 1 10 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.746 -0.139 18093 6668 1 10 . 1 1 43 43 ILE C C 43 177.323 177.323 177.857 -0.534 18093 6669 1 10 . 1 1 43 43 ILE CA C 43 65.249 65.249 64.965 0.284 18093 6670 1 10 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.834 0.204 18093 6671 1 10 . 1 1 43 43 ILE H H 43 8.428 8.428 7.652 0.776 18093 6672 1 10 . 1 1 44 44 SER N N 44 115.950 115.950 116.341 -0.391 18093 6673 1 10 . 1 1 44 44 SER HA H 44 4.012 4.012 4.183 -0.171 18093 6674 1 10 . 1 1 44 44 SER C C 44 176.965 176.965 176.574 0.391 18093 6675 1 10 . 1 1 44 44 SER CA C 44 63.575 63.575 61.887 1.688 18093 6676 1 10 . 1 1 44 44 SER H H 44 7.984 7.984 7.399 0.585 18093 6677 1 10 . 1 1 45 45 VAL N N 45 123.544 123.544 121.282 2.262 18093 6678 1 10 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.715 -0.167 18093 6679 1 10 . 1 1 45 45 VAL C C 45 177.139 177.139 177.515 -0.376 18093 6680 1 10 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.556 0.677 18093 6681 1 10 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.519 0.123 18093 6682 1 10 . 1 1 45 45 VAL H H 45 8.280 8.280 8.167 0.113 18093 6683 1 10 . 1 1 46 46 LEU N N 46 119.883 119.883 119.291 0.592 18093 6684 1 10 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.003 -0.060 18093 6685 1 10 . 1 1 46 46 LEU C C 46 180.125 180.125 178.776 1.349 18093 6686 1 10 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.671 0.929 18093 6687 1 10 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.765 0.247 18093 6688 1 10 . 1 1 46 46 LEU H H 46 8.117 8.117 7.480 0.637 18093 6689 1 10 . 1 1 47 47 LEU N N 47 120.193 120.193 120.010 0.183 18093 6690 1 10 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.903 0.101 18093 6691 1 10 . 1 1 47 47 LEU C C 47 178.370 178.370 179.021 -0.651 18093 6692 1 10 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.446 -0.020 18093 6693 1 10 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.663 0.392 18093 6694 1 10 . 1 1 47 47 LEU H H 47 8.933 8.933 7.595 1.338 18093 6695 1 10 . 1 1 48 48 SER N N 48 115.861 115.861 114.507 1.354 18093 6696 1 10 . 1 1 48 48 SER HA H 48 4.013 4.013 4.211 -0.198 18093 6697 1 10 . 1 1 48 48 SER C C 48 175.642 175.642 177.184 -1.542 18093 6698 1 10 . 1 1 48 48 SER CA C 48 63.571 63.571 61.904 1.667 18093 6699 1 10 . 1 1 48 48 SER CB C 48 62.879 62.879 63.096 -0.217 18093 6700 1 10 . 1 1 48 48 SER H H 48 7.996 7.996 7.652 0.344 18093 6701 1 10 . 1 1 49 49 LEU N N 49 120.673 120.673 121.047 -0.374 18093 6702 1 10 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.469 -0.434 18093 6703 1 10 . 1 1 49 49 LEU C C 49 178.229 178.229 177.747 0.482 18093 6704 1 10 . 1 1 49 49 LEU CA C 49 58.283 58.283 57.343 0.940 18093 6705 1 10 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.172 -0.226 18093 6706 1 10 . 1 1 49 49 LEU H H 49 8.352 8.352 7.631 0.721 18093 6707 1 10 . 1 1 50 50 THR N N 50 115.582 115.582 116.062 -0.480 18093 6708 1 10 . 1 1 50 50 THR HA H 50 3.672 3.672 4.111 -0.439 18093 6709 1 10 . 1 1 50 50 THR C C 50 175.877 175.877 176.206 -0.329 18093 6710 1 10 . 1 1 50 50 THR CA C 50 68.628 68.628 67.096 1.532 18093 6711 1 10 . 1 1 50 50 THR H H 50 7.937 7.937 7.641 0.296 18093 6712 1 10 . 1 1 51 51 VAL N N 51 119.774 119.774 119.678 0.096 18093 6713 1 10 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.906 -0.408 18093 6714 1 10 . 1 1 51 51 VAL C C 51 177.162 177.162 176.923 0.239 18093 6715 1 10 . 1 1 51 51 VAL CA C 51 67.585 67.585 64.531 3.054 18093 6716 1 10 . 1 1 51 51 VAL CB C 51 31.521 31.521 30.459 1.062 18093 6717 1 10 . 1 1 51 51 VAL H H 51 8.115 8.115 8.238 -0.123 18093 6718 1 10 . 1 1 52 52 PHE N N 52 118.808 118.808 121.993 -3.185 18093 6719 1 10 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.348 -0.226 18093 6720 1 10 . 1 1 52 52 PHE C C 52 176.697 176.697 176.390 0.307 18093 6721 1 10 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.780 0.991 18093 6722 1 10 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.346 -0.084 18093 6723 1 10 . 1 1 52 52 PHE H H 52 8.256 8.256 7.668 0.588 18093 6724 1 10 . 1 1 53 53 LEU N N 53 117.267 117.267 118.433 -1.166 18093 6725 1 10 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.370 0.523 18093 6726 1 10 . 1 1 53 53 LEU C C 53 179.319 179.319 178.481 0.838 18093 6727 1 10 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.630 0.354 18093 6728 1 10 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.092 0.735 18093 6729 1 10 . 1 1 53 53 LEU H H 53 8.443 8.443 7.384 1.059 18093 6730 1 10 . 1 1 54 54 LEU N N 54 119.762 119.762 119.342 0.420 18093 6731 1 10 . 1 1 54 54 LEU HA H 54 4.054 4.054 4.075 -0.021 18093 6732 1 10 . 1 1 54 54 LEU C C 54 178.827 178.827 179.499 -0.672 18093 6733 1 10 . 1 1 54 54 LEU CA C 54 58.105 58.105 57.470 0.635 18093 6734 1 10 . 1 1 54 54 LEU CB C 54 41.947 41.947 40.766 1.181 18093 6735 1 10 . 1 1 54 54 LEU H H 54 8.205 8.205 7.598 0.607 18093 6736 1 10 . 1 1 55 55 LEU N N 55 118.585 118.585 120.051 -1.466 18093 6737 1 10 . 1 1 55 55 LEU HA H 55 4.077 4.077 4.245 -0.168 18093 6738 1 10 . 1 1 55 55 LEU C C 55 178.909 178.909 179.213 -0.304 18093 6739 1 10 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.591 0.517 18093 6740 1 10 . 1 1 55 55 LEU CB C 55 41.979 41.979 41.877 0.102 18093 6741 1 10 . 1 1 55 55 LEU H H 55 8.179 8.179 7.176 1.003 18093 6742 1 10 . 1 1 56 56 ILE N N 56 116.079 116.079 115.812 0.267 18093 6743 1 10 . 1 1 56 56 ILE HA H 56 3.729 3.729 4.007 -0.278 18093 6744 1 10 . 1 1 56 56 ILE C C 56 176.988 176.988 177.249 -0.261 18093 6745 1 10 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.275 0.982 18093 6746 1 10 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.806 0.611 18093 6747 1 10 . 1 1 56 56 ILE H H 56 8.040 8.040 7.497 0.543 18093 6748 1 10 . 1 1 57 57 THR N N 57 110.105 110.105 109.243 0.862 18093 6749 1 10 . 1 1 57 57 THR HA H 57 4.015 4.015 4.277 -0.262 18093 6750 1 10 . 1 1 57 57 THR C C 57 175.435 175.435 176.967 -1.532 18093 6751 1 10 . 1 1 57 57 THR CA C 57 65.067 65.067 64.332 0.735 18093 6752 1 10 . 1 1 57 57 THR CB C 57 69.179 69.179 70.297 -1.119 18093 6753 1 10 . 1 1 57 57 THR H H 57 7.655 7.655 7.360 0.295 18093 6754 1 10 . 1 1 58 58 GLU N N 58 117.313 117.313 123.320 -6.007 18093 6755 1 10 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.130 0.203 18093 6756 1 10 . 1 1 58 58 GLU C C 58 176.940 176.940 178.158 -1.218 18093 6757 1 10 . 1 1 58 58 GLU CA C 58 57.068 57.068 58.978 -1.910 18093 6758 1 10 . 1 1 58 58 GLU CB C 58 29.396 29.396 28.981 0.415 18093 6759 1 10 . 1 1 58 58 GLU H H 58 7.521 7.521 8.523 -1.002 18093 6760 1 10 . 1 1 59 59 ILE N N 59 114.870 114.870 112.589 2.281 18093 6761 1 10 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.078 0.011 18093 6762 1 10 . 1 1 59 59 ILE C C 59 175.456 175.456 175.830 -0.374 18093 6763 1 10 . 1 1 59 59 ILE CA C 59 62.434 62.434 61.764 0.670 18093 6764 1 10 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.689 -0.032 18093 6765 1 10 . 1 1 59 59 ILE H H 59 7.579 7.579 7.401 0.178 18093 6766 1 10 . 1 1 60 60 ILE N N 60 119.354 119.354 118.292 1.062 18093 6767 1 10 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.883 0.421 18093 6768 1 10 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.495 -1.879 18093 6769 1 10 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.331 2.531 18093 6770 1 10 . 1 1 60 60 ILE H H 60 7.629 7.629 7.752 -0.123 18093 6771 1 10 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.458 -0.058 18093 6772 1 10 . 1 1 61 61 PRO C C 61 177.144 177.144 177.085 0.059 18093 6773 1 10 . 1 1 61 61 PRO CA C 61 63.808 63.808 64.140 -0.332 18093 6774 1 10 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.062 -0.180 18093 6775 1 10 . 1 1 62 62 SER N N 62 114.474 114.474 112.505 1.969 18093 6776 1 10 . 1 1 62 62 SER HA H 62 4.434 4.434 4.162 0.272 18093 6777 1 10 . 1 1 62 62 SER C C 62 175.161 175.161 173.369 1.792 18093 6778 1 10 . 1 1 62 62 SER CA C 62 59.047 59.047 59.168 -0.121 18093 6779 1 10 . 1 1 62 62 SER CB C 62 63.704 63.704 62.869 0.835 18093 6780 1 10 . 1 1 62 62 SER H H 62 8.186 8.186 8.220 -0.034 18093 6781 1 10 . 1 1 63 63 THR N N 63 113.573 113.573 115.604 -2.031 18093 6782 1 10 . 1 1 63 63 THR HA H 63 4.319 4.319 4.519 -0.200 18093 6783 1 10 . 1 1 63 63 THR C C 63 174.834 174.834 174.599 0.235 18093 6784 1 10 . 1 1 63 63 THR CA C 63 62.377 62.377 61.487 0.890 18093 6785 1 10 . 1 1 63 63 THR CB C 63 69.422 69.422 70.256 -0.834 18093 6786 1 10 . 1 1 63 63 THR H H 63 7.963 7.963 7.943 0.020 18093 6787 1 10 . 1 1 64 64 SER N N 64 116.598 116.598 121.802 -5.204 18093 6788 1 10 . 1 1 64 64 SER HA H 64 4.428 4.428 4.648 -0.220 18093 6789 1 10 . 1 1 64 64 SER C C 64 174.618 174.618 175.825 -1.207 18093 6790 1 10 . 1 1 64 64 SER CA C 64 59.045 59.045 57.727 1.318 18093 6791 1 10 . 1 1 64 64 SER CB C 64 63.700 63.700 64.023 -0.323 18093 6792 1 10 . 1 1 64 64 SER H H 64 8.052 8.052 8.506 -0.454 18093 6793 1 10 . 1 1 65 65 SER N N 65 116.673 116.673 116.241 0.432 18093 6794 1 10 . 1 1 65 65 SER HA H 65 4.432 4.432 4.328 0.104 18093 6795 1 10 . 1 1 65 65 SER C C 65 174.335 174.335 175.030 -0.695 18093 6796 1 10 . 1 1 65 65 SER CA C 65 58.927 58.927 59.468 -0.541 18093 6797 1 10 . 1 1 65 65 SER CB C 65 63.621 63.621 63.234 0.387 18093 6798 1 10 . 1 1 65 65 SER H H 65 8.114 8.114 8.658 -0.544 18093 6799 1 10 . 1 1 66 66 VAL N N 66 119.054 119.054 114.539 4.515 18093 6800 1 10 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.170 0.000 18093 6801 1 10 . 1 1 66 66 VAL C C 66 175.278 175.278 175.736 -0.458 18093 6802 1 10 . 1 1 66 66 VAL CA C 66 62.062 62.062 63.008 -0.946 18093 6803 1 10 . 1 1 66 66 VAL CB C 66 32.629 32.629 31.854 0.775 18093 6804 1 10 . 1 1 66 66 VAL H H 66 7.740 7.740 7.703 0.037 18093 6805 1 10 . 1 1 67 67 SER N N 67 118.882 118.882 116.225 2.657 18093 6806 1 10 . 1 1 67 67 SER HA H 67 4.704 4.704 4.895 -0.191 18093 6807 1 10 . 1 1 67 67 SER CA C 67 56.715 56.715 55.787 0.928 18093 6808 1 10 . 1 1 67 67 SER CB C 67 63.624 63.624 64.506 -0.882 18093 6809 1 10 . 1 1 67 67 SER H H 67 8.060 8.060 7.468 0.593 18093 6810 1 10 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.554 -0.154 18093 6811 1 10 . 1 1 68 68 PRO C C 68 176.925 176.925 175.855 1.070 18093 6812 1 10 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.587 1.161 18093 6813 1 10 . 1 1 68 68 PRO CB C 68 32.005 32.005 32.427 -0.422 18093 6814 1 10 . 1 1 69 69 SER N N 69 114.930 114.930 113.568 1.362 18093 6815 1 10 . 1 1 69 69 SER HA H 69 4.422 4.422 4.539 -0.117 18093 6816 1 10 . 1 1 69 69 SER C C 69 175.617 175.617 174.626 0.991 18093 6817 1 10 . 1 1 69 69 SER CA C 69 58.697 58.697 57.684 1.013 18093 6818 1 10 . 1 1 69 69 SER CB C 69 63.804 63.804 64.204 -0.400 18093 6819 1 10 . 1 1 69 69 SER H H 69 8.205 8.205 7.863 0.342 18093 6820 1 10 . 1 1 70 70 ILE N N 70 120.840 120.840 122.082 -1.242 18093 6821 1 10 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.076 -0.084 18093 6822 1 10 . 1 1 70 70 ILE C C 70 177.524 177.524 176.632 0.892 18093 6823 1 10 . 1 1 70 70 ILE CA C 70 64.335 64.335 61.937 2.398 18093 6824 1 10 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.094 -0.634 18093 6825 1 10 . 1 1 70 70 ILE H H 70 8.283 8.283 8.530 -0.247 18093 6826 1 10 . 1 1 71 71 GLY N N 71 107.823 107.823 107.911 -0.088 18093 6827 1 10 . 1 1 71 71 GLY C C 71 175.296 175.296 176.057 -0.761 18093 6828 1 10 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.129 0.326 18093 6829 1 10 . 1 1 71 71 GLY H H 71 8.557 8.557 8.646 -0.089 18093 6830 1 10 . 1 1 72 72 GLU N N 72 120.835 120.835 121.131 -0.296 18093 6831 1 10 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.021 -0.174 18093 6832 1 10 . 1 1 72 72 GLU C C 72 178.198 178.198 178.355 -0.157 18093 6833 1 10 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.277 1.840 18093 6834 1 10 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.449 -0.056 18093 6835 1 10 . 1 1 72 72 GLU H H 72 7.922 7.922 7.727 0.195 18093 6836 1 10 . 1 1 73 73 TYR N N 73 117.375 117.375 121.691 -4.316 18093 6837 1 10 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.275 -0.113 18093 6838 1 10 . 1 1 73 73 TYR C C 73 179.912 179.912 177.410 2.502 18093 6839 1 10 . 1 1 73 73 TYR CA C 73 62.155 62.155 60.841 1.314 18093 6840 1 10 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.685 0.081 18093 6841 1 10 . 1 1 73 73 TYR H H 73 8.062 8.062 7.776 0.286 18093 6842 1 10 . 1 1 74 74 LEU N N 74 121.493 121.493 119.979 1.514 18093 6843 1 10 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.761 0.288 18093 6844 1 10 . 1 1 74 74 LEU C C 74 178.063 178.063 178.794 -0.731 18093 6845 1 10 . 1 1 74 74 LEU CA C 74 58.495 58.495 58.253 0.242 18093 6846 1 10 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.866 -0.019 18093 6847 1 10 . 1 1 74 74 LEU H H 74 8.552 8.552 8.664 -0.112 18093 6848 1 10 . 1 1 75 75 LEU N N 75 120.375 120.375 119.742 0.633 18093 6849 1 10 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.062 -0.022 18093 6850 1 10 . 1 1 75 75 LEU C C 75 178.515 178.515 178.920 -0.405 18093 6851 1 10 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.415 0.223 18093 6852 1 10 . 1 1 75 75 LEU CB C 75 42.039 42.039 41.886 0.153 18093 6853 1 10 . 1 1 75 75 LEU H H 75 8.276 8.276 7.520 0.756 18093 6854 1 10 . 1 1 76 76 PHE N N 76 116.626 116.626 118.168 -1.542 18093 6855 1 10 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.257 -0.178 18093 6856 1 10 . 1 1 76 76 PHE C C 76 177.399 177.399 178.068 -0.669 18093 6857 1 10 . 1 1 76 76 PHE CA C 76 61.734 61.734 60.535 1.199 18093 6858 1 10 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.198 0.543 18093 6859 1 10 . 1 1 76 76 PHE H H 76 8.454 8.454 8.108 0.346 18093 6860 1 10 . 1 1 77 77 THR N N 77 116.080 116.080 116.810 -0.730 18093 6861 1 10 . 1 1 77 77 THR HA H 77 3.687 3.687 4.044 -0.357 18093 6862 1 10 . 1 1 77 77 THR C C 77 176.018 176.018 176.238 -0.220 18093 6863 1 10 . 1 1 77 77 THR CA C 77 68.640 68.640 66.568 2.072 18093 6864 1 10 . 1 1 77 77 THR H H 77 8.224 8.224 8.234 -0.010 18093 6865 1 10 . 1 1 78 78 MET N N 78 119.394 119.394 120.712 -1.318 18093 6866 1 10 . 1 1 78 78 MET HA H 78 4.129 4.129 4.069 0.060 18093 6867 1 10 . 1 1 78 78 MET C C 78 179.608 179.608 178.769 0.839 18093 6868 1 10 . 1 1 78 78 MET CA C 78 58.831 58.831 59.710 -0.879 18093 6869 1 10 . 1 1 78 78 MET CB C 78 31.590 31.590 32.480 -0.890 18093 6870 1 10 . 1 1 78 78 MET H H 78 8.372 8.372 7.715 0.657 18093 6871 1 10 . 1 1 79 79 ILE N N 79 121.819 121.819 118.733 3.086 18093 6872 1 10 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.774 -0.224 18093 6873 1 10 . 1 1 79 79 ILE C C 79 176.426 176.426 177.679 -1.253 18093 6874 1 10 . 1 1 79 79 ILE CA C 79 65.876 65.876 64.156 1.720 18093 6875 1 10 . 1 1 79 79 ILE CB C 79 37.673 37.673 36.922 0.751 18093 6876 1 10 . 1 1 79 79 ILE H H 79 8.391 8.391 7.794 0.597 18093 6877 1 10 . 1 1 80 80 PHE N N 80 119.916 119.916 121.349 -1.433 18093 6878 1 10 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.114 -0.061 18093 6879 1 10 . 1 1 80 80 PHE C C 80 178.568 178.568 177.420 1.148 18093 6880 1 10 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.347 -0.040 18093 6881 1 10 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.188 -0.414 18093 6882 1 10 . 1 1 80 80 PHE H H 80 8.479 8.479 7.558 0.921 18093 6883 1 10 . 1 1 81 81 VAL N N 81 120.191 120.191 116.182 4.009 18093 6884 1 10 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.685 -0.232 18093 6885 1 10 . 1 1 81 81 VAL C C 81 178.225 178.225 177.621 0.604 18093 6886 1 10 . 1 1 81 81 VAL CA C 81 67.408 67.408 65.979 1.429 18093 6887 1 10 . 1 1 81 81 VAL CB C 81 31.556 31.556 30.675 0.881 18093 6888 1 10 . 1 1 81 81 VAL H H 81 8.928 8.928 8.701 0.227 18093 6889 1 10 . 1 1 82 82 THR N N 82 115.930 115.930 117.453 -1.523 18093 6890 1 10 . 1 1 82 82 THR HA H 82 3.636 3.636 3.882 -0.246 18093 6891 1 10 . 1 1 82 82 THR C C 82 176.420 176.420 176.366 0.054 18093 6892 1 10 . 1 1 82 82 THR CA C 82 68.570 68.570 67.455 1.115 18093 6893 1 10 . 1 1 82 82 THR CB C 82 68.202 68.202 68.775 -0.573 18093 6894 1 10 . 1 1 82 82 THR H H 82 7.969 7.969 7.232 0.737 18093 6895 1 10 . 1 1 83 83 LEU N N 83 119.780 119.780 120.702 -0.922 18093 6896 1 10 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.868 -0.021 18093 6897 1 10 . 1 1 83 83 LEU C C 83 178.214 178.214 178.598 -0.384 18093 6898 1 10 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.469 0.768 18093 6899 1 10 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.274 0.517 18093 6900 1 10 . 1 1 83 83 LEU H H 83 8.483 8.483 7.419 1.064 18093 6901 1 10 . 1 1 84 84 SER N N 84 114.559 114.559 116.209 -1.650 18093 6902 1 10 . 1 1 84 84 SER HA H 84 4.099 4.099 4.062 0.037 18093 6903 1 10 . 1 1 84 84 SER C C 84 176.799 176.799 176.755 0.044 18093 6904 1 10 . 1 1 84 84 SER CA C 84 63.609 63.609 61.836 1.773 18093 6905 1 10 . 1 1 84 84 SER CB C 84 63.110 63.110 62.838 0.272 18093 6906 1 10 . 1 1 84 84 SER H H 84 8.023 8.023 7.958 0.065 18093 6907 1 10 . 1 1 85 85 ILE N N 85 123.962 123.962 121.245 2.717 18093 6908 1 10 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.922 -0.318 18093 6909 1 10 . 1 1 85 85 ILE C C 85 177.487 177.487 178.222 -0.735 18093 6910 1 10 . 1 1 85 85 ILE CA C 85 65.759 65.759 64.979 0.780 18093 6911 1 10 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.952 -0.065 18093 6912 1 10 . 1 1 85 85 ILE H H 85 8.054 8.054 8.065 -0.011 18093 6913 1 10 . 1 1 86 86 VAL N N 86 118.744 118.744 120.837 -2.093 18093 6914 1 10 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.757 -0.238 18093 6915 1 10 . 1 1 86 86 VAL C C 86 177.557 177.557 177.896 -0.339 18093 6916 1 10 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.422 1.113 18093 6917 1 10 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.650 -0.184 18093 6918 1 10 . 1 1 86 86 VAL H H 86 8.158 8.158 7.268 0.890 18093 6919 1 10 . 1 1 87 87 ILE N N 87 117.206 117.206 119.389 -2.183 18093 6920 1 10 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.756 -0.152 18093 6921 1 10 . 1 1 87 87 ILE C C 87 177.283 177.283 178.495 -1.212 18093 6922 1 10 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.823 1.853 18093 6923 1 10 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.494 1.095 18093 6924 1 10 . 1 1 87 87 ILE H H 87 8.459 8.459 8.450 0.009 18093 6925 1 10 . 1 1 88 88 THR N N 88 116.158 116.158 117.149 -0.991 18093 6926 1 10 . 1 1 88 88 THR HA H 88 3.672 3.672 4.121 -0.449 18093 6927 1 10 . 1 1 88 88 THR C C 88 175.485 175.485 176.591 -1.106 18093 6928 1 10 . 1 1 88 88 THR CA C 88 68.549 68.549 67.109 1.440 18093 6929 1 10 . 1 1 88 88 THR CB C 88 68.127 68.127 68.844 -0.717 18093 6930 1 10 . 1 1 88 88 THR H H 88 7.776 7.776 8.283 -0.507 18093 6931 1 10 . 1 1 89 89 VAL N N 89 117.985 117.985 121.315 -3.330 18093 6932 1 10 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.919 -0.376 18093 6933 1 10 . 1 1 89 89 VAL C C 89 177.393 177.393 177.408 -0.015 18093 6934 1 10 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.627 0.963 18093 6935 1 10 . 1 1 89 89 VAL CB C 89 31.778 31.778 32.058 -0.280 18093 6936 1 10 . 1 1 89 89 VAL H H 89 8.206 8.206 7.600 0.606 18093 6937 1 10 . 1 1 90 90 PHE N N 90 116.709 116.709 119.687 -2.978 18093 6938 1 10 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.239 0.139 18093 6939 1 10 . 1 1 90 90 PHE C C 90 177.305 177.305 177.622 -0.317 18093 6940 1 10 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.213 -0.094 18093 6941 1 10 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.436 0.949 18093 6942 1 10 . 1 1 90 90 PHE H H 90 7.956 7.956 7.928 0.028 18093 6943 1 10 . 1 1 91 91 VAL N N 91 116.565 116.565 119.283 -2.718 18093 6944 1 10 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.707 0.128 18093 6945 1 10 . 1 1 91 91 VAL C C 91 176.927 176.927 177.366 -0.439 18093 6946 1 10 . 1 1 91 91 VAL CA C 91 65.347 65.347 66.179 -0.832 18093 6947 1 10 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.987 -0.120 18093 6948 1 10 . 1 1 91 91 VAL H H 91 8.239 8.239 7.658 0.581 18093 6949 1 10 . 1 1 92 92 LEU N N 92 117.443 117.443 116.899 0.544 18093 6950 1 10 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.317 -0.123 18093 6951 1 10 . 1 1 92 92 LEU C C 92 177.180 177.180 176.927 0.253 18093 6952 1 10 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.506 -0.322 18093 6953 1 10 . 1 1 92 92 LEU CB C 92 41.944 41.944 41.991 -0.047 18093 6954 1 10 . 1 1 92 92 LEU H H 92 7.967 7.967 7.487 0.480 18093 6955 1 10 . 1 1 93 93 ASN N N 93 116.705 116.705 116.252 0.453 18093 6956 1 10 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.548 0.099 18093 6957 1 10 . 1 1 93 93 ASN C C 93 175.129 175.129 176.468 -1.339 18093 6958 1 10 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.434 -1.580 18093 6959 1 10 . 1 1 93 93 ASN CB C 93 39.395 39.395 38.730 0.665 18093 6960 1 10 . 1 1 93 93 ASN H H 93 7.683 7.683 7.534 0.149 18093 6961 1 10 . 1 1 94 94 VAL N N 94 118.224 118.224 119.135 -0.911 18093 6962 1 10 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.764 0.197 18093 6963 1 10 . 1 1 94 94 VAL C C 94 175.600 175.600 176.480 -0.880 18093 6964 1 10 . 1 1 94 94 VAL CA C 94 62.825 62.825 64.859 -2.034 18093 6965 1 10 . 1 1 94 94 VAL CB C 94 32.214 32.214 32.304 -0.090 18093 6966 1 10 . 1 1 94 94 VAL H H 94 7.627 7.627 7.477 0.150 18093 6967 1 10 . 1 1 95 95 HIS N N 95 120.999 120.999 118.184 2.815 18093 6968 1 10 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.327 0.266 18093 6969 1 10 . 1 1 95 95 HIS C C 95 174.146 174.146 175.009 -0.863 18093 6970 1 10 . 1 1 95 95 HIS CA C 95 55.666 55.666 57.489 -1.823 18093 6971 1 10 . 1 1 95 95 HIS CB C 95 29.736 29.736 29.111 0.625 18093 6972 1 10 . 1 1 95 95 HIS H H 95 8.263 8.263 7.720 0.543 18093 6973 1 10 . 1 1 96 96 HIS N N 96 122.740 122.740 122.352 0.388 18093 6974 1 10 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.619 0.014 18093 6975 1 10 . 1 1 96 96 HIS CA C 96 55.895 55.895 55.785 0.111 18093 6976 1 10 . 1 1 96 96 HIS CB C 96 29.750 29.750 30.903 -1.153 18093 6977 1 10 . 1 1 96 96 HIS H H 96 8.298 8.298 8.625 -0.327 18093 6978 1 10 . 1 1 97 97 ARG N N 97 118.503 118.503 120.129 -1.626 18093 6979 1 10 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.702 -0.390 18093 6980 1 10 . 1 1 97 97 ARG C C 97 175.776 175.776 175.302 0.474 18093 6981 1 10 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.585 0.640 18093 6982 1 10 . 1 1 97 97 ARG CB C 97 30.912 30.912 32.011 -1.099 18093 6983 1 10 . 1 1 97 97 ARG H H 97 8.250 8.250 8.282 -0.032 18093 6984 1 10 . 1 1 98 98 SER N N 98 118.482 118.482 114.505 3.977 18093 6985 1 10 . 1 1 98 98 SER HA H 98 4.722 4.722 4.766 -0.044 18093 6986 1 10 . 1 1 98 98 SER CA C 98 56.547 56.547 56.008 0.539 18093 6987 1 10 . 1 1 98 98 SER CB C 98 63.624 63.624 64.472 -0.847 18093 6988 1 10 . 1 1 98 98 SER H H 98 8.254 8.254 8.457 -0.203 18093 6989 1 10 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.473 -0.070 18093 6990 1 10 . 1 1 99 99 PRO C C 99 176.899 176.899 176.628 0.271 18093 6991 1 10 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.417 -0.716 18093 6992 1 10 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.416 -0.467 18093 6993 1 10 . 1 1 100 100 GLU N N 100 120.187 120.187 114.466 5.721 18093 6994 1 10 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.330 -0.042 18093 6995 1 10 . 1 1 100 100 GLU C C 100 176.593 176.593 175.214 1.379 18093 6996 1 10 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.580 0.142 18093 6997 1 10 . 1 1 100 100 GLU CB C 100 29.999 29.999 29.753 0.246 18093 6998 1 10 . 1 1 100 100 GLU H H 100 8.401 8.401 8.052 0.349 18093 6999 1 10 . 1 1 101 101 THR N N 101 113.968 113.968 115.989 -2.021 18093 7000 1 10 . 1 1 101 101 THR HA H 101 4.286 4.286 4.325 -0.039 18093 7001 1 10 . 1 1 101 101 THR C C 101 174.525 174.525 175.478 -0.953 18093 7002 1 10 . 1 1 101 101 THR CA C 101 61.956 61.956 62.758 -0.802 18093 7003 1 10 . 1 1 101 101 THR CB C 101 69.697 69.697 69.718 -0.021 18093 7004 1 10 . 1 1 101 101 THR H H 101 7.945 7.945 7.890 0.055 18093 7005 1 10 . 1 1 102 102 HIS N N 102 120.322 120.322 123.247 -2.925 18093 7006 1 10 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.244 0.497 18093 7007 1 10 . 1 1 102 102 HIS C C 102 174.783 174.783 176.065 -1.282 18093 7008 1 10 . 1 1 102 102 HIS CA C 102 55.701 55.701 58.614 -2.913 18093 7009 1 10 . 1 1 102 102 HIS CB C 102 29.093 29.093 30.104 -1.011 18093 7010 1 10 . 1 1 102 102 HIS H H 102 8.455 8.455 8.834 -0.379 18093 7011 1 10 . 1 1 103 103 THR N N 103 114.282 114.282 112.033 2.249 18093 7012 1 10 . 1 1 103 103 THR HA H 103 4.352 4.352 4.445 -0.093 18093 7013 1 10 . 1 1 103 103 THR C C 103 175.104 175.104 174.125 0.979 18093 7014 1 10 . 1 1 103 103 THR CA C 103 62.057 62.057 61.671 0.386 18093 7015 1 10 . 1 1 103 103 THR CB C 103 69.966 69.966 69.620 0.347 18093 7016 1 10 . 1 1 103 103 THR H H 103 8.069 8.069 7.704 0.365 18093 7017 1 10 . 1 1 104 104 GLY N N 104 111.159 111.159 113.028 -1.869 18093 7018 1 10 . 1 1 104 104 GLY C C 104 174.776 174.776 173.626 1.150 18093 7019 1 10 . 1 1 104 104 GLY CA C 104 45.588 45.588 44.630 0.959 18093 7020 1 10 . 1 1 104 104 GLY H H 104 8.393 8.393 8.305 0.088 18093 7021 1 10 . 1 1 105 105 GLY N N 105 108.657 108.657 109.039 -0.382 18093 7022 1 10 . 1 1 105 105 GLY C C 105 174.957 174.957 174.564 0.393 18093 7023 1 10 . 1 1 105 105 GLY CA C 105 45.612 45.612 44.797 0.815 18093 7024 1 10 . 1 1 105 105 GLY H H 105 8.275 8.275 8.307 -0.033 18093 7025 1 10 . 1 1 106 106 GLY N N 106 108.870 108.870 109.701 -0.831 18093 7026 1 10 . 1 1 106 106 GLY C C 106 174.877 174.877 174.343 0.534 18093 7027 1 10 . 1 1 106 106 GLY CA C 106 45.665 45.665 44.691 0.974 18093 7028 1 10 . 1 1 106 106 GLY H H 106 8.357 8.357 7.963 0.394 18093 7029 1 10 . 1 1 107 107 GLY N N 107 108.476 108.476 109.164 -0.688 18093 7030 1 10 . 1 1 107 107 GLY C C 107 174.877 174.877 174.950 -0.073 18093 7031 1 10 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.205 0.491 18093 7032 1 10 . 1 1 107 107 GLY H H 107 8.330 8.330 8.279 0.051 18093 7033 1 10 . 1 1 108 108 GLY N N 108 108.486 108.486 108.390 0.096 18093 7034 1 10 . 1 1 108 108 GLY C C 108 175.345 175.345 175.752 -0.407 18093 7035 1 10 . 1 1 108 108 GLY CA C 108 45.763 45.763 44.568 1.195 18093 7036 1 10 . 1 1 108 108 GLY H H 108 8.328 8.328 8.433 -0.105 18093 7037 1 10 . 1 1 109 109 ILE N N 109 120.433 120.433 120.527 -0.094 18093 7038 1 10 . 1 1 109 109 ILE HA H 109 3.968 3.968 4.033 -0.065 18093 7039 1 10 . 1 1 109 109 ILE C C 109 176.127 176.127 177.083 -0.956 18093 7040 1 10 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.451 -0.716 18093 7041 1 10 . 1 1 109 109 ILE CB C 109 38.125 38.125 38.336 -0.211 18093 7042 1 10 . 1 1 109 109 ILE H H 109 8.192 8.192 8.094 0.098 18093 7043 1 10 . 1 1 110 110 ASP N N 110 121.148 121.148 119.781 1.367 18093 7044 1 10 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.599 -0.293 18093 7045 1 10 . 1 1 110 110 ASP C C 110 177.651 177.651 178.535 -0.884 18093 7046 1 10 . 1 1 110 110 ASP CA C 110 56.776 56.776 58.141 -1.365 18093 7047 1 10 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.352 0.744 18093 7048 1 10 . 1 1 110 110 ASP H H 110 8.427 8.427 8.621 -0.194 18093 7049 1 10 . 1 1 111 111 ARG N N 111 119.228 119.228 118.851 0.377 18093 7050 1 10 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.242 -0.246 18093 7051 1 10 . 1 1 111 111 ARG C C 111 177.786 177.786 179.005 -1.219 18093 7052 1 10 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.071 -0.129 18093 7053 1 10 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.917 0.279 18093 7054 1 10 . 1 1 111 111 ARG H H 111 7.850 7.850 8.433 -0.583 18093 7055 1 10 . 1 1 112 112 ILE N N 112 118.000 118.000 119.693 -1.693 18093 7056 1 10 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.106 -0.293 18093 7057 1 10 . 1 1 112 112 ILE C C 112 177.496 177.496 177.978 -0.482 18093 7058 1 10 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.231 2.581 18093 7059 1 10 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.918 0.809 18093 7060 1 10 . 1 1 112 112 ILE H H 112 7.764 7.764 7.661 0.103 18093 7061 1 10 . 1 1 113 113 PHE N N 113 118.367 118.367 122.182 -3.815 18093 7062 1 10 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.247 0.008 18093 7063 1 10 . 1 1 113 113 PHE C C 113 177.218 177.218 177.388 -0.170 18093 7064 1 10 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.419 -0.986 18093 7065 1 10 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.184 -0.377 18093 7066 1 10 . 1 1 113 113 PHE H H 113 7.963 7.963 8.104 -0.141 18093 7067 1 10 . 1 1 114 114 LEU N N 114 118.921 118.921 117.761 1.160 18093 7068 1 10 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.967 0.030 18093 7069 1 10 . 1 1 114 114 LEU C C 114 178.297 178.297 178.332 -0.035 18093 7070 1 10 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.287 0.324 18093 7071 1 10 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.209 0.743 18093 7072 1 10 . 1 1 114 114 LEU H H 114 7.939 7.939 8.064 -0.125 18093 7073 1 10 . 1 1 115 115 TRP N N 115 117.464 117.464 119.464 -2.000 18093 7074 1 10 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.377 -0.003 18093 7075 1 10 . 1 1 115 115 TRP C C 115 178.572 178.572 178.247 0.325 18093 7076 1 10 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.781 1.141 18093 7077 1 10 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.770 -1.263 18093 7078 1 10 . 1 1 115 115 TRP H H 115 7.969 7.969 7.610 0.359 18093 7079 1 10 . 1 1 116 116 MET N N 116 117.069 117.069 118.911 -1.842 18093 7080 1 10 . 1 1 116 116 MET HA H 116 4.065 4.065 4.213 -0.148 18093 7081 1 10 . 1 1 116 116 MET C C 116 177.425 177.425 178.177 -0.752 18093 7082 1 10 . 1 1 116 116 MET CA C 116 59.289 59.289 59.086 0.203 18093 7083 1 10 . 1 1 116 116 MET CB C 116 31.692 31.692 32.506 -0.814 18093 7084 1 10 . 1 1 116 116 MET H H 116 8.465 8.465 7.710 0.755 18093 7085 1 10 . 1 1 117 117 PHE N N 117 118.755 118.755 117.726 1.029 18093 7086 1 10 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.064 0.035 18093 7087 1 10 . 1 1 117 117 PHE C C 117 177.965 177.965 178.315 -0.350 18093 7088 1 10 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.214 -0.506 18093 7089 1 10 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.259 0.926 18093 7090 1 10 . 1 1 117 117 PHE H H 117 8.418 8.418 7.838 0.580 18093 7091 1 10 . 1 1 118 118 ILE N N 118 119.133 119.133 115.349 3.784 18093 7092 1 10 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.898 -0.554 18093 7093 1 10 . 1 1 118 118 ILE C C 118 177.244 177.244 177.619 -0.375 18093 7094 1 10 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.310 1.515 18093 7095 1 10 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.763 -0.215 18093 7096 1 10 . 1 1 118 118 ILE H H 118 8.266 8.266 7.723 0.543 18093 7097 1 10 . 1 1 119 119 ILE N N 119 118.846 118.846 121.411 -2.565 18093 7098 1 10 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.962 -0.390 18093 7099 1 10 . 1 1 119 119 ILE C C 119 177.523 177.523 177.662 -0.139 18093 7100 1 10 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.089 0.800 18093 7101 1 10 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.299 -0.735 18093 7102 1 10 . 1 1 119 119 ILE H H 119 8.308 8.308 7.322 0.987 18093 7103 1 10 . 1 1 120 120 VAL N N 120 119.228 119.228 117.940 1.288 18093 7104 1 10 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.831 -0.323 18093 7105 1 10 . 1 1 120 120 VAL C C 120 177.651 177.651 177.507 0.144 18093 7106 1 10 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.819 1.782 18093 7107 1 10 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.424 0.982 18093 7108 1 10 . 1 1 120 120 VAL H H 120 8.399 8.399 8.013 0.386 18093 7109 1 10 . 1 1 121 121 CYS N N 121 117.151 117.151 119.971 -2.820 18093 7110 1 10 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.159 -0.256 18093 7111 1 10 . 1 1 121 121 CYS C C 121 177.719 177.719 177.178 0.541 18093 7112 1 10 . 1 1 121 121 CYS CA C 121 64.298 64.298 63.318 0.980 18093 7113 1 10 . 1 1 121 121 CYS CB C 121 26.677 26.677 26.161 0.516 18093 7114 1 10 . 1 1 121 121 CYS H H 121 8.008 8.008 7.585 0.423 18093 7115 1 10 . 1 1 122 122 LEU N N 122 121.402 121.402 120.040 1.362 18093 7116 1 10 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.225 -0.242 18093 7117 1 10 . 1 1 122 122 LEU C C 122 178.282 178.282 178.841 -0.559 18093 7118 1 10 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.693 0.852 18093 7119 1 10 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.414 0.552 18093 7120 1 10 . 1 1 122 122 LEU H H 122 8.417 8.417 7.713 0.704 18093 7121 1 10 . 1 1 123 123 LEU N N 123 118.543 118.543 120.840 -2.297 18093 7122 1 10 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.102 -0.182 18093 7123 1 10 . 1 1 123 123 LEU C C 123 179.028 179.028 178.637 0.391 18093 7124 1 10 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.415 -0.298 18093 7125 1 10 . 1 1 123 123 LEU CB C 123 42.056 42.056 41.081 0.975 18093 7126 1 10 . 1 1 123 123 LEU H H 123 8.590 8.590 7.667 0.923 18093 7127 1 10 . 1 1 124 124 GLY N N 124 104.896 104.896 105.560 -0.664 18093 7128 1 10 . 1 1 124 124 GLY C C 124 173.932 173.932 176.183 -2.251 18093 7129 1 10 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.452 -0.225 18093 7130 1 10 . 1 1 124 124 GLY H H 124 8.601 8.601 8.402 0.199 18093 7131 1 10 . 1 1 125 125 THR N N 125 115.403 115.403 119.073 -3.670 18093 7132 1 10 . 1 1 125 125 THR HA H 125 3.686 3.686 3.792 -0.106 18093 7133 1 10 . 1 1 125 125 THR C C 125 176.407 176.407 176.466 -0.059 18093 7134 1 10 . 1 1 125 125 THR CA C 125 67.565 67.565 67.406 0.159 18093 7135 1 10 . 1 1 125 125 THR CB C 125 68.143 68.143 68.772 -0.629 18093 7136 1 10 . 1 1 125 125 THR H H 125 7.734 7.734 7.402 0.332 18093 7137 1 10 . 1 1 126 126 VAL N N 126 119.056 119.056 121.347 -2.291 18093 7138 1 10 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.712 -0.173 18093 7139 1 10 . 1 1 126 126 VAL C C 126 177.628 177.628 178.215 -0.587 18093 7140 1 10 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.875 -0.274 18093 7141 1 10 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.697 -0.203 18093 7142 1 10 . 1 1 126 126 VAL H H 126 8.015 8.015 7.804 0.211 18093 7143 1 10 . 1 1 127 127 GLY N N 127 104.644 104.644 106.898 -2.254 18093 7144 1 10 . 1 1 127 127 GLY C C 127 173.933 173.933 175.726 -1.793 18093 7145 1 10 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.175 0.105 18093 7146 1 10 . 1 1 127 127 GLY H H 127 8.248 8.248 8.365 -0.117 18093 7147 1 10 . 1 1 128 128 LEU N N 128 117.354 117.354 120.875 -3.521 18093 7148 1 10 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.067 -0.055 18093 7149 1 10 . 1 1 128 128 LEU C C 128 177.443 177.443 178.208 -0.765 18093 7150 1 10 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.988 -0.362 18093 7151 1 10 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.689 0.571 18093 7152 1 10 . 1 1 128 128 LEU H H 128 7.568 7.568 7.714 -0.146 18093 7153 1 10 . 1 1 129 129 PHE N N 129 113.971 113.971 116.639 -2.668 18093 7154 1 10 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.372 0.086 18093 7155 1 10 . 1 1 129 129 PHE C C 129 176.216 176.216 176.360 -0.144 18093 7156 1 10 . 1 1 129 129 PHE CA C 129 58.385 58.385 60.965 -2.579 18093 7157 1 10 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.727 -0.008 18093 7158 1 10 . 1 1 129 129 PHE H H 129 7.639 7.639 7.415 0.224 18093 7159 1 10 . 1 1 130 130 LEU N N 130 117.752 117.752 119.905 -2.153 18093 7160 1 10 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.851 -0.418 18093 7161 1 10 . 1 1 130 130 LEU CA C 130 54.156 54.156 52.326 1.830 18093 7162 1 10 . 1 1 130 130 LEU H H 130 8.099 8.099 7.632 0.467 18093 7163 1 10 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.908 -0.458 18093 7164 1 10 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.470 2.429 18093 7165 1 10 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.406 -0.144 18093 7166 1 10 . 1 1 132 132 PRO C C 132 177.616 177.616 178.678 -1.062 18093 7167 1 10 . 1 1 132 132 PRO CA C 132 64.980 64.980 65.442 -0.462 18093 7168 1 10 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.202 -0.577 18093 7169 1 10 . 1 1 133 133 TRP N N 133 115.508 115.508 119.760 -4.252 18093 7170 1 10 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.406 0.186 18093 7171 1 10 . 1 1 133 133 TRP C C 133 176.842 176.842 177.936 -1.094 18093 7172 1 10 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.639 -2.356 18093 7173 1 10 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.438 -0.842 18093 7174 1 10 . 1 1 133 133 TRP H H 133 7.311 7.311 8.272 -0.961 18093 7175 1 10 . 1 1 134 134 LEU N N 134 119.570 119.570 117.068 2.502 18093 7176 1 10 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.214 -0.037 18093 7177 1 10 . 1 1 134 134 LEU C C 134 175.768 175.768 177.552 -1.784 18093 7178 1 10 . 1 1 134 134 LEU CA C 134 55.621 55.621 55.272 0.349 18093 7179 1 10 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.367 1.281 18093 7180 1 10 . 1 1 134 134 LEU H H 134 7.453 7.453 7.877 -0.424 18093 7181 1 10 . 1 1 135 135 ALA N N 135 119.004 119.004 122.526 -3.522 18093 7182 1 10 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.187 0.036 18093 7183 1 10 . 1 1 135 135 ALA C C 135 177.170 177.170 178.081 -0.911 18093 7184 1 10 . 1 1 135 135 ALA CA C 135 52.456 52.456 53.981 -1.525 18093 7185 1 10 . 1 1 135 135 ALA CB C 135 19.736 19.736 19.556 0.180 18093 7186 1 10 . 1 1 135 135 ALA H H 135 7.541 7.541 7.518 0.023 18093 7187 1 10 . 1 1 136 136 GLY N N 136 105.879 105.879 106.268 -0.389 18093 7188 1 10 . 1 1 136 136 GLY C C 136 173.042 173.042 173.520 -0.478 18093 7189 1 10 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.079 0.614 18093 7190 1 10 . 1 1 136 136 GLY H H 136 7.846 7.846 7.745 0.101 18093 7191 1 11 . 1 1 5 5 GLU N N 5 119.627 119.627 120.114 -0.487 18093 7192 1 11 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.428 -0.220 18093 7193 1 11 . 1 1 5 5 GLU C C 5 176.581 176.581 175.153 1.428 18093 7194 1 11 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.369 0.676 18093 7195 1 11 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.895 0.143 18093 7196 1 11 . 1 1 5 5 GLU H H 5 8.003 8.003 8.246 -0.243 18093 7197 1 11 . 1 1 6 6 LEU N N 6 121.267 121.267 122.187 -0.920 18093 7198 1 11 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.696 -0.271 18093 7199 1 11 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.422 2.213 18093 7200 1 11 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.803 -0.507 18093 7201 1 11 . 1 1 6 6 LEU H H 6 8.104 8.104 7.890 0.214 18093 7202 1 11 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.576 -0.177 18093 7203 1 11 . 1 1 7 7 PRO C C 7 178.408 178.408 177.982 0.426 18093 7204 1 11 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.085 2.627 18093 7205 1 11 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.847 -0.930 18093 7206 1 11 . 1 1 8 8 LEU N N 8 121.835 121.835 121.028 0.807 18093 7207 1 11 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.128 -0.039 18093 7208 1 11 . 1 1 8 8 LEU C C 8 177.902 177.902 178.353 -0.451 18093 7209 1 11 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.669 0.436 18093 7210 1 11 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.199 0.408 18093 7211 1 11 . 1 1 8 8 LEU H H 8 8.162 8.162 8.580 -0.418 18093 7212 1 11 . 1 1 9 9 PHE N N 9 118.342 118.342 119.087 -0.745 18093 7213 1 11 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.156 0.033 18093 7214 1 11 . 1 1 9 9 PHE C C 9 177.596 177.596 177.116 0.480 18093 7215 1 11 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.193 -0.079 18093 7216 1 11 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.221 0.506 18093 7217 1 11 . 1 1 9 9 PHE H H 9 8.318 8.318 8.206 0.112 18093 7218 1 11 . 1 1 10 10 TYR N N 10 117.584 117.584 118.897 -1.313 18093 7219 1 11 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.797 0.357 18093 7220 1 11 . 1 1 10 10 TYR C C 10 177.630 177.630 177.309 0.321 18093 7221 1 11 . 1 1 10 10 TYR CA C 10 61.036 61.036 59.858 1.178 18093 7222 1 11 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.117 0.543 18093 7223 1 11 . 1 1 10 10 TYR H H 10 8.105 8.105 8.411 -0.306 18093 7224 1 11 . 1 1 11 11 THR N N 11 115.563 115.563 116.608 -1.045 18093 7225 1 11 . 1 1 11 11 THR HA H 11 3.871 3.871 3.848 0.023 18093 7226 1 11 . 1 1 11 11 THR C C 11 175.955 175.955 176.548 -0.593 18093 7227 1 11 . 1 1 11 11 THR CA C 11 67.290 67.290 66.604 0.686 18093 7228 1 11 . 1 1 11 11 THR CB C 11 68.201 68.201 68.678 -0.477 18093 7229 1 11 . 1 1 11 11 THR H H 11 7.915 7.915 7.603 0.312 18093 7230 1 11 . 1 1 12 12 ILE N N 12 119.727 119.727 120.120 -0.393 18093 7231 1 11 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.879 -0.180 18093 7232 1 11 . 1 1 12 12 ILE C C 12 175.773 175.773 177.333 -1.560 18093 7233 1 11 . 1 1 12 12 ILE CA C 12 64.699 64.699 62.847 1.852 18093 7234 1 11 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.799 1.297 18093 7235 1 11 . 1 1 12 12 ILE H H 12 8.186 8.186 7.861 0.325 18093 7236 1 11 . 1 1 13 13 ASN N N 13 114.190 114.190 118.362 -4.172 18093 7237 1 11 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.528 -0.106 18093 7238 1 11 . 1 1 13 13 ASN C C 13 174.786 174.786 176.654 -1.868 18093 7239 1 11 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.258 0.297 18093 7240 1 11 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.677 0.681 18093 7241 1 11 . 1 1 13 13 ASN H H 13 7.601 7.601 7.315 0.286 18093 7242 1 11 . 1 1 14 14 LEU N N 14 115.031 115.031 119.480 -4.449 18093 7243 1 11 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.104 0.092 18093 7244 1 11 . 1 1 14 14 LEU C C 14 177.540 177.540 178.149 -0.609 18093 7245 1 11 . 1 1 14 14 LEU CA C 14 56.407 56.407 55.743 0.664 18093 7246 1 11 . 1 1 14 14 LEU CB C 14 41.842 41.842 41.791 0.051 18093 7247 1 11 . 1 1 14 14 LEU H H 14 7.390 7.390 7.371 0.019 18093 7248 1 11 . 1 1 15 15 ILE N N 15 118.223 118.223 120.738 -2.515 18093 7249 1 11 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.679 -0.066 18093 7250 1 11 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.465 3.255 18093 7251 1 11 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.126 -0.514 18093 7252 1 11 . 1 1 15 15 ILE H H 15 8.123 8.123 7.445 0.678 18093 7253 1 11 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.296 -0.227 18093 7254 1 11 . 1 1 17 17 PRO C C 17 177.721 177.721 178.591 -0.870 18093 7255 1 11 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.477 1.284 18093 7256 1 11 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.736 0.006 18093 7257 1 11 . 1 1 18 18 CYS N N 18 113.538 113.538 117.469 -3.931 18093 7258 1 11 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.078 -0.070 18093 7259 1 11 . 1 1 18 18 CYS C C 18 177.683 177.683 177.017 0.666 18093 7260 1 11 . 1 1 18 18 CYS CA C 18 64.500 64.500 62.991 1.509 18093 7261 1 11 . 1 1 18 18 CYS CB C 18 26.873 26.873 26.496 0.377 18093 7262 1 11 . 1 1 18 18 CYS H H 18 7.410 7.410 7.408 0.002 18093 7263 1 11 . 1 1 19 19 LEU N N 19 122.545 122.545 119.123 3.422 18093 7264 1 11 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.138 -0.139 18093 7265 1 11 . 1 1 19 19 LEU C C 19 178.608 178.608 178.995 -0.387 18093 7266 1 11 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.228 1.193 18093 7267 1 11 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.285 0.559 18093 7268 1 11 . 1 1 19 19 LEU H H 19 8.635 8.635 7.378 1.257 18093 7269 1 11 . 1 1 20 20 LEU N N 20 119.404 119.404 120.907 -1.503 18093 7270 1 11 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.900 0.106 18093 7271 1 11 . 1 1 20 20 LEU C C 20 178.540 178.540 179.231 -0.691 18093 7272 1 11 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.518 0.281 18093 7273 1 11 . 1 1 20 20 LEU CB C 20 41.999 41.999 42.110 -0.111 18093 7274 1 11 . 1 1 20 20 LEU H H 20 8.392 8.392 7.498 0.894 18093 7275 1 11 . 1 1 21 21 ILE N N 21 117.335 117.335 114.615 2.720 18093 7276 1 11 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.788 -0.137 18093 7277 1 11 . 1 1 21 21 ILE C C 21 177.249 177.249 177.718 -0.469 18093 7278 1 11 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.860 0.401 18093 7279 1 11 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.357 0.603 18093 7280 1 11 . 1 1 21 21 ILE H H 21 8.403 8.403 8.537 -0.134 18093 7281 1 11 . 1 1 22 22 SER N N 22 116.385 116.385 118.641 -2.256 18093 7282 1 11 . 1 1 22 22 SER HA H 22 4.056 4.056 4.304 -0.248 18093 7283 1 11 . 1 1 22 22 SER C C 22 176.813 176.813 176.792 0.021 18093 7284 1 11 . 1 1 22 22 SER CA C 22 63.866 63.866 62.083 1.783 18093 7285 1 11 . 1 1 22 22 SER CB C 22 62.898 62.898 62.480 0.418 18093 7286 1 11 . 1 1 22 22 SER H H 22 8.271 8.271 7.558 0.713 18093 7287 1 11 . 1 1 23 23 CYS N N 23 119.001 119.001 120.747 -1.746 18093 7288 1 11 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.072 -0.082 18093 7289 1 11 . 1 1 23 23 CYS C C 23 177.594 177.594 176.395 1.199 18093 7290 1 11 . 1 1 23 23 CYS CA C 23 64.429 64.429 63.661 0.768 18093 7291 1 11 . 1 1 23 23 CYS CB C 23 26.940 26.940 27.497 -0.557 18093 7292 1 11 . 1 1 23 23 CYS H H 23 8.161 8.161 8.594 -0.433 18093 7293 1 11 . 1 1 24 24 LEU N N 24 117.814 117.814 120.897 -3.083 18093 7294 1 11 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.847 0.130 18093 7295 1 11 . 1 1 24 24 LEU C C 24 177.944 177.944 177.815 0.129 18093 7296 1 11 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.545 -0.258 18093 7297 1 11 . 1 1 24 24 LEU CB C 24 41.903 41.903 42.052 -0.149 18093 7298 1 11 . 1 1 24 24 LEU H H 24 8.106 8.106 7.548 0.558 18093 7299 1 11 . 1 1 25 25 THR N N 25 115.670 115.670 114.761 0.909 18093 7300 1 11 . 1 1 25 25 THR HA H 25 3.687 3.687 3.940 -0.253 18093 7301 1 11 . 1 1 25 25 THR C C 25 175.845 175.845 176.564 -0.719 18093 7302 1 11 . 1 1 25 25 THR CA C 25 68.306 68.306 66.932 1.374 18093 7303 1 11 . 1 1 25 25 THR H H 25 7.924 7.924 7.506 0.418 18093 7304 1 11 . 1 1 26 26 VAL N N 26 118.809 118.809 121.251 -2.442 18093 7305 1 11 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.752 -0.237 18093 7306 1 11 . 1 1 26 26 VAL C C 26 177.530 177.530 177.661 -0.131 18093 7307 1 11 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.054 1.227 18093 7308 1 11 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.181 0.543 18093 7309 1 11 . 1 1 26 26 VAL H H 26 7.764 7.764 7.273 0.491 18093 7310 1 11 . 1 1 27 27 LEU N N 27 117.958 117.958 121.394 -3.436 18093 7311 1 11 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.063 -0.027 18093 7312 1 11 . 1 1 27 27 LEU C C 27 178.163 178.163 178.735 -0.572 18093 7313 1 11 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.001 0.508 18093 7314 1 11 . 1 1 27 27 LEU CB C 27 41.919 41.919 41.039 0.880 18093 7315 1 11 . 1 1 27 27 LEU H H 27 7.912 7.912 8.168 -0.256 18093 7316 1 11 . 1 1 28 28 VAL N N 28 114.472 114.472 115.857 -1.385 18093 7317 1 11 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.807 -0.272 18093 7318 1 11 . 1 1 28 28 VAL C C 28 176.871 176.871 177.941 -1.070 18093 7319 1 11 . 1 1 28 28 VAL CA C 28 65.977 65.977 65.236 0.741 18093 7320 1 11 . 1 1 28 28 VAL CB C 28 31.934 31.934 30.610 1.324 18093 7321 1 11 . 1 1 28 28 VAL H H 28 7.892 7.892 7.618 0.274 18093 7322 1 11 . 1 1 29 29 PHE N N 29 115.206 115.206 117.295 -2.089 18093 7323 1 11 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.177 0.026 18093 7324 1 11 . 1 1 29 29 PHE C C 29 176.614 176.614 176.148 0.466 18093 7325 1 11 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.911 0.053 18093 7326 1 11 . 1 1 29 29 PHE CB C 29 39.752 39.752 38.904 0.848 18093 7327 1 11 . 1 1 29 29 PHE H H 29 7.748 7.748 7.710 0.038 18093 7328 1 11 . 1 1 30 30 TYR N N 30 115.975 115.975 118.073 -2.098 18093 7329 1 11 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.676 -0.354 18093 7330 1 11 . 1 1 30 30 TYR C C 30 175.553 175.553 176.104 -0.551 18093 7331 1 11 . 1 1 30 30 TYR CA C 30 59.598 59.598 59.657 -0.059 18093 7332 1 11 . 1 1 30 30 TYR CB C 30 39.763 39.763 40.726 -0.963 18093 7333 1 11 . 1 1 30 30 TYR H H 30 7.985 7.985 7.563 0.422 18093 7334 1 11 . 1 1 31 31 LEU N N 31 120.780 120.780 121.178 -0.398 18093 7335 1 11 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.887 -0.460 18093 7336 1 11 . 1 1 31 31 LEU CA C 31 54.665 54.665 51.973 2.692 18093 7337 1 11 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.617 -1.229 18093 7338 1 11 . 1 1 31 31 LEU H H 31 7.643 7.643 7.818 -0.175 18093 7339 1 11 . 1 1 34 34 GLU C C 34 176.271 176.271 176.174 0.097 18093 7340 1 11 . 1 1 34 34 GLU CA C 34 57.590 57.590 56.862 0.728 18093 7341 1 11 . 1 1 35 35 CYS N N 35 116.430 116.430 119.079 -2.649 18093 7342 1 11 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.404 -0.037 18093 7343 1 11 . 1 1 35 35 CYS C C 35 175.198 175.198 175.425 -0.227 18093 7344 1 11 . 1 1 35 35 CYS CA C 35 60.293 60.293 59.356 0.937 18093 7345 1 11 . 1 1 35 35 CYS CB C 35 28.130 28.130 27.858 0.272 18093 7346 1 11 . 1 1 35 35 CYS H H 35 7.970 7.970 8.405 -0.435 18093 7347 1 11 . 1 1 36 36 GLY N N 36 108.315 108.315 107.931 0.384 18093 7348 1 11 . 1 1 36 36 GLY C C 36 174.610 174.610 174.933 -0.323 18093 7349 1 11 . 1 1 36 36 GLY CA C 36 46.004 46.004 45.147 0.857 18093 7350 1 11 . 1 1 36 36 GLY H H 36 8.120 8.120 7.795 0.325 18093 7351 1 11 . 1 1 37 37 GLU N N 37 121.347 121.347 120.893 0.454 18093 7352 1 11 . 1 1 37 37 GLU HA H 37 4.047 4.047 3.977 0.070 18093 7353 1 11 . 1 1 37 37 GLU C C 37 177.338 177.338 178.176 -0.838 18093 7354 1 11 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.985 -1.478 18093 7355 1 11 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.681 -0.111 18093 7356 1 11 . 1 1 37 37 GLU H H 37 8.423 8.423 8.695 -0.272 18093 7357 1 11 . 1 1 38 38 LYS N N 38 123.788 123.788 119.266 4.522 18093 7358 1 11 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.114 0.082 18093 7359 1 11 . 1 1 38 38 LYS C C 38 177.976 177.976 179.027 -1.051 18093 7360 1 11 . 1 1 38 38 LYS CA C 38 58.273 58.273 59.581 -1.308 18093 7361 1 11 . 1 1 38 38 LYS CB C 38 31.649 31.649 31.623 0.026 18093 7362 1 11 . 1 1 38 38 LYS H H 38 8.211 8.211 8.321 -0.110 18093 7363 1 11 . 1 1 39 39 ILE N N 39 115.675 115.675 119.877 -4.202 18093 7364 1 11 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.698 -0.090 18093 7365 1 11 . 1 1 39 39 ILE C C 39 177.204 177.204 178.188 -0.984 18093 7366 1 11 . 1 1 39 39 ILE CA C 39 65.501 65.501 64.769 0.732 18093 7367 1 11 . 1 1 39 39 ILE H H 39 7.933 7.933 7.999 -0.066 18093 7368 1 11 . 1 1 40 40 THR N N 40 117.411 117.411 115.957 1.454 18093 7369 1 11 . 1 1 40 40 THR HA H 40 3.844 3.844 3.978 -0.134 18093 7370 1 11 . 1 1 40 40 THR C C 40 175.983 175.983 176.729 -0.746 18093 7371 1 11 . 1 1 40 40 THR CA C 40 67.360 67.360 66.808 0.552 18093 7372 1 11 . 1 1 40 40 THR H H 40 8.362 8.362 8.230 0.132 18093 7373 1 11 . 1 1 41 41 LEU N N 41 123.059 123.059 122.603 0.456 18093 7374 1 11 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.209 -0.193 18093 7375 1 11 . 1 1 41 41 LEU C C 41 178.914 178.914 178.762 0.152 18093 7376 1 11 . 1 1 41 41 LEU CA C 41 58.366 58.366 57.608 0.758 18093 7377 1 11 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.012 1.038 18093 7378 1 11 . 1 1 41 41 LEU H H 41 8.282 8.282 7.764 0.518 18093 7379 1 11 . 1 1 42 42 CYS N N 42 118.762 118.762 118.570 0.192 18093 7380 1 11 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.108 -0.172 18093 7381 1 11 . 1 1 42 42 CYS C C 42 176.607 176.607 177.436 -0.829 18093 7382 1 11 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.277 1.040 18093 7383 1 11 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.276 -0.357 18093 7384 1 11 . 1 1 42 42 CYS H H 42 8.195 8.195 7.974 0.221 18093 7385 1 11 . 1 1 43 43 ILE N N 43 117.589 117.589 120.856 -3.267 18093 7386 1 11 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.708 -0.101 18093 7387 1 11 . 1 1 43 43 ILE C C 43 177.323 177.323 177.616 -0.293 18093 7388 1 11 . 1 1 43 43 ILE CA C 43 65.249 65.249 64.919 0.330 18093 7389 1 11 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.982 0.056 18093 7390 1 11 . 1 1 43 43 ILE H H 43 8.428 8.428 7.598 0.830 18093 7391 1 11 . 1 1 44 44 SER N N 44 115.950 115.950 116.709 -0.759 18093 7392 1 11 . 1 1 44 44 SER HA H 44 4.012 4.012 4.057 -0.045 18093 7393 1 11 . 1 1 44 44 SER C C 44 176.965 176.965 176.753 0.212 18093 7394 1 11 . 1 1 44 44 SER CA C 44 63.575 63.575 62.118 1.457 18093 7395 1 11 . 1 1 44 44 SER H H 44 7.984 7.984 8.167 -0.183 18093 7396 1 11 . 1 1 45 45 VAL N N 45 123.544 123.544 121.104 2.440 18093 7397 1 11 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.722 -0.174 18093 7398 1 11 . 1 1 45 45 VAL C C 45 177.139 177.139 177.853 -0.714 18093 7399 1 11 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.005 1.228 18093 7400 1 11 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.854 -0.212 18093 7401 1 11 . 1 1 45 45 VAL H H 45 8.280 8.280 8.057 0.223 18093 7402 1 11 . 1 1 46 46 LEU N N 46 119.883 119.883 120.645 -0.762 18093 7403 1 11 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.062 -0.119 18093 7404 1 11 . 1 1 46 46 LEU C C 46 180.125 180.125 178.353 1.772 18093 7405 1 11 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.937 0.663 18093 7406 1 11 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.954 0.058 18093 7407 1 11 . 1 1 46 46 LEU H H 46 8.117 8.117 7.518 0.599 18093 7408 1 11 . 1 1 47 47 LEU N N 47 120.193 120.193 120.091 0.102 18093 7409 1 11 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.837 0.167 18093 7410 1 11 . 1 1 47 47 LEU C C 47 178.370 178.370 179.064 -0.694 18093 7411 1 11 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.411 0.015 18093 7412 1 11 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.809 0.246 18093 7413 1 11 . 1 1 47 47 LEU H H 47 8.933 8.933 8.440 0.493 18093 7414 1 11 . 1 1 48 48 SER N N 48 115.861 115.861 114.099 1.762 18093 7415 1 11 . 1 1 48 48 SER HA H 48 4.013 4.013 4.263 -0.250 18093 7416 1 11 . 1 1 48 48 SER C C 48 175.642 175.642 176.847 -1.205 18093 7417 1 11 . 1 1 48 48 SER CA C 48 63.571 63.571 61.365 2.205 18093 7418 1 11 . 1 1 48 48 SER CB C 48 62.879 62.879 62.770 0.109 18093 7419 1 11 . 1 1 48 48 SER H H 48 7.996 7.996 7.704 0.292 18093 7420 1 11 . 1 1 49 49 LEU N N 49 120.673 120.673 123.447 -2.774 18093 7421 1 11 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.287 -0.252 18093 7422 1 11 . 1 1 49 49 LEU C C 49 178.229 178.229 178.368 -0.139 18093 7423 1 11 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.420 -0.137 18093 7424 1 11 . 1 1 49 49 LEU CB C 49 41.946 41.946 41.926 0.020 18093 7425 1 11 . 1 1 49 49 LEU H H 49 8.352 8.352 8.141 0.211 18093 7426 1 11 . 1 1 50 50 THR N N 50 115.582 115.582 114.526 1.056 18093 7427 1 11 . 1 1 50 50 THR HA H 50 3.672 3.672 4.102 -0.430 18093 7428 1 11 . 1 1 50 50 THR C C 50 175.877 175.877 176.523 -0.646 18093 7429 1 11 . 1 1 50 50 THR CA C 50 68.628 68.628 66.195 2.433 18093 7430 1 11 . 1 1 50 50 THR H H 50 7.937 7.937 8.029 -0.092 18093 7431 1 11 . 1 1 51 51 VAL N N 51 119.774 119.774 122.442 -2.668 18093 7432 1 11 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.852 -0.354 18093 7433 1 11 . 1 1 51 51 VAL C C 51 177.162 177.162 177.619 -0.457 18093 7434 1 11 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.573 1.012 18093 7435 1 11 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.628 -0.107 18093 7436 1 11 . 1 1 51 51 VAL H H 51 8.115 8.115 7.531 0.584 18093 7437 1 11 . 1 1 52 52 PHE N N 52 118.808 118.808 120.458 -1.650 18093 7438 1 11 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.335 -0.213 18093 7439 1 11 . 1 1 52 52 PHE C C 52 176.697 176.697 176.650 0.047 18093 7440 1 11 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.376 1.395 18093 7441 1 11 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.206 0.056 18093 7442 1 11 . 1 1 52 52 PHE H H 52 8.256 8.256 8.688 -0.432 18093 7443 1 11 . 1 1 53 53 LEU N N 53 117.267 117.267 121.436 -4.169 18093 7444 1 11 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.563 0.330 18093 7445 1 11 . 1 1 53 53 LEU C C 53 179.319 179.319 177.689 1.630 18093 7446 1 11 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.765 0.220 18093 7447 1 11 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.353 0.473 18093 7448 1 11 . 1 1 53 53 LEU H H 53 8.443 8.443 7.603 0.840 18093 7449 1 11 . 1 1 54 54 LEU N N 54 119.762 119.762 118.852 0.910 18093 7450 1 11 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.955 0.099 18093 7451 1 11 . 1 1 54 54 LEU C C 54 178.827 178.827 178.927 -0.100 18093 7452 1 11 . 1 1 54 54 LEU CA C 54 58.105 58.105 57.625 0.480 18093 7453 1 11 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.925 0.022 18093 7454 1 11 . 1 1 54 54 LEU H H 54 8.205 8.205 7.344 0.861 18093 7455 1 11 . 1 1 55 55 LEU N N 55 118.585 118.585 117.914 0.671 18093 7456 1 11 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.977 0.100 18093 7457 1 11 . 1 1 55 55 LEU C C 55 178.909 178.909 178.860 0.049 18093 7458 1 11 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.894 0.214 18093 7459 1 11 . 1 1 55 55 LEU CB C 55 41.979 41.979 40.960 1.019 18093 7460 1 11 . 1 1 55 55 LEU H H 55 8.179 8.179 7.456 0.723 18093 7461 1 11 . 1 1 56 56 ILE N N 56 116.079 116.079 115.310 0.769 18093 7462 1 11 . 1 1 56 56 ILE HA H 56 3.729 3.729 4.001 -0.272 18093 7463 1 11 . 1 1 56 56 ILE C C 56 176.988 176.988 177.594 -0.606 18093 7464 1 11 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.785 0.472 18093 7465 1 11 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.779 0.638 18093 7466 1 11 . 1 1 56 56 ILE H H 56 8.040 8.040 7.296 0.744 18093 7467 1 11 . 1 1 57 57 THR N N 57 110.105 110.105 112.519 -2.414 18093 7468 1 11 . 1 1 57 57 THR HA H 57 4.015 4.015 4.117 -0.102 18093 7469 1 11 . 1 1 57 57 THR C C 57 175.435 175.435 176.056 -0.621 18093 7470 1 11 . 1 1 57 57 THR CA C 57 65.067 65.067 65.300 -0.233 18093 7471 1 11 . 1 1 57 57 THR CB C 57 69.179 69.179 68.458 0.721 18093 7472 1 11 . 1 1 57 57 THR H H 57 7.655 7.655 7.541 0.114 18093 7473 1 11 . 1 1 58 58 GLU N N 58 117.313 117.313 120.437 -3.124 18093 7474 1 11 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.321 0.012 18093 7475 1 11 . 1 1 58 58 GLU C C 58 176.940 176.940 178.102 -1.162 18093 7476 1 11 . 1 1 58 58 GLU CA C 58 57.068 57.068 57.794 -0.726 18093 7477 1 11 . 1 1 58 58 GLU CB C 58 29.396 29.396 29.882 -0.486 18093 7478 1 11 . 1 1 58 58 GLU H H 58 7.521 7.521 7.810 -0.289 18093 7479 1 11 . 1 1 59 59 ILE N N 59 114.870 114.870 114.165 0.705 18093 7480 1 11 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.055 0.034 18093 7481 1 11 . 1 1 59 59 ILE C C 59 175.456 175.456 176.268 -0.812 18093 7482 1 11 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.453 -0.019 18093 7483 1 11 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.927 -0.270 18093 7484 1 11 . 1 1 59 59 ILE H H 59 7.579 7.579 7.218 0.361 18093 7485 1 11 . 1 1 60 60 ILE N N 60 119.354 119.354 117.432 1.922 18093 7486 1 11 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.891 0.413 18093 7487 1 11 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.460 -1.843 18093 7488 1 11 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.449 2.413 18093 7489 1 11 . 1 1 60 60 ILE H H 60 7.629 7.629 7.777 -0.148 18093 7490 1 11 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.326 0.074 18093 7491 1 11 . 1 1 61 61 PRO C C 61 177.144 177.144 177.229 -0.085 18093 7492 1 11 . 1 1 61 61 PRO CA C 61 63.808 63.808 63.837 -0.029 18093 7493 1 11 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.203 -0.321 18093 7494 1 11 . 1 1 62 62 SER N N 62 114.474 114.474 114.519 -0.045 18093 7495 1 11 . 1 1 62 62 SER HA H 62 4.434 4.434 4.454 -0.020 18093 7496 1 11 . 1 1 62 62 SER C C 62 175.161 175.161 174.131 1.030 18093 7497 1 11 . 1 1 62 62 SER CA C 62 59.047 59.047 58.167 0.880 18093 7498 1 11 . 1 1 62 62 SER CB C 62 63.704 63.704 61.155 2.549 18093 7499 1 11 . 1 1 62 62 SER H H 62 8.186 8.186 7.917 0.269 18093 7500 1 11 . 1 1 63 63 THR N N 63 113.573 113.573 117.577 -4.004 18093 7501 1 11 . 1 1 63 63 THR HA H 63 4.319 4.319 4.444 -0.125 18093 7502 1 11 . 1 1 63 63 THR C C 63 174.834 174.834 173.621 1.213 18093 7503 1 11 . 1 1 63 63 THR CA C 63 62.377 62.377 62.305 0.072 18093 7504 1 11 . 1 1 63 63 THR CB C 63 69.422 69.422 69.130 0.292 18093 7505 1 11 . 1 1 63 63 THR H H 63 7.963 7.963 7.949 0.014 18093 7506 1 11 . 1 1 64 64 SER N N 64 116.598 116.598 117.124 -0.526 18093 7507 1 11 . 1 1 64 64 SER HA H 64 4.428 4.428 4.735 -0.307 18093 7508 1 11 . 1 1 64 64 SER C C 64 174.618 174.618 173.038 1.580 18093 7509 1 11 . 1 1 64 64 SER CA C 64 59.045 59.045 57.908 1.137 18093 7510 1 11 . 1 1 64 64 SER CB C 64 63.700 63.700 64.699 -0.999 18093 7511 1 11 . 1 1 64 64 SER H H 64 8.052 8.052 8.096 -0.044 18093 7512 1 11 . 1 1 65 65 SER N N 65 116.673 116.673 117.006 -0.333 18093 7513 1 11 . 1 1 65 65 SER HA H 65 4.432 4.432 4.736 -0.304 18093 7514 1 11 . 1 1 65 65 SER C C 65 174.335 174.335 174.924 -0.589 18093 7515 1 11 . 1 1 65 65 SER CA C 65 58.927 58.927 58.043 0.884 18093 7516 1 11 . 1 1 65 65 SER CB C 65 63.621 63.621 63.411 0.210 18093 7517 1 11 . 1 1 65 65 SER H H 65 8.114 8.114 8.463 -0.349 18093 7518 1 11 . 1 1 66 66 VAL N N 66 119.054 119.054 116.759 2.295 18093 7519 1 11 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.327 -0.157 18093 7520 1 11 . 1 1 66 66 VAL C C 66 175.278 175.278 175.236 0.042 18093 7521 1 11 . 1 1 66 66 VAL CA C 66 62.062 62.062 62.876 -0.814 18093 7522 1 11 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.565 0.065 18093 7523 1 11 . 1 1 66 66 VAL H H 66 7.740 7.740 7.848 -0.108 18093 7524 1 11 . 1 1 67 67 SER N N 67 118.882 118.882 115.516 3.366 18093 7525 1 11 . 1 1 67 67 SER HA H 67 4.704 4.704 4.704 -0.000 18093 7526 1 11 . 1 1 67 67 SER CA C 67 56.715 56.715 56.740 -0.026 18093 7527 1 11 . 1 1 67 67 SER CB C 67 63.624 63.624 65.000 -1.376 18093 7528 1 11 . 1 1 67 67 SER H H 67 8.060 8.060 7.579 0.481 18093 7529 1 11 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.479 -0.079 18093 7530 1 11 . 1 1 68 68 PRO C C 68 176.925 176.925 175.868 1.057 18093 7531 1 11 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.697 1.051 18093 7532 1 11 . 1 1 68 68 PRO CB C 68 32.005 32.005 32.150 -0.145 18093 7533 1 11 . 1 1 69 69 SER N N 69 114.930 114.930 114.727 0.203 18093 7534 1 11 . 1 1 69 69 SER HA H 69 4.422 4.422 4.660 -0.238 18093 7535 1 11 . 1 1 69 69 SER C C 69 175.617 175.617 175.457 0.160 18093 7536 1 11 . 1 1 69 69 SER CA C 69 58.697 58.697 56.921 1.776 18093 7537 1 11 . 1 1 69 69 SER CB C 69 63.804 63.804 65.024 -1.220 18093 7538 1 11 . 1 1 69 69 SER H H 69 8.205 8.205 8.251 -0.046 18093 7539 1 11 . 1 1 70 70 ILE N N 70 120.840 120.840 125.045 -4.205 18093 7540 1 11 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.084 -0.092 18093 7541 1 11 . 1 1 70 70 ILE C C 70 177.524 177.524 176.892 0.632 18093 7542 1 11 . 1 1 70 70 ILE CA C 70 64.335 64.335 61.891 2.444 18093 7543 1 11 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.236 -0.776 18093 7544 1 11 . 1 1 70 70 ILE H H 70 8.283 8.283 8.846 -0.563 18093 7545 1 11 . 1 1 71 71 GLY N N 71 107.823 107.823 107.789 0.034 18093 7546 1 11 . 1 1 71 71 GLY C C 71 175.296 175.296 176.096 -0.800 18093 7547 1 11 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.063 0.392 18093 7548 1 11 . 1 1 71 71 GLY H H 71 8.557 8.557 8.663 -0.106 18093 7549 1 11 . 1 1 72 72 GLU N N 72 120.835 120.835 120.788 0.047 18093 7550 1 11 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.101 -0.254 18093 7551 1 11 . 1 1 72 72 GLU C C 72 178.198 178.198 178.205 -0.007 18093 7552 1 11 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.065 2.052 18093 7553 1 11 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.620 -0.227 18093 7554 1 11 . 1 1 72 72 GLU H H 72 7.922 7.922 7.712 0.210 18093 7555 1 11 . 1 1 73 73 TYR N N 73 117.375 117.375 122.041 -4.666 18093 7556 1 11 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.289 -0.127 18093 7557 1 11 . 1 1 73 73 TYR C C 73 179.912 179.912 177.400 2.512 18093 7558 1 11 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.100 1.055 18093 7559 1 11 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.712 0.054 18093 7560 1 11 . 1 1 73 73 TYR H H 73 8.062 8.062 7.847 0.215 18093 7561 1 11 . 1 1 74 74 LEU N N 74 121.493 121.493 119.233 2.260 18093 7562 1 11 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.724 0.325 18093 7563 1 11 . 1 1 74 74 LEU C C 74 178.063 178.063 178.376 -0.313 18093 7564 1 11 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.381 1.114 18093 7565 1 11 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.810 0.037 18093 7566 1 11 . 1 1 74 74 LEU H H 74 8.552 8.552 8.911 -0.359 18093 7567 1 11 . 1 1 75 75 LEU N N 75 120.375 120.375 120.401 -0.026 18093 7568 1 11 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.061 -0.021 18093 7569 1 11 . 1 1 75 75 LEU C C 75 178.515 178.515 178.767 -0.252 18093 7570 1 11 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.325 0.313 18093 7571 1 11 . 1 1 75 75 LEU CB C 75 42.039 42.039 42.048 -0.009 18093 7572 1 11 . 1 1 75 75 LEU H H 75 8.276 8.276 7.449 0.827 18093 7573 1 11 . 1 1 76 76 PHE N N 76 116.626 116.626 117.775 -1.149 18093 7574 1 11 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.251 -0.172 18093 7575 1 11 . 1 1 76 76 PHE C C 76 177.399 177.399 178.098 -0.699 18093 7576 1 11 . 1 1 76 76 PHE CA C 76 61.734 61.734 60.417 1.317 18093 7577 1 11 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.415 0.326 18093 7578 1 11 . 1 1 76 76 PHE H H 76 8.454 8.454 8.056 0.398 18093 7579 1 11 . 1 1 77 77 THR N N 77 116.080 116.080 116.795 -0.715 18093 7580 1 11 . 1 1 77 77 THR HA H 77 3.687 3.687 3.927 -0.240 18093 7581 1 11 . 1 1 77 77 THR C C 77 176.018 176.018 176.467 -0.449 18093 7582 1 11 . 1 1 77 77 THR CA C 77 68.640 68.640 67.111 1.529 18093 7583 1 11 . 1 1 77 77 THR H H 77 8.224 8.224 8.229 -0.005 18093 7584 1 11 . 1 1 78 78 MET N N 78 119.394 119.394 120.363 -0.969 18093 7585 1 11 . 1 1 78 78 MET HA H 78 4.129 4.129 4.080 0.049 18093 7586 1 11 . 1 1 78 78 MET C C 78 179.608 179.608 178.958 0.650 18093 7587 1 11 . 1 1 78 78 MET CA C 78 58.831 58.831 59.501 -0.670 18093 7588 1 11 . 1 1 78 78 MET CB C 78 31.590 31.590 32.429 -0.839 18093 7589 1 11 . 1 1 78 78 MET H H 78 8.372 8.372 7.590 0.782 18093 7590 1 11 . 1 1 79 79 ILE N N 79 121.819 121.819 118.858 2.961 18093 7591 1 11 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.795 -0.245 18093 7592 1 11 . 1 1 79 79 ILE C C 79 176.426 176.426 177.708 -1.282 18093 7593 1 11 . 1 1 79 79 ILE CA C 79 65.876 65.876 64.040 1.836 18093 7594 1 11 . 1 1 79 79 ILE CB C 79 37.673 37.673 37.019 0.654 18093 7595 1 11 . 1 1 79 79 ILE H H 79 8.391 8.391 7.566 0.825 18093 7596 1 11 . 1 1 80 80 PHE N N 80 119.916 119.916 121.330 -1.414 18093 7597 1 11 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.135 -0.082 18093 7598 1 11 . 1 1 80 80 PHE C C 80 178.568 178.568 177.536 1.032 18093 7599 1 11 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.285 0.022 18093 7600 1 11 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.723 -0.949 18093 7601 1 11 . 1 1 80 80 PHE H H 80 8.479 8.479 7.725 0.754 18093 7602 1 11 . 1 1 81 81 VAL N N 81 120.191 120.191 115.285 4.906 18093 7603 1 11 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.693 -0.240 18093 7604 1 11 . 1 1 81 81 VAL C C 81 178.225 178.225 177.423 0.802 18093 7605 1 11 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.323 1.085 18093 7606 1 11 . 1 1 81 81 VAL CB C 81 31.556 31.556 31.473 0.083 18093 7607 1 11 . 1 1 81 81 VAL H H 81 8.928 8.928 8.899 0.029 18093 7608 1 11 . 1 1 82 82 THR N N 82 115.930 115.930 118.016 -2.086 18093 7609 1 11 . 1 1 82 82 THR HA H 82 3.636 3.636 3.971 -0.335 18093 7610 1 11 . 1 1 82 82 THR C C 82 176.420 176.420 176.509 -0.089 18093 7611 1 11 . 1 1 82 82 THR CA C 82 68.570 68.570 67.023 1.547 18093 7612 1 11 . 1 1 82 82 THR CB C 82 68.202 68.202 68.524 -0.322 18093 7613 1 11 . 1 1 82 82 THR H H 82 7.969 7.969 7.556 0.413 18093 7614 1 11 . 1 1 83 83 LEU N N 83 119.780 119.780 119.295 0.485 18093 7615 1 11 . 1 1 83 83 LEU HA H 83 3.847 3.847 4.129 -0.282 18093 7616 1 11 . 1 1 83 83 LEU C C 83 178.214 178.214 178.457 -0.243 18093 7617 1 11 . 1 1 83 83 LEU CA C 83 58.237 58.237 58.114 0.123 18093 7618 1 11 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.062 0.729 18093 7619 1 11 . 1 1 83 83 LEU H H 83 8.483 8.483 7.402 1.081 18093 7620 1 11 . 1 1 84 84 SER N N 84 114.559 114.559 116.420 -1.861 18093 7621 1 11 . 1 1 84 84 SER HA H 84 4.099 4.099 4.046 0.053 18093 7622 1 11 . 1 1 84 84 SER C C 84 176.799 176.799 176.517 0.282 18093 7623 1 11 . 1 1 84 84 SER CA C 84 63.609 63.609 63.111 0.498 18093 7624 1 11 . 1 1 84 84 SER CB C 84 63.110 63.110 63.089 0.021 18093 7625 1 11 . 1 1 84 84 SER H H 84 8.023 8.023 7.459 0.564 18093 7626 1 11 . 1 1 85 85 ILE N N 85 123.962 123.962 121.718 2.244 18093 7627 1 11 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.799 -0.195 18093 7628 1 11 . 1 1 85 85 ILE C C 85 177.487 177.487 177.801 -0.314 18093 7629 1 11 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.088 0.671 18093 7630 1 11 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.806 0.081 18093 7631 1 11 . 1 1 85 85 ILE H H 85 8.054 8.054 8.272 -0.218 18093 7632 1 11 . 1 1 86 86 VAL N N 86 118.744 118.744 120.559 -1.815 18093 7633 1 11 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.590 -0.071 18093 7634 1 11 . 1 1 86 86 VAL C C 86 177.557 177.557 177.953 -0.396 18093 7635 1 11 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.522 1.013 18093 7636 1 11 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.616 -0.150 18093 7637 1 11 . 1 1 86 86 VAL H H 86 8.158 8.158 7.387 0.771 18093 7638 1 11 . 1 1 87 87 ILE N N 87 117.206 117.206 120.428 -3.222 18093 7639 1 11 . 1 1 87 87 ILE HA H 87 3.604 3.604 4.008 -0.404 18093 7640 1 11 . 1 1 87 87 ILE C C 87 177.283 177.283 178.503 -1.220 18093 7641 1 11 . 1 1 87 87 ILE CA C 87 65.676 65.676 64.431 1.245 18093 7642 1 11 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.848 0.741 18093 7643 1 11 . 1 1 87 87 ILE H H 87 8.459 8.459 8.376 0.083 18093 7644 1 11 . 1 1 88 88 THR N N 88 116.158 116.158 116.497 -0.339 18093 7645 1 11 . 1 1 88 88 THR HA H 88 3.672 3.672 4.140 -0.468 18093 7646 1 11 . 1 1 88 88 THR C C 88 175.485 175.485 177.359 -1.874 18093 7647 1 11 . 1 1 88 88 THR CA C 88 68.549 68.549 67.659 0.891 18093 7648 1 11 . 1 1 88 88 THR CB C 88 68.127 68.127 68.603 -0.476 18093 7649 1 11 . 1 1 88 88 THR H H 88 7.776 7.776 8.511 -0.735 18093 7650 1 11 . 1 1 89 89 VAL N N 89 117.985 117.985 120.973 -2.988 18093 7651 1 11 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.716 -0.173 18093 7652 1 11 . 1 1 89 89 VAL C C 89 177.393 177.393 177.769 -0.376 18093 7653 1 11 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.966 0.624 18093 7654 1 11 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.660 0.118 18093 7655 1 11 . 1 1 89 89 VAL H H 89 8.206 8.206 7.436 0.770 18093 7656 1 11 . 1 1 90 90 PHE N N 90 116.709 116.709 119.197 -2.488 18093 7657 1 11 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.208 0.170 18093 7658 1 11 . 1 1 90 90 PHE C C 90 177.305 177.305 177.673 -0.368 18093 7659 1 11 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.404 -0.285 18093 7660 1 11 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.339 1.046 18093 7661 1 11 . 1 1 90 90 PHE H H 90 7.956 7.956 7.562 0.394 18093 7662 1 11 . 1 1 91 91 VAL N N 91 116.565 116.565 119.102 -2.537 18093 7663 1 11 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.650 0.185 18093 7664 1 11 . 1 1 91 91 VAL C C 91 176.927 176.927 176.651 0.276 18093 7665 1 11 . 1 1 91 91 VAL CA C 91 65.347 65.347 66.169 -0.822 18093 7666 1 11 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.940 -0.073 18093 7667 1 11 . 1 1 91 91 VAL H H 91 8.239 8.239 8.523 -0.284 18093 7668 1 11 . 1 1 92 92 LEU N N 92 117.443 117.443 116.369 1.074 18093 7669 1 11 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.280 -0.086 18093 7670 1 11 . 1 1 92 92 LEU C C 92 177.180 177.180 177.813 -0.633 18093 7671 1 11 . 1 1 92 92 LEU CA C 92 56.184 56.184 55.702 0.482 18093 7672 1 11 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.308 -0.364 18093 7673 1 11 . 1 1 92 92 LEU H H 92 7.967 7.967 7.499 0.468 18093 7674 1 11 . 1 1 93 93 ASN N N 93 116.705 116.705 117.350 -0.645 18093 7675 1 11 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.593 0.054 18093 7676 1 11 . 1 1 93 93 ASN C C 93 175.129 175.129 175.310 -0.181 18093 7677 1 11 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.175 -1.321 18093 7678 1 11 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.410 -0.015 18093 7679 1 11 . 1 1 93 93 ASN H H 93 7.683 7.683 7.449 0.234 18093 7680 1 11 . 1 1 94 94 VAL N N 94 118.224 118.224 114.132 4.092 18093 7681 1 11 . 1 1 94 94 VAL HA H 94 3.961 3.961 4.285 -0.324 18093 7682 1 11 . 1 1 94 94 VAL C C 94 175.600 175.600 173.739 1.861 18093 7683 1 11 . 1 1 94 94 VAL CA C 94 62.825 62.825 61.030 1.795 18093 7684 1 11 . 1 1 94 94 VAL CB C 94 32.214 32.214 35.263 -3.049 18093 7685 1 11 . 1 1 94 94 VAL H H 94 7.627 7.627 7.800 -0.173 18093 7686 1 11 . 1 1 95 95 HIS N N 95 120.999 120.999 117.983 3.016 18093 7687 1 11 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.946 -0.353 18093 7688 1 11 . 1 1 95 95 HIS C C 95 174.146 174.146 174.144 0.002 18093 7689 1 11 . 1 1 95 95 HIS CA C 95 55.666 55.666 55.915 -0.249 18093 7690 1 11 . 1 1 95 95 HIS CB C 95 29.736 29.736 30.351 -0.615 18093 7691 1 11 . 1 1 95 95 HIS H H 95 8.263 8.263 8.458 -0.195 18093 7692 1 11 . 1 1 96 96 HIS N N 96 122.740 122.740 121.035 1.705 18093 7693 1 11 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.741 -0.108 18093 7694 1 11 . 1 1 96 96 HIS CA C 96 55.895 55.895 57.066 -1.171 18093 7695 1 11 . 1 1 96 96 HIS CB C 96 29.750 29.750 31.109 -1.359 18093 7696 1 11 . 1 1 96 96 HIS H H 96 8.298 8.298 8.672 -0.374 18093 7697 1 11 . 1 1 97 97 ARG N N 97 118.503 118.503 121.456 -2.953 18093 7698 1 11 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.721 -0.409 18093 7699 1 11 . 1 1 97 97 ARG C C 97 175.776 175.776 175.428 0.348 18093 7700 1 11 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.160 1.065 18093 7701 1 11 . 1 1 97 97 ARG CB C 97 30.912 30.912 30.869 0.043 18093 7702 1 11 . 1 1 97 97 ARG H H 97 8.250 8.250 8.293 -0.043 18093 7703 1 11 . 1 1 98 98 SER N N 98 118.482 118.482 118.855 -0.373 18093 7704 1 11 . 1 1 98 98 SER HA H 98 4.722 4.722 4.862 -0.140 18093 7705 1 11 . 1 1 98 98 SER CA C 98 56.547 56.547 57.707 -1.160 18093 7706 1 11 . 1 1 98 98 SER CB C 98 63.624 63.624 63.634 -0.010 18093 7707 1 11 . 1 1 98 98 SER H H 98 8.254 8.254 8.296 -0.042 18093 7708 1 11 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.419 -0.016 18093 7709 1 11 . 1 1 99 99 PRO C C 99 176.899 176.899 176.499 0.400 18093 7710 1 11 . 1 1 99 99 PRO CA C 99 63.701 63.701 63.556 0.145 18093 7711 1 11 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.174 -0.225 18093 7712 1 11 . 1 1 100 100 GLU N N 100 120.187 120.187 116.682 3.505 18093 7713 1 11 . 1 1 100 100 GLU HA H 100 4.288 4.288 3.958 0.330 18093 7714 1 11 . 1 1 100 100 GLU C C 100 176.593 176.593 175.755 0.838 18093 7715 1 11 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.532 0.190 18093 7716 1 11 . 1 1 100 100 GLU CB C 100 29.999 29.999 28.891 1.108 18093 7717 1 11 . 1 1 100 100 GLU H H 100 8.401 8.401 8.372 0.029 18093 7718 1 11 . 1 1 101 101 THR N N 101 113.968 113.968 110.611 3.357 18093 7719 1 11 . 1 1 101 101 THR HA H 101 4.286 4.286 4.083 0.203 18093 7720 1 11 . 1 1 101 101 THR C C 101 174.525 174.525 174.687 -0.162 18093 7721 1 11 . 1 1 101 101 THR CA C 101 61.956 61.956 63.794 -1.838 18093 7722 1 11 . 1 1 101 101 THR CB C 101 69.697 69.697 68.906 0.791 18093 7723 1 11 . 1 1 101 101 THR H H 101 7.945 7.945 7.936 0.009 18093 7724 1 11 . 1 1 102 102 HIS N N 102 120.322 120.322 117.133 3.189 18093 7725 1 11 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.807 -0.066 18093 7726 1 11 . 1 1 102 102 HIS C C 102 174.783 174.783 174.012 0.771 18093 7727 1 11 . 1 1 102 102 HIS CA C 102 55.701 55.701 53.387 2.314 18093 7728 1 11 . 1 1 102 102 HIS CB C 102 29.093 29.093 31.144 -2.051 18093 7729 1 11 . 1 1 102 102 HIS H H 102 8.455 8.455 7.016 1.439 18093 7730 1 11 . 1 1 103 103 THR N N 103 114.282 114.282 111.598 2.684 18093 7731 1 11 . 1 1 103 103 THR HA H 103 4.352 4.352 4.477 -0.125 18093 7732 1 11 . 1 1 103 103 THR C C 103 175.104 175.104 175.660 -0.556 18093 7733 1 11 . 1 1 103 103 THR CA C 103 62.057 62.057 61.087 0.970 18093 7734 1 11 . 1 1 103 103 THR CB C 103 69.966 69.966 69.367 0.599 18093 7735 1 11 . 1 1 103 103 THR H H 103 8.069 8.069 8.274 -0.205 18093 7736 1 11 . 1 1 104 104 GLY N N 104 111.159 111.159 113.968 -2.809 18093 7737 1 11 . 1 1 104 104 GLY C C 104 174.776 174.776 173.738 1.038 18093 7738 1 11 . 1 1 104 104 GLY CA C 104 45.588 45.588 44.872 0.716 18093 7739 1 11 . 1 1 104 104 GLY H H 104 8.393 8.393 8.709 -0.316 18093 7740 1 11 . 1 1 105 105 GLY N N 105 108.657 108.657 109.329 -0.672 18093 7741 1 11 . 1 1 105 105 GLY C C 105 174.957 174.957 173.729 1.228 18093 7742 1 11 . 1 1 105 105 GLY CA C 105 45.612 45.612 45.489 0.123 18093 7743 1 11 . 1 1 105 105 GLY H H 105 8.275 8.275 8.415 -0.140 18093 7744 1 11 . 1 1 106 106 GLY N N 106 108.870 108.870 107.518 1.352 18093 7745 1 11 . 1 1 106 106 GLY C C 106 174.877 174.877 173.040 1.837 18093 7746 1 11 . 1 1 106 106 GLY CA C 106 45.665 45.665 44.713 0.952 18093 7747 1 11 . 1 1 106 106 GLY H H 106 8.357 8.357 7.699 0.658 18093 7748 1 11 . 1 1 107 107 GLY N N 107 108.476 108.476 106.498 1.978 18093 7749 1 11 . 1 1 107 107 GLY C C 107 174.877 174.877 173.456 1.421 18093 7750 1 11 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.967 -0.271 18093 7751 1 11 . 1 1 107 107 GLY H H 107 8.330 8.330 8.004 0.326 18093 7752 1 11 . 1 1 108 108 GLY N N 108 108.486 108.486 109.383 -0.897 18093 7753 1 11 . 1 1 108 108 GLY C C 108 175.345 175.345 175.558 -0.213 18093 7754 1 11 . 1 1 108 108 GLY CA C 108 45.763 45.763 44.648 1.115 18093 7755 1 11 . 1 1 108 108 GLY H H 108 8.328 8.328 8.160 0.168 18093 7756 1 11 . 1 1 109 109 ILE N N 109 120.433 120.433 120.086 0.347 18093 7757 1 11 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.990 -0.022 18093 7758 1 11 . 1 1 109 109 ILE C C 109 176.127 176.127 177.207 -1.080 18093 7759 1 11 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.892 -1.157 18093 7760 1 11 . 1 1 109 109 ILE CB C 109 38.125 38.125 38.065 0.060 18093 7761 1 11 . 1 1 109 109 ILE H H 109 8.192 8.192 7.884 0.308 18093 7762 1 11 . 1 1 110 110 ASP N N 110 121.148 121.148 118.905 2.243 18093 7763 1 11 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.337 -0.031 18093 7764 1 11 . 1 1 110 110 ASP C C 110 177.651 177.651 178.059 -0.408 18093 7765 1 11 . 1 1 110 110 ASP CA C 110 56.776 56.776 58.998 -2.222 18093 7766 1 11 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.731 0.366 18093 7767 1 11 . 1 1 110 110 ASP H H 110 8.427 8.427 8.696 -0.269 18093 7768 1 11 . 1 1 111 111 ARG N N 111 119.228 119.228 119.350 -0.122 18093 7769 1 11 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.350 -0.354 18093 7770 1 11 . 1 1 111 111 ARG C C 111 177.786 177.786 178.810 -1.024 18093 7771 1 11 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.163 -0.221 18093 7772 1 11 . 1 1 111 111 ARG CB C 111 30.196 30.196 30.012 0.184 18093 7773 1 11 . 1 1 111 111 ARG H H 111 7.850 7.850 8.454 -0.604 18093 7774 1 11 . 1 1 112 112 ILE N N 112 118.000 118.000 119.622 -1.622 18093 7775 1 11 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.136 -0.324 18093 7776 1 11 . 1 1 112 112 ILE C C 112 177.496 177.496 177.954 -0.458 18093 7777 1 11 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.238 2.574 18093 7778 1 11 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.946 0.781 18093 7779 1 11 . 1 1 112 112 ILE H H 112 7.764 7.764 7.746 0.018 18093 7780 1 11 . 1 1 113 113 PHE N N 113 118.367 118.367 122.078 -3.711 18093 7781 1 11 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.280 -0.025 18093 7782 1 11 . 1 1 113 113 PHE C C 113 177.218 177.218 177.432 -0.214 18093 7783 1 11 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.375 -0.942 18093 7784 1 11 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.184 -0.377 18093 7785 1 11 . 1 1 113 113 PHE H H 113 7.963 7.963 7.968 -0.005 18093 7786 1 11 . 1 1 114 114 LEU N N 114 118.921 118.921 117.260 1.661 18093 7787 1 11 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.999 -0.002 18093 7788 1 11 . 1 1 114 114 LEU C C 114 178.297 178.297 178.499 -0.202 18093 7789 1 11 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.254 0.357 18093 7790 1 11 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.395 0.556 18093 7791 1 11 . 1 1 114 114 LEU H H 114 7.939 7.939 8.143 -0.204 18093 7792 1 11 . 1 1 115 115 TRP N N 115 117.464 117.464 119.481 -2.017 18093 7793 1 11 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.413 -0.039 18093 7794 1 11 . 1 1 115 115 TRP C C 115 178.572 178.572 178.261 0.311 18093 7795 1 11 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.800 1.122 18093 7796 1 11 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.806 -1.299 18093 7797 1 11 . 1 1 115 115 TRP H H 115 7.969 7.969 7.663 0.306 18093 7798 1 11 . 1 1 116 116 MET N N 116 117.069 117.069 119.006 -1.937 18093 7799 1 11 . 1 1 116 116 MET HA H 116 4.065 4.065 4.229 -0.164 18093 7800 1 11 . 1 1 116 116 MET C C 116 177.425 177.425 178.189 -0.764 18093 7801 1 11 . 1 1 116 116 MET CA C 116 59.289 59.289 59.186 0.103 18093 7802 1 11 . 1 1 116 116 MET CB C 116 31.692 31.692 32.549 -0.857 18093 7803 1 11 . 1 1 116 116 MET H H 116 8.465 8.465 7.745 0.720 18093 7804 1 11 . 1 1 117 117 PHE N N 117 118.755 118.755 117.504 1.251 18093 7805 1 11 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.068 0.031 18093 7806 1 11 . 1 1 117 117 PHE C C 117 177.965 177.965 178.234 -0.269 18093 7807 1 11 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.199 -0.491 18093 7808 1 11 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.267 0.918 18093 7809 1 11 . 1 1 117 117 PHE H H 117 8.418 8.418 7.859 0.559 18093 7810 1 11 . 1 1 118 118 ILE N N 118 119.133 119.133 115.316 3.817 18093 7811 1 11 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.910 -0.566 18093 7812 1 11 . 1 1 118 118 ILE C C 118 177.244 177.244 177.575 -0.331 18093 7813 1 11 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.276 1.549 18093 7814 1 11 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.781 -0.233 18093 7815 1 11 . 1 1 118 118 ILE H H 118 8.266 8.266 7.741 0.525 18093 7816 1 11 . 1 1 119 119 ILE N N 119 118.846 118.846 121.539 -2.693 18093 7817 1 11 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.967 -0.395 18093 7818 1 11 . 1 1 119 119 ILE C C 119 177.523 177.523 177.515 0.008 18093 7819 1 11 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.230 0.659 18093 7820 1 11 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.276 -0.712 18093 7821 1 11 . 1 1 119 119 ILE H H 119 8.308 8.308 7.360 0.948 18093 7822 1 11 . 1 1 120 120 VAL N N 120 119.228 119.228 118.055 1.173 18093 7823 1 11 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.879 -0.371 18093 7824 1 11 . 1 1 120 120 VAL C C 120 177.651 177.651 177.189 0.462 18093 7825 1 11 . 1 1 120 120 VAL CA C 120 67.601 67.601 64.599 3.002 18093 7826 1 11 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.155 1.251 18093 7827 1 11 . 1 1 120 120 VAL H H 120 8.399 8.399 7.947 0.452 18093 7828 1 11 . 1 1 121 121 CYS N N 121 117.151 117.151 119.744 -2.593 18093 7829 1 11 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.072 -0.169 18093 7830 1 11 . 1 1 121 121 CYS C C 121 177.719 177.719 177.071 0.648 18093 7831 1 11 . 1 1 121 121 CYS CA C 121 64.298 64.298 64.342 -0.044 18093 7832 1 11 . 1 1 121 121 CYS CB C 121 26.677 26.677 27.148 -0.471 18093 7833 1 11 . 1 1 121 121 CYS H H 121 8.008 8.008 7.460 0.549 18093 7834 1 11 . 1 1 122 122 LEU N N 122 121.402 121.402 119.548 1.854 18093 7835 1 11 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.173 -0.190 18093 7836 1 11 . 1 1 122 122 LEU C C 122 178.282 178.282 179.159 -0.877 18093 7837 1 11 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.651 0.894 18093 7838 1 11 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.225 0.741 18093 7839 1 11 . 1 1 122 122 LEU H H 122 8.417 8.417 7.677 0.740 18093 7840 1 11 . 1 1 123 123 LEU N N 123 118.543 118.543 120.877 -2.334 18093 7841 1 11 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.036 -0.116 18093 7842 1 11 . 1 1 123 123 LEU C C 123 179.028 179.028 178.764 0.264 18093 7843 1 11 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.423 -0.306 18093 7844 1 11 . 1 1 123 123 LEU CB C 123 42.056 42.056 41.017 1.039 18093 7845 1 11 . 1 1 123 123 LEU H H 123 8.590 8.590 7.739 0.851 18093 7846 1 11 . 1 1 124 124 GLY N N 124 104.896 104.896 105.846 -0.950 18093 7847 1 11 . 1 1 124 124 GLY C C 124 173.932 173.932 176.160 -2.228 18093 7848 1 11 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.544 -0.317 18093 7849 1 11 . 1 1 124 124 GLY H H 124 8.601 8.601 8.462 0.139 18093 7850 1 11 . 1 1 125 125 THR N N 125 115.403 115.403 119.171 -3.768 18093 7851 1 11 . 1 1 125 125 THR HA H 125 3.686 3.686 3.907 -0.221 18093 7852 1 11 . 1 1 125 125 THR C C 125 176.407 176.407 176.865 -0.458 18093 7853 1 11 . 1 1 125 125 THR CA C 125 67.565 67.565 66.860 0.705 18093 7854 1 11 . 1 1 125 125 THR CB C 125 68.143 68.143 68.578 -0.435 18093 7855 1 11 . 1 1 125 125 THR H H 125 7.734 7.734 7.494 0.240 18093 7856 1 11 . 1 1 126 126 VAL N N 126 119.056 119.056 121.102 -2.046 18093 7857 1 11 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.778 -0.239 18093 7858 1 11 . 1 1 126 126 VAL C C 126 177.628 177.628 178.158 -0.530 18093 7859 1 11 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.383 0.218 18093 7860 1 11 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.438 0.056 18093 7861 1 11 . 1 1 126 126 VAL H H 126 8.015 8.015 8.226 -0.211 18093 7862 1 11 . 1 1 127 127 GLY N N 127 104.644 104.644 107.485 -2.841 18093 7863 1 11 . 1 1 127 127 GLY C C 127 173.933 173.933 175.451 -1.518 18093 7864 1 11 . 1 1 127 127 GLY CA C 127 47.281 47.281 46.972 0.309 18093 7865 1 11 . 1 1 127 127 GLY H H 127 8.248 8.248 8.496 -0.248 18093 7866 1 11 . 1 1 128 128 LEU N N 128 117.354 117.354 121.241 -3.887 18093 7867 1 11 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.234 -0.222 18093 7868 1 11 . 1 1 128 128 LEU C C 128 177.443 177.443 178.124 -0.681 18093 7869 1 11 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.876 -0.250 18093 7870 1 11 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.936 0.324 18093 7871 1 11 . 1 1 128 128 LEU H H 128 7.568 7.568 7.984 -0.416 18093 7872 1 11 . 1 1 129 129 PHE N N 129 113.971 113.971 116.660 -2.689 18093 7873 1 11 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.294 0.164 18093 7874 1 11 . 1 1 129 129 PHE C C 129 176.216 176.216 176.271 -0.055 18093 7875 1 11 . 1 1 129 129 PHE CA C 129 58.385 58.385 62.087 -3.702 18093 7876 1 11 . 1 1 129 129 PHE CB C 129 39.719 39.719 40.086 -0.367 18093 7877 1 11 . 1 1 129 129 PHE H H 129 7.639 7.639 7.785 -0.146 18093 7878 1 11 . 1 1 130 130 LEU N N 130 117.752 117.752 119.444 -1.692 18093 7879 1 11 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.769 -0.336 18093 7880 1 11 . 1 1 130 130 LEU CA C 130 54.156 54.156 52.456 1.700 18093 7881 1 11 . 1 1 130 130 LEU H H 130 8.099 8.099 7.599 0.500 18093 7882 1 11 . 1 1 131 131 PRO HA H 131 4.450 4.450 5.004 -0.554 18093 7883 1 11 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.361 2.538 18093 7884 1 11 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.390 -0.128 18093 7885 1 11 . 1 1 132 132 PRO C C 132 177.616 177.616 178.143 -0.527 18093 7886 1 11 . 1 1 132 132 PRO CA C 132 64.980 64.980 64.547 0.433 18093 7887 1 11 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.032 -0.407 18093 7888 1 11 . 1 1 133 133 TRP N N 133 115.508 115.508 118.154 -2.646 18093 7889 1 11 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.535 0.057 18093 7890 1 11 . 1 1 133 133 TRP C C 133 176.842 176.842 175.665 1.177 18093 7891 1 11 . 1 1 133 133 TRP CA C 133 57.283 57.283 58.327 -1.044 18093 7892 1 11 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.254 -0.658 18093 7893 1 11 . 1 1 133 133 TRP H H 133 7.311 7.311 8.205 -0.894 18093 7894 1 11 . 1 1 134 134 LEU N N 134 119.570 119.570 117.531 2.039 18093 7895 1 11 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.510 -0.333 18093 7896 1 11 . 1 1 134 134 LEU C C 134 175.768 175.768 176.277 -0.509 18093 7897 1 11 . 1 1 134 134 LEU CA C 134 55.621 55.621 53.754 1.867 18093 7898 1 11 . 1 1 134 134 LEU CB C 134 42.648 42.648 42.426 0.222 18093 7899 1 11 . 1 1 134 134 LEU H H 134 7.453 7.453 7.294 0.159 18093 7900 1 11 . 1 1 135 135 ALA N N 135 119.004 119.004 122.108 -3.104 18093 7901 1 11 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.382 -0.159 18093 7902 1 11 . 1 1 135 135 ALA C C 135 177.170 177.170 178.424 -1.254 18093 7903 1 11 . 1 1 135 135 ALA CA C 135 52.456 52.456 53.444 -0.988 18093 7904 1 11 . 1 1 135 135 ALA CB C 135 19.736 19.736 19.983 -0.247 18093 7905 1 11 . 1 1 135 135 ALA H H 135 7.541 7.541 7.345 0.196 18093 7906 1 11 . 1 1 136 136 GLY N N 136 105.879 105.879 106.162 -0.283 18093 7907 1 11 . 1 1 136 136 GLY C C 136 173.042 173.042 174.555 -1.513 18093 7908 1 11 . 1 1 136 136 GLY CA C 136 45.693 45.693 44.782 0.911 18093 7909 1 11 . 1 1 136 136 GLY H H 136 7.846 7.846 8.538 -0.692 18093 7910 1 12 . 1 1 5 5 GLU N N 5 119.627 119.627 120.320 -0.693 18093 7911 1 12 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.411 -0.203 18093 7912 1 12 . 1 1 5 5 GLU C C 5 176.581 176.581 175.168 1.413 18093 7913 1 12 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.352 0.693 18093 7914 1 12 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.797 0.241 18093 7915 1 12 . 1 1 5 5 GLU H H 5 8.003 8.003 8.303 -0.300 18093 7916 1 12 . 1 1 6 6 LEU N N 6 121.267 121.267 122.395 -1.128 18093 7917 1 12 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.764 -0.339 18093 7918 1 12 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.566 2.069 18093 7919 1 12 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.827 -0.531 18093 7920 1 12 . 1 1 6 6 LEU H H 6 8.104 8.104 7.904 0.200 18093 7921 1 12 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.567 -0.168 18093 7922 1 12 . 1 1 7 7 PRO C C 7 178.408 178.408 177.839 0.569 18093 7923 1 12 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.108 2.604 18093 7924 1 12 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.766 -0.849 18093 7925 1 12 . 1 1 8 8 LEU N N 8 121.835 121.835 119.970 1.865 18093 7926 1 12 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.172 -0.083 18093 7927 1 12 . 1 1 8 8 LEU C C 8 177.902 177.902 178.084 -0.182 18093 7928 1 12 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.292 0.813 18093 7929 1 12 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.249 0.358 18093 7930 1 12 . 1 1 8 8 LEU H H 8 8.162 8.162 8.426 -0.264 18093 7931 1 12 . 1 1 9 9 PHE N N 9 118.342 118.342 119.768 -1.426 18093 7932 1 12 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.136 0.053 18093 7933 1 12 . 1 1 9 9 PHE C C 9 177.596 177.596 177.086 0.510 18093 7934 1 12 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.759 -0.645 18093 7935 1 12 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.355 0.372 18093 7936 1 12 . 1 1 9 9 PHE H H 9 8.318 8.318 8.123 0.195 18093 7937 1 12 . 1 1 10 10 TYR N N 10 117.584 117.584 118.527 -0.943 18093 7938 1 12 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.930 0.224 18093 7939 1 12 . 1 1 10 10 TYR C C 10 177.630 177.630 177.401 0.229 18093 7940 1 12 . 1 1 10 10 TYR CA C 10 61.036 61.036 60.196 0.840 18093 7941 1 12 . 1 1 10 10 TYR CB C 10 38.660 38.660 37.696 0.965 18093 7942 1 12 . 1 1 10 10 TYR H H 10 8.105 8.105 8.026 0.079 18093 7943 1 12 . 1 1 11 11 THR N N 11 115.563 115.563 114.596 0.967 18093 7944 1 12 . 1 1 11 11 THR HA H 11 3.871 3.871 3.869 0.002 18093 7945 1 12 . 1 1 11 11 THR C C 11 175.955 175.955 176.276 -0.321 18093 7946 1 12 . 1 1 11 11 THR CA C 11 67.290 67.290 66.515 0.775 18093 7947 1 12 . 1 1 11 11 THR CB C 11 68.201 68.201 68.391 -0.190 18093 7948 1 12 . 1 1 11 11 THR H H 11 7.915 7.915 7.427 0.488 18093 7949 1 12 . 1 1 12 12 ILE N N 12 119.727 119.727 121.384 -1.657 18093 7950 1 12 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.726 -0.027 18093 7951 1 12 . 1 1 12 12 ILE C C 12 175.773 175.773 177.448 -1.675 18093 7952 1 12 . 1 1 12 12 ILE CA C 12 64.699 64.699 63.566 1.133 18093 7953 1 12 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.685 1.411 18093 7954 1 12 . 1 1 12 12 ILE H H 12 8.186 8.186 7.571 0.615 18093 7955 1 12 . 1 1 13 13 ASN N N 13 114.190 114.190 118.498 -4.308 18093 7956 1 12 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.453 -0.031 18093 7957 1 12 . 1 1 13 13 ASN C C 13 174.786 174.786 176.719 -1.933 18093 7958 1 12 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.334 0.221 18093 7959 1 12 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.829 0.529 18093 7960 1 12 . 1 1 13 13 ASN H H 13 7.601 7.601 7.347 0.254 18093 7961 1 12 . 1 1 14 14 LEU N N 14 115.031 115.031 119.012 -3.981 18093 7962 1 12 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.055 0.141 18093 7963 1 12 . 1 1 14 14 LEU C C 14 177.540 177.540 178.395 -0.855 18093 7964 1 12 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.206 0.201 18093 7965 1 12 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.245 -0.403 18093 7966 1 12 . 1 1 14 14 LEU H H 14 7.390 7.390 7.154 0.236 18093 7967 1 12 . 1 1 15 15 ILE N N 15 118.223 118.223 120.346 -2.123 18093 7968 1 12 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.754 -0.141 18093 7969 1 12 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.752 2.968 18093 7970 1 12 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.529 -0.917 18093 7971 1 12 . 1 1 15 15 ILE H H 15 8.123 8.123 8.257 -0.134 18093 7972 1 12 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.349 -0.280 18093 7973 1 12 . 1 1 17 17 PRO C C 17 177.721 177.721 178.966 -1.245 18093 7974 1 12 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.436 1.325 18093 7975 1 12 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.762 -0.019 18093 7976 1 12 . 1 1 18 18 CYS N N 18 113.538 113.538 117.844 -4.306 18093 7977 1 12 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.096 -0.088 18093 7978 1 12 . 1 1 18 18 CYS C C 18 177.683 177.683 177.359 0.324 18093 7979 1 12 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.160 1.340 18093 7980 1 12 . 1 1 18 18 CYS CB C 18 26.873 26.873 26.769 0.104 18093 7981 1 12 . 1 1 18 18 CYS H H 18 7.410 7.410 7.448 -0.038 18093 7982 1 12 . 1 1 19 19 LEU N N 19 122.545 122.545 118.875 3.670 18093 7983 1 12 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.109 -0.110 18093 7984 1 12 . 1 1 19 19 LEU C C 19 178.608 178.608 178.814 -0.206 18093 7985 1 12 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.279 1.143 18093 7986 1 12 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.166 0.678 18093 7987 1 12 . 1 1 19 19 LEU H H 19 8.635 8.635 7.438 1.197 18093 7988 1 12 . 1 1 20 20 LEU N N 20 119.404 119.404 121.364 -1.960 18093 7989 1 12 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.987 0.019 18093 7990 1 12 . 1 1 20 20 LEU C C 20 178.540 178.540 179.302 -0.762 18093 7991 1 12 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.170 0.629 18093 7992 1 12 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.308 0.691 18093 7993 1 12 . 1 1 20 20 LEU H H 20 8.392 8.392 7.536 0.856 18093 7994 1 12 . 1 1 21 21 ILE N N 21 117.335 117.335 114.200 3.135 18093 7995 1 12 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.824 -0.173 18093 7996 1 12 . 1 1 21 21 ILE C C 21 177.249 177.249 177.731 -0.482 18093 7997 1 12 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.691 0.570 18093 7998 1 12 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.173 0.787 18093 7999 1 12 . 1 1 21 21 ILE H H 21 8.403 8.403 8.539 -0.136 18093 8000 1 12 . 1 1 22 22 SER N N 22 116.385 116.385 118.104 -1.719 18093 8001 1 12 . 1 1 22 22 SER HA H 22 4.056 4.056 4.267 -0.211 18093 8002 1 12 . 1 1 22 22 SER C C 22 176.813 176.813 176.502 0.311 18093 8003 1 12 . 1 1 22 22 SER CA C 22 63.866 63.866 61.931 1.935 18093 8004 1 12 . 1 1 22 22 SER CB C 22 62.898 62.898 62.987 -0.089 18093 8005 1 12 . 1 1 22 22 SER H H 22 8.271 8.271 7.586 0.685 18093 8006 1 12 . 1 1 23 23 CYS N N 23 119.001 119.001 120.593 -1.592 18093 8007 1 12 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.110 -0.120 18093 8008 1 12 . 1 1 23 23 CYS C C 23 177.594 177.594 176.657 0.937 18093 8009 1 12 . 1 1 23 23 CYS CA C 23 64.429 64.429 63.556 0.873 18093 8010 1 12 . 1 1 23 23 CYS CB C 23 26.940 26.940 27.175 -0.235 18093 8011 1 12 . 1 1 23 23 CYS H H 23 8.161 8.161 8.610 -0.449 18093 8012 1 12 . 1 1 24 24 LEU N N 24 117.814 117.814 121.097 -3.283 18093 8013 1 12 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.838 0.139 18093 8014 1 12 . 1 1 24 24 LEU C C 24 177.944 177.944 178.550 -0.606 18093 8015 1 12 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.685 -0.398 18093 8016 1 12 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.847 0.056 18093 8017 1 12 . 1 1 24 24 LEU H H 24 8.106 8.106 7.682 0.424 18093 8018 1 12 . 1 1 25 25 THR N N 25 115.670 115.670 114.493 1.177 18093 8019 1 12 . 1 1 25 25 THR HA H 25 3.687 3.687 4.064 -0.377 18093 8020 1 12 . 1 1 25 25 THR C C 25 175.845 175.845 177.120 -1.275 18093 8021 1 12 . 1 1 25 25 THR CA C 25 68.306 68.306 66.594 1.712 18093 8022 1 12 . 1 1 25 25 THR H H 25 7.924 7.924 7.553 0.371 18093 8023 1 12 . 1 1 26 26 VAL N N 26 118.809 118.809 121.084 -2.275 18093 8024 1 12 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.784 -0.269 18093 8025 1 12 . 1 1 26 26 VAL C C 26 177.530 177.530 178.062 -0.532 18093 8026 1 12 . 1 1 26 26 VAL CA C 26 67.281 67.281 65.603 1.678 18093 8027 1 12 . 1 1 26 26 VAL CB C 26 31.724 31.724 30.582 1.142 18093 8028 1 12 . 1 1 26 26 VAL H H 26 7.764 7.764 7.415 0.349 18093 8029 1 12 . 1 1 27 27 LEU N N 27 117.958 117.958 121.672 -3.714 18093 8030 1 12 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.133 -0.097 18093 8031 1 12 . 1 1 27 27 LEU C C 27 178.163 178.163 179.183 -1.020 18093 8032 1 12 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.242 0.267 18093 8033 1 12 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.958 0.961 18093 8034 1 12 . 1 1 27 27 LEU H H 27 7.912 7.912 7.893 0.019 18093 8035 1 12 . 1 1 28 28 VAL N N 28 114.472 114.472 114.969 -0.497 18093 8036 1 12 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.683 -0.148 18093 8037 1 12 . 1 1 28 28 VAL C C 28 176.871 176.871 178.002 -1.131 18093 8038 1 12 . 1 1 28 28 VAL CA C 28 65.977 65.977 66.127 -0.150 18093 8039 1 12 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.436 0.498 18093 8040 1 12 . 1 1 28 28 VAL H H 28 7.892 7.892 7.532 0.360 18093 8041 1 12 . 1 1 29 29 PHE N N 29 115.206 115.206 117.996 -2.790 18093 8042 1 12 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.228 -0.025 18093 8043 1 12 . 1 1 29 29 PHE C C 29 176.614 176.614 177.526 -0.912 18093 8044 1 12 . 1 1 29 29 PHE CA C 29 60.964 60.964 61.535 -0.571 18093 8045 1 12 . 1 1 29 29 PHE CB C 29 39.752 39.752 39.415 0.337 18093 8046 1 12 . 1 1 29 29 PHE H H 29 7.748 7.748 7.675 0.073 18093 8047 1 12 . 1 1 30 30 TYR N N 30 115.975 115.975 119.370 -3.395 18093 8048 1 12 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.154 0.168 18093 8049 1 12 . 1 1 30 30 TYR C C 30 175.553 175.553 175.730 -0.177 18093 8050 1 12 . 1 1 30 30 TYR CA C 30 59.598 59.598 60.245 -0.647 18093 8051 1 12 . 1 1 30 30 TYR CB C 30 39.763 39.763 39.663 0.100 18093 8052 1 12 . 1 1 30 30 TYR H H 30 7.985 7.985 7.913 0.072 18093 8053 1 12 . 1 1 31 31 LEU N N 31 120.780 120.780 119.267 1.513 18093 8054 1 12 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.585 -0.158 18093 8055 1 12 . 1 1 31 31 LEU CA C 31 54.665 54.665 52.548 2.117 18093 8056 1 12 . 1 1 31 31 LEU CB C 31 42.388 42.388 44.274 -1.886 18093 8057 1 12 . 1 1 31 31 LEU H H 31 7.643 7.643 7.691 -0.048 18093 8058 1 12 . 1 1 34 34 GLU C C 34 176.271 176.271 176.365 -0.094 18093 8059 1 12 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.553 2.037 18093 8060 1 12 . 1 1 35 35 CYS N N 35 116.430 116.430 118.796 -2.366 18093 8061 1 12 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.699 -0.332 18093 8062 1 12 . 1 1 35 35 CYS C C 35 175.198 175.198 174.918 0.280 18093 8063 1 12 . 1 1 35 35 CYS CA C 35 60.293 60.293 59.071 1.222 18093 8064 1 12 . 1 1 35 35 CYS CB C 35 28.130 28.130 28.487 -0.357 18093 8065 1 12 . 1 1 35 35 CYS H H 35 7.970 7.970 8.338 -0.368 18093 8066 1 12 . 1 1 36 36 GLY N N 36 108.315 108.315 110.319 -2.004 18093 8067 1 12 . 1 1 36 36 GLY C C 36 174.610 174.610 175.483 -0.873 18093 8068 1 12 . 1 1 36 36 GLY CA C 36 46.004 46.004 45.319 0.685 18093 8069 1 12 . 1 1 36 36 GLY H H 36 8.120 8.120 7.873 0.247 18093 8070 1 12 . 1 1 37 37 GLU N N 37 121.347 121.347 121.690 -0.343 18093 8071 1 12 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.024 0.023 18093 8072 1 12 . 1 1 37 37 GLU C C 37 177.338 177.338 178.215 -0.877 18093 8073 1 12 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.972 -1.465 18093 8074 1 12 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.530 0.040 18093 8075 1 12 . 1 1 37 37 GLU H H 37 8.423 8.423 8.669 -0.246 18093 8076 1 12 . 1 1 38 38 LYS N N 38 123.788 123.788 119.417 4.371 18093 8077 1 12 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.016 0.180 18093 8078 1 12 . 1 1 38 38 LYS C C 38 177.976 177.976 178.834 -0.858 18093 8079 1 12 . 1 1 38 38 LYS CA C 38 58.273 58.273 59.788 -1.515 18093 8080 1 12 . 1 1 38 38 LYS CB C 38 31.649 31.649 32.002 -0.353 18093 8081 1 12 . 1 1 38 38 LYS H H 38 8.211 8.211 8.043 0.168 18093 8082 1 12 . 1 1 39 39 ILE N N 39 115.675 115.675 118.334 -2.659 18093 8083 1 12 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.781 -0.173 18093 8084 1 12 . 1 1 39 39 ILE C C 39 177.204 177.204 178.287 -1.083 18093 8085 1 12 . 1 1 39 39 ILE CA C 39 65.501 65.501 65.015 0.486 18093 8086 1 12 . 1 1 39 39 ILE H H 39 7.933 7.933 7.603 0.330 18093 8087 1 12 . 1 1 40 40 THR N N 40 117.411 117.411 116.012 1.399 18093 8088 1 12 . 1 1 40 40 THR HA H 40 3.844 3.844 4.020 -0.176 18093 8089 1 12 . 1 1 40 40 THR C C 40 175.983 175.983 176.727 -0.744 18093 8090 1 12 . 1 1 40 40 THR CA C 40 67.360 67.360 66.095 1.265 18093 8091 1 12 . 1 1 40 40 THR H H 40 8.362 8.362 7.692 0.670 18093 8092 1 12 . 1 1 41 41 LEU N N 41 123.059 123.059 122.788 0.271 18093 8093 1 12 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.106 -0.090 18093 8094 1 12 . 1 1 41 41 LEU C C 41 178.914 178.914 178.213 0.701 18093 8095 1 12 . 1 1 41 41 LEU CA C 41 58.366 58.366 58.175 0.191 18093 8096 1 12 . 1 1 41 41 LEU CB C 41 42.050 42.050 42.053 -0.003 18093 8097 1 12 . 1 1 41 41 LEU H H 41 8.282 8.282 7.915 0.367 18093 8098 1 12 . 1 1 42 42 CYS N N 42 118.762 118.762 118.061 0.701 18093 8099 1 12 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.037 -0.101 18093 8100 1 12 . 1 1 42 42 CYS C C 42 176.607 176.607 176.642 -0.035 18093 8101 1 12 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.484 0.833 18093 8102 1 12 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.617 -0.698 18093 8103 1 12 . 1 1 42 42 CYS H H 42 8.195 8.195 7.922 0.273 18093 8104 1 12 . 1 1 43 43 ILE N N 43 117.589 117.589 119.928 -2.339 18093 8105 1 12 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.647 -0.040 18093 8106 1 12 . 1 1 43 43 ILE C C 43 177.323 177.323 178.133 -0.810 18093 8107 1 12 . 1 1 43 43 ILE CA C 43 65.249 65.249 64.747 0.502 18093 8108 1 12 . 1 1 43 43 ILE CB C 43 38.038 38.038 36.877 1.161 18093 8109 1 12 . 1 1 43 43 ILE H H 43 8.428 8.428 7.694 0.734 18093 8110 1 12 . 1 1 44 44 SER N N 44 115.950 115.950 116.226 -0.276 18093 8111 1 12 . 1 1 44 44 SER HA H 44 4.012 4.012 4.130 -0.118 18093 8112 1 12 . 1 1 44 44 SER C C 44 176.965 176.965 177.152 -0.187 18093 8113 1 12 . 1 1 44 44 SER CA C 44 63.575 63.575 62.309 1.266 18093 8114 1 12 . 1 1 44 44 SER H H 44 7.984 7.984 7.692 0.292 18093 8115 1 12 . 1 1 45 45 VAL N N 45 123.544 123.544 122.227 1.317 18093 8116 1 12 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.673 -0.125 18093 8117 1 12 . 1 1 45 45 VAL C C 45 177.139 177.139 177.868 -0.729 18093 8118 1 12 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.340 0.893 18093 8119 1 12 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.522 0.120 18093 8120 1 12 . 1 1 45 45 VAL H H 45 8.280 8.280 7.623 0.657 18093 8121 1 12 . 1 1 46 46 LEU N N 46 119.883 119.883 120.577 -0.694 18093 8122 1 12 . 1 1 46 46 LEU HA H 46 3.943 3.943 3.962 -0.019 18093 8123 1 12 . 1 1 46 46 LEU C C 46 180.125 180.125 178.717 1.408 18093 8124 1 12 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.988 0.612 18093 8125 1 12 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.945 0.067 18093 8126 1 12 . 1 1 46 46 LEU H H 46 8.117 8.117 7.753 0.364 18093 8127 1 12 . 1 1 47 47 LEU N N 47 120.193 120.193 120.019 0.174 18093 8128 1 12 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.782 0.222 18093 8129 1 12 . 1 1 47 47 LEU C C 47 178.370 178.370 179.100 -0.730 18093 8130 1 12 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.645 -0.219 18093 8131 1 12 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.757 0.298 18093 8132 1 12 . 1 1 47 47 LEU H H 47 8.933 8.933 8.146 0.787 18093 8133 1 12 . 1 1 48 48 SER N N 48 115.861 115.861 114.965 0.896 18093 8134 1 12 . 1 1 48 48 SER HA H 48 4.013 4.013 4.183 -0.170 18093 8135 1 12 . 1 1 48 48 SER C C 48 175.642 175.642 177.005 -1.363 18093 8136 1 12 . 1 1 48 48 SER CA C 48 63.571 63.571 61.959 1.612 18093 8137 1 12 . 1 1 48 48 SER CB C 48 62.879 62.879 62.669 0.210 18093 8138 1 12 . 1 1 48 48 SER H H 48 7.996 7.996 7.633 0.363 18093 8139 1 12 . 1 1 49 49 LEU N N 49 120.673 120.673 121.526 -0.853 18093 8140 1 12 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.120 -0.085 18093 8141 1 12 . 1 1 49 49 LEU C C 49 178.229 178.229 179.133 -0.904 18093 8142 1 12 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.353 -0.070 18093 8143 1 12 . 1 1 49 49 LEU CB C 49 41.946 41.946 41.982 -0.036 18093 8144 1 12 . 1 1 49 49 LEU H H 49 8.352 8.352 7.938 0.414 18093 8145 1 12 . 1 1 50 50 THR N N 50 115.582 115.582 114.597 0.985 18093 8146 1 12 . 1 1 50 50 THR HA H 50 3.672 3.672 4.115 -0.443 18093 8147 1 12 . 1 1 50 50 THR C C 50 175.877 175.877 176.265 -0.388 18093 8148 1 12 . 1 1 50 50 THR CA C 50 68.628 68.628 66.247 2.381 18093 8149 1 12 . 1 1 50 50 THR H H 50 7.937 7.937 7.887 0.050 18093 8150 1 12 . 1 1 51 51 VAL N N 51 119.774 119.774 122.744 -2.970 18093 8151 1 12 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.829 -0.331 18093 8152 1 12 . 1 1 51 51 VAL C C 51 177.162 177.162 177.387 -0.225 18093 8153 1 12 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.500 1.085 18093 8154 1 12 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.691 -0.170 18093 8155 1 12 . 1 1 51 51 VAL H H 51 8.115 8.115 7.988 0.127 18093 8156 1 12 . 1 1 52 52 PHE N N 52 118.808 118.808 120.351 -1.543 18093 8157 1 12 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.330 -0.208 18093 8158 1 12 . 1 1 52 52 PHE C C 52 176.697 176.697 176.569 0.128 18093 8159 1 12 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.392 1.379 18093 8160 1 12 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.189 0.073 18093 8161 1 12 . 1 1 52 52 PHE H H 52 8.256 8.256 8.760 -0.504 18093 8162 1 12 . 1 1 53 53 LEU N N 53 117.267 117.267 121.369 -4.102 18093 8163 1 12 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.575 0.318 18093 8164 1 12 . 1 1 53 53 LEU C C 53 179.319 179.319 177.789 1.530 18093 8165 1 12 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.740 0.245 18093 8166 1 12 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.352 0.475 18093 8167 1 12 . 1 1 53 53 LEU H H 53 8.443 8.443 7.503 0.940 18093 8168 1 12 . 1 1 54 54 LEU N N 54 119.762 119.762 118.795 0.967 18093 8169 1 12 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.920 0.134 18093 8170 1 12 . 1 1 54 54 LEU C C 54 178.827 178.827 178.960 -0.133 18093 8171 1 12 . 1 1 54 54 LEU CA C 54 58.105 58.105 57.985 0.120 18093 8172 1 12 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.908 0.039 18093 8173 1 12 . 1 1 54 54 LEU H H 54 8.205 8.205 7.331 0.874 18093 8174 1 12 . 1 1 55 55 LEU N N 55 118.585 118.585 118.037 0.548 18093 8175 1 12 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.916 0.161 18093 8176 1 12 . 1 1 55 55 LEU C C 55 178.909 178.909 178.576 0.333 18093 8177 1 12 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.563 0.545 18093 8178 1 12 . 1 1 55 55 LEU CB C 55 41.979 41.979 41.878 0.101 18093 8179 1 12 . 1 1 55 55 LEU H H 55 8.179 8.179 7.418 0.761 18093 8180 1 12 . 1 1 56 56 ILE N N 56 116.079 116.079 115.862 0.217 18093 8181 1 12 . 1 1 56 56 ILE HA H 56 3.729 3.729 3.950 -0.221 18093 8182 1 12 . 1 1 56 56 ILE C C 56 176.988 176.988 177.591 -0.603 18093 8183 1 12 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.317 0.940 18093 8184 1 12 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.821 0.596 18093 8185 1 12 . 1 1 56 56 ILE H H 56 8.040 8.040 7.428 0.612 18093 8186 1 12 . 1 1 57 57 THR N N 57 110.105 110.105 109.652 0.453 18093 8187 1 12 . 1 1 57 57 THR HA H 57 4.015 4.015 4.189 -0.174 18093 8188 1 12 . 1 1 57 57 THR C C 57 175.435 175.435 175.651 -0.216 18093 8189 1 12 . 1 1 57 57 THR CA C 57 65.067 65.067 64.490 0.577 18093 8190 1 12 . 1 1 57 57 THR CB C 57 69.179 69.179 68.755 0.424 18093 8191 1 12 . 1 1 57 57 THR H H 57 7.655 7.655 7.863 -0.208 18093 8192 1 12 . 1 1 58 58 GLU N N 58 117.313 117.313 121.276 -3.963 18093 8193 1 12 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.304 0.029 18093 8194 1 12 . 1 1 58 58 GLU C C 58 176.940 176.940 178.000 -1.060 18093 8195 1 12 . 1 1 58 58 GLU CA C 58 57.068 57.068 57.856 -0.788 18093 8196 1 12 . 1 1 58 58 GLU CB C 58 29.396 29.396 30.122 -0.726 18093 8197 1 12 . 1 1 58 58 GLU H H 58 7.521 7.521 7.683 -0.162 18093 8198 1 12 . 1 1 59 59 ILE N N 59 114.870 114.870 114.220 0.650 18093 8199 1 12 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.052 0.037 18093 8200 1 12 . 1 1 59 59 ILE C C 59 175.456 175.456 176.251 -0.795 18093 8201 1 12 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.262 0.172 18093 8202 1 12 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.827 -0.170 18093 8203 1 12 . 1 1 59 59 ILE H H 59 7.579 7.579 7.205 0.374 18093 8204 1 12 . 1 1 60 60 ILE N N 60 119.354 119.354 118.245 1.109 18093 8205 1 12 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.879 0.425 18093 8206 1 12 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.386 -1.769 18093 8207 1 12 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.697 2.165 18093 8208 1 12 . 1 1 60 60 ILE H H 60 7.629 7.629 7.653 -0.024 18093 8209 1 12 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.410 -0.010 18093 8210 1 12 . 1 1 61 61 PRO C C 61 177.144 177.144 176.681 0.463 18093 8211 1 12 . 1 1 61 61 PRO CA C 61 63.808 63.808 63.966 -0.158 18093 8212 1 12 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.511 -0.629 18093 8213 1 12 . 1 1 62 62 SER N N 62 114.474 114.474 112.018 2.456 18093 8214 1 12 . 1 1 62 62 SER HA H 62 4.434 4.434 4.627 -0.193 18093 8215 1 12 . 1 1 62 62 SER C C 62 175.161 175.161 172.876 2.285 18093 8216 1 12 . 1 1 62 62 SER CA C 62 59.047 59.047 58.575 0.472 18093 8217 1 12 . 1 1 62 62 SER CB C 62 63.704 63.704 63.978 -0.274 18093 8218 1 12 . 1 1 62 62 SER H H 62 8.186 8.186 7.827 0.359 18093 8219 1 12 . 1 1 63 63 THR N N 63 113.573 113.573 117.387 -3.814 18093 8220 1 12 . 1 1 63 63 THR HA H 63 4.319 4.319 4.718 -0.399 18093 8221 1 12 . 1 1 63 63 THR C C 63 174.834 174.834 173.382 1.452 18093 8222 1 12 . 1 1 63 63 THR CA C 63 62.377 62.377 61.294 1.083 18093 8223 1 12 . 1 1 63 63 THR CB C 63 69.422 69.422 70.366 -0.944 18093 8224 1 12 . 1 1 63 63 THR H H 63 7.963 7.963 8.229 -0.267 18093 8225 1 12 . 1 1 64 64 SER N N 64 116.598 116.598 119.347 -2.749 18093 8226 1 12 . 1 1 64 64 SER HA H 64 4.428 4.428 4.505 -0.077 18093 8227 1 12 . 1 1 64 64 SER C C 64 174.618 174.618 173.977 0.641 18093 8228 1 12 . 1 1 64 64 SER CA C 64 59.045 59.045 59.583 -0.538 18093 8229 1 12 . 1 1 64 64 SER CB C 64 63.700 63.700 63.123 0.577 18093 8230 1 12 . 1 1 64 64 SER H H 64 8.052 8.052 9.130 -1.078 18093 8231 1 12 . 1 1 65 65 SER N N 65 116.673 116.673 114.473 2.200 18093 8232 1 12 . 1 1 65 65 SER HA H 65 4.432 4.432 4.405 0.027 18093 8233 1 12 . 1 1 65 65 SER C C 65 174.335 174.335 173.672 0.663 18093 8234 1 12 . 1 1 65 65 SER CA C 65 58.927 58.927 59.006 -0.079 18093 8235 1 12 . 1 1 65 65 SER CB C 65 63.621 63.621 63.241 0.380 18093 8236 1 12 . 1 1 65 65 SER H H 65 8.114 8.114 8.213 -0.099 18093 8237 1 12 . 1 1 66 66 VAL N N 66 119.054 119.054 120.107 -1.053 18093 8238 1 12 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.423 -0.253 18093 8239 1 12 . 1 1 66 66 VAL C C 66 175.278 175.278 175.486 -0.208 18093 8240 1 12 . 1 1 66 66 VAL CA C 66 62.062 62.062 59.972 2.090 18093 8241 1 12 . 1 1 66 66 VAL CB C 66 32.629 32.629 33.265 -0.636 18093 8242 1 12 . 1 1 66 66 VAL H H 66 7.740 7.740 7.468 0.272 18093 8243 1 12 . 1 1 67 67 SER N N 67 118.882 118.882 116.083 2.799 18093 8244 1 12 . 1 1 67 67 SER HA H 67 4.704 4.704 4.517 0.187 18093 8245 1 12 . 1 1 67 67 SER CA C 67 56.715 56.715 57.594 -0.879 18093 8246 1 12 . 1 1 67 67 SER CB C 67 63.624 63.624 63.529 0.096 18093 8247 1 12 . 1 1 67 67 SER H H 67 8.060 8.060 8.458 -0.398 18093 8248 1 12 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.821 -0.421 18093 8249 1 12 . 1 1 68 68 PRO C C 68 176.925 176.925 177.254 -0.329 18093 8250 1 12 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.552 1.196 18093 8251 1 12 . 1 1 68 68 PRO CB C 68 32.005 32.005 32.532 -0.527 18093 8252 1 12 . 1 1 69 69 SER N N 69 114.930 114.930 114.449 0.481 18093 8253 1 12 . 1 1 69 69 SER HA H 69 4.422 4.422 4.164 0.258 18093 8254 1 12 . 1 1 69 69 SER C C 69 175.617 175.617 177.256 -1.639 18093 8255 1 12 . 1 1 69 69 SER CA C 69 58.697 58.697 61.217 -2.520 18093 8256 1 12 . 1 1 69 69 SER CB C 69 63.804 63.804 63.154 0.650 18093 8257 1 12 . 1 1 69 69 SER H H 69 8.205 8.205 8.362 -0.157 18093 8258 1 12 . 1 1 70 70 ILE N N 70 120.840 120.840 121.133 -0.293 18093 8259 1 12 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.082 -0.090 18093 8260 1 12 . 1 1 70 70 ILE C C 70 177.524 177.524 176.828 0.696 18093 8261 1 12 . 1 1 70 70 ILE CA C 70 64.335 64.335 62.730 1.605 18093 8262 1 12 . 1 1 70 70 ILE CB C 70 37.460 37.460 37.468 -0.007 18093 8263 1 12 . 1 1 70 70 ILE H H 70 8.283 8.283 8.344 -0.061 18093 8264 1 12 . 1 1 71 71 GLY N N 71 107.823 107.823 107.600 0.223 18093 8265 1 12 . 1 1 71 71 GLY C C 71 175.296 175.296 176.171 -0.875 18093 8266 1 12 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.084 0.372 18093 8267 1 12 . 1 1 71 71 GLY H H 71 8.557 8.557 8.511 0.046 18093 8268 1 12 . 1 1 72 72 GLU N N 72 120.835 120.835 120.742 0.093 18093 8269 1 12 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.258 -0.411 18093 8270 1 12 . 1 1 72 72 GLU C C 72 178.198 178.198 178.202 -0.004 18093 8271 1 12 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.232 1.885 18093 8272 1 12 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.741 -0.348 18093 8273 1 12 . 1 1 72 72 GLU H H 72 7.922 7.922 7.804 0.118 18093 8274 1 12 . 1 1 73 73 TYR N N 73 117.375 117.375 122.460 -5.085 18093 8275 1 12 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.238 -0.076 18093 8276 1 12 . 1 1 73 73 TYR C C 73 179.912 179.912 177.150 2.762 18093 8277 1 12 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.484 0.671 18093 8278 1 12 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.577 0.189 18093 8279 1 12 . 1 1 73 73 TYR H H 73 8.062 8.062 7.825 0.237 18093 8280 1 12 . 1 1 74 74 LEU N N 74 121.493 121.493 119.195 2.298 18093 8281 1 12 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.781 0.268 18093 8282 1 12 . 1 1 74 74 LEU C C 74 178.063 178.063 178.838 -0.775 18093 8283 1 12 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.914 0.581 18093 8284 1 12 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.820 0.027 18093 8285 1 12 . 1 1 74 74 LEU H H 74 8.552 8.552 8.935 -0.383 18093 8286 1 12 . 1 1 75 75 LEU N N 75 120.375 120.375 119.756 0.619 18093 8287 1 12 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.016 0.024 18093 8288 1 12 . 1 1 75 75 LEU C C 75 178.515 178.515 178.639 -0.124 18093 8289 1 12 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.436 0.202 18093 8290 1 12 . 1 1 75 75 LEU CB C 75 42.039 42.039 41.925 0.114 18093 8291 1 12 . 1 1 75 75 LEU H H 75 8.276 8.276 7.473 0.803 18093 8292 1 12 . 1 1 76 76 PHE N N 76 116.626 116.626 118.505 -1.879 18093 8293 1 12 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.057 0.022 18093 8294 1 12 . 1 1 76 76 PHE C C 76 177.399 177.399 178.032 -0.633 18093 8295 1 12 . 1 1 76 76 PHE CA C 76 61.734 61.734 62.262 -0.528 18093 8296 1 12 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.295 0.446 18093 8297 1 12 . 1 1 76 76 PHE H H 76 8.454 8.454 8.323 0.131 18093 8298 1 12 . 1 1 77 77 THR N N 77 116.080 116.080 115.727 0.353 18093 8299 1 12 . 1 1 77 77 THR HA H 77 3.687 3.687 3.835 -0.148 18093 8300 1 12 . 1 1 77 77 THR C C 77 176.018 176.018 176.429 -0.411 18093 8301 1 12 . 1 1 77 77 THR CA C 77 68.640 68.640 67.040 1.600 18093 8302 1 12 . 1 1 77 77 THR H H 77 8.224 8.224 8.424 -0.200 18093 8303 1 12 . 1 1 78 78 MET N N 78 119.394 119.394 120.672 -1.278 18093 8304 1 12 . 1 1 78 78 MET HA H 78 4.129 4.129 3.951 0.178 18093 8305 1 12 . 1 1 78 78 MET C C 78 179.608 179.608 178.499 1.109 18093 8306 1 12 . 1 1 78 78 MET CA C 78 58.831 58.831 60.116 -1.285 18093 8307 1 12 . 1 1 78 78 MET CB C 78 31.590 31.590 32.442 -0.852 18093 8308 1 12 . 1 1 78 78 MET H H 78 8.372 8.372 7.489 0.883 18093 8309 1 12 . 1 1 79 79 ILE N N 79 121.819 121.819 119.143 2.676 18093 8310 1 12 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.589 -0.039 18093 8311 1 12 . 1 1 79 79 ILE C C 79 176.426 176.426 177.847 -1.421 18093 8312 1 12 . 1 1 79 79 ILE CA C 79 65.876 65.876 65.078 0.798 18093 8313 1 12 . 1 1 79 79 ILE CB C 79 37.673 37.673 37.557 0.116 18093 8314 1 12 . 1 1 79 79 ILE H H 79 8.391 8.391 8.387 0.004 18093 8315 1 12 . 1 1 80 80 PHE N N 80 119.916 119.916 121.018 -1.102 18093 8316 1 12 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.049 0.004 18093 8317 1 12 . 1 1 80 80 PHE C C 80 178.568 178.568 177.013 1.555 18093 8318 1 12 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.228 0.079 18093 8319 1 12 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.376 -0.602 18093 8320 1 12 . 1 1 80 80 PHE H H 80 8.479 8.479 7.879 0.600 18093 8321 1 12 . 1 1 81 81 VAL N N 81 120.191 120.191 116.286 3.905 18093 8322 1 12 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.549 -0.096 18093 8323 1 12 . 1 1 81 81 VAL C C 81 178.225 178.225 177.773 0.452 18093 8324 1 12 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.667 0.741 18093 8325 1 12 . 1 1 81 81 VAL CB C 81 31.556 31.556 31.394 0.162 18093 8326 1 12 . 1 1 81 81 VAL H H 81 8.928 8.928 8.680 0.248 18093 8327 1 12 . 1 1 82 82 THR N N 82 115.930 115.930 117.297 -1.367 18093 8328 1 12 . 1 1 82 82 THR HA H 82 3.636 3.636 3.854 -0.218 18093 8329 1 12 . 1 1 82 82 THR C C 82 176.420 176.420 176.310 0.110 18093 8330 1 12 . 1 1 82 82 THR CA C 82 68.570 68.570 67.632 0.938 18093 8331 1 12 . 1 1 82 82 THR CB C 82 68.202 68.202 68.927 -0.725 18093 8332 1 12 . 1 1 82 82 THR H H 82 7.969 7.969 7.876 0.093 18093 8333 1 12 . 1 1 83 83 LEU N N 83 119.780 119.780 120.700 -0.920 18093 8334 1 12 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.868 -0.021 18093 8335 1 12 . 1 1 83 83 LEU C C 83 178.214 178.214 178.836 -0.622 18093 8336 1 12 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.514 0.723 18093 8337 1 12 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.460 0.331 18093 8338 1 12 . 1 1 83 83 LEU H H 83 8.483 8.483 7.476 1.007 18093 8339 1 12 . 1 1 84 84 SER N N 84 114.559 114.559 113.806 0.753 18093 8340 1 12 . 1 1 84 84 SER HA H 84 4.099 4.099 4.118 -0.019 18093 8341 1 12 . 1 1 84 84 SER C C 84 176.799 176.799 175.792 1.007 18093 8342 1 12 . 1 1 84 84 SER CA C 84 63.609 63.609 61.467 2.142 18093 8343 1 12 . 1 1 84 84 SER CB C 84 63.110 63.110 62.516 0.594 18093 8344 1 12 . 1 1 84 84 SER H H 84 8.023 8.023 7.970 0.053 18093 8345 1 12 . 1 1 85 85 ILE N N 85 123.962 123.962 121.050 2.912 18093 8346 1 12 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.683 -0.079 18093 8347 1 12 . 1 1 85 85 ILE C C 85 177.487 177.487 177.209 0.278 18093 8348 1 12 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.189 0.570 18093 8349 1 12 . 1 1 85 85 ILE CB C 85 37.887 37.887 38.191 -0.303 18093 8350 1 12 . 1 1 85 85 ILE H H 85 8.054 8.054 7.395 0.659 18093 8351 1 12 . 1 1 86 86 VAL N N 86 118.744 118.744 118.712 0.032 18093 8352 1 12 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.659 -0.140 18093 8353 1 12 . 1 1 86 86 VAL C C 86 177.557 177.557 177.989 -0.432 18093 8354 1 12 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.471 1.064 18093 8355 1 12 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.369 0.097 18093 8356 1 12 . 1 1 86 86 VAL H H 86 8.158 8.158 7.454 0.704 18093 8357 1 12 . 1 1 87 87 ILE N N 87 117.206 117.206 118.712 -1.506 18093 8358 1 12 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.849 -0.245 18093 8359 1 12 . 1 1 87 87 ILE C C 87 177.283 177.283 178.118 -0.835 18093 8360 1 12 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.190 2.486 18093 8361 1 12 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.475 1.114 18093 8362 1 12 . 1 1 87 87 ILE H H 87 8.459 8.459 7.926 0.533 18093 8363 1 12 . 1 1 88 88 THR N N 88 116.158 116.158 117.354 -1.196 18093 8364 1 12 . 1 1 88 88 THR HA H 88 3.672 3.672 4.338 -0.666 18093 8365 1 12 . 1 1 88 88 THR C C 88 175.485 175.485 177.204 -1.719 18093 8366 1 12 . 1 1 88 88 THR CA C 88 68.549 68.549 67.156 1.393 18093 8367 1 12 . 1 1 88 88 THR CB C 88 68.127 68.127 69.066 -0.939 18093 8368 1 12 . 1 1 88 88 THR H H 88 7.776 7.776 7.639 0.137 18093 8369 1 12 . 1 1 89 89 VAL N N 89 117.985 117.985 121.197 -3.212 18093 8370 1 12 . 1 1 89 89 VAL HA H 89 3.543 3.543 4.023 -0.480 18093 8371 1 12 . 1 1 89 89 VAL C C 89 177.393 177.393 177.274 0.119 18093 8372 1 12 . 1 1 89 89 VAL CA C 89 66.590 66.590 64.554 2.036 18093 8373 1 12 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.282 0.496 18093 8374 1 12 . 1 1 89 89 VAL H H 89 8.206 8.206 8.778 -0.572 18093 8375 1 12 . 1 1 90 90 PHE N N 90 116.709 116.709 120.484 -3.775 18093 8376 1 12 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.308 0.070 18093 8377 1 12 . 1 1 90 90 PHE C C 90 177.305 177.305 177.793 -0.488 18093 8378 1 12 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.307 -0.188 18093 8379 1 12 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.546 0.839 18093 8380 1 12 . 1 1 90 90 PHE H H 90 7.956 7.956 7.699 0.257 18093 8381 1 12 . 1 1 91 91 VAL N N 91 116.565 116.565 119.353 -2.788 18093 8382 1 12 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.721 0.114 18093 8383 1 12 . 1 1 91 91 VAL C C 91 176.927 176.927 177.156 -0.229 18093 8384 1 12 . 1 1 91 91 VAL CA C 91 65.347 65.347 65.572 -0.225 18093 8385 1 12 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.892 -0.024 18093 8386 1 12 . 1 1 91 91 VAL H H 91 8.239 8.239 7.750 0.489 18093 8387 1 12 . 1 1 92 92 LEU N N 92 117.443 117.443 117.194 0.249 18093 8388 1 12 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.218 -0.024 18093 8389 1 12 . 1 1 92 92 LEU C C 92 177.180 177.180 177.876 -0.696 18093 8390 1 12 . 1 1 92 92 LEU CA C 92 56.184 56.184 55.904 0.280 18093 8391 1 12 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.553 -0.609 18093 8392 1 12 . 1 1 92 92 LEU H H 92 7.967 7.967 7.656 0.311 18093 8393 1 12 . 1 1 93 93 ASN N N 93 116.705 116.705 117.177 -0.472 18093 8394 1 12 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.496 0.151 18093 8395 1 12 . 1 1 93 93 ASN C C 93 175.129 175.129 175.956 -0.827 18093 8396 1 12 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.466 -1.612 18093 8397 1 12 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.506 -0.111 18093 8398 1 12 . 1 1 93 93 ASN H H 93 7.683 7.683 7.787 -0.104 18093 8399 1 12 . 1 1 94 94 VAL N N 94 118.224 118.224 118.007 0.217 18093 8400 1 12 . 1 1 94 94 VAL HA H 94 3.961 3.961 4.258 -0.297 18093 8401 1 12 . 1 1 94 94 VAL C C 94 175.600 175.600 173.707 1.893 18093 8402 1 12 . 1 1 94 94 VAL CA C 94 62.825 62.825 62.207 0.618 18093 8403 1 12 . 1 1 94 94 VAL CB C 94 32.214 32.214 33.326 -1.112 18093 8404 1 12 . 1 1 94 94 VAL H H 94 7.627 7.627 7.538 0.089 18093 8405 1 12 . 1 1 95 95 HIS N N 95 120.999 120.999 125.454 -4.455 18093 8406 1 12 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.787 -0.194 18093 8407 1 12 . 1 1 95 95 HIS C C 95 174.146 174.146 174.227 -0.081 18093 8408 1 12 . 1 1 95 95 HIS CA C 95 55.666 55.666 56.176 -0.510 18093 8409 1 12 . 1 1 95 95 HIS CB C 95 29.736 29.736 30.359 -0.623 18093 8410 1 12 . 1 1 95 95 HIS H H 95 8.263 8.263 8.735 -0.472 18093 8411 1 12 . 1 1 96 96 HIS N N 96 122.740 122.740 116.443 6.297 18093 8412 1 12 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.723 -0.090 18093 8413 1 12 . 1 1 96 96 HIS CA C 96 55.895 55.895 55.724 0.171 18093 8414 1 12 . 1 1 96 96 HIS CB C 96 29.750 29.750 29.926 -0.176 18093 8415 1 12 . 1 1 96 96 HIS H H 96 8.298 8.298 8.297 0.001 18093 8416 1 12 . 1 1 97 97 ARG N N 97 118.503 118.503 120.909 -2.406 18093 8417 1 12 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.393 -0.081 18093 8418 1 12 . 1 1 97 97 ARG C C 97 175.776 175.776 175.038 0.738 18093 8419 1 12 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.164 1.061 18093 8420 1 12 . 1 1 97 97 ARG CB C 97 30.912 30.912 31.736 -0.824 18093 8421 1 12 . 1 1 97 97 ARG H H 97 8.250 8.250 8.357 -0.107 18093 8422 1 12 . 1 1 98 98 SER N N 98 118.482 118.482 114.009 4.473 18093 8423 1 12 . 1 1 98 98 SER HA H 98 4.722 4.722 4.465 0.257 18093 8424 1 12 . 1 1 98 98 SER CA C 98 56.547 56.547 56.367 0.180 18093 8425 1 12 . 1 1 98 98 SER CB C 98 63.624 63.624 64.018 -0.394 18093 8426 1 12 . 1 1 98 98 SER H H 98 8.254 8.254 7.942 0.312 18093 8427 1 12 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.358 0.045 18093 8428 1 12 . 1 1 99 99 PRO C C 99 176.899 176.899 176.706 0.193 18093 8429 1 12 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.730 -1.029 18093 8430 1 12 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.150 -0.201 18093 8431 1 12 . 1 1 100 100 GLU N N 100 120.187 120.187 114.828 5.359 18093 8432 1 12 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.358 -0.070 18093 8433 1 12 . 1 1 100 100 GLU C C 100 176.593 176.593 175.097 1.496 18093 8434 1 12 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.527 0.195 18093 8435 1 12 . 1 1 100 100 GLU CB C 100 29.999 29.999 30.674 -0.675 18093 8436 1 12 . 1 1 100 100 GLU H H 100 8.401 8.401 8.427 -0.026 18093 8437 1 12 . 1 1 101 101 THR N N 101 113.968 113.968 115.147 -1.179 18093 8438 1 12 . 1 1 101 101 THR HA H 101 4.286 4.286 4.599 -0.313 18093 8439 1 12 . 1 1 101 101 THR C C 101 174.525 174.525 174.175 0.350 18093 8440 1 12 . 1 1 101 101 THR CA C 101 61.956 61.956 62.776 -0.820 18093 8441 1 12 . 1 1 101 101 THR CB C 101 69.697 69.697 69.131 0.566 18093 8442 1 12 . 1 1 101 101 THR H H 101 7.945 7.945 7.934 0.011 18093 8443 1 12 . 1 1 102 102 HIS N N 102 120.322 120.322 125.996 -5.674 18093 8444 1 12 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.753 -0.012 18093 8445 1 12 . 1 1 102 102 HIS C C 102 174.783 174.783 173.716 1.067 18093 8446 1 12 . 1 1 102 102 HIS CA C 102 55.701 55.701 56.842 -1.141 18093 8447 1 12 . 1 1 102 102 HIS CB C 102 29.093 29.093 31.040 -1.947 18093 8448 1 12 . 1 1 102 102 HIS H H 102 8.455 8.455 8.508 -0.053 18093 8449 1 12 . 1 1 103 103 THR N N 103 114.282 114.282 117.187 -2.905 18093 8450 1 12 . 1 1 103 103 THR HA H 103 4.352 4.352 4.505 -0.153 18093 8451 1 12 . 1 1 103 103 THR C C 103 175.104 175.104 174.910 0.194 18093 8452 1 12 . 1 1 103 103 THR CA C 103 62.057 62.057 62.225 -0.168 18093 8453 1 12 . 1 1 103 103 THR CB C 103 69.966 69.966 69.848 0.118 18093 8454 1 12 . 1 1 103 103 THR H H 103 8.069 8.069 8.029 0.040 18093 8455 1 12 . 1 1 104 104 GLY N N 104 111.159 111.159 114.328 -3.169 18093 8456 1 12 . 1 1 104 104 GLY C C 104 174.776 174.776 174.420 0.356 18093 8457 1 12 . 1 1 104 104 GLY CA C 104 45.588 45.588 45.079 0.509 18093 8458 1 12 . 1 1 104 104 GLY H H 104 8.393 8.393 8.467 -0.074 18093 8459 1 12 . 1 1 105 105 GLY N N 105 108.657 108.657 109.846 -1.189 18093 8460 1 12 . 1 1 105 105 GLY C C 105 174.957 174.957 175.356 -0.399 18093 8461 1 12 . 1 1 105 105 GLY CA C 105 45.612 45.612 44.621 0.991 18093 8462 1 12 . 1 1 105 105 GLY H H 105 8.275 8.275 7.800 0.475 18093 8463 1 12 . 1 1 106 106 GLY N N 106 108.870 108.870 111.445 -2.575 18093 8464 1 12 . 1 1 106 106 GLY C C 106 174.877 174.877 173.853 1.024 18093 8465 1 12 . 1 1 106 106 GLY CA C 106 45.665 45.665 45.231 0.434 18093 8466 1 12 . 1 1 106 106 GLY H H 106 8.357 8.357 8.238 0.119 18093 8467 1 12 . 1 1 107 107 GLY N N 107 108.476 108.476 108.102 0.374 18093 8468 1 12 . 1 1 107 107 GLY C C 107 174.877 174.877 174.295 0.582 18093 8469 1 12 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.105 0.591 18093 8470 1 12 . 1 1 107 107 GLY H H 107 8.330 8.330 8.125 0.205 18093 8471 1 12 . 1 1 108 108 GLY N N 108 108.486 108.486 110.327 -1.841 18093 8472 1 12 . 1 1 108 108 GLY C C 108 175.345 175.345 175.303 0.042 18093 8473 1 12 . 1 1 108 108 GLY CA C 108 45.763 45.763 44.431 1.332 18093 8474 1 12 . 1 1 108 108 GLY H H 108 8.328 8.328 8.466 -0.138 18093 8475 1 12 . 1 1 109 109 ILE N N 109 120.433 120.433 120.489 -0.056 18093 8476 1 12 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.968 0.000 18093 8477 1 12 . 1 1 109 109 ILE C C 109 176.127 176.127 177.092 -0.965 18093 8478 1 12 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.403 -0.668 18093 8479 1 12 . 1 1 109 109 ILE CB C 109 38.125 38.125 38.117 0.008 18093 8480 1 12 . 1 1 109 109 ILE H H 109 8.192 8.192 7.898 0.294 18093 8481 1 12 . 1 1 110 110 ASP N N 110 121.148 121.148 119.351 1.797 18093 8482 1 12 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.578 -0.272 18093 8483 1 12 . 1 1 110 110 ASP C C 110 177.651 177.651 178.191 -0.540 18093 8484 1 12 . 1 1 110 110 ASP CA C 110 56.776 56.776 57.768 -0.992 18093 8485 1 12 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.847 0.250 18093 8486 1 12 . 1 1 110 110 ASP H H 110 8.427 8.427 8.660 -0.233 18093 8487 1 12 . 1 1 111 111 ARG N N 111 119.228 119.228 119.155 0.073 18093 8488 1 12 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.260 -0.264 18093 8489 1 12 . 1 1 111 111 ARG C C 111 177.786 177.786 178.916 -1.130 18093 8490 1 12 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.049 -0.107 18093 8491 1 12 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.942 0.254 18093 8492 1 12 . 1 1 111 111 ARG H H 111 7.850 7.850 8.440 -0.590 18093 8493 1 12 . 1 1 112 112 ILE N N 112 118.000 118.000 119.538 -1.538 18093 8494 1 12 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.116 -0.303 18093 8495 1 12 . 1 1 112 112 ILE C C 112 177.496 177.496 177.919 -0.423 18093 8496 1 12 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.158 2.654 18093 8497 1 12 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.896 0.831 18093 8498 1 12 . 1 1 112 112 ILE H H 112 7.764 7.764 7.799 -0.035 18093 8499 1 12 . 1 1 113 113 PHE N N 113 118.367 118.367 122.088 -3.721 18093 8500 1 12 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.282 -0.027 18093 8501 1 12 . 1 1 113 113 PHE C C 113 177.218 177.218 177.386 -0.168 18093 8502 1 12 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.334 -0.901 18093 8503 1 12 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.191 -0.384 18093 8504 1 12 . 1 1 113 113 PHE H H 113 7.963 7.963 7.896 0.067 18093 8505 1 12 . 1 1 114 114 LEU N N 114 118.921 118.921 117.260 1.661 18093 8506 1 12 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.930 0.067 18093 8507 1 12 . 1 1 114 114 LEU C C 114 178.297 178.297 178.444 -0.147 18093 8508 1 12 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.158 0.453 18093 8509 1 12 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.266 0.686 18093 8510 1 12 . 1 1 114 114 LEU H H 114 7.939 7.939 8.059 -0.120 18093 8511 1 12 . 1 1 115 115 TRP N N 115 117.464 117.464 119.463 -1.999 18093 8512 1 12 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.381 -0.007 18093 8513 1 12 . 1 1 115 115 TRP C C 115 178.572 178.572 178.251 0.321 18093 8514 1 12 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.781 1.141 18093 8515 1 12 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.777 -1.270 18093 8516 1 12 . 1 1 115 115 TRP H H 115 7.969 7.969 7.619 0.350 18093 8517 1 12 . 1 1 116 116 MET N N 116 117.069 117.069 118.920 -1.851 18093 8518 1 12 . 1 1 116 116 MET HA H 116 4.065 4.065 4.221 -0.156 18093 8519 1 12 . 1 1 116 116 MET C C 116 177.425 177.425 178.186 -0.761 18093 8520 1 12 . 1 1 116 116 MET CA C 116 59.289 59.289 59.074 0.215 18093 8521 1 12 . 1 1 116 116 MET CB C 116 31.692 31.692 32.512 -0.820 18093 8522 1 12 . 1 1 116 116 MET H H 116 8.465 8.465 7.721 0.744 18093 8523 1 12 . 1 1 117 117 PHE N N 117 118.755 118.755 117.586 1.169 18093 8524 1 12 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.085 0.014 18093 8525 1 12 . 1 1 117 117 PHE C C 117 177.965 177.965 178.182 -0.217 18093 8526 1 12 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.144 -0.436 18093 8527 1 12 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.253 0.932 18093 8528 1 12 . 1 1 117 117 PHE H H 117 8.418 8.418 7.856 0.562 18093 8529 1 12 . 1 1 118 118 ILE N N 118 119.133 119.133 115.298 3.835 18093 8530 1 12 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.870 -0.526 18093 8531 1 12 . 1 1 118 118 ILE C C 118 177.244 177.244 177.355 -0.111 18093 8532 1 12 . 1 1 118 118 ILE CA C 118 65.825 65.825 63.920 1.905 18093 8533 1 12 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.840 -0.292 18093 8534 1 12 . 1 1 118 118 ILE H H 118 8.266 8.266 7.661 0.605 18093 8535 1 12 . 1 1 119 119 ILE N N 119 118.846 118.846 121.557 -2.711 18093 8536 1 12 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.944 -0.372 18093 8537 1 12 . 1 1 119 119 ILE C C 119 177.523 177.523 177.424 0.099 18093 8538 1 12 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.220 0.669 18093 8539 1 12 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.255 -0.691 18093 8540 1 12 . 1 1 119 119 ILE H H 119 8.308 8.308 7.291 1.017 18093 8541 1 12 . 1 1 120 120 VAL N N 120 119.228 119.228 118.041 1.187 18093 8542 1 12 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.847 -0.339 18093 8543 1 12 . 1 1 120 120 VAL C C 120 177.651 177.651 177.100 0.551 18093 8544 1 12 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.031 2.570 18093 8545 1 12 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.572 0.834 18093 8546 1 12 . 1 1 120 120 VAL H H 120 8.399 8.399 7.936 0.463 18093 8547 1 12 . 1 1 121 121 CYS N N 121 117.151 117.151 119.091 -1.940 18093 8548 1 12 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.035 -0.133 18093 8549 1 12 . 1 1 121 121 CYS C C 121 177.719 177.719 176.986 0.733 18093 8550 1 12 . 1 1 121 121 CYS CA C 121 64.298 64.298 63.770 0.528 18093 8551 1 12 . 1 1 121 121 CYS CB C 121 26.677 26.677 27.253 -0.576 18093 8552 1 12 . 1 1 121 121 CYS H H 121 8.008 8.008 7.423 0.585 18093 8553 1 12 . 1 1 122 122 LEU N N 122 121.402 121.402 120.761 0.641 18093 8554 1 12 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.199 -0.216 18093 8555 1 12 . 1 1 122 122 LEU C C 122 178.282 178.282 178.739 -0.457 18093 8556 1 12 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.804 0.741 18093 8557 1 12 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.416 0.550 18093 8558 1 12 . 1 1 122 122 LEU H H 122 8.417 8.417 7.712 0.705 18093 8559 1 12 . 1 1 123 123 LEU N N 123 118.543 118.543 119.763 -1.220 18093 8560 1 12 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.018 -0.097 18093 8561 1 12 . 1 1 123 123 LEU C C 123 179.028 179.028 178.727 0.301 18093 8562 1 12 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.538 -0.420 18093 8563 1 12 . 1 1 123 123 LEU CB C 123 42.056 42.056 40.894 1.162 18093 8564 1 12 . 1 1 123 123 LEU H H 123 8.590 8.590 7.754 0.836 18093 8565 1 12 . 1 1 124 124 GLY N N 124 104.896 104.896 105.659 -0.763 18093 8566 1 12 . 1 1 124 124 GLY C C 124 173.932 173.932 176.001 -2.069 18093 8567 1 12 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.617 -0.390 18093 8568 1 12 . 1 1 124 124 GLY H H 124 8.601 8.601 8.247 0.354 18093 8569 1 12 . 1 1 125 125 THR N N 125 115.403 115.403 119.238 -3.835 18093 8570 1 12 . 1 1 125 125 THR HA H 125 3.686 3.686 3.901 -0.215 18093 8571 1 12 . 1 1 125 125 THR C C 125 176.407 176.407 176.815 -0.408 18093 8572 1 12 . 1 1 125 125 THR CA C 125 67.565 67.565 67.071 0.494 18093 8573 1 12 . 1 1 125 125 THR CB C 125 68.143 68.143 68.404 -0.261 18093 8574 1 12 . 1 1 125 125 THR H H 125 7.734 7.734 7.540 0.194 18093 8575 1 12 . 1 1 126 126 VAL N N 126 119.056 119.056 121.146 -2.090 18093 8576 1 12 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.707 -0.168 18093 8577 1 12 . 1 1 126 126 VAL C C 126 177.628 177.628 177.961 -0.333 18093 8578 1 12 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.837 -0.236 18093 8579 1 12 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.682 -0.188 18093 8580 1 12 . 1 1 126 126 VAL H H 126 8.015 8.015 8.257 -0.242 18093 8581 1 12 . 1 1 127 127 GLY N N 127 104.644 104.644 107.365 -2.721 18093 8582 1 12 . 1 1 127 127 GLY C C 127 173.933 173.933 175.863 -1.930 18093 8583 1 12 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.289 -0.008 18093 8584 1 12 . 1 1 127 127 GLY H H 127 8.248 8.248 8.361 -0.113 18093 8585 1 12 . 1 1 128 128 LEU N N 128 117.354 117.354 120.701 -3.347 18093 8586 1 12 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.040 -0.028 18093 8587 1 12 . 1 1 128 128 LEU C C 128 177.443 177.443 178.258 -0.815 18093 8588 1 12 . 1 1 128 128 LEU CA C 128 56.626 56.626 57.102 -0.476 18093 8589 1 12 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.861 0.399 18093 8590 1 12 . 1 1 128 128 LEU H H 128 7.568 7.568 8.002 -0.434 18093 8591 1 12 . 1 1 129 129 PHE N N 129 113.971 113.971 116.822 -2.851 18093 8592 1 12 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.316 0.142 18093 8593 1 12 . 1 1 129 129 PHE C C 129 176.216 176.216 176.075 0.141 18093 8594 1 12 . 1 1 129 129 PHE CA C 129 58.385 58.385 60.607 -2.222 18093 8595 1 12 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.669 0.050 18093 8596 1 12 . 1 1 129 129 PHE H H 129 7.639 7.639 7.831 -0.192 18093 8597 1 12 . 1 1 130 130 LEU N N 130 117.752 117.752 119.973 -2.221 18093 8598 1 12 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.826 -0.393 18093 8599 1 12 . 1 1 130 130 LEU CA C 130 54.156 54.156 52.065 2.091 18093 8600 1 12 . 1 1 130 130 LEU H H 130 8.099 8.099 7.532 0.567 18093 8601 1 12 . 1 1 131 131 PRO HA H 131 4.450 4.450 5.103 -0.653 18093 8602 1 12 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.464 2.435 18093 8603 1 12 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.414 -0.152 18093 8604 1 12 . 1 1 132 132 PRO C C 132 177.616 177.616 178.668 -1.052 18093 8605 1 12 . 1 1 132 132 PRO CA C 132 64.980 64.980 65.452 -0.472 18093 8606 1 12 . 1 1 132 132 PRO CB C 132 31.625 31.625 31.919 -0.294 18093 8607 1 12 . 1 1 133 133 TRP N N 133 115.508 115.508 119.336 -3.828 18093 8608 1 12 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.451 0.141 18093 8609 1 12 . 1 1 133 133 TRP C C 133 176.842 176.842 176.671 0.171 18093 8610 1 12 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.479 -2.196 18093 8611 1 12 . 1 1 133 133 TRP CB C 133 28.596 28.596 28.750 -0.154 18093 8612 1 12 . 1 1 133 133 TRP H H 133 7.311 7.311 8.386 -1.075 18093 8613 1 12 . 1 1 134 134 LEU N N 134 119.570 119.570 115.888 3.682 18093 8614 1 12 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.179 -0.002 18093 8615 1 12 . 1 1 134 134 LEU C C 134 175.768 175.768 177.441 -1.673 18093 8616 1 12 . 1 1 134 134 LEU CA C 134 55.621 55.621 54.623 0.998 18093 8617 1 12 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.935 0.713 18093 8618 1 12 . 1 1 134 134 LEU H H 134 7.453 7.453 7.256 0.197 18093 8619 1 12 . 1 1 135 135 ALA N N 135 119.004 119.004 121.372 -2.368 18093 8620 1 12 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.193 0.030 18093 8621 1 12 . 1 1 135 135 ALA C C 135 177.170 177.170 178.306 -1.136 18093 8622 1 12 . 1 1 135 135 ALA CA C 135 52.456 52.456 54.052 -1.596 18093 8623 1 12 . 1 1 135 135 ALA CB C 135 19.736 19.736 19.626 0.110 18093 8624 1 12 . 1 1 135 135 ALA H H 135 7.541 7.541 7.444 0.097 18093 8625 1 12 . 1 1 136 136 GLY N N 136 105.879 105.879 104.412 1.467 18093 8626 1 12 . 1 1 136 136 GLY C C 136 173.042 173.042 174.460 -1.418 18093 8627 1 12 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.132 0.561 18093 8628 1 12 . 1 1 136 136 GLY H H 136 7.846 7.846 7.940 -0.094 18093 8629 1 13 . 1 1 5 5 GLU N N 5 119.627 119.627 120.142 -0.515 18093 8630 1 13 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.391 -0.183 18093 8631 1 13 . 1 1 5 5 GLU C C 5 176.581 176.581 175.124 1.457 18093 8632 1 13 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.277 0.768 18093 8633 1 13 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.806 0.232 18093 8634 1 13 . 1 1 5 5 GLU H H 5 8.003 8.003 8.348 -0.345 18093 8635 1 13 . 1 1 6 6 LEU N N 6 121.267 121.267 122.371 -1.104 18093 8636 1 13 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.683 -0.258 18093 8637 1 13 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.478 2.157 18093 8638 1 13 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.809 -0.513 18093 8639 1 13 . 1 1 6 6 LEU H H 6 8.104 8.104 7.871 0.233 18093 8640 1 13 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.555 -0.156 18093 8641 1 13 . 1 1 7 7 PRO C C 7 178.408 178.408 177.961 0.447 18093 8642 1 13 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.066 2.646 18093 8643 1 13 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.835 -0.918 18093 8644 1 13 . 1 1 8 8 LEU N N 8 121.835 121.835 121.023 0.812 18093 8645 1 13 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.056 0.033 18093 8646 1 13 . 1 1 8 8 LEU C C 8 177.902 177.902 178.308 -0.406 18093 8647 1 13 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.618 0.486 18093 8648 1 13 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.116 0.491 18093 8649 1 13 . 1 1 8 8 LEU H H 8 8.162 8.162 8.547 -0.385 18093 8650 1 13 . 1 1 9 9 PHE N N 9 118.342 118.342 119.051 -0.709 18093 8651 1 13 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.155 0.034 18093 8652 1 13 . 1 1 9 9 PHE C C 9 177.596 177.596 177.112 0.484 18093 8653 1 13 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.127 -0.013 18093 8654 1 13 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.191 0.537 18093 8655 1 13 . 1 1 9 9 PHE H H 9 8.318 8.318 8.189 0.129 18093 8656 1 13 . 1 1 10 10 TYR N N 10 117.584 117.584 118.846 -1.262 18093 8657 1 13 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.790 0.364 18093 8658 1 13 . 1 1 10 10 TYR C C 10 177.630 177.630 177.288 0.342 18093 8659 1 13 . 1 1 10 10 TYR CA C 10 61.036 61.036 59.905 1.131 18093 8660 1 13 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.144 0.516 18093 8661 1 13 . 1 1 10 10 TYR H H 10 8.105 8.105 8.391 -0.286 18093 8662 1 13 . 1 1 11 11 THR N N 11 115.563 115.563 116.554 -0.991 18093 8663 1 13 . 1 1 11 11 THR HA H 11 3.871 3.871 3.872 -0.001 18093 8664 1 13 . 1 1 11 11 THR C C 11 175.955 175.955 176.558 -0.603 18093 8665 1 13 . 1 1 11 11 THR CA C 11 67.290 67.290 66.575 0.715 18093 8666 1 13 . 1 1 11 11 THR CB C 11 68.201 68.201 68.636 -0.435 18093 8667 1 13 . 1 1 11 11 THR H H 11 7.915 7.915 7.638 0.277 18093 8668 1 13 . 1 1 12 12 ILE N N 12 119.727 119.727 119.933 -0.206 18093 8669 1 13 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.937 -0.238 18093 8670 1 13 . 1 1 12 12 ILE C C 12 175.773 175.773 177.029 -1.256 18093 8671 1 13 . 1 1 12 12 ILE CA C 12 64.699 64.699 62.836 1.863 18093 8672 1 13 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.722 1.374 18093 8673 1 13 . 1 1 12 12 ILE H H 12 8.186 8.186 7.860 0.326 18093 8674 1 13 . 1 1 13 13 ASN N N 13 114.190 114.190 118.728 -4.538 18093 8675 1 13 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.504 -0.082 18093 8676 1 13 . 1 1 13 13 ASN C C 13 174.786 174.786 176.628 -1.842 18093 8677 1 13 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.379 0.176 18093 8678 1 13 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.924 0.434 18093 8679 1 13 . 1 1 13 13 ASN H H 13 7.601 7.601 7.321 0.280 18093 8680 1 13 . 1 1 14 14 LEU N N 14 115.031 115.031 118.929 -3.898 18093 8681 1 13 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.012 0.184 18093 8682 1 13 . 1 1 14 14 LEU C C 14 177.540 177.540 178.215 -0.675 18093 8683 1 13 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.188 0.219 18093 8684 1 13 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.304 -0.462 18093 8685 1 13 . 1 1 14 14 LEU H H 14 7.390 7.390 7.306 0.084 18093 8686 1 13 . 1 1 15 15 ILE N N 15 118.223 118.223 120.053 -1.830 18093 8687 1 13 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.719 -0.106 18093 8688 1 13 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.790 2.930 18093 8689 1 13 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.407 -0.795 18093 8690 1 13 . 1 1 15 15 ILE H H 15 8.123 8.123 7.396 0.727 18093 8691 1 13 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.294 -0.225 18093 8692 1 13 . 1 1 17 17 PRO C C 17 177.721 177.721 178.973 -1.252 18093 8693 1 13 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.424 1.337 18093 8694 1 13 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.721 0.021 18093 8695 1 13 . 1 1 18 18 CYS N N 18 113.538 113.538 116.118 -2.580 18093 8696 1 13 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.036 -0.028 18093 8697 1 13 . 1 1 18 18 CYS C C 18 177.683 177.683 176.281 1.402 18093 8698 1 13 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.272 1.228 18093 8699 1 13 . 1 1 18 18 CYS CB C 18 26.873 26.873 27.260 -0.387 18093 8700 1 13 . 1 1 18 18 CYS H H 18 7.410 7.410 7.396 0.014 18093 8701 1 13 . 1 1 19 19 LEU N N 19 122.545 122.545 118.032 4.513 18093 8702 1 13 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.154 -0.155 18093 8703 1 13 . 1 1 19 19 LEU C C 19 178.608 178.608 178.947 -0.339 18093 8704 1 13 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.097 1.324 18093 8705 1 13 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.555 0.289 18093 8706 1 13 . 1 1 19 19 LEU H H 19 8.635 8.635 7.370 1.265 18093 8707 1 13 . 1 1 20 20 LEU N N 20 119.404 119.404 121.119 -1.715 18093 8708 1 13 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.927 0.079 18093 8709 1 13 . 1 1 20 20 LEU C C 20 178.540 178.540 179.113 -0.573 18093 8710 1 13 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.408 0.391 18093 8711 1 13 . 1 1 20 20 LEU CB C 20 41.999 41.999 42.165 -0.166 18093 8712 1 13 . 1 1 20 20 LEU H H 20 8.392 8.392 7.500 0.892 18093 8713 1 13 . 1 1 21 21 ILE N N 21 117.335 117.335 113.723 3.612 18093 8714 1 13 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.828 -0.177 18093 8715 1 13 . 1 1 21 21 ILE C C 21 177.249 177.249 177.332 -0.083 18093 8716 1 13 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.545 0.716 18093 8717 1 13 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.229 0.731 18093 8718 1 13 . 1 1 21 21 ILE H H 21 8.403 8.403 8.367 0.036 18093 8719 1 13 . 1 1 22 22 SER N N 22 116.385 116.385 118.667 -2.282 18093 8720 1 13 . 1 1 22 22 SER HA H 22 4.056 4.056 4.192 -0.136 18093 8721 1 13 . 1 1 22 22 SER C C 22 176.813 176.813 176.455 0.358 18093 8722 1 13 . 1 1 22 22 SER CA C 22 63.866 63.866 62.158 1.708 18093 8723 1 13 . 1 1 22 22 SER CB C 22 62.898 62.898 63.059 -0.162 18093 8724 1 13 . 1 1 22 22 SER H H 22 8.271 8.271 7.539 0.732 18093 8725 1 13 . 1 1 23 23 CYS N N 23 119.001 119.001 119.595 -0.594 18093 8726 1 13 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.174 -0.184 18093 8727 1 13 . 1 1 23 23 CYS C C 23 177.594 177.594 176.187 1.407 18093 8728 1 13 . 1 1 23 23 CYS CA C 23 64.429 64.429 63.569 0.860 18093 8729 1 13 . 1 1 23 23 CYS CB C 23 26.940 26.940 26.910 0.030 18093 8730 1 13 . 1 1 23 23 CYS H H 23 8.161 8.161 8.759 -0.598 18093 8731 1 13 . 1 1 24 24 LEU N N 24 117.814 117.814 121.446 -3.632 18093 8732 1 13 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.897 0.080 18093 8733 1 13 . 1 1 24 24 LEU C C 24 177.944 177.944 178.797 -0.853 18093 8734 1 13 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.688 -0.401 18093 8735 1 13 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.277 0.626 18093 8736 1 13 . 1 1 24 24 LEU H H 24 8.106 8.106 7.648 0.458 18093 8737 1 13 . 1 1 25 25 THR N N 25 115.670 115.670 115.482 0.188 18093 8738 1 13 . 1 1 25 25 THR HA H 25 3.687 3.687 4.008 -0.321 18093 8739 1 13 . 1 1 25 25 THR C C 25 175.845 175.845 176.825 -0.980 18093 8740 1 13 . 1 1 25 25 THR CA C 25 68.306 68.306 67.258 1.048 18093 8741 1 13 . 1 1 25 25 THR H H 25 7.924 7.924 7.494 0.430 18093 8742 1 13 . 1 1 26 26 VAL N N 26 118.809 118.809 121.228 -2.419 18093 8743 1 13 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.488 0.027 18093 8744 1 13 . 1 1 26 26 VAL C C 26 177.530 177.530 177.608 -0.078 18093 8745 1 13 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.046 1.235 18093 8746 1 13 . 1 1 26 26 VAL CB C 26 31.724 31.724 30.855 0.869 18093 8747 1 13 . 1 1 26 26 VAL H H 26 7.764 7.764 7.343 0.421 18093 8748 1 13 . 1 1 27 27 LEU N N 27 117.958 117.958 121.049 -3.091 18093 8749 1 13 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.021 0.015 18093 8750 1 13 . 1 1 27 27 LEU C C 27 178.163 178.163 178.974 -0.811 18093 8751 1 13 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.324 0.185 18093 8752 1 13 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.822 1.097 18093 8753 1 13 . 1 1 27 27 LEU H H 27 7.912 7.912 8.156 -0.244 18093 8754 1 13 . 1 1 28 28 VAL N N 28 114.472 114.472 117.729 -3.257 18093 8755 1 13 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.697 -0.162 18093 8756 1 13 . 1 1 28 28 VAL C C 28 176.871 176.871 178.030 -1.159 18093 8757 1 13 . 1 1 28 28 VAL CA C 28 65.977 65.977 66.508 -0.531 18093 8758 1 13 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.508 0.426 18093 8759 1 13 . 1 1 28 28 VAL H H 28 7.892 7.892 7.581 0.311 18093 8760 1 13 . 1 1 29 29 PHE N N 29 115.206 115.206 115.939 -0.733 18093 8761 1 13 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.119 0.084 18093 8762 1 13 . 1 1 29 29 PHE C C 29 176.614 176.614 176.832 -0.218 18093 8763 1 13 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.995 -0.030 18093 8764 1 13 . 1 1 29 29 PHE CB C 29 39.752 39.752 38.739 1.013 18093 8765 1 13 . 1 1 29 29 PHE H H 29 7.748 7.748 7.866 -0.118 18093 8766 1 13 . 1 1 30 30 TYR N N 30 115.975 115.975 118.768 -2.793 18093 8767 1 13 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.454 -0.132 18093 8768 1 13 . 1 1 30 30 TYR C C 30 175.553 175.553 176.545 -0.992 18093 8769 1 13 . 1 1 30 30 TYR CA C 30 59.598 59.598 59.743 -0.145 18093 8770 1 13 . 1 1 30 30 TYR CB C 30 39.763 39.763 40.039 -0.276 18093 8771 1 13 . 1 1 30 30 TYR H H 30 7.985 7.985 7.694 0.291 18093 8772 1 13 . 1 1 31 31 LEU N N 31 120.780 120.780 120.509 0.271 18093 8773 1 13 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.716 -0.289 18093 8774 1 13 . 1 1 31 31 LEU CA C 31 54.665 54.665 51.173 3.492 18093 8775 1 13 . 1 1 31 31 LEU CB C 31 42.388 42.388 42.966 -0.578 18093 8776 1 13 . 1 1 31 31 LEU H H 31 7.643 7.643 7.899 -0.256 18093 8777 1 13 . 1 1 34 34 GLU C C 34 176.271 176.271 175.826 0.445 18093 8778 1 13 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.936 1.654 18093 8779 1 13 . 1 1 35 35 CYS N N 35 116.430 116.430 117.276 -0.846 18093 8780 1 13 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.513 -0.146 18093 8781 1 13 . 1 1 35 35 CYS C C 35 175.198 175.198 175.981 -0.783 18093 8782 1 13 . 1 1 35 35 CYS CA C 35 60.293 60.293 58.958 1.335 18093 8783 1 13 . 1 1 35 35 CYS CB C 35 28.130 28.130 28.894 -0.764 18093 8784 1 13 . 1 1 35 35 CYS H H 35 7.970 7.970 8.331 -0.361 18093 8785 1 13 . 1 1 36 36 GLY N N 36 108.315 108.315 108.265 0.050 18093 8786 1 13 . 1 1 36 36 GLY C C 36 174.610 174.610 174.751 -0.141 18093 8787 1 13 . 1 1 36 36 GLY CA C 36 46.004 46.004 45.093 0.912 18093 8788 1 13 . 1 1 36 36 GLY H H 36 8.120 8.120 8.050 0.070 18093 8789 1 13 . 1 1 37 37 GLU N N 37 121.347 121.347 120.637 0.710 18093 8790 1 13 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.038 0.009 18093 8791 1 13 . 1 1 37 37 GLU C C 37 177.338 177.338 178.158 -0.820 18093 8792 1 13 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.592 -1.085 18093 8793 1 13 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.542 0.028 18093 8794 1 13 . 1 1 37 37 GLU H H 37 8.423 8.423 8.518 -0.095 18093 8795 1 13 . 1 1 38 38 LYS N N 38 123.788 123.788 118.459 5.329 18093 8796 1 13 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.074 0.122 18093 8797 1 13 . 1 1 38 38 LYS C C 38 177.976 177.976 178.911 -0.935 18093 8798 1 13 . 1 1 38 38 LYS CA C 38 58.273 58.273 58.923 -0.650 18093 8799 1 13 . 1 1 38 38 LYS CB C 38 31.649 31.649 31.571 0.078 18093 8800 1 13 . 1 1 38 38 LYS H H 38 8.211 8.211 8.251 -0.040 18093 8801 1 13 . 1 1 39 39 ILE N N 39 115.675 115.675 119.302 -3.627 18093 8802 1 13 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.713 -0.105 18093 8803 1 13 . 1 1 39 39 ILE C C 39 177.204 177.204 178.012 -0.808 18093 8804 1 13 . 1 1 39 39 ILE CA C 39 65.501 65.501 65.479 0.022 18093 8805 1 13 . 1 1 39 39 ILE H H 39 7.933 7.933 8.005 -0.072 18093 8806 1 13 . 1 1 40 40 THR N N 40 117.411 117.411 115.832 1.579 18093 8807 1 13 . 1 1 40 40 THR HA H 40 3.844 3.844 3.968 -0.124 18093 8808 1 13 . 1 1 40 40 THR C C 40 175.983 175.983 176.625 -0.642 18093 8809 1 13 . 1 1 40 40 THR CA C 40 67.360 67.360 66.358 1.002 18093 8810 1 13 . 1 1 40 40 THR H H 40 8.362 8.362 7.640 0.722 18093 8811 1 13 . 1 1 41 41 LEU N N 41 123.059 123.059 122.623 0.436 18093 8812 1 13 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.097 -0.081 18093 8813 1 13 . 1 1 41 41 LEU C C 41 178.914 178.914 178.168 0.746 18093 8814 1 13 . 1 1 41 41 LEU CA C 41 58.366 58.366 57.921 0.445 18093 8815 1 13 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.735 0.315 18093 8816 1 13 . 1 1 41 41 LEU H H 41 8.282 8.282 7.885 0.397 18093 8817 1 13 . 1 1 42 42 CYS N N 42 118.762 118.762 118.264 0.498 18093 8818 1 13 . 1 1 42 42 CYS HA H 42 3.936 3.936 3.986 -0.050 18093 8819 1 13 . 1 1 42 42 CYS C C 42 176.607 176.607 176.742 -0.135 18093 8820 1 13 . 1 1 42 42 CYS CA C 42 64.317 64.317 64.155 0.162 18093 8821 1 13 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.318 -0.399 18093 8822 1 13 . 1 1 42 42 CYS H H 42 8.195 8.195 8.359 -0.164 18093 8823 1 13 . 1 1 43 43 ILE N N 43 117.589 117.589 119.952 -2.363 18093 8824 1 13 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.622 -0.015 18093 8825 1 13 . 1 1 43 43 ILE C C 43 177.323 177.323 178.055 -0.732 18093 8826 1 13 . 1 1 43 43 ILE CA C 43 65.249 65.249 65.353 -0.104 18093 8827 1 13 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.831 0.207 18093 8828 1 13 . 1 1 43 43 ILE H H 43 8.428 8.428 7.555 0.873 18093 8829 1 13 . 1 1 44 44 SER N N 44 115.950 115.950 116.768 -0.818 18093 8830 1 13 . 1 1 44 44 SER HA H 44 4.012 4.012 4.235 -0.223 18093 8831 1 13 . 1 1 44 44 SER C C 44 176.965 176.965 176.763 0.202 18093 8832 1 13 . 1 1 44 44 SER CA C 44 63.575 63.575 62.633 0.943 18093 8833 1 13 . 1 1 44 44 SER H H 44 7.984 7.984 7.506 0.478 18093 8834 1 13 . 1 1 45 45 VAL N N 45 123.544 123.544 120.871 2.673 18093 8835 1 13 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.829 -0.281 18093 8836 1 13 . 1 1 45 45 VAL C C 45 177.139 177.139 178.142 -1.003 18093 8837 1 13 . 1 1 45 45 VAL CA C 45 67.233 67.233 65.678 1.555 18093 8838 1 13 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.338 0.304 18093 8839 1 13 . 1 1 45 45 VAL H H 45 8.280 8.280 8.593 -0.313 18093 8840 1 13 . 1 1 46 46 LEU N N 46 119.883 119.883 121.100 -1.217 18093 8841 1 13 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.183 -0.240 18093 8842 1 13 . 1 1 46 46 LEU C C 46 180.125 180.125 178.205 1.920 18093 8843 1 13 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.835 0.765 18093 8844 1 13 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.891 0.121 18093 8845 1 13 . 1 1 46 46 LEU H H 46 8.117 8.117 7.725 0.392 18093 8846 1 13 . 1 1 47 47 LEU N N 47 120.193 120.193 120.617 -0.424 18093 8847 1 13 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.825 0.179 18093 8848 1 13 . 1 1 47 47 LEU C C 47 178.370 178.370 178.920 -0.550 18093 8849 1 13 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.895 -0.469 18093 8850 1 13 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.695 0.360 18093 8851 1 13 . 1 1 47 47 LEU H H 47 8.933 8.933 7.919 1.014 18093 8852 1 13 . 1 1 48 48 SER N N 48 115.861 115.861 114.662 1.199 18093 8853 1 13 . 1 1 48 48 SER HA H 48 4.013 4.013 4.188 -0.175 18093 8854 1 13 . 1 1 48 48 SER C C 48 175.642 175.642 177.075 -1.433 18093 8855 1 13 . 1 1 48 48 SER CA C 48 63.571 63.571 62.428 1.143 18093 8856 1 13 . 1 1 48 48 SER CB C 48 62.879 62.879 63.081 -0.202 18093 8857 1 13 . 1 1 48 48 SER H H 48 7.996 7.996 7.634 0.362 18093 8858 1 13 . 1 1 49 49 LEU N N 49 120.673 120.673 122.554 -1.881 18093 8859 1 13 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.194 -0.159 18093 8860 1 13 . 1 1 49 49 LEU C C 49 178.229 178.229 179.038 -0.809 18093 8861 1 13 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.140 0.143 18093 8862 1 13 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.126 -0.180 18093 8863 1 13 . 1 1 49 49 LEU H H 49 8.352 8.352 7.551 0.801 18093 8864 1 13 . 1 1 50 50 THR N N 50 115.582 115.582 114.944 0.638 18093 8865 1 13 . 1 1 50 50 THR HA H 50 3.672 3.672 4.083 -0.411 18093 8866 1 13 . 1 1 50 50 THR C C 50 175.877 175.877 176.874 -0.997 18093 8867 1 13 . 1 1 50 50 THR CA C 50 68.628 68.628 66.681 1.947 18093 8868 1 13 . 1 1 50 50 THR H H 50 7.937 7.937 8.356 -0.419 18093 8869 1 13 . 1 1 51 51 VAL N N 51 119.774 119.774 122.260 -2.486 18093 8870 1 13 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.768 -0.270 18093 8871 1 13 . 1 1 51 51 VAL C C 51 177.162 177.162 177.365 -0.203 18093 8872 1 13 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.588 0.997 18093 8873 1 13 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.957 -0.436 18093 8874 1 13 . 1 1 51 51 VAL H H 51 8.115 8.115 8.030 0.085 18093 8875 1 13 . 1 1 52 52 PHE N N 52 118.808 118.808 120.439 -1.631 18093 8876 1 13 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.311 -0.189 18093 8877 1 13 . 1 1 52 52 PHE C C 52 176.697 176.697 176.479 0.218 18093 8878 1 13 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.175 1.596 18093 8879 1 13 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.277 -0.015 18093 8880 1 13 . 1 1 52 52 PHE H H 52 8.256 8.256 8.345 -0.089 18093 8881 1 13 . 1 1 53 53 LEU N N 53 117.267 117.267 121.409 -4.142 18093 8882 1 13 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.568 0.325 18093 8883 1 13 . 1 1 53 53 LEU C C 53 179.319 179.319 177.861 1.458 18093 8884 1 13 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.837 0.148 18093 8885 1 13 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.333 0.494 18093 8886 1 13 . 1 1 53 53 LEU H H 53 8.443 8.443 7.810 0.633 18093 8887 1 13 . 1 1 54 54 LEU N N 54 119.762 119.762 118.913 0.849 18093 8888 1 13 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.944 0.110 18093 8889 1 13 . 1 1 54 54 LEU C C 54 178.827 178.827 178.968 -0.141 18093 8890 1 13 . 1 1 54 54 LEU CA C 54 58.105 58.105 58.084 0.021 18093 8891 1 13 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.827 0.120 18093 8892 1 13 . 1 1 54 54 LEU H H 54 8.205 8.205 7.348 0.857 18093 8893 1 13 . 1 1 55 55 LEU N N 55 118.585 118.585 117.913 0.672 18093 8894 1 13 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.896 0.181 18093 8895 1 13 . 1 1 55 55 LEU C C 55 178.909 178.909 178.675 0.234 18093 8896 1 13 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.587 0.521 18093 8897 1 13 . 1 1 55 55 LEU CB C 55 41.979 41.979 41.842 0.137 18093 8898 1 13 . 1 1 55 55 LEU H H 55 8.179 8.179 7.427 0.752 18093 8899 1 13 . 1 1 56 56 ILE N N 56 116.079 116.079 116.344 -0.265 18093 8900 1 13 . 1 1 56 56 ILE HA H 56 3.729 3.729 3.914 -0.185 18093 8901 1 13 . 1 1 56 56 ILE C C 56 176.988 176.988 177.750 -0.762 18093 8902 1 13 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.377 0.880 18093 8903 1 13 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.741 0.676 18093 8904 1 13 . 1 1 56 56 ILE H H 56 8.040 8.040 7.403 0.637 18093 8905 1 13 . 1 1 57 57 THR N N 57 110.105 110.105 110.382 -0.277 18093 8906 1 13 . 1 1 57 57 THR HA H 57 4.015 4.015 4.152 -0.137 18093 8907 1 13 . 1 1 57 57 THR C C 57 175.435 175.435 176.035 -0.600 18093 8908 1 13 . 1 1 57 57 THR CA C 57 65.067 65.067 64.790 0.277 18093 8909 1 13 . 1 1 57 57 THR CB C 57 69.179 69.179 68.921 0.258 18093 8910 1 13 . 1 1 57 57 THR H H 57 7.655 7.655 7.762 -0.107 18093 8911 1 13 . 1 1 58 58 GLU N N 58 117.313 117.313 120.999 -3.686 18093 8912 1 13 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.336 -0.003 18093 8913 1 13 . 1 1 58 58 GLU C C 58 176.940 176.940 178.086 -1.146 18093 8914 1 13 . 1 1 58 58 GLU CA C 58 57.068 57.068 57.701 -0.633 18093 8915 1 13 . 1 1 58 58 GLU CB C 58 29.396 29.396 29.666 -0.271 18093 8916 1 13 . 1 1 58 58 GLU H H 58 7.521 7.521 7.885 -0.364 18093 8917 1 13 . 1 1 59 59 ILE N N 59 114.870 114.870 114.383 0.487 18093 8918 1 13 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.091 -0.002 18093 8919 1 13 . 1 1 59 59 ILE C C 59 175.456 175.456 176.487 -1.031 18093 8920 1 13 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.252 0.182 18093 8921 1 13 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.737 -0.080 18093 8922 1 13 . 1 1 59 59 ILE H H 59 7.579 7.579 7.321 0.258 18093 8923 1 13 . 1 1 60 60 ILE N N 60 119.354 119.354 118.479 0.875 18093 8924 1 13 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.824 0.480 18093 8925 1 13 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.510 -1.893 18093 8926 1 13 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.654 2.208 18093 8927 1 13 . 1 1 60 60 ILE H H 60 7.629 7.629 7.577 0.052 18093 8928 1 13 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.347 0.053 18093 8929 1 13 . 1 1 61 61 PRO C C 61 177.144 177.144 176.782 0.362 18093 8930 1 13 . 1 1 61 61 PRO CA C 61 63.808 63.808 64.258 -0.451 18093 8931 1 13 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.484 -0.602 18093 8932 1 13 . 1 1 62 62 SER N N 62 114.474 114.474 110.708 3.766 18093 8933 1 13 . 1 1 62 62 SER HA H 62 4.434 4.434 4.377 0.057 18093 8934 1 13 . 1 1 62 62 SER C C 62 175.161 175.161 173.508 1.653 18093 8935 1 13 . 1 1 62 62 SER CA C 62 59.047 59.047 58.999 0.048 18093 8936 1 13 . 1 1 62 62 SER CB C 62 63.704 63.704 63.288 0.416 18093 8937 1 13 . 1 1 62 62 SER H H 62 8.186 8.186 8.040 0.146 18093 8938 1 13 . 1 1 63 63 THR N N 63 113.573 113.573 114.847 -1.274 18093 8939 1 13 . 1 1 63 63 THR HA H 63 4.319 4.319 3.986 0.333 18093 8940 1 13 . 1 1 63 63 THR C C 63 174.834 174.834 173.932 0.902 18093 8941 1 13 . 1 1 63 63 THR CA C 63 62.377 62.377 63.473 -1.096 18093 8942 1 13 . 1 1 63 63 THR CB C 63 69.422 69.422 67.753 1.669 18093 8943 1 13 . 1 1 63 63 THR H H 63 7.963 7.963 8.399 -0.436 18093 8944 1 13 . 1 1 64 64 SER N N 64 116.598 116.598 114.862 1.736 18093 8945 1 13 . 1 1 64 64 SER HA H 64 4.428 4.428 4.654 -0.226 18093 8946 1 13 . 1 1 64 64 SER C C 64 174.618 174.618 174.189 0.429 18093 8947 1 13 . 1 1 64 64 SER CA C 64 59.045 59.045 56.830 2.215 18093 8948 1 13 . 1 1 64 64 SER CB C 64 63.700 63.700 65.102 -1.402 18093 8949 1 13 . 1 1 64 64 SER H H 64 8.052 8.052 8.103 -0.051 18093 8950 1 13 . 1 1 65 65 SER N N 65 116.673 116.673 115.310 1.363 18093 8951 1 13 . 1 1 65 65 SER HA H 65 4.432 4.432 4.496 -0.064 18093 8952 1 13 . 1 1 65 65 SER C C 65 174.335 174.335 175.697 -1.362 18093 8953 1 13 . 1 1 65 65 SER CA C 65 58.927 58.927 58.840 0.087 18093 8954 1 13 . 1 1 65 65 SER CB C 65 63.621 63.621 63.786 -0.165 18093 8955 1 13 . 1 1 65 65 SER H H 65 8.114 8.114 8.342 -0.228 18093 8956 1 13 . 1 1 66 66 VAL N N 66 119.054 119.054 116.353 2.701 18093 8957 1 13 . 1 1 66 66 VAL HA H 66 4.170 4.170 3.926 0.244 18093 8958 1 13 . 1 1 66 66 VAL C C 66 175.278 175.278 175.859 -0.581 18093 8959 1 13 . 1 1 66 66 VAL CA C 66 62.062 62.062 62.687 -0.625 18093 8960 1 13 . 1 1 66 66 VAL CB C 66 32.629 32.629 31.753 0.876 18093 8961 1 13 . 1 1 66 66 VAL H H 66 7.740 7.740 7.649 0.091 18093 8962 1 13 . 1 1 67 67 SER N N 67 118.882 118.882 118.316 0.566 18093 8963 1 13 . 1 1 67 67 SER HA H 67 4.704 4.704 4.765 -0.061 18093 8964 1 13 . 1 1 67 67 SER CA C 67 56.715 56.715 55.939 0.776 18093 8965 1 13 . 1 1 67 67 SER CB C 67 63.624 63.624 64.861 -1.237 18093 8966 1 13 . 1 1 67 67 SER H H 67 8.060 8.060 7.740 0.320 18093 8967 1 13 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.480 -0.080 18093 8968 1 13 . 1 1 68 68 PRO C C 68 176.925 176.925 175.757 1.168 18093 8969 1 13 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.973 0.775 18093 8970 1 13 . 1 1 68 68 PRO CB C 68 32.005 32.005 31.578 0.428 18093 8971 1 13 . 1 1 69 69 SER N N 69 114.930 114.930 118.746 -3.816 18093 8972 1 13 . 1 1 69 69 SER HA H 69 4.422 4.422 4.665 -0.243 18093 8973 1 13 . 1 1 69 69 SER C C 69 175.617 175.617 175.298 0.319 18093 8974 1 13 . 1 1 69 69 SER CA C 69 58.697 58.697 56.696 2.001 18093 8975 1 13 . 1 1 69 69 SER CB C 69 63.804 63.804 66.346 -2.542 18093 8976 1 13 . 1 1 69 69 SER H H 69 8.205 8.205 8.049 0.156 18093 8977 1 13 . 1 1 70 70 ILE N N 70 120.840 120.840 125.973 -5.133 18093 8978 1 13 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.146 -0.154 18093 8979 1 13 . 1 1 70 70 ILE C C 70 177.524 177.524 176.876 0.648 18093 8980 1 13 . 1 1 70 70 ILE CA C 70 64.335 64.335 61.508 2.827 18093 8981 1 13 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.046 -0.586 18093 8982 1 13 . 1 1 70 70 ILE H H 70 8.283 8.283 8.924 -0.641 18093 8983 1 13 . 1 1 71 71 GLY N N 71 107.823 107.823 107.802 0.021 18093 8984 1 13 . 1 1 71 71 GLY C C 71 175.296 175.296 175.939 -0.643 18093 8985 1 13 . 1 1 71 71 GLY CA C 71 47.455 47.455 46.980 0.475 18093 8986 1 13 . 1 1 71 71 GLY H H 71 8.557 8.557 8.645 -0.088 18093 8987 1 13 . 1 1 72 72 GLU N N 72 120.835 120.835 120.381 0.454 18093 8988 1 13 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.198 -0.351 18093 8989 1 13 . 1 1 72 72 GLU C C 72 178.198 178.198 178.076 0.122 18093 8990 1 13 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.128 1.989 18093 8991 1 13 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.797 -0.404 18093 8992 1 13 . 1 1 72 72 GLU H H 72 7.922 7.922 7.725 0.197 18093 8993 1 13 . 1 1 73 73 TYR N N 73 117.375 117.375 122.488 -5.113 18093 8994 1 13 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.295 -0.133 18093 8995 1 13 . 1 1 73 73 TYR C C 73 179.912 179.912 177.175 2.737 18093 8996 1 13 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.470 0.685 18093 8997 1 13 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.743 0.023 18093 8998 1 13 . 1 1 73 73 TYR H H 73 8.062 8.062 7.889 0.173 18093 8999 1 13 . 1 1 74 74 LEU N N 74 121.493 121.493 118.783 2.710 18093 9000 1 13 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.779 0.270 18093 9001 1 13 . 1 1 74 74 LEU C C 74 178.063 178.063 178.796 -0.733 18093 9002 1 13 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.653 0.842 18093 9003 1 13 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.732 0.115 18093 9004 1 13 . 1 1 74 74 LEU H H 74 8.552 8.552 8.854 -0.302 18093 9005 1 13 . 1 1 75 75 LEU N N 75 120.375 120.375 120.046 0.329 18093 9006 1 13 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.075 -0.035 18093 9007 1 13 . 1 1 75 75 LEU C C 75 178.515 178.515 178.627 -0.112 18093 9008 1 13 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.237 0.401 18093 9009 1 13 . 1 1 75 75 LEU CB C 75 42.039 42.039 41.722 0.317 18093 9010 1 13 . 1 1 75 75 LEU H H 75 8.276 8.276 7.445 0.831 18093 9011 1 13 . 1 1 76 76 PHE N N 76 116.626 116.626 118.946 -2.320 18093 9012 1 13 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.123 -0.044 18093 9013 1 13 . 1 1 76 76 PHE C C 76 177.399 177.399 178.185 -0.786 18093 9014 1 13 . 1 1 76 76 PHE CA C 76 61.734 61.734 61.633 0.101 18093 9015 1 13 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.500 0.241 18093 9016 1 13 . 1 1 76 76 PHE H H 76 8.454 8.454 8.120 0.334 18093 9017 1 13 . 1 1 77 77 THR N N 77 116.080 116.080 115.733 0.347 18093 9018 1 13 . 1 1 77 77 THR HA H 77 3.687 3.687 3.839 -0.152 18093 9019 1 13 . 1 1 77 77 THR C C 77 176.018 176.018 176.639 -0.621 18093 9020 1 13 . 1 1 77 77 THR CA C 77 68.640 68.640 67.126 1.514 18093 9021 1 13 . 1 1 77 77 THR H H 77 8.224 8.224 8.589 -0.365 18093 9022 1 13 . 1 1 78 78 MET N N 78 119.394 119.394 120.464 -1.070 18093 9023 1 13 . 1 1 78 78 MET HA H 78 4.129 4.129 4.160 -0.031 18093 9024 1 13 . 1 1 78 78 MET C C 78 179.608 179.608 178.784 0.824 18093 9025 1 13 . 1 1 78 78 MET CA C 78 58.831 58.831 59.395 -0.564 18093 9026 1 13 . 1 1 78 78 MET CB C 78 31.590 31.590 32.568 -0.978 18093 9027 1 13 . 1 1 78 78 MET H H 78 8.372 8.372 7.483 0.889 18093 9028 1 13 . 1 1 79 79 ILE N N 79 121.819 121.819 119.642 2.177 18093 9029 1 13 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.713 -0.163 18093 9030 1 13 . 1 1 79 79 ILE C C 79 176.426 176.426 177.977 -1.551 18093 9031 1 13 . 1 1 79 79 ILE CA C 79 65.876 65.876 64.458 1.418 18093 9032 1 13 . 1 1 79 79 ILE CB C 79 37.673 37.673 36.690 0.983 18093 9033 1 13 . 1 1 79 79 ILE H H 79 8.391 8.391 8.563 -0.172 18093 9034 1 13 . 1 1 80 80 PHE N N 80 119.916 119.916 121.054 -1.138 18093 9035 1 13 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.040 0.013 18093 9036 1 13 . 1 1 80 80 PHE C C 80 178.568 178.568 177.476 1.092 18093 9037 1 13 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.537 -0.230 18093 9038 1 13 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.375 -0.601 18093 9039 1 13 . 1 1 80 80 PHE H H 80 8.479 8.479 7.980 0.499 18093 9040 1 13 . 1 1 81 81 VAL N N 81 120.191 120.191 115.618 4.573 18093 9041 1 13 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.569 -0.116 18093 9042 1 13 . 1 1 81 81 VAL C C 81 178.225 178.225 177.585 0.640 18093 9043 1 13 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.510 0.898 18093 9044 1 13 . 1 1 81 81 VAL CB C 81 31.556 31.556 31.288 0.268 18093 9045 1 13 . 1 1 81 81 VAL H H 81 8.928 8.928 8.222 0.706 18093 9046 1 13 . 1 1 82 82 THR N N 82 115.930 115.930 117.118 -1.188 18093 9047 1 13 . 1 1 82 82 THR HA H 82 3.636 3.636 3.937 -0.301 18093 9048 1 13 . 1 1 82 82 THR C C 82 176.420 176.420 176.624 -0.204 18093 9049 1 13 . 1 1 82 82 THR CA C 82 68.570 68.570 67.623 0.947 18093 9050 1 13 . 1 1 82 82 THR CB C 82 68.202 68.202 68.661 -0.459 18093 9051 1 13 . 1 1 82 82 THR H H 82 7.969 7.969 7.651 0.318 18093 9052 1 13 . 1 1 83 83 LEU N N 83 119.780 119.780 120.702 -0.922 18093 9053 1 13 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.873 -0.026 18093 9054 1 13 . 1 1 83 83 LEU C C 83 178.214 178.214 178.507 -0.293 18093 9055 1 13 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.698 0.539 18093 9056 1 13 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.292 0.499 18093 9057 1 13 . 1 1 83 83 LEU H H 83 8.483 8.483 7.411 1.072 18093 9058 1 13 . 1 1 84 84 SER N N 84 114.559 114.559 115.891 -1.332 18093 9059 1 13 . 1 1 84 84 SER HA H 84 4.099 4.099 4.029 0.070 18093 9060 1 13 . 1 1 84 84 SER C C 84 176.799 176.799 176.625 0.174 18093 9061 1 13 . 1 1 84 84 SER CA C 84 63.609 63.609 62.908 0.701 18093 9062 1 13 . 1 1 84 84 SER CB C 84 63.110 63.110 63.110 -0.000 18093 9063 1 13 . 1 1 84 84 SER H H 84 8.023 8.023 7.822 0.201 18093 9064 1 13 . 1 1 85 85 ILE N N 85 123.962 123.962 121.253 2.709 18093 9065 1 13 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.900 -0.296 18093 9066 1 13 . 1 1 85 85 ILE C C 85 177.487 177.487 177.983 -0.496 18093 9067 1 13 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.183 0.576 18093 9068 1 13 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.925 -0.038 18093 9069 1 13 . 1 1 85 85 ILE H H 85 8.054 8.054 8.162 -0.108 18093 9070 1 13 . 1 1 86 86 VAL N N 86 118.744 118.744 120.465 -1.721 18093 9071 1 13 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.574 -0.055 18093 9072 1 13 . 1 1 86 86 VAL C C 86 177.557 177.557 177.731 -0.174 18093 9073 1 13 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.655 0.880 18093 9074 1 13 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.755 -0.289 18093 9075 1 13 . 1 1 86 86 VAL H H 86 8.158 8.158 7.345 0.813 18093 9076 1 13 . 1 1 87 87 ILE N N 87 117.206 117.206 120.082 -2.876 18093 9077 1 13 . 1 1 87 87 ILE HA H 87 3.604 3.604 4.010 -0.406 18093 9078 1 13 . 1 1 87 87 ILE C C 87 177.283 177.283 178.350 -1.067 18093 9079 1 13 . 1 1 87 87 ILE CA C 87 65.676 65.676 64.457 1.219 18093 9080 1 13 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.645 0.944 18093 9081 1 13 . 1 1 87 87 ILE H H 87 8.459 8.459 8.674 -0.215 18093 9082 1 13 . 1 1 88 88 THR N N 88 116.158 116.158 116.803 -0.645 18093 9083 1 13 . 1 1 88 88 THR HA H 88 3.672 3.672 4.082 -0.410 18093 9084 1 13 . 1 1 88 88 THR C C 88 175.485 175.485 177.163 -1.678 18093 9085 1 13 . 1 1 88 88 THR CA C 88 68.549 68.549 67.369 1.180 18093 9086 1 13 . 1 1 88 88 THR CB C 88 68.127 68.127 68.733 -0.606 18093 9087 1 13 . 1 1 88 88 THR H H 88 7.776 7.776 8.654 -0.878 18093 9088 1 13 . 1 1 89 89 VAL N N 89 117.985 117.985 120.507 -2.522 18093 9089 1 13 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.742 -0.199 18093 9090 1 13 . 1 1 89 89 VAL C C 89 177.393 177.393 177.700 -0.307 18093 9091 1 13 . 1 1 89 89 VAL CA C 89 66.590 66.590 66.162 0.428 18093 9092 1 13 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.393 0.385 18093 9093 1 13 . 1 1 89 89 VAL H H 89 8.206 8.206 7.543 0.663 18093 9094 1 13 . 1 1 90 90 PHE N N 90 116.709 116.709 119.177 -2.468 18093 9095 1 13 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.264 0.114 18093 9096 1 13 . 1 1 90 90 PHE C C 90 177.305 177.305 177.919 -0.614 18093 9097 1 13 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.041 0.078 18093 9098 1 13 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.076 1.309 18093 9099 1 13 . 1 1 90 90 PHE H H 90 7.956 7.956 7.165 0.791 18093 9100 1 13 . 1 1 91 91 VAL N N 91 116.565 116.565 119.671 -3.106 18093 9101 1 13 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.769 0.066 18093 9102 1 13 . 1 1 91 91 VAL C C 91 176.927 176.927 177.320 -0.393 18093 9103 1 13 . 1 1 91 91 VAL CA C 91 65.347 65.347 66.007 -0.660 18093 9104 1 13 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.654 0.213 18093 9105 1 13 . 1 1 91 91 VAL H H 91 8.239 8.239 8.619 -0.380 18093 9106 1 13 . 1 1 92 92 LEU N N 92 117.443 117.443 118.509 -1.066 18093 9107 1 13 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.193 0.001 18093 9108 1 13 . 1 1 92 92 LEU C C 92 177.180 177.180 177.877 -0.697 18093 9109 1 13 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.516 -0.332 18093 9110 1 13 . 1 1 92 92 LEU CB C 92 41.944 41.944 41.450 0.494 18093 9111 1 13 . 1 1 92 92 LEU H H 92 7.967 7.967 7.587 0.380 18093 9112 1 13 . 1 1 93 93 ASN N N 93 116.705 116.705 117.135 -0.430 18093 9113 1 13 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.459 0.188 18093 9114 1 13 . 1 1 93 93 ASN C C 93 175.129 175.129 176.533 -1.404 18093 9115 1 13 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.462 -1.608 18093 9116 1 13 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.348 0.047 18093 9117 1 13 . 1 1 93 93 ASN H H 93 7.683 7.683 7.899 -0.216 18093 9118 1 13 . 1 1 94 94 VAL N N 94 118.224 118.224 120.826 -2.602 18093 9119 1 13 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.781 0.180 18093 9120 1 13 . 1 1 94 94 VAL C C 94 175.600 175.600 175.201 0.399 18093 9121 1 13 . 1 1 94 94 VAL CA C 94 62.825 62.825 63.205 -0.380 18093 9122 1 13 . 1 1 94 94 VAL CB C 94 32.214 32.214 32.786 -0.572 18093 9123 1 13 . 1 1 94 94 VAL H H 94 7.627 7.627 7.975 -0.348 18093 9124 1 13 . 1 1 95 95 HIS N N 95 120.999 120.999 123.586 -2.587 18093 9125 1 13 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.677 -0.084 18093 9126 1 13 . 1 1 95 95 HIS C C 95 174.146 174.146 174.486 -0.340 18093 9127 1 13 . 1 1 95 95 HIS CA C 95 55.666 55.666 56.643 -0.977 18093 9128 1 13 . 1 1 95 95 HIS CB C 95 29.736 29.736 30.983 -1.247 18093 9129 1 13 . 1 1 95 95 HIS H H 95 8.263 8.263 8.172 0.091 18093 9130 1 13 . 1 1 96 96 HIS N N 96 122.740 122.740 116.549 6.191 18093 9131 1 13 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.752 -0.119 18093 9132 1 13 . 1 1 96 96 HIS CA C 96 55.895 55.895 55.818 0.077 18093 9133 1 13 . 1 1 96 96 HIS CB C 96 29.750 29.750 30.683 -0.933 18093 9134 1 13 . 1 1 96 96 HIS H H 96 8.298 8.298 8.268 0.030 18093 9135 1 13 . 1 1 97 97 ARG N N 97 118.503 118.503 120.588 -2.085 18093 9136 1 13 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.737 -0.425 18093 9137 1 13 . 1 1 97 97 ARG C C 97 175.776 175.776 175.933 -0.157 18093 9138 1 13 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.733 0.492 18093 9139 1 13 . 1 1 97 97 ARG CB C 97 30.912 30.912 31.557 -0.645 18093 9140 1 13 . 1 1 97 97 ARG H H 97 8.250 8.250 8.514 -0.264 18093 9141 1 13 . 1 1 98 98 SER N N 98 118.482 118.482 118.782 -0.300 18093 9142 1 13 . 1 1 98 98 SER HA H 98 4.722 4.722 4.830 -0.108 18093 9143 1 13 . 1 1 98 98 SER CA C 98 56.547 56.547 56.333 0.214 18093 9144 1 13 . 1 1 98 98 SER CB C 98 63.624 63.624 65.025 -1.401 18093 9145 1 13 . 1 1 98 98 SER H H 98 8.254 8.254 8.452 -0.198 18093 9146 1 13 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.520 -0.117 18093 9147 1 13 . 1 1 99 99 PRO C C 99 176.899 176.899 176.870 0.029 18093 9148 1 13 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.519 -0.818 18093 9149 1 13 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.466 -0.517 18093 9150 1 13 . 1 1 100 100 GLU N N 100 120.187 120.187 113.797 6.390 18093 9151 1 13 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.424 -0.136 18093 9152 1 13 . 1 1 100 100 GLU C C 100 176.593 176.593 175.531 1.062 18093 9153 1 13 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.760 -0.038 18093 9154 1 13 . 1 1 100 100 GLU CB C 100 29.999 29.999 30.051 -0.052 18093 9155 1 13 . 1 1 100 100 GLU H H 100 8.401 8.401 8.116 0.285 18093 9156 1 13 . 1 1 101 101 THR N N 101 113.968 113.968 115.070 -1.102 18093 9157 1 13 . 1 1 101 101 THR HA H 101 4.286 4.286 4.300 -0.014 18093 9158 1 13 . 1 1 101 101 THR C C 101 174.525 174.525 174.819 -0.294 18093 9159 1 13 . 1 1 101 101 THR CA C 101 61.956 61.956 63.648 -1.692 18093 9160 1 13 . 1 1 101 101 THR CB C 101 69.697 69.697 69.365 0.332 18093 9161 1 13 . 1 1 101 101 THR H H 101 7.945 7.945 8.020 -0.075 18093 9162 1 13 . 1 1 102 102 HIS N N 102 120.322 120.322 122.168 -1.846 18093 9163 1 13 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.645 0.096 18093 9164 1 13 . 1 1 102 102 HIS C C 102 174.783 174.783 175.113 -0.330 18093 9165 1 13 . 1 1 102 102 HIS CA C 102 55.701 55.701 56.404 -0.703 18093 9166 1 13 . 1 1 102 102 HIS CB C 102 29.093 29.093 31.726 -2.633 18093 9167 1 13 . 1 1 102 102 HIS H H 102 8.455 8.455 8.345 0.110 18093 9168 1 13 . 1 1 103 103 THR N N 103 114.282 114.282 114.122 0.160 18093 9169 1 13 . 1 1 103 103 THR HA H 103 4.352 4.352 4.035 0.317 18093 9170 1 13 . 1 1 103 103 THR C C 103 175.104 175.104 174.006 1.098 18093 9171 1 13 . 1 1 103 103 THR CA C 103 62.057 62.057 62.818 -0.761 18093 9172 1 13 . 1 1 103 103 THR CB C 103 69.966 69.966 68.027 1.939 18093 9173 1 13 . 1 1 103 103 THR H H 103 8.069 8.069 8.445 -0.376 18093 9174 1 13 . 1 1 104 104 GLY N N 104 111.159 111.159 106.252 4.907 18093 9175 1 13 . 1 1 104 104 GLY C C 104 174.776 174.776 173.939 0.837 18093 9176 1 13 . 1 1 104 104 GLY CA C 104 45.588 45.588 44.548 1.040 18093 9177 1 13 . 1 1 104 104 GLY H H 104 8.393 8.393 7.596 0.797 18093 9178 1 13 . 1 1 105 105 GLY N N 105 108.657 108.657 108.324 0.333 18093 9179 1 13 . 1 1 105 105 GLY C C 105 174.957 174.957 174.834 0.123 18093 9180 1 13 . 1 1 105 105 GLY CA C 105 45.612 45.612 45.542 0.070 18093 9181 1 13 . 1 1 105 105 GLY H H 105 8.275 8.275 8.205 0.070 18093 9182 1 13 . 1 1 106 106 GLY N N 106 108.870 108.870 107.528 1.342 18093 9183 1 13 . 1 1 106 106 GLY C C 106 174.877 174.877 173.476 1.401 18093 9184 1 13 . 1 1 106 106 GLY CA C 106 45.665 45.665 45.158 0.507 18093 9185 1 13 . 1 1 106 106 GLY H H 106 8.357 8.357 8.579 -0.222 18093 9186 1 13 . 1 1 107 107 GLY N N 107 108.476 108.476 109.903 -1.427 18093 9187 1 13 . 1 1 107 107 GLY C C 107 174.877 174.877 174.625 0.252 18093 9188 1 13 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.257 0.439 18093 9189 1 13 . 1 1 107 107 GLY H H 107 8.330 8.330 8.188 0.142 18093 9190 1 13 . 1 1 108 108 GLY N N 108 108.486 108.486 109.050 -0.564 18093 9191 1 13 . 1 1 108 108 GLY C C 108 175.345 175.345 175.359 -0.014 18093 9192 1 13 . 1 1 108 108 GLY CA C 108 45.763 45.763 45.575 0.188 18093 9193 1 13 . 1 1 108 108 GLY H H 108 8.328 8.328 8.283 0.045 18093 9194 1 13 . 1 1 109 109 ILE N N 109 120.433 120.433 118.907 1.526 18093 9195 1 13 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.900 0.068 18093 9196 1 13 . 1 1 109 109 ILE C C 109 176.127 176.127 177.109 -0.982 18093 9197 1 13 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.029 -0.293 18093 9198 1 13 . 1 1 109 109 ILE CB C 109 38.125 38.125 38.072 0.053 18093 9199 1 13 . 1 1 109 109 ILE H H 109 8.192 8.192 8.097 0.095 18093 9200 1 13 . 1 1 110 110 ASP N N 110 121.148 121.148 120.822 0.326 18093 9201 1 13 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.677 -0.371 18093 9202 1 13 . 1 1 110 110 ASP C C 110 177.651 177.651 178.322 -0.671 18093 9203 1 13 . 1 1 110 110 ASP CA C 110 56.776 56.776 58.043 -1.267 18093 9204 1 13 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.416 0.681 18093 9205 1 13 . 1 1 110 110 ASP H H 110 8.427 8.427 8.587 -0.160 18093 9206 1 13 . 1 1 111 111 ARG N N 111 119.228 119.228 119.778 -0.550 18093 9207 1 13 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.243 -0.247 18093 9208 1 13 . 1 1 111 111 ARG C C 111 177.786 177.786 179.001 -1.215 18093 9209 1 13 . 1 1 111 111 ARG CA C 111 58.942 58.942 58.946 -0.004 18093 9210 1 13 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.891 0.305 18093 9211 1 13 . 1 1 111 111 ARG H H 111 7.850 7.850 8.551 -0.701 18093 9212 1 13 . 1 1 112 112 ILE N N 112 118.000 118.000 119.475 -1.475 18093 9213 1 13 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.109 -0.296 18093 9214 1 13 . 1 1 112 112 ILE C C 112 177.496 177.496 177.885 -0.389 18093 9215 1 13 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.187 2.625 18093 9216 1 13 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.928 0.799 18093 9217 1 13 . 1 1 112 112 ILE H H 112 7.764 7.764 7.751 0.013 18093 9218 1 13 . 1 1 113 113 PHE N N 113 118.367 118.367 122.049 -3.682 18093 9219 1 13 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.270 -0.015 18093 9220 1 13 . 1 1 113 113 PHE C C 113 177.218 177.218 177.391 -0.173 18093 9221 1 13 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.299 -0.866 18093 9222 1 13 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.175 -0.368 18093 9223 1 13 . 1 1 113 113 PHE H H 113 7.963 7.963 7.869 0.094 18093 9224 1 13 . 1 1 114 114 LEU N N 114 118.921 118.921 117.218 1.703 18093 9225 1 13 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.916 0.081 18093 9226 1 13 . 1 1 114 114 LEU C C 114 178.297 178.297 178.429 -0.132 18093 9227 1 13 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.165 0.446 18093 9228 1 13 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.281 0.671 18093 9229 1 13 . 1 1 114 114 LEU H H 114 7.939 7.939 8.089 -0.150 18093 9230 1 13 . 1 1 115 115 TRP N N 115 117.464 117.464 119.448 -1.984 18093 9231 1 13 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.364 0.010 18093 9232 1 13 . 1 1 115 115 TRP C C 115 178.572 178.572 178.239 0.333 18093 9233 1 13 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.769 1.153 18093 9234 1 13 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.759 -1.252 18093 9235 1 13 . 1 1 115 115 TRP H H 115 7.969 7.969 7.605 0.364 18093 9236 1 13 . 1 1 116 116 MET N N 116 117.069 117.069 118.908 -1.839 18093 9237 1 13 . 1 1 116 116 MET HA H 116 4.065 4.065 4.210 -0.145 18093 9238 1 13 . 1 1 116 116 MET C C 116 177.425 177.425 178.170 -0.745 18093 9239 1 13 . 1 1 116 116 MET CA C 116 59.289 59.289 59.086 0.203 18093 9240 1 13 . 1 1 116 116 MET CB C 116 31.692 31.692 32.518 -0.826 18093 9241 1 13 . 1 1 116 116 MET H H 116 8.465 8.465 7.710 0.755 18093 9242 1 13 . 1 1 117 117 PHE N N 117 118.755 118.755 117.674 1.081 18093 9243 1 13 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.056 0.043 18093 9244 1 13 . 1 1 117 117 PHE C C 117 177.965 177.965 178.266 -0.301 18093 9245 1 13 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.189 -0.481 18093 9246 1 13 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.218 0.967 18093 9247 1 13 . 1 1 117 117 PHE H H 117 8.418 8.418 7.831 0.587 18093 9248 1 13 . 1 1 118 118 ILE N N 118 119.133 119.133 115.244 3.889 18093 9249 1 13 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.857 -0.513 18093 9250 1 13 . 1 1 118 118 ILE C C 118 177.244 177.244 177.348 -0.104 18093 9251 1 13 . 1 1 118 118 ILE CA C 118 65.825 65.825 63.921 1.904 18093 9252 1 13 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.805 -0.257 18093 9253 1 13 . 1 1 118 118 ILE H H 118 8.266 8.266 7.644 0.622 18093 9254 1 13 . 1 1 119 119 ILE N N 119 118.846 118.846 121.473 -2.627 18093 9255 1 13 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.871 -0.299 18093 9256 1 13 . 1 1 119 119 ILE C C 119 177.523 177.523 177.582 -0.059 18093 9257 1 13 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.151 0.738 18093 9258 1 13 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.245 -0.681 18093 9259 1 13 . 1 1 119 119 ILE H H 119 8.308 8.308 7.280 1.028 18093 9260 1 13 . 1 1 120 120 VAL N N 120 119.228 119.228 117.163 2.065 18093 9261 1 13 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.717 -0.209 18093 9262 1 13 . 1 1 120 120 VAL C C 120 177.651 177.651 177.307 0.344 18093 9263 1 13 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.653 1.948 18093 9264 1 13 . 1 1 120 120 VAL CB C 120 31.406 31.406 31.170 0.236 18093 9265 1 13 . 1 1 120 120 VAL H H 120 8.399 8.399 7.857 0.542 18093 9266 1 13 . 1 1 121 121 CYS N N 121 117.151 117.151 119.389 -2.238 18093 9267 1 13 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.038 -0.135 18093 9268 1 13 . 1 1 121 121 CYS C C 121 177.719 177.719 177.016 0.703 18093 9269 1 13 . 1 1 121 121 CYS CA C 121 64.298 64.298 64.067 0.231 18093 9270 1 13 . 1 1 121 121 CYS CB C 121 26.677 26.677 27.385 -0.708 18093 9271 1 13 . 1 1 121 121 CYS H H 121 8.008 8.008 7.441 0.567 18093 9272 1 13 . 1 1 122 122 LEU N N 122 121.402 121.402 120.531 0.871 18093 9273 1 13 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.078 -0.095 18093 9274 1 13 . 1 1 122 122 LEU C C 122 178.282 178.282 178.639 -0.357 18093 9275 1 13 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.706 0.839 18093 9276 1 13 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.067 0.899 18093 9277 1 13 . 1 1 122 122 LEU H H 122 8.417 8.417 7.666 0.751 18093 9278 1 13 . 1 1 123 123 LEU N N 123 118.543 118.543 119.770 -1.227 18093 9279 1 13 . 1 1 123 123 LEU HA H 123 3.920 3.920 3.990 -0.070 18093 9280 1 13 . 1 1 123 123 LEU C C 123 179.028 179.028 178.749 0.279 18093 9281 1 13 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.542 -0.425 18093 9282 1 13 . 1 1 123 123 LEU CB C 123 42.056 42.056 40.828 1.228 18093 9283 1 13 . 1 1 123 123 LEU H H 123 8.590 8.590 7.656 0.934 18093 9284 1 13 . 1 1 124 124 GLY N N 124 104.896 104.896 105.556 -0.660 18093 9285 1 13 . 1 1 124 124 GLY C C 124 173.932 173.932 176.101 -2.169 18093 9286 1 13 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.609 -0.382 18093 9287 1 13 . 1 1 124 124 GLY H H 124 8.601 8.601 8.325 0.276 18093 9288 1 13 . 1 1 125 125 THR N N 125 115.403 115.403 119.466 -4.063 18093 9289 1 13 . 1 1 125 125 THR HA H 125 3.686 3.686 3.855 -0.169 18093 9290 1 13 . 1 1 125 125 THR C C 125 176.407 176.407 176.551 -0.144 18093 9291 1 13 . 1 1 125 125 THR CA C 125 67.565 67.565 67.148 0.417 18093 9292 1 13 . 1 1 125 125 THR CB C 125 68.143 68.143 68.446 -0.303 18093 9293 1 13 . 1 1 125 125 THR H H 125 7.734 7.734 7.667 0.067 18093 9294 1 13 . 1 1 126 126 VAL N N 126 119.056 119.056 121.017 -1.961 18093 9295 1 13 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.456 0.083 18093 9296 1 13 . 1 1 126 126 VAL C C 126 177.628 177.628 177.988 -0.360 18093 9297 1 13 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.842 -0.241 18093 9298 1 13 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.529 -0.035 18093 9299 1 13 . 1 1 126 126 VAL H H 126 8.015 8.015 8.374 -0.359 18093 9300 1 13 . 1 1 127 127 GLY N N 127 104.644 104.644 107.149 -2.505 18093 9301 1 13 . 1 1 127 127 GLY C C 127 173.933 173.933 175.675 -1.742 18093 9302 1 13 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.193 0.088 18093 9303 1 13 . 1 1 127 127 GLY H H 127 8.248 8.248 8.320 -0.072 18093 9304 1 13 . 1 1 128 128 LEU N N 128 117.354 117.354 121.712 -4.358 18093 9305 1 13 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.154 -0.142 18093 9306 1 13 . 1 1 128 128 LEU C C 128 177.443 177.443 177.866 -0.423 18093 9307 1 13 . 1 1 128 128 LEU CA C 128 56.626 56.626 57.234 -0.608 18093 9308 1 13 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.716 0.544 18093 9309 1 13 . 1 1 128 128 LEU H H 128 7.568 7.568 7.714 -0.146 18093 9310 1 13 . 1 1 129 129 PHE N N 129 113.971 113.971 116.233 -2.262 18093 9311 1 13 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.332 0.126 18093 9312 1 13 . 1 1 129 129 PHE C C 129 176.216 176.216 176.758 -0.542 18093 9313 1 13 . 1 1 129 129 PHE CA C 129 58.385 58.385 60.060 -1.675 18093 9314 1 13 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.757 -0.038 18093 9315 1 13 . 1 1 129 129 PHE H H 129 7.639 7.639 7.785 -0.146 18093 9316 1 13 . 1 1 130 130 LEU N N 130 117.752 117.752 119.847 -2.095 18093 9317 1 13 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.910 -0.477 18093 9318 1 13 . 1 1 130 130 LEU CA C 130 54.156 54.156 51.434 2.722 18093 9319 1 13 . 1 1 130 130 LEU H H 130 8.099 8.099 7.784 0.315 18093 9320 1 13 . 1 1 131 131 PRO HA H 131 4.450 4.450 5.030 -0.580 18093 9321 1 13 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.447 2.452 18093 9322 1 13 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.401 -0.139 18093 9323 1 13 . 1 1 132 132 PRO C C 132 177.616 177.616 178.761 -1.145 18093 9324 1 13 . 1 1 132 132 PRO CA C 132 64.980 64.980 65.270 -0.290 18093 9325 1 13 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.027 -0.402 18093 9326 1 13 . 1 1 133 133 TRP N N 133 115.508 115.508 121.448 -5.940 18093 9327 1 13 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.487 0.105 18093 9328 1 13 . 1 1 133 133 TRP C C 133 176.842 176.842 176.196 0.646 18093 9329 1 13 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.496 -2.213 18093 9330 1 13 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.632 -1.036 18093 9331 1 13 . 1 1 133 133 TRP H H 133 7.311 7.311 8.576 -1.265 18093 9332 1 13 . 1 1 134 134 LEU N N 134 119.570 119.570 115.404 4.166 18093 9333 1 13 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.584 -0.407 18093 9334 1 13 . 1 1 134 134 LEU C C 134 175.768 175.768 176.340 -0.572 18093 9335 1 13 . 1 1 134 134 LEU CA C 134 55.621 55.621 53.817 1.804 18093 9336 1 13 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.821 0.827 18093 9337 1 13 . 1 1 134 134 LEU H H 134 7.453 7.453 7.244 0.209 18093 9338 1 13 . 1 1 135 135 ALA N N 135 119.004 119.004 122.631 -3.627 18093 9339 1 13 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.422 -0.199 18093 9340 1 13 . 1 1 135 135 ALA C C 135 177.170 177.170 178.715 -1.545 18093 9341 1 13 . 1 1 135 135 ALA CA C 135 52.456 52.456 54.220 -1.764 18093 9342 1 13 . 1 1 135 135 ALA CB C 135 19.736 19.736 19.449 0.287 18093 9343 1 13 . 1 1 135 135 ALA H H 135 7.541 7.541 7.711 -0.170 18093 9344 1 13 . 1 1 136 136 GLY N N 136 105.879 105.879 106.656 -0.777 18093 9345 1 13 . 1 1 136 136 GLY C C 136 173.042 173.042 175.028 -1.986 18093 9346 1 13 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.336 0.357 18093 9347 1 13 . 1 1 136 136 GLY H H 136 7.846 7.846 8.342 -0.496 18093 9348 1 14 . 1 1 5 5 GLU N N 5 119.627 119.627 118.236 1.391 18093 9349 1 14 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.277 -0.069 18093 9350 1 14 . 1 1 5 5 GLU C C 5 176.581 176.581 174.644 1.937 18093 9351 1 14 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.347 0.698 18093 9352 1 14 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.134 0.904 18093 9353 1 14 . 1 1 5 5 GLU H H 5 8.003 8.003 8.241 -0.238 18093 9354 1 14 . 1 1 6 6 LEU N N 6 121.267 121.267 122.652 -1.385 18093 9355 1 14 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.485 -0.060 18093 9356 1 14 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.136 2.499 18093 9357 1 14 . 1 1 6 6 LEU CB C 6 41.296 41.296 42.026 -0.730 18093 9358 1 14 . 1 1 6 6 LEU H H 6 8.104 8.104 7.810 0.294 18093 9359 1 14 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.466 -0.067 18093 9360 1 14 . 1 1 7 7 PRO C C 7 178.408 178.408 177.504 0.904 18093 9361 1 14 . 1 1 7 7 PRO CA C 7 64.712 64.712 61.964 2.748 18093 9362 1 14 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.612 -0.695 18093 9363 1 14 . 1 1 8 8 LEU N N 8 121.835 121.835 120.044 1.791 18093 9364 1 14 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.131 -0.042 18093 9365 1 14 . 1 1 8 8 LEU C C 8 177.902 177.902 178.500 -0.598 18093 9366 1 14 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.866 0.239 18093 9367 1 14 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.035 0.572 18093 9368 1 14 . 1 1 8 8 LEU H H 8 8.162 8.162 8.291 -0.129 18093 9369 1 14 . 1 1 9 9 PHE N N 9 118.342 118.342 115.662 2.680 18093 9370 1 14 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.209 -0.020 18093 9371 1 14 . 1 1 9 9 PHE C C 9 177.596 177.596 178.626 -1.030 18093 9372 1 14 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.071 0.043 18093 9373 1 14 . 1 1 9 9 PHE CB C 9 38.727 38.727 37.182 1.545 18093 9374 1 14 . 1 1 9 9 PHE H H 9 8.318 8.318 7.661 0.657 18093 9375 1 14 . 1 1 10 10 TYR N N 10 117.584 117.584 118.339 -0.755 18093 9376 1 14 . 1 1 10 10 TYR HA H 10 4.154 4.154 4.413 -0.259 18093 9377 1 14 . 1 1 10 10 TYR C C 10 177.630 177.630 177.844 -0.214 18093 9378 1 14 . 1 1 10 10 TYR CA C 10 61.036 61.036 61.762 -0.726 18093 9379 1 14 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.625 0.035 18093 9380 1 14 . 1 1 10 10 TYR H H 10 8.105 8.105 8.018 0.087 18093 9381 1 14 . 1 1 11 11 THR N N 11 115.563 115.563 116.825 -1.262 18093 9382 1 14 . 1 1 11 11 THR HA H 11 3.871 3.871 4.030 -0.159 18093 9383 1 14 . 1 1 11 11 THR C C 11 175.955 175.955 176.730 -0.775 18093 9384 1 14 . 1 1 11 11 THR CA C 11 67.290 67.290 66.591 0.699 18093 9385 1 14 . 1 1 11 11 THR CB C 11 68.201 68.201 68.732 -0.531 18093 9386 1 14 . 1 1 11 11 THR H H 11 7.915 7.915 7.847 0.068 18093 9387 1 14 . 1 1 12 12 ILE N N 12 119.727 119.727 120.752 -1.025 18093 9388 1 14 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.891 -0.192 18093 9389 1 14 . 1 1 12 12 ILE C C 12 175.773 175.773 177.719 -1.946 18093 9390 1 14 . 1 1 12 12 ILE CA C 12 64.699 64.699 63.525 1.174 18093 9391 1 14 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.863 1.233 18093 9392 1 14 . 1 1 12 12 ILE H H 12 8.186 8.186 8.168 0.018 18093 9393 1 14 . 1 1 13 13 ASN N N 13 114.190 114.190 118.119 -3.929 18093 9394 1 14 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.534 -0.112 18093 9395 1 14 . 1 1 13 13 ASN C C 13 174.786 174.786 176.623 -1.837 18093 9396 1 14 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.638 -0.083 18093 9397 1 14 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.785 0.573 18093 9398 1 14 . 1 1 13 13 ASN H H 13 7.601 7.601 7.626 -0.025 18093 9399 1 14 . 1 1 14 14 LEU N N 14 115.031 115.031 119.162 -4.131 18093 9400 1 14 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.076 0.120 18093 9401 1 14 . 1 1 14 14 LEU C C 14 177.540 177.540 177.925 -0.385 18093 9402 1 14 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.334 0.073 18093 9403 1 14 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.136 -0.294 18093 9404 1 14 . 1 1 14 14 LEU H H 14 7.390 7.390 7.535 -0.145 18093 9405 1 14 . 1 1 15 15 ILE N N 15 118.223 118.223 121.009 -2.786 18093 9406 1 14 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.686 -0.073 18093 9407 1 14 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.354 3.366 18093 9408 1 14 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.054 -0.442 18093 9409 1 14 . 1 1 15 15 ILE H H 15 8.123 8.123 7.727 0.396 18093 9410 1 14 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.328 -0.259 18093 9411 1 14 . 1 1 17 17 PRO C C 17 177.721 177.721 178.522 -0.801 18093 9412 1 14 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.499 1.262 18093 9413 1 14 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.763 -0.021 18093 9414 1 14 . 1 1 18 18 CYS N N 18 113.538 113.538 118.076 -4.538 18093 9415 1 14 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.144 -0.136 18093 9416 1 14 . 1 1 18 18 CYS C C 18 177.683 177.683 177.017 0.666 18093 9417 1 14 . 1 1 18 18 CYS CA C 18 64.500 64.500 62.761 1.739 18093 9418 1 14 . 1 1 18 18 CYS CB C 18 26.873 26.873 26.826 0.047 18093 9419 1 14 . 1 1 18 18 CYS H H 18 7.410 7.410 7.383 0.027 18093 9420 1 14 . 1 1 19 19 LEU N N 19 122.545 122.545 118.982 3.563 18093 9421 1 14 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.159 -0.160 18093 9422 1 14 . 1 1 19 19 LEU C C 19 178.608 178.608 178.999 -0.391 18093 9423 1 14 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.237 1.183 18093 9424 1 14 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.418 0.426 18093 9425 1 14 . 1 1 19 19 LEU H H 19 8.635 8.635 7.405 1.230 18093 9426 1 14 . 1 1 20 20 LEU N N 20 119.404 119.404 120.554 -1.150 18093 9427 1 14 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.899 0.107 18093 9428 1 14 . 1 1 20 20 LEU C C 20 178.540 178.540 179.452 -0.912 18093 9429 1 14 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.293 0.506 18093 9430 1 14 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.950 0.049 18093 9431 1 14 . 1 1 20 20 LEU H H 20 8.392 8.392 7.492 0.900 18093 9432 1 14 . 1 1 21 21 ILE N N 21 117.335 117.335 114.645 2.690 18093 9433 1 14 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.806 -0.155 18093 9434 1 14 . 1 1 21 21 ILE C C 21 177.249 177.249 177.811 -0.562 18093 9435 1 14 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.868 0.393 18093 9436 1 14 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.386 0.574 18093 9437 1 14 . 1 1 21 21 ILE H H 21 8.403 8.403 8.462 -0.059 18093 9438 1 14 . 1 1 22 22 SER N N 22 116.385 116.385 118.091 -1.706 18093 9439 1 14 . 1 1 22 22 SER HA H 22 4.056 4.056 4.418 -0.362 18093 9440 1 14 . 1 1 22 22 SER C C 22 176.813 176.813 176.671 0.142 18093 9441 1 14 . 1 1 22 22 SER CA C 22 63.866 63.866 62.145 1.721 18093 9442 1 14 . 1 1 22 22 SER CB C 22 62.898 62.898 62.592 0.306 18093 9443 1 14 . 1 1 22 22 SER H H 22 8.271 8.271 7.603 0.668 18093 9444 1 14 . 1 1 23 23 CYS N N 23 119.001 119.001 120.474 -1.473 18093 9445 1 14 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.125 -0.135 18093 9446 1 14 . 1 1 23 23 CYS C C 23 177.594 177.594 176.601 0.993 18093 9447 1 14 . 1 1 23 23 CYS CA C 23 64.429 64.429 62.649 1.780 18093 9448 1 14 . 1 1 23 23 CYS CB C 23 26.940 26.940 26.866 0.074 18093 9449 1 14 . 1 1 23 23 CYS H H 23 8.161 8.161 8.584 -0.423 18093 9450 1 14 . 1 1 24 24 LEU N N 24 117.814 117.814 121.247 -3.433 18093 9451 1 14 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.867 0.110 18093 9452 1 14 . 1 1 24 24 LEU C C 24 177.944 177.944 178.411 -0.467 18093 9453 1 14 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.711 -0.424 18093 9454 1 14 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.858 0.045 18093 9455 1 14 . 1 1 24 24 LEU H H 24 8.106 8.106 7.539 0.567 18093 9456 1 14 . 1 1 25 25 THR N N 25 115.670 115.670 114.262 1.408 18093 9457 1 14 . 1 1 25 25 THR HA H 25 3.687 3.687 3.980 -0.293 18093 9458 1 14 . 1 1 25 25 THR C C 25 175.845 175.845 176.746 -0.901 18093 9459 1 14 . 1 1 25 25 THR CA C 25 68.306 68.306 66.407 1.899 18093 9460 1 14 . 1 1 25 25 THR H H 25 7.924 7.924 7.552 0.372 18093 9461 1 14 . 1 1 26 26 VAL N N 26 118.809 118.809 121.199 -2.390 18093 9462 1 14 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.769 -0.254 18093 9463 1 14 . 1 1 26 26 VAL C C 26 177.530 177.530 177.857 -0.327 18093 9464 1 14 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.055 1.226 18093 9465 1 14 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.382 0.342 18093 9466 1 14 . 1 1 26 26 VAL H H 26 7.764 7.764 7.359 0.406 18093 9467 1 14 . 1 1 27 27 LEU N N 27 117.958 117.958 120.872 -2.914 18093 9468 1 14 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.048 -0.012 18093 9469 1 14 . 1 1 27 27 LEU C C 27 178.163 178.163 179.051 -0.888 18093 9470 1 14 . 1 1 27 27 LEU CA C 27 58.509 58.509 57.797 0.712 18093 9471 1 14 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.767 1.152 18093 9472 1 14 . 1 1 27 27 LEU H H 27 7.912 7.912 8.073 -0.161 18093 9473 1 14 . 1 1 28 28 VAL N N 28 114.472 114.472 118.058 -3.586 18093 9474 1 14 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.739 -0.204 18093 9475 1 14 . 1 1 28 28 VAL C C 28 176.871 176.871 178.979 -2.108 18093 9476 1 14 . 1 1 28 28 VAL CA C 28 65.977 65.977 66.739 -0.762 18093 9477 1 14 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.548 0.386 18093 9478 1 14 . 1 1 28 28 VAL H H 28 7.892 7.892 7.614 0.278 18093 9479 1 14 . 1 1 29 29 PHE N N 29 115.206 115.206 118.802 -3.596 18093 9480 1 14 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.284 -0.081 18093 9481 1 14 . 1 1 29 29 PHE C C 29 176.614 176.614 176.075 0.539 18093 9482 1 14 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.109 0.855 18093 9483 1 14 . 1 1 29 29 PHE CB C 29 39.752 39.752 39.017 0.735 18093 9484 1 14 . 1 1 29 29 PHE H H 29 7.748 7.748 7.773 -0.025 18093 9485 1 14 . 1 1 30 30 TYR N N 30 115.975 115.975 118.926 -2.951 18093 9486 1 14 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.481 -0.159 18093 9487 1 14 . 1 1 30 30 TYR C C 30 175.553 175.553 175.292 0.261 18093 9488 1 14 . 1 1 30 30 TYR CA C 30 59.598 59.598 58.578 1.020 18093 9489 1 14 . 1 1 30 30 TYR CB C 30 39.763 39.763 40.327 -0.564 18093 9490 1 14 . 1 1 30 30 TYR H H 30 7.985 7.985 7.753 0.232 18093 9491 1 14 . 1 1 31 31 LEU N N 31 120.780 120.780 122.540 -1.760 18093 9492 1 14 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.745 -0.318 18093 9493 1 14 . 1 1 31 31 LEU CA C 31 54.665 54.665 51.078 3.587 18093 9494 1 14 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.156 -0.768 18093 9495 1 14 . 1 1 31 31 LEU H H 31 7.643 7.643 7.611 0.032 18093 9496 1 14 . 1 1 34 34 GLU C C 34 176.271 176.271 176.388 -0.117 18093 9497 1 14 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.911 1.679 18093 9498 1 14 . 1 1 35 35 CYS N N 35 116.430 116.430 123.642 -7.212 18093 9499 1 14 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.421 -0.054 18093 9500 1 14 . 1 1 35 35 CYS C C 35 175.198 175.198 177.061 -1.863 18093 9501 1 14 . 1 1 35 35 CYS CA C 35 60.293 60.293 60.335 -0.042 18093 9502 1 14 . 1 1 35 35 CYS CB C 35 28.130 28.130 27.639 0.491 18093 9503 1 14 . 1 1 35 35 CYS H H 35 7.970 7.970 9.049 -1.079 18093 9504 1 14 . 1 1 36 36 GLY N N 36 108.315 108.315 108.503 -0.188 18093 9505 1 14 . 1 1 36 36 GLY C C 36 174.610 174.610 175.351 -0.741 18093 9506 1 14 . 1 1 36 36 GLY CA C 36 46.004 46.004 46.704 -0.700 18093 9507 1 14 . 1 1 36 36 GLY H H 36 8.120 8.120 8.540 -0.420 18093 9508 1 14 . 1 1 37 37 GLU N N 37 121.347 121.347 120.485 0.862 18093 9509 1 14 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.278 -0.231 18093 9510 1 14 . 1 1 37 37 GLU C C 37 177.338 177.338 178.522 -1.184 18093 9511 1 14 . 1 1 37 37 GLU CA C 37 58.507 58.507 58.727 -0.220 18093 9512 1 14 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.719 -0.149 18093 9513 1 14 . 1 1 37 37 GLU H H 37 8.423 8.423 7.735 0.688 18093 9514 1 14 . 1 1 38 38 LYS N N 38 123.788 123.788 120.518 3.270 18093 9515 1 14 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.178 0.018 18093 9516 1 14 . 1 1 38 38 LYS C C 38 177.976 177.976 178.550 -0.574 18093 9517 1 14 . 1 1 38 38 LYS CA C 38 58.273 58.273 58.866 -0.593 18093 9518 1 14 . 1 1 38 38 LYS CB C 38 31.649 31.649 32.012 -0.363 18093 9519 1 14 . 1 1 38 38 LYS H H 38 8.211 8.211 7.848 0.363 18093 9520 1 14 . 1 1 39 39 ILE N N 39 115.675 115.675 118.419 -2.744 18093 9521 1 14 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.729 -0.121 18093 9522 1 14 . 1 1 39 39 ILE C C 39 177.204 177.204 177.800 -0.596 18093 9523 1 14 . 1 1 39 39 ILE CA C 39 65.501 65.501 65.141 0.360 18093 9524 1 14 . 1 1 39 39 ILE H H 39 7.933 7.933 7.510 0.423 18093 9525 1 14 . 1 1 40 40 THR N N 40 117.411 117.411 114.341 3.070 18093 9526 1 14 . 1 1 40 40 THR HA H 40 3.844 3.844 3.899 -0.055 18093 9527 1 14 . 1 1 40 40 THR C C 40 175.983 175.983 176.415 -0.432 18093 9528 1 14 . 1 1 40 40 THR CA C 40 67.360 67.360 66.108 1.252 18093 9529 1 14 . 1 1 40 40 THR H H 40 8.362 8.362 7.685 0.677 18093 9530 1 14 . 1 1 41 41 LEU N N 41 123.059 123.059 123.673 -0.614 18093 9531 1 14 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.182 -0.166 18093 9532 1 14 . 1 1 41 41 LEU C C 41 178.914 178.914 177.885 1.029 18093 9533 1 14 . 1 1 41 41 LEU CA C 41 58.366 58.366 57.735 0.631 18093 9534 1 14 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.539 0.511 18093 9535 1 14 . 1 1 41 41 LEU H H 41 8.282 8.282 7.493 0.789 18093 9536 1 14 . 1 1 42 42 CYS N N 42 118.762 118.762 117.774 0.988 18093 9537 1 14 . 1 1 42 42 CYS HA H 42 3.936 3.936 3.957 -0.021 18093 9538 1 14 . 1 1 42 42 CYS C C 42 176.607 176.607 177.003 -0.396 18093 9539 1 14 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.068 1.249 18093 9540 1 14 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.193 -0.274 18093 9541 1 14 . 1 1 42 42 CYS H H 42 8.195 8.195 7.730 0.465 18093 9542 1 14 . 1 1 43 43 ILE N N 43 117.589 117.589 120.125 -2.536 18093 9543 1 14 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.690 -0.083 18093 9544 1 14 . 1 1 43 43 ILE C C 43 177.323 177.323 177.733 -0.410 18093 9545 1 14 . 1 1 43 43 ILE CA C 43 65.249 65.249 64.768 0.481 18093 9546 1 14 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.748 0.290 18093 9547 1 14 . 1 1 43 43 ILE H H 43 8.428 8.428 7.472 0.956 18093 9548 1 14 . 1 1 44 44 SER N N 44 115.950 115.950 117.157 -1.207 18093 9549 1 14 . 1 1 44 44 SER HA H 44 4.012 4.012 4.133 -0.121 18093 9550 1 14 . 1 1 44 44 SER C C 44 176.965 176.965 176.858 0.107 18093 9551 1 14 . 1 1 44 44 SER CA C 44 63.575 63.575 62.389 1.186 18093 9552 1 14 . 1 1 44 44 SER H H 44 7.984 7.984 7.877 0.107 18093 9553 1 14 . 1 1 45 45 VAL N N 45 123.544 123.544 121.053 2.491 18093 9554 1 14 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.765 -0.217 18093 9555 1 14 . 1 1 45 45 VAL C C 45 177.139 177.139 177.961 -0.822 18093 9556 1 14 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.510 0.723 18093 9557 1 14 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.407 0.235 18093 9558 1 14 . 1 1 45 45 VAL H H 45 8.280 8.280 8.038 0.242 18093 9559 1 14 . 1 1 46 46 LEU N N 46 119.883 119.883 119.799 0.084 18093 9560 1 14 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.064 -0.121 18093 9561 1 14 . 1 1 46 46 LEU C C 46 180.125 180.125 179.107 1.018 18093 9562 1 14 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.405 1.195 18093 9563 1 14 . 1 1 46 46 LEU CB C 46 42.012 42.012 40.839 1.173 18093 9564 1 14 . 1 1 46 46 LEU H H 46 8.117 8.117 7.363 0.754 18093 9565 1 14 . 1 1 47 47 LEU N N 47 120.193 120.193 121.062 -0.869 18093 9566 1 14 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.841 0.163 18093 9567 1 14 . 1 1 47 47 LEU C C 47 178.370 178.370 179.129 -0.759 18093 9568 1 14 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.612 -0.186 18093 9569 1 14 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.793 0.262 18093 9570 1 14 . 1 1 47 47 LEU H H 47 8.933 8.933 8.311 0.622 18093 9571 1 14 . 1 1 48 48 SER N N 48 115.861 115.861 114.177 1.684 18093 9572 1 14 . 1 1 48 48 SER HA H 48 4.013 4.013 4.286 -0.273 18093 9573 1 14 . 1 1 48 48 SER C C 48 175.642 175.642 176.831 -1.189 18093 9574 1 14 . 1 1 48 48 SER CA C 48 63.571 63.571 61.383 2.188 18093 9575 1 14 . 1 1 48 48 SER CB C 48 62.879 62.879 63.352 -0.473 18093 9576 1 14 . 1 1 48 48 SER H H 48 7.996 7.996 7.549 0.447 18093 9577 1 14 . 1 1 49 49 LEU N N 49 120.673 120.673 123.750 -3.077 18093 9578 1 14 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.221 -0.186 18093 9579 1 14 . 1 1 49 49 LEU C C 49 178.229 178.229 178.259 -0.030 18093 9580 1 14 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.541 -0.258 18093 9581 1 14 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.393 -0.447 18093 9582 1 14 . 1 1 49 49 LEU H H 49 8.352 8.352 8.267 0.085 18093 9583 1 14 . 1 1 50 50 THR N N 50 115.582 115.582 114.992 0.590 18093 9584 1 14 . 1 1 50 50 THR HA H 50 3.672 3.672 4.040 -0.368 18093 9585 1 14 . 1 1 50 50 THR C C 50 175.877 175.877 176.835 -0.958 18093 9586 1 14 . 1 1 50 50 THR CA C 50 68.628 68.628 66.588 2.040 18093 9587 1 14 . 1 1 50 50 THR H H 50 7.937 7.937 8.462 -0.525 18093 9588 1 14 . 1 1 51 51 VAL N N 51 119.774 119.774 122.338 -2.564 18093 9589 1 14 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.808 -0.310 18093 9590 1 14 . 1 1 51 51 VAL C C 51 177.162 177.162 177.270 -0.108 18093 9591 1 14 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.404 1.181 18093 9592 1 14 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.666 -0.145 18093 9593 1 14 . 1 1 51 51 VAL H H 51 8.115 8.115 7.442 0.673 18093 9594 1 14 . 1 1 52 52 PHE N N 52 118.808 118.808 120.638 -1.830 18093 9595 1 14 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.294 -0.172 18093 9596 1 14 . 1 1 52 52 PHE C C 52 176.697 176.697 177.026 -0.329 18093 9597 1 14 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.972 0.799 18093 9598 1 14 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.096 0.166 18093 9599 1 14 . 1 1 52 52 PHE H H 52 8.256 8.256 8.368 -0.112 18093 9600 1 14 . 1 1 53 53 LEU N N 53 117.267 117.267 121.197 -3.930 18093 9601 1 14 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.564 0.329 18093 9602 1 14 . 1 1 53 53 LEU C C 53 179.319 179.319 177.798 1.521 18093 9603 1 14 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.750 0.235 18093 9604 1 14 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.302 0.525 18093 9605 1 14 . 1 1 53 53 LEU H H 53 8.443 8.443 7.687 0.756 18093 9606 1 14 . 1 1 54 54 LEU N N 54 119.762 119.762 119.269 0.493 18093 9607 1 14 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.891 0.163 18093 9608 1 14 . 1 1 54 54 LEU C C 54 178.827 178.827 179.029 -0.202 18093 9609 1 14 . 1 1 54 54 LEU CA C 54 58.105 58.105 58.293 -0.188 18093 9610 1 14 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.843 0.104 18093 9611 1 14 . 1 1 54 54 LEU H H 54 8.205 8.205 7.370 0.835 18093 9612 1 14 . 1 1 55 55 LEU N N 55 118.585 118.585 117.733 0.852 18093 9613 1 14 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.918 0.159 18093 9614 1 14 . 1 1 55 55 LEU C C 55 178.909 178.909 178.710 0.199 18093 9615 1 14 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.623 0.485 18093 9616 1 14 . 1 1 55 55 LEU CB C 55 41.979 41.979 41.877 0.102 18093 9617 1 14 . 1 1 55 55 LEU H H 55 8.179 8.179 7.417 0.762 18093 9618 1 14 . 1 1 56 56 ILE N N 56 116.079 116.079 115.671 0.408 18093 9619 1 14 . 1 1 56 56 ILE HA H 56 3.729 3.729 4.025 -0.296 18093 9620 1 14 . 1 1 56 56 ILE C C 56 176.988 176.988 177.817 -0.829 18093 9621 1 14 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.117 1.140 18093 9622 1 14 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.880 0.537 18093 9623 1 14 . 1 1 56 56 ILE H H 56 8.040 8.040 7.497 0.543 18093 9624 1 14 . 1 1 57 57 THR N N 57 110.105 110.105 111.658 -1.553 18093 9625 1 14 . 1 1 57 57 THR HA H 57 4.015 4.015 4.158 -0.143 18093 9626 1 14 . 1 1 57 57 THR C C 57 175.435 175.435 175.698 -0.263 18093 9627 1 14 . 1 1 57 57 THR CA C 57 65.067 65.067 65.019 0.048 18093 9628 1 14 . 1 1 57 57 THR CB C 57 69.179 69.179 68.889 0.290 18093 9629 1 14 . 1 1 57 57 THR H H 57 7.655 7.655 7.723 -0.068 18093 9630 1 14 . 1 1 58 58 GLU N N 58 117.313 117.313 120.698 -3.385 18093 9631 1 14 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.293 0.040 18093 9632 1 14 . 1 1 58 58 GLU C C 58 176.940 176.940 177.837 -0.897 18093 9633 1 14 . 1 1 58 58 GLU CA C 58 57.068 57.068 57.901 -0.833 18093 9634 1 14 . 1 1 58 58 GLU CB C 58 29.396 29.396 29.992 -0.596 18093 9635 1 14 . 1 1 58 58 GLU H H 58 7.521 7.521 7.656 -0.135 18093 9636 1 14 . 1 1 59 59 ILE N N 59 114.870 114.870 114.507 0.363 18093 9637 1 14 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.059 0.030 18093 9638 1 14 . 1 1 59 59 ILE C C 59 175.456 175.456 176.499 -1.043 18093 9639 1 14 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.516 -0.082 18093 9640 1 14 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.962 -0.305 18093 9641 1 14 . 1 1 59 59 ILE H H 59 7.579 7.579 7.377 0.202 18093 9642 1 14 . 1 1 60 60 ILE N N 60 119.354 119.354 117.059 2.295 18093 9643 1 14 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.892 0.412 18093 9644 1 14 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.441 -1.824 18093 9645 1 14 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.517 2.345 18093 9646 1 14 . 1 1 60 60 ILE H H 60 7.629 7.629 7.734 -0.105 18093 9647 1 14 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.531 -0.131 18093 9648 1 14 . 1 1 61 61 PRO C C 61 177.144 177.144 177.119 0.025 18093 9649 1 14 . 1 1 61 61 PRO CA C 61 63.808 63.808 62.853 0.955 18093 9650 1 14 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.389 -0.507 18093 9651 1 14 . 1 1 62 62 SER N N 62 114.474 114.474 113.084 1.390 18093 9652 1 14 . 1 1 62 62 SER HA H 62 4.434 4.434 4.152 0.282 18093 9653 1 14 . 1 1 62 62 SER C C 62 175.161 175.161 173.659 1.502 18093 9654 1 14 . 1 1 62 62 SER CA C 62 59.047 59.047 58.159 0.888 18093 9655 1 14 . 1 1 62 62 SER CB C 62 63.704 63.704 63.807 -0.103 18093 9656 1 14 . 1 1 62 62 SER H H 62 8.186 8.186 8.173 0.013 18093 9657 1 14 . 1 1 63 63 THR N N 63 113.573 113.573 117.582 -4.009 18093 9658 1 14 . 1 1 63 63 THR HA H 63 4.319 4.319 4.217 0.102 18093 9659 1 14 . 1 1 63 63 THR C C 63 174.834 174.834 174.132 0.702 18093 9660 1 14 . 1 1 63 63 THR CA C 63 62.377 62.377 62.603 -0.226 18093 9661 1 14 . 1 1 63 63 THR CB C 63 69.422 69.422 69.325 0.097 18093 9662 1 14 . 1 1 63 63 THR H H 63 7.963 7.963 8.113 -0.150 18093 9663 1 14 . 1 1 64 64 SER N N 64 116.598 116.598 121.572 -4.974 18093 9664 1 14 . 1 1 64 64 SER HA H 64 4.428 4.428 4.732 -0.304 18093 9665 1 14 . 1 1 64 64 SER C C 64 174.618 174.618 172.973 1.645 18093 9666 1 14 . 1 1 64 64 SER CA C 64 59.045 59.045 57.354 1.691 18093 9667 1 14 . 1 1 64 64 SER CB C 64 63.700 63.700 65.530 -1.830 18093 9668 1 14 . 1 1 64 64 SER H H 64 8.052 8.052 8.000 0.052 18093 9669 1 14 . 1 1 65 65 SER N N 65 116.673 116.673 114.521 2.152 18093 9670 1 14 . 1 1 65 65 SER HA H 65 4.432 4.432 5.088 -0.656 18093 9671 1 14 . 1 1 65 65 SER C C 65 174.335 174.335 174.811 -0.476 18093 9672 1 14 . 1 1 65 65 SER CA C 65 58.927 58.927 58.250 0.677 18093 9673 1 14 . 1 1 65 65 SER CB C 65 63.621 63.621 63.996 -0.375 18093 9674 1 14 . 1 1 65 65 SER H H 65 8.114 8.114 8.644 -0.530 18093 9675 1 14 . 1 1 66 66 VAL N N 66 119.054 119.054 117.909 1.145 18093 9676 1 14 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.465 -0.295 18093 9677 1 14 . 1 1 66 66 VAL C C 66 175.278 175.278 175.902 -0.624 18093 9678 1 14 . 1 1 66 66 VAL CA C 66 62.062 62.062 61.347 0.715 18093 9679 1 14 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.520 0.110 18093 9680 1 14 . 1 1 66 66 VAL H H 66 7.740 7.740 7.500 0.240 18093 9681 1 14 . 1 1 67 67 SER N N 67 118.882 118.882 117.677 1.205 18093 9682 1 14 . 1 1 67 67 SER HA H 67 4.704 4.704 4.961 -0.257 18093 9683 1 14 . 1 1 67 67 SER CA C 67 56.715 56.715 55.787 0.928 18093 9684 1 14 . 1 1 67 67 SER CB C 67 63.624 63.624 64.646 -1.022 18093 9685 1 14 . 1 1 67 67 SER H H 67 8.060 8.060 7.950 0.110 18093 9686 1 14 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.539 -0.139 18093 9687 1 14 . 1 1 68 68 PRO C C 68 176.925 176.925 176.127 0.798 18093 9688 1 14 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.963 0.785 18093 9689 1 14 . 1 1 68 68 PRO CB C 68 32.005 32.005 30.735 1.270 18093 9690 1 14 . 1 1 69 69 SER N N 69 114.930 114.930 118.293 -3.363 18093 9691 1 14 . 1 1 69 69 SER HA H 69 4.422 4.422 4.676 -0.254 18093 9692 1 14 . 1 1 69 69 SER C C 69 175.617 175.617 174.638 0.979 18093 9693 1 14 . 1 1 69 69 SER CA C 69 58.697 58.697 56.132 2.565 18093 9694 1 14 . 1 1 69 69 SER CB C 69 63.804 63.804 65.781 -1.977 18093 9695 1 14 . 1 1 69 69 SER H H 69 8.205 8.205 7.750 0.455 18093 9696 1 14 . 1 1 70 70 ILE N N 70 120.840 120.840 122.626 -1.786 18093 9697 1 14 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.115 -0.123 18093 9698 1 14 . 1 1 70 70 ILE C C 70 177.524 177.524 176.421 1.103 18093 9699 1 14 . 1 1 70 70 ILE CA C 70 64.335 64.335 62.006 2.329 18093 9700 1 14 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.019 -0.559 18093 9701 1 14 . 1 1 70 70 ILE H H 70 8.283 8.283 8.735 -0.452 18093 9702 1 14 . 1 1 71 71 GLY N N 71 107.823 107.823 107.822 0.001 18093 9703 1 14 . 1 1 71 71 GLY C C 71 175.296 175.296 176.026 -0.730 18093 9704 1 14 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.146 0.309 18093 9705 1 14 . 1 1 71 71 GLY H H 71 8.557 8.557 8.763 -0.206 18093 9706 1 14 . 1 1 72 72 GLU N N 72 120.835 120.835 120.833 0.002 18093 9707 1 14 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.035 -0.188 18093 9708 1 14 . 1 1 72 72 GLU C C 72 178.198 178.198 178.044 0.154 18093 9709 1 14 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.675 1.442 18093 9710 1 14 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.628 -0.235 18093 9711 1 14 . 1 1 72 72 GLU H H 72 7.922 7.922 7.678 0.244 18093 9712 1 14 . 1 1 73 73 TYR N N 73 117.375 117.375 122.350 -4.975 18093 9713 1 14 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.245 -0.083 18093 9714 1 14 . 1 1 73 73 TYR C C 73 179.912 179.912 177.509 2.403 18093 9715 1 14 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.184 0.970 18093 9716 1 14 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.481 0.285 18093 9717 1 14 . 1 1 73 73 TYR H H 73 8.062 8.062 7.883 0.179 18093 9718 1 14 . 1 1 74 74 LEU N N 74 121.493 121.493 119.237 2.256 18093 9719 1 14 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.771 0.278 18093 9720 1 14 . 1 1 74 74 LEU C C 74 178.063 178.063 178.948 -0.885 18093 9721 1 14 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.672 0.823 18093 9722 1 14 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.915 -0.068 18093 9723 1 14 . 1 1 74 74 LEU H H 74 8.552 8.552 8.401 0.151 18093 9724 1 14 . 1 1 75 75 LEU N N 75 120.375 120.375 120.678 -0.303 18093 9725 1 14 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.129 -0.089 18093 9726 1 14 . 1 1 75 75 LEU C C 75 178.515 178.515 178.129 0.386 18093 9727 1 14 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.101 0.537 18093 9728 1 14 . 1 1 75 75 LEU CB C 75 42.039 42.039 41.982 0.057 18093 9729 1 14 . 1 1 75 75 LEU H H 75 8.276 8.276 7.482 0.794 18093 9730 1 14 . 1 1 76 76 PHE N N 76 116.626 116.626 118.124 -1.498 18093 9731 1 14 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.100 -0.021 18093 9732 1 14 . 1 1 76 76 PHE C C 76 177.399 177.399 178.117 -0.718 18093 9733 1 14 . 1 1 76 76 PHE CA C 76 61.734 61.734 61.414 0.320 18093 9734 1 14 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.090 0.651 18093 9735 1 14 . 1 1 76 76 PHE H H 76 8.454 8.454 8.625 -0.171 18093 9736 1 14 . 1 1 77 77 THR N N 77 116.080 116.080 115.986 0.094 18093 9737 1 14 . 1 1 77 77 THR HA H 77 3.687 3.687 3.874 -0.187 18093 9738 1 14 . 1 1 77 77 THR C C 77 176.018 176.018 176.548 -0.530 18093 9739 1 14 . 1 1 77 77 THR CA C 77 68.640 68.640 67.193 1.447 18093 9740 1 14 . 1 1 77 77 THR H H 77 8.224 8.224 8.368 -0.144 18093 9741 1 14 . 1 1 78 78 MET N N 78 119.394 119.394 120.916 -1.522 18093 9742 1 14 . 1 1 78 78 MET HA H 78 4.129 4.129 3.999 0.130 18093 9743 1 14 . 1 1 78 78 MET C C 78 179.608 179.608 178.112 1.496 18093 9744 1 14 . 1 1 78 78 MET CA C 78 58.831 58.831 59.943 -1.112 18093 9745 1 14 . 1 1 78 78 MET CB C 78 31.590 31.590 32.396 -0.806 18093 9746 1 14 . 1 1 78 78 MET H H 78 8.372 8.372 7.526 0.846 18093 9747 1 14 . 1 1 79 79 ILE N N 79 121.819 121.819 119.046 2.773 18093 9748 1 14 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.786 -0.236 18093 9749 1 14 . 1 1 79 79 ILE C C 79 176.426 176.426 178.102 -1.676 18093 9750 1 14 . 1 1 79 79 ILE CA C 79 65.876 65.876 63.845 2.031 18093 9751 1 14 . 1 1 79 79 ILE CB C 79 37.673 37.673 36.574 1.099 18093 9752 1 14 . 1 1 79 79 ILE H H 79 8.391 8.391 8.356 0.035 18093 9753 1 14 . 1 1 80 80 PHE N N 80 119.916 119.916 121.679 -1.763 18093 9754 1 14 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.123 -0.070 18093 9755 1 14 . 1 1 80 80 PHE C C 80 178.568 178.568 177.643 0.925 18093 9756 1 14 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.367 -0.060 18093 9757 1 14 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.373 -0.599 18093 9758 1 14 . 1 1 80 80 PHE H H 80 8.479 8.479 8.213 0.266 18093 9759 1 14 . 1 1 81 81 VAL N N 81 120.191 120.191 115.382 4.809 18093 9760 1 14 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.597 -0.144 18093 9761 1 14 . 1 1 81 81 VAL C C 81 178.225 178.225 177.659 0.566 18093 9762 1 14 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.528 0.880 18093 9763 1 14 . 1 1 81 81 VAL CB C 81 31.556 31.556 31.066 0.490 18093 9764 1 14 . 1 1 81 81 VAL H H 81 8.928 8.928 8.825 0.103 18093 9765 1 14 . 1 1 82 82 THR N N 82 115.930 115.930 118.021 -2.091 18093 9766 1 14 . 1 1 82 82 THR HA H 82 3.636 3.636 4.015 -0.379 18093 9767 1 14 . 1 1 82 82 THR C C 82 176.420 176.420 176.737 -0.317 18093 9768 1 14 . 1 1 82 82 THR CA C 82 68.570 68.570 66.957 1.613 18093 9769 1 14 . 1 1 82 82 THR CB C 82 68.202 68.202 68.589 -0.387 18093 9770 1 14 . 1 1 82 82 THR H H 82 7.969 7.969 7.445 0.524 18093 9771 1 14 . 1 1 83 83 LEU N N 83 119.780 119.780 120.663 -0.883 18093 9772 1 14 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.929 -0.082 18093 9773 1 14 . 1 1 83 83 LEU C C 83 178.214 178.214 178.714 -0.500 18093 9774 1 14 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.458 0.779 18093 9775 1 14 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.236 0.555 18093 9776 1 14 . 1 1 83 83 LEU H H 83 8.483 8.483 7.605 0.878 18093 9777 1 14 . 1 1 84 84 SER N N 84 114.559 114.559 115.769 -1.210 18093 9778 1 14 . 1 1 84 84 SER HA H 84 4.099 4.099 4.068 0.031 18093 9779 1 14 . 1 1 84 84 SER C C 84 176.799 176.799 176.428 0.371 18093 9780 1 14 . 1 1 84 84 SER CA C 84 63.609 63.609 62.741 0.868 18093 9781 1 14 . 1 1 84 84 SER CB C 84 63.110 63.110 62.995 0.115 18093 9782 1 14 . 1 1 84 84 SER H H 84 8.023 8.023 7.780 0.243 18093 9783 1 14 . 1 1 85 85 ILE N N 85 123.962 123.962 121.371 2.591 18093 9784 1 14 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.763 -0.159 18093 9785 1 14 . 1 1 85 85 ILE C C 85 177.487 177.487 177.786 -0.299 18093 9786 1 14 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.069 0.690 18093 9787 1 14 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.932 -0.045 18093 9788 1 14 . 1 1 85 85 ILE H H 85 8.054 8.054 7.736 0.318 18093 9789 1 14 . 1 1 86 86 VAL N N 86 118.744 118.744 120.656 -1.912 18093 9790 1 14 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.802 -0.283 18093 9791 1 14 . 1 1 86 86 VAL C C 86 177.557 177.557 177.803 -0.246 18093 9792 1 14 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.634 0.901 18093 9793 1 14 . 1 1 86 86 VAL CB C 86 31.466 31.466 32.054 -0.589 18093 9794 1 14 . 1 1 86 86 VAL H H 86 8.158 8.158 7.333 0.825 18093 9795 1 14 . 1 1 87 87 ILE N N 87 117.206 117.206 119.822 -2.616 18093 9796 1 14 . 1 1 87 87 ILE HA H 87 3.604 3.604 4.045 -0.441 18093 9797 1 14 . 1 1 87 87 ILE C C 87 177.283 177.283 178.366 -1.083 18093 9798 1 14 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.561 2.115 18093 9799 1 14 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.509 1.080 18093 9800 1 14 . 1 1 87 87 ILE H H 87 8.459 8.459 8.660 -0.201 18093 9801 1 14 . 1 1 88 88 THR N N 88 116.158 116.158 117.119 -0.961 18093 9802 1 14 . 1 1 88 88 THR HA H 88 3.672 3.672 4.141 -0.469 18093 9803 1 14 . 1 1 88 88 THR C C 88 175.485 175.485 176.649 -1.164 18093 9804 1 14 . 1 1 88 88 THR CA C 88 68.549 68.549 67.064 1.485 18093 9805 1 14 . 1 1 88 88 THR CB C 88 68.127 68.127 68.417 -0.290 18093 9806 1 14 . 1 1 88 88 THR H H 88 7.776 7.776 8.491 -0.715 18093 9807 1 14 . 1 1 89 89 VAL N N 89 117.985 117.985 119.077 -1.092 18093 9808 1 14 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.769 -0.226 18093 9809 1 14 . 1 1 89 89 VAL C C 89 177.393 177.393 177.483 -0.090 18093 9810 1 14 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.758 0.832 18093 9811 1 14 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.307 0.471 18093 9812 1 14 . 1 1 89 89 VAL H H 89 8.206 8.206 7.379 0.827 18093 9813 1 14 . 1 1 90 90 PHE N N 90 116.709 116.709 120.545 -3.836 18093 9814 1 14 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.162 0.216 18093 9815 1 14 . 1 1 90 90 PHE C C 90 177.305 177.305 177.594 -0.289 18093 9816 1 14 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.920 -0.801 18093 9817 1 14 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.826 0.559 18093 9818 1 14 . 1 1 90 90 PHE H H 90 7.956 7.956 7.588 0.368 18093 9819 1 14 . 1 1 91 91 VAL N N 91 116.565 116.565 119.031 -2.466 18093 9820 1 14 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.716 0.119 18093 9821 1 14 . 1 1 91 91 VAL C C 91 176.927 176.927 177.424 -0.497 18093 9822 1 14 . 1 1 91 91 VAL CA C 91 65.347 65.347 66.041 -0.694 18093 9823 1 14 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.997 -0.130 18093 9824 1 14 . 1 1 91 91 VAL H H 91 8.239 8.239 7.665 0.574 18093 9825 1 14 . 1 1 92 92 LEU N N 92 117.443 117.443 118.274 -0.831 18093 9826 1 14 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.192 0.002 18093 9827 1 14 . 1 1 92 92 LEU C C 92 177.180 177.180 178.393 -1.213 18093 9828 1 14 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.923 -0.739 18093 9829 1 14 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.303 -0.359 18093 9830 1 14 . 1 1 92 92 LEU H H 92 7.967 7.967 7.724 0.243 18093 9831 1 14 . 1 1 93 93 ASN N N 93 116.705 116.705 116.488 0.217 18093 9832 1 14 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.578 0.069 18093 9833 1 14 . 1 1 93 93 ASN C C 93 175.129 175.129 175.983 -0.854 18093 9834 1 14 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.188 -1.334 18093 9835 1 14 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.546 -0.151 18093 9836 1 14 . 1 1 93 93 ASN H H 93 7.683 7.683 7.774 -0.091 18093 9837 1 14 . 1 1 94 94 VAL N N 94 118.224 118.224 118.144 0.080 18093 9838 1 14 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.931 0.030 18093 9839 1 14 . 1 1 94 94 VAL C C 94 175.600 175.600 174.402 1.198 18093 9840 1 14 . 1 1 94 94 VAL CA C 94 62.825 62.825 63.769 -0.944 18093 9841 1 14 . 1 1 94 94 VAL CB C 94 32.214 32.214 31.667 0.547 18093 9842 1 14 . 1 1 94 94 VAL H H 94 7.627 7.627 7.901 -0.274 18093 9843 1 14 . 1 1 95 95 HIS N N 95 120.999 120.999 124.915 -3.916 18093 9844 1 14 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.746 -0.153 18093 9845 1 14 . 1 1 95 95 HIS C C 95 174.146 174.146 173.329 0.817 18093 9846 1 14 . 1 1 95 95 HIS CA C 95 55.666 55.666 55.715 -0.049 18093 9847 1 14 . 1 1 95 95 HIS CB C 95 29.736 29.736 30.390 -0.654 18093 9848 1 14 . 1 1 95 95 HIS H H 95 8.263 8.263 8.700 -0.437 18093 9849 1 14 . 1 1 96 96 HIS N N 96 122.740 122.740 118.892 3.848 18093 9850 1 14 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.882 -0.249 18093 9851 1 14 . 1 1 96 96 HIS CA C 96 55.895 55.895 55.974 -0.079 18093 9852 1 14 . 1 1 96 96 HIS CB C 96 29.750 29.750 31.452 -1.702 18093 9853 1 14 . 1 1 96 96 HIS H H 96 8.298 8.298 8.099 0.199 18093 9854 1 14 . 1 1 97 97 ARG N N 97 118.503 118.503 122.374 -3.871 18093 9855 1 14 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.623 -0.311 18093 9856 1 14 . 1 1 97 97 ARG C C 97 175.776 175.776 175.354 0.422 18093 9857 1 14 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.982 0.243 18093 9858 1 14 . 1 1 97 97 ARG CB C 97 30.912 30.912 29.993 0.919 18093 9859 1 14 . 1 1 97 97 ARG H H 97 8.250 8.250 8.816 -0.566 18093 9860 1 14 . 1 1 98 98 SER N N 98 118.482 118.482 118.293 0.189 18093 9861 1 14 . 1 1 98 98 SER HA H 98 4.722 4.722 4.975 -0.253 18093 9862 1 14 . 1 1 98 98 SER CA C 98 56.547 56.547 56.602 -0.055 18093 9863 1 14 . 1 1 98 98 SER CB C 98 63.624 63.624 63.940 -0.315 18093 9864 1 14 . 1 1 98 98 SER H H 98 8.254 8.254 8.176 0.078 18093 9865 1 14 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.302 0.101 18093 9866 1 14 . 1 1 99 99 PRO C C 99 176.899 176.899 176.770 0.129 18093 9867 1 14 . 1 1 99 99 PRO CA C 99 63.701 63.701 63.701 0.000 18093 9868 1 14 . 1 1 99 99 PRO CB C 99 31.949 31.949 31.807 0.142 18093 9869 1 14 . 1 1 100 100 GLU N N 100 120.187 120.187 119.046 1.141 18093 9870 1 14 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.072 0.216 18093 9871 1 14 . 1 1 100 100 GLU C C 100 176.593 176.593 175.485 1.108 18093 9872 1 14 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.563 0.159 18093 9873 1 14 . 1 1 100 100 GLU CB C 100 29.999 29.999 28.945 1.054 18093 9874 1 14 . 1 1 100 100 GLU H H 100 8.401 8.401 8.659 -0.258 18093 9875 1 14 . 1 1 101 101 THR N N 101 113.968 113.968 107.580 6.388 18093 9876 1 14 . 1 1 101 101 THR HA H 101 4.286 4.286 4.076 0.210 18093 9877 1 14 . 1 1 101 101 THR C C 101 174.525 174.525 173.924 0.601 18093 9878 1 14 . 1 1 101 101 THR CA C 101 61.956 61.956 62.827 -0.870 18093 9879 1 14 . 1 1 101 101 THR CB C 101 69.697 69.697 68.740 0.957 18093 9880 1 14 . 1 1 101 101 THR H H 101 7.945 7.945 7.646 0.299 18093 9881 1 14 . 1 1 102 102 HIS N N 102 120.322 120.322 119.641 0.681 18093 9882 1 14 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.614 0.127 18093 9883 1 14 . 1 1 102 102 HIS C C 102 174.783 174.783 175.748 -0.965 18093 9884 1 14 . 1 1 102 102 HIS CA C 102 55.701 55.701 57.693 -1.992 18093 9885 1 14 . 1 1 102 102 HIS CB C 102 29.093 29.093 30.329 -1.236 18093 9886 1 14 . 1 1 102 102 HIS H H 102 8.455 8.455 8.506 -0.051 18093 9887 1 14 . 1 1 103 103 THR N N 103 114.282 114.282 113.572 0.710 18093 9888 1 14 . 1 1 103 103 THR HA H 103 4.352 4.352 4.527 -0.175 18093 9889 1 14 . 1 1 103 103 THR C C 103 175.104 175.104 174.389 0.715 18093 9890 1 14 . 1 1 103 103 THR CA C 103 62.057 62.057 61.726 0.331 18093 9891 1 14 . 1 1 103 103 THR CB C 103 69.966 69.966 68.907 1.059 18093 9892 1 14 . 1 1 103 103 THR H H 103 8.069 8.069 7.897 0.172 18093 9893 1 14 . 1 1 104 104 GLY N N 104 111.159 111.159 111.280 -0.121 18093 9894 1 14 . 1 1 104 104 GLY C C 104 174.776 174.776 173.088 1.688 18093 9895 1 14 . 1 1 104 104 GLY CA C 104 45.588 45.588 45.591 -0.003 18093 9896 1 14 . 1 1 104 104 GLY H H 104 8.393 8.393 8.228 0.165 18093 9897 1 14 . 1 1 105 105 GLY N N 105 108.657 108.657 108.430 0.227 18093 9898 1 14 . 1 1 105 105 GLY C C 105 174.957 174.957 175.112 -0.155 18093 9899 1 14 . 1 1 105 105 GLY CA C 105 45.612 45.612 44.504 1.108 18093 9900 1 14 . 1 1 105 105 GLY H H 105 8.275 8.275 8.468 -0.193 18093 9901 1 14 . 1 1 106 106 GLY N N 106 108.870 108.870 109.853 -0.983 18093 9902 1 14 . 1 1 106 106 GLY C C 106 174.877 174.877 173.693 1.184 18093 9903 1 14 . 1 1 106 106 GLY CA C 106 45.665 45.665 44.737 0.928 18093 9904 1 14 . 1 1 106 106 GLY H H 106 8.357 8.357 8.298 0.059 18093 9905 1 14 . 1 1 107 107 GLY N N 107 108.476 108.476 107.090 1.386 18093 9906 1 14 . 1 1 107 107 GLY C C 107 174.877 174.877 174.159 0.718 18093 9907 1 14 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.092 0.604 18093 9908 1 14 . 1 1 107 107 GLY H H 107 8.330 8.330 8.272 0.058 18093 9909 1 14 . 1 1 108 108 GLY N N 108 108.486 108.486 108.769 -0.283 18093 9910 1 14 . 1 1 108 108 GLY C C 108 175.345 175.345 175.395 -0.050 18093 9911 1 14 . 1 1 108 108 GLY CA C 108 45.763 45.763 44.760 1.003 18093 9912 1 14 . 1 1 108 108 GLY H H 108 8.328 8.328 8.209 0.119 18093 9913 1 14 . 1 1 109 109 ILE N N 109 120.433 120.433 119.886 0.547 18093 9914 1 14 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.982 -0.014 18093 9915 1 14 . 1 1 109 109 ILE C C 109 176.127 176.127 177.021 -0.894 18093 9916 1 14 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.297 -0.562 18093 9917 1 14 . 1 1 109 109 ILE CB C 109 38.125 38.125 38.168 -0.043 18093 9918 1 14 . 1 1 109 109 ILE H H 109 8.192 8.192 8.177 0.015 18093 9919 1 14 . 1 1 110 110 ASP N N 110 121.148 121.148 120.837 0.311 18093 9920 1 14 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.693 -0.387 18093 9921 1 14 . 1 1 110 110 ASP C C 110 177.651 177.651 178.196 -0.545 18093 9922 1 14 . 1 1 110 110 ASP CA C 110 56.776 56.776 57.736 -0.960 18093 9923 1 14 . 1 1 110 110 ASP CB C 110 41.097 41.097 39.957 1.140 18093 9924 1 14 . 1 1 110 110 ASP H H 110 8.427 8.427 8.581 -0.154 18093 9925 1 14 . 1 1 111 111 ARG N N 111 119.228 119.228 119.746 -0.518 18093 9926 1 14 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.235 -0.239 18093 9927 1 14 . 1 1 111 111 ARG C C 111 177.786 177.786 178.929 -1.143 18093 9928 1 14 . 1 1 111 111 ARG CA C 111 58.942 58.942 58.999 -0.057 18093 9929 1 14 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.905 0.291 18093 9930 1 14 . 1 1 111 111 ARG H H 111 7.850 7.850 8.519 -0.669 18093 9931 1 14 . 1 1 112 112 ILE N N 112 118.000 118.000 119.697 -1.697 18093 9932 1 14 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.121 -0.308 18093 9933 1 14 . 1 1 112 112 ILE C C 112 177.496 177.496 177.978 -0.482 18093 9934 1 14 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.267 2.545 18093 9935 1 14 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.938 0.789 18093 9936 1 14 . 1 1 112 112 ILE H H 112 7.764 7.764 7.784 -0.020 18093 9937 1 14 . 1 1 113 113 PHE N N 113 118.367 118.367 122.139 -3.772 18093 9938 1 14 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.286 -0.031 18093 9939 1 14 . 1 1 113 113 PHE C C 113 177.218 177.218 177.430 -0.212 18093 9940 1 14 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.410 -0.977 18093 9941 1 14 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.224 -0.417 18093 9942 1 14 . 1 1 113 113 PHE H H 113 7.963 7.963 8.009 -0.046 18093 9943 1 14 . 1 1 114 114 LEU N N 114 118.921 118.921 117.612 1.309 18093 9944 1 14 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.989 0.008 18093 9945 1 14 . 1 1 114 114 LEU C C 114 178.297 178.297 178.314 -0.017 18093 9946 1 14 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.296 0.315 18093 9947 1 14 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.191 0.761 18093 9948 1 14 . 1 1 114 114 LEU H H 114 7.939 7.939 8.083 -0.144 18093 9949 1 14 . 1 1 115 115 TRP N N 115 117.464 117.464 119.488 -2.024 18093 9950 1 14 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.387 -0.013 18093 9951 1 14 . 1 1 115 115 TRP C C 115 178.572 178.572 178.268 0.304 18093 9952 1 14 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.806 1.116 18093 9953 1 14 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.780 -1.273 18093 9954 1 14 . 1 1 115 115 TRP H H 115 7.969 7.969 7.634 0.335 18093 9955 1 14 . 1 1 116 116 MET N N 116 117.069 117.069 118.922 -1.853 18093 9956 1 14 . 1 1 116 116 MET HA H 116 4.065 4.065 4.235 -0.170 18093 9957 1 14 . 1 1 116 116 MET C C 116 177.425 177.425 178.208 -0.783 18093 9958 1 14 . 1 1 116 116 MET CA C 116 59.289 59.289 59.098 0.191 18093 9959 1 14 . 1 1 116 116 MET CB C 116 31.692 31.692 32.549 -0.857 18093 9960 1 14 . 1 1 116 116 MET H H 116 8.465 8.465 7.736 0.729 18093 9961 1 14 . 1 1 117 117 PHE N N 117 118.755 118.755 117.776 0.979 18093 9962 1 14 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.144 -0.045 18093 9963 1 14 . 1 1 117 117 PHE C C 117 177.965 177.965 178.270 -0.305 18093 9964 1 14 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.361 -0.653 18093 9965 1 14 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.217 0.969 18093 9966 1 14 . 1 1 117 117 PHE H H 117 8.418 8.418 7.846 0.572 18093 9967 1 14 . 1 1 118 118 ILE N N 118 119.133 119.133 115.414 3.719 18093 9968 1 14 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.914 -0.570 18093 9969 1 14 . 1 1 118 118 ILE C C 118 177.244 177.244 177.615 -0.371 18093 9970 1 14 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.331 1.494 18093 9971 1 14 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.789 -0.241 18093 9972 1 14 . 1 1 118 118 ILE H H 118 8.266 8.266 7.739 0.527 18093 9973 1 14 . 1 1 119 119 ILE N N 119 118.846 118.846 121.479 -2.633 18093 9974 1 14 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.896 -0.324 18093 9975 1 14 . 1 1 119 119 ILE C C 119 177.523 177.523 177.580 -0.057 18093 9976 1 14 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.175 0.714 18093 9977 1 14 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.279 -0.715 18093 9978 1 14 . 1 1 119 119 ILE H H 119 8.308 8.308 7.306 1.002 18093 9979 1 14 . 1 1 120 120 VAL N N 120 119.228 119.228 117.277 1.951 18093 9980 1 14 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.770 -0.262 18093 9981 1 14 . 1 1 120 120 VAL C C 120 177.651 177.651 177.447 0.204 18093 9982 1 14 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.802 1.799 18093 9983 1 14 . 1 1 120 120 VAL CB C 120 31.406 31.406 31.333 0.073 18093 9984 1 14 . 1 1 120 120 VAL H H 120 8.399 8.399 7.916 0.483 18093 9985 1 14 . 1 1 121 121 CYS N N 121 117.151 117.151 119.149 -1.998 18093 9986 1 14 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.057 -0.154 18093 9987 1 14 . 1 1 121 121 CYS C C 121 177.719 177.719 176.625 1.094 18093 9988 1 14 . 1 1 121 121 CYS CA C 121 64.298 64.298 63.901 0.397 18093 9989 1 14 . 1 1 121 121 CYS CB C 121 26.677 26.677 27.514 -0.837 18093 9990 1 14 . 1 1 121 121 CYS H H 121 8.008 8.008 7.559 0.449 18093 9991 1 14 . 1 1 122 122 LEU N N 122 121.402 121.402 119.857 1.545 18093 9992 1 14 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.165 -0.182 18093 9993 1 14 . 1 1 122 122 LEU C C 122 178.282 178.282 178.801 -0.519 18093 9994 1 14 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.980 0.565 18093 9995 1 14 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.370 0.596 18093 9996 1 14 . 1 1 122 122 LEU H H 122 8.417 8.417 7.603 0.814 18093 9997 1 14 . 1 1 123 123 LEU N N 123 118.543 118.543 119.951 -1.408 18093 9998 1 14 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.016 -0.096 18093 9999 1 14 . 1 1 123 123 LEU C C 123 179.028 179.028 178.758 0.270 18093 10000 1 14 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.557 -0.440 18093 10001 1 14 . 1 1 123 123 LEU CB C 123 42.056 42.056 40.944 1.111 18093 10002 1 14 . 1 1 123 123 LEU H H 123 8.590 8.590 7.758 0.832 18093 10003 1 14 . 1 1 124 124 GLY N N 124 104.896 104.896 105.164 -0.268 18093 10004 1 14 . 1 1 124 124 GLY C C 124 173.932 173.932 176.160 -2.228 18093 10005 1 14 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.456 -0.229 18093 10006 1 14 . 1 1 124 124 GLY H H 124 8.601 8.601 8.334 0.267 18093 10007 1 14 . 1 1 125 125 THR N N 125 115.403 115.403 118.687 -3.284 18093 10008 1 14 . 1 1 125 125 THR HA H 125 3.686 3.686 3.834 -0.148 18093 10009 1 14 . 1 1 125 125 THR C C 125 176.407 176.407 176.434 -0.027 18093 10010 1 14 . 1 1 125 125 THR CA C 125 67.565 67.565 67.017 0.548 18093 10011 1 14 . 1 1 125 125 THR CB C 125 68.143 68.143 68.655 -0.512 18093 10012 1 14 . 1 1 125 125 THR H H 125 7.734 7.734 7.394 0.340 18093 10013 1 14 . 1 1 126 126 VAL N N 126 119.056 119.056 121.211 -2.155 18093 10014 1 14 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.835 -0.296 18093 10015 1 14 . 1 1 126 126 VAL C C 126 177.628 177.628 178.415 -0.787 18093 10016 1 14 . 1 1 126 126 VAL CA C 126 66.601 66.601 67.090 -0.489 18093 10017 1 14 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.382 0.112 18093 10018 1 14 . 1 1 126 126 VAL H H 126 8.015 8.015 8.317 -0.302 18093 10019 1 14 . 1 1 127 127 GLY N N 127 104.644 104.644 107.227 -2.583 18093 10020 1 14 . 1 1 127 127 GLY C C 127 173.933 173.933 176.083 -2.150 18093 10021 1 14 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.152 0.129 18093 10022 1 14 . 1 1 127 127 GLY H H 127 8.248 8.248 8.576 -0.328 18093 10023 1 14 . 1 1 128 128 LEU N N 128 117.354 117.354 120.794 -3.440 18093 10024 1 14 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.066 -0.054 18093 10025 1 14 . 1 1 128 128 LEU C C 128 177.443 177.443 177.726 -0.283 18093 10026 1 14 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.556 0.070 18093 10027 1 14 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.596 0.663 18093 10028 1 14 . 1 1 128 128 LEU H H 128 7.568 7.568 7.698 -0.130 18093 10029 1 14 . 1 1 129 129 PHE N N 129 113.971 113.971 115.251 -1.280 18093 10030 1 14 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.240 0.218 18093 10031 1 14 . 1 1 129 129 PHE C C 129 176.216 176.216 175.682 0.534 18093 10032 1 14 . 1 1 129 129 PHE CA C 129 58.385 58.385 59.605 -1.220 18093 10033 1 14 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.431 0.289 18093 10034 1 14 . 1 1 129 129 PHE H H 129 7.639 7.639 7.306 0.333 18093 10035 1 14 . 1 1 130 130 LEU N N 130 117.752 117.752 116.621 1.131 18093 10036 1 14 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.143 0.290 18093 10037 1 14 . 1 1 130 130 LEU CA C 130 54.156 54.156 54.132 0.024 18093 10038 1 14 . 1 1 130 130 LEU H H 130 8.099 8.099 7.347 0.752 18093 10039 1 14 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.733 -0.283 18093 10040 1 14 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.460 2.439 18093 10041 1 14 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.387 -0.125 18093 10042 1 14 . 1 1 132 132 PRO C C 132 177.616 177.616 178.161 -0.545 18093 10043 1 14 . 1 1 132 132 PRO CA C 132 64.980 64.980 64.888 0.092 18093 10044 1 14 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.238 -0.613 18093 10045 1 14 . 1 1 133 133 TRP N N 133 115.508 115.508 119.842 -4.334 18093 10046 1 14 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.508 0.084 18093 10047 1 14 . 1 1 133 133 TRP C C 133 176.842 176.842 176.582 0.260 18093 10048 1 14 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.516 -2.233 18093 10049 1 14 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.436 -0.840 18093 10050 1 14 . 1 1 133 133 TRP H H 133 7.311 7.311 7.967 -0.656 18093 10051 1 14 . 1 1 134 134 LEU N N 134 119.570 119.570 116.286 3.284 18093 10052 1 14 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.390 -0.213 18093 10053 1 14 . 1 1 134 134 LEU C C 134 175.768 175.768 176.923 -1.155 18093 10054 1 14 . 1 1 134 134 LEU CA C 134 55.621 55.621 54.385 1.236 18093 10055 1 14 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.552 1.096 18093 10056 1 14 . 1 1 134 134 LEU H H 134 7.453 7.453 7.820 -0.367 18093 10057 1 14 . 1 1 135 135 ALA N N 135 119.004 119.004 121.640 -2.636 18093 10058 1 14 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.295 -0.072 18093 10059 1 14 . 1 1 135 135 ALA C C 135 177.170 177.170 178.240 -1.070 18093 10060 1 14 . 1 1 135 135 ALA CA C 135 52.456 52.456 53.645 -1.189 18093 10061 1 14 . 1 1 135 135 ALA CB C 135 19.736 19.736 19.901 -0.164 18093 10062 1 14 . 1 1 135 135 ALA H H 135 7.541 7.541 7.382 0.159 18093 10063 1 14 . 1 1 136 136 GLY N N 136 105.879 105.879 105.282 0.597 18093 10064 1 14 . 1 1 136 136 GLY C C 136 173.042 173.042 174.044 -1.002 18093 10065 1 14 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.039 0.654 18093 10066 1 14 . 1 1 136 136 GLY H H 136 7.846 7.846 8.036 -0.190 18093 10067 1 15 . 1 1 5 5 GLU N N 5 119.627 119.627 120.207 -0.580 18093 10068 1 15 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.435 -0.227 18093 10069 1 15 . 1 1 5 5 GLU C C 5 176.581 176.581 175.135 1.446 18093 10070 1 15 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.381 0.664 18093 10071 1 15 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.949 0.089 18093 10072 1 15 . 1 1 5 5 GLU H H 5 8.003 8.003 8.257 -0.254 18093 10073 1 15 . 1 1 6 6 LEU N N 6 121.267 121.267 122.174 -0.907 18093 10074 1 15 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.696 -0.271 18093 10075 1 15 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.439 2.196 18093 10076 1 15 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.801 -0.505 18093 10077 1 15 . 1 1 6 6 LEU H H 6 8.104 8.104 7.898 0.206 18093 10078 1 15 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.579 -0.180 18093 10079 1 15 . 1 1 7 7 PRO C C 7 178.408 178.408 177.985 0.423 18093 10080 1 15 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.087 2.625 18093 10081 1 15 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.853 -0.936 18093 10082 1 15 . 1 1 8 8 LEU N N 8 121.835 121.835 121.015 0.820 18093 10083 1 15 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.111 -0.022 18093 10084 1 15 . 1 1 8 8 LEU C C 8 177.902 177.902 178.337 -0.435 18093 10085 1 15 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.646 0.459 18093 10086 1 15 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.187 0.420 18093 10087 1 15 . 1 1 8 8 LEU H H 8 8.162 8.162 8.580 -0.418 18093 10088 1 15 . 1 1 9 9 PHE N N 9 118.342 118.342 119.111 -0.769 18093 10089 1 15 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.162 0.027 18093 10090 1 15 . 1 1 9 9 PHE C C 9 177.596 177.596 177.112 0.484 18093 10091 1 15 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.133 -0.019 18093 10092 1 15 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.195 0.532 18093 10093 1 15 . 1 1 9 9 PHE H H 9 8.318 8.318 8.206 0.112 18093 10094 1 15 . 1 1 10 10 TYR N N 10 117.584 117.584 118.857 -1.273 18093 10095 1 15 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.787 0.367 18093 10096 1 15 . 1 1 10 10 TYR C C 10 177.630 177.630 177.266 0.364 18093 10097 1 15 . 1 1 10 10 TYR CA C 10 61.036 61.036 59.768 1.268 18093 10098 1 15 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.102 0.558 18093 10099 1 15 . 1 1 10 10 TYR H H 10 8.105 8.105 8.393 -0.288 18093 10100 1 15 . 1 1 11 11 THR N N 11 115.563 115.563 116.518 -0.955 18093 10101 1 15 . 1 1 11 11 THR HA H 11 3.871 3.871 3.826 0.045 18093 10102 1 15 . 1 1 11 11 THR C C 11 175.955 175.955 176.517 -0.562 18093 10103 1 15 . 1 1 11 11 THR CA C 11 67.290 67.290 66.530 0.760 18093 10104 1 15 . 1 1 11 11 THR CB C 11 68.201 68.201 68.639 -0.438 18093 10105 1 15 . 1 1 11 11 THR H H 11 7.915 7.915 7.632 0.283 18093 10106 1 15 . 1 1 12 12 ILE N N 12 119.727 119.727 119.893 -0.166 18093 10107 1 15 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.887 -0.188 18093 10108 1 15 . 1 1 12 12 ILE C C 12 175.773 175.773 177.282 -1.509 18093 10109 1 15 . 1 1 12 12 ILE CA C 12 64.699 64.699 62.441 2.258 18093 10110 1 15 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.896 1.200 18093 10111 1 15 . 1 1 12 12 ILE H H 12 8.186 8.186 7.863 0.323 18093 10112 1 15 . 1 1 13 13 ASN N N 13 114.190 114.190 118.446 -4.256 18093 10113 1 15 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.545 -0.123 18093 10114 1 15 . 1 1 13 13 ASN C C 13 174.786 174.786 176.595 -1.809 18093 10115 1 15 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.382 0.173 18093 10116 1 15 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.756 0.602 18093 10117 1 15 . 1 1 13 13 ASN H H 13 7.601 7.601 7.339 0.262 18093 10118 1 15 . 1 1 14 14 LEU N N 14 115.031 115.031 118.799 -3.768 18093 10119 1 15 . 1 1 14 14 LEU HA H 14 4.196 4.196 3.970 0.226 18093 10120 1 15 . 1 1 14 14 LEU C C 14 177.540 177.540 177.917 -0.377 18093 10121 1 15 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.333 0.074 18093 10122 1 15 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.166 -0.324 18093 10123 1 15 . 1 1 14 14 LEU H H 14 7.390 7.390 7.292 0.098 18093 10124 1 15 . 1 1 15 15 ILE N N 15 118.223 118.223 120.502 -2.279 18093 10125 1 15 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.721 -0.108 18093 10126 1 15 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.510 3.210 18093 10127 1 15 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.240 -0.628 18093 10128 1 15 . 1 1 15 15 ILE H H 15 8.123 8.123 7.358 0.765 18093 10129 1 15 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.284 -0.215 18093 10130 1 15 . 1 1 17 17 PRO C C 17 177.721 177.721 178.511 -0.790 18093 10131 1 15 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.530 1.231 18093 10132 1 15 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.771 -0.029 18093 10133 1 15 . 1 1 18 18 CYS N N 18 113.538 113.538 117.289 -3.751 18093 10134 1 15 . 1 1 18 18 CYS HA H 18 4.008 4.008 3.976 0.032 18093 10135 1 15 . 1 1 18 18 CYS C C 18 177.683 177.683 176.964 0.719 18093 10136 1 15 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.728 0.772 18093 10137 1 15 . 1 1 18 18 CYS CB C 18 26.873 26.873 27.523 -0.650 18093 10138 1 15 . 1 1 18 18 CYS H H 18 7.410 7.410 7.335 0.075 18093 10139 1 15 . 1 1 19 19 LEU N N 19 122.545 122.545 119.055 3.490 18093 10140 1 15 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.145 -0.146 18093 10141 1 15 . 1 1 19 19 LEU C C 19 178.608 178.608 178.715 -0.107 18093 10142 1 15 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.262 1.159 18093 10143 1 15 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.343 0.501 18093 10144 1 15 . 1 1 19 19 LEU H H 19 8.635 8.635 7.448 1.187 18093 10145 1 15 . 1 1 20 20 LEU N N 20 119.404 119.404 121.008 -1.604 18093 10146 1 15 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.949 0.057 18093 10147 1 15 . 1 1 20 20 LEU C C 20 178.540 178.540 179.187 -0.647 18093 10148 1 15 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.684 0.116 18093 10149 1 15 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.827 0.172 18093 10150 1 15 . 1 1 20 20 LEU H H 20 8.392 8.392 7.544 0.848 18093 10151 1 15 . 1 1 21 21 ILE N N 21 117.335 117.335 114.548 2.787 18093 10152 1 15 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.813 -0.162 18093 10153 1 15 . 1 1 21 21 ILE C C 21 177.249 177.249 177.711 -0.462 18093 10154 1 15 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.952 0.309 18093 10155 1 15 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.278 0.682 18093 10156 1 15 . 1 1 21 21 ILE H H 21 8.403 8.403 8.456 -0.053 18093 10157 1 15 . 1 1 22 22 SER N N 22 116.385 116.385 118.405 -2.020 18093 10158 1 15 . 1 1 22 22 SER HA H 22 4.056 4.056 4.268 -0.212 18093 10159 1 15 . 1 1 22 22 SER C C 22 176.813 176.813 176.720 0.093 18093 10160 1 15 . 1 1 22 22 SER CA C 22 63.866 63.866 62.196 1.670 18093 10161 1 15 . 1 1 22 22 SER CB C 22 62.898 62.898 62.631 0.267 18093 10162 1 15 . 1 1 22 22 SER H H 22 8.271 8.271 7.565 0.706 18093 10163 1 15 . 1 1 23 23 CYS N N 23 119.001 119.001 120.580 -1.579 18093 10164 1 15 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.111 -0.121 18093 10165 1 15 . 1 1 23 23 CYS C C 23 177.594 177.594 176.498 1.096 18093 10166 1 15 . 1 1 23 23 CYS CA C 23 64.429 64.429 62.919 1.510 18093 10167 1 15 . 1 1 23 23 CYS CB C 23 26.940 26.940 26.815 0.125 18093 10168 1 15 . 1 1 23 23 CYS H H 23 8.161 8.161 8.620 -0.459 18093 10169 1 15 . 1 1 24 24 LEU N N 24 117.814 117.814 120.542 -2.728 18093 10170 1 15 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.814 0.163 18093 10171 1 15 . 1 1 24 24 LEU C C 24 177.944 177.944 178.205 -0.261 18093 10172 1 15 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.693 -0.406 18093 10173 1 15 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.951 -0.048 18093 10174 1 15 . 1 1 24 24 LEU H H 24 8.106 8.106 7.619 0.487 18093 10175 1 15 . 1 1 25 25 THR N N 25 115.670 115.670 114.743 0.927 18093 10176 1 15 . 1 1 25 25 THR HA H 25 3.687 3.687 3.950 -0.263 18093 10177 1 15 . 1 1 25 25 THR C C 25 175.845 175.845 176.848 -1.003 18093 10178 1 15 . 1 1 25 25 THR CA C 25 68.306 68.306 67.006 1.300 18093 10179 1 15 . 1 1 25 25 THR H H 25 7.924 7.924 7.528 0.396 18093 10180 1 15 . 1 1 26 26 VAL N N 26 118.809 118.809 121.355 -2.546 18093 10181 1 15 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.691 -0.176 18093 10182 1 15 . 1 1 26 26 VAL C C 26 177.530 177.530 177.596 -0.066 18093 10183 1 15 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.229 1.052 18093 10184 1 15 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.029 0.695 18093 10185 1 15 . 1 1 26 26 VAL H H 26 7.764 7.764 7.286 0.478 18093 10186 1 15 . 1 1 27 27 LEU N N 27 117.958 117.958 121.527 -3.569 18093 10187 1 15 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.016 0.020 18093 10188 1 15 . 1 1 27 27 LEU C C 27 178.163 178.163 179.588 -1.425 18093 10189 1 15 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.478 0.031 18093 10190 1 15 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.916 1.003 18093 10191 1 15 . 1 1 27 27 LEU H H 27 7.912 7.912 8.316 -0.404 18093 10192 1 15 . 1 1 28 28 VAL N N 28 114.472 114.472 117.794 -3.322 18093 10193 1 15 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.669 -0.134 18093 10194 1 15 . 1 1 28 28 VAL C C 28 176.871 176.871 178.642 -1.771 18093 10195 1 15 . 1 1 28 28 VAL CA C 28 65.977 65.977 66.461 -0.484 18093 10196 1 15 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.161 0.773 18093 10197 1 15 . 1 1 28 28 VAL H H 28 7.892 7.892 7.514 0.378 18093 10198 1 15 . 1 1 29 29 PHE N N 29 115.206 115.206 118.929 -3.723 18093 10199 1 15 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.105 0.098 18093 10200 1 15 . 1 1 29 29 PHE C C 29 176.614 176.614 177.710 -1.096 18093 10201 1 15 . 1 1 29 29 PHE CA C 29 60.964 60.964 61.835 -0.871 18093 10202 1 15 . 1 1 29 29 PHE CB C 29 39.752 39.752 38.933 0.819 18093 10203 1 15 . 1 1 29 29 PHE H H 29 7.748 7.748 7.573 0.175 18093 10204 1 15 . 1 1 30 30 TYR N N 30 115.975 115.975 117.948 -1.973 18093 10205 1 15 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.373 -0.051 18093 10206 1 15 . 1 1 30 30 TYR C C 30 175.553 175.553 175.510 0.043 18093 10207 1 15 . 1 1 30 30 TYR CA C 30 59.598 59.598 59.962 -0.363 18093 10208 1 15 . 1 1 30 30 TYR CB C 30 39.763 39.763 39.655 0.108 18093 10209 1 15 . 1 1 30 30 TYR H H 30 7.985 7.985 7.995 -0.010 18093 10210 1 15 . 1 1 31 31 LEU N N 31 120.780 120.780 121.311 -0.531 18093 10211 1 15 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.780 -0.353 18093 10212 1 15 . 1 1 31 31 LEU CA C 31 54.665 54.665 51.308 3.357 18093 10213 1 15 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.635 -1.247 18093 10214 1 15 . 1 1 31 31 LEU H H 31 7.643 7.643 7.682 -0.039 18093 10215 1 15 . 1 1 34 34 GLU C C 34 176.271 176.271 175.165 1.106 18093 10216 1 15 . 1 1 34 34 GLU CA C 34 57.590 57.590 57.593 -0.003 18093 10217 1 15 . 1 1 35 35 CYS N N 35 116.430 116.430 117.825 -1.395 18093 10218 1 15 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.558 -0.191 18093 10219 1 15 . 1 1 35 35 CYS C C 35 175.198 175.198 175.101 0.097 18093 10220 1 15 . 1 1 35 35 CYS CA C 35 60.293 60.293 58.961 1.332 18093 10221 1 15 . 1 1 35 35 CYS CB C 35 28.130 28.130 28.390 -0.260 18093 10222 1 15 . 1 1 35 35 CYS H H 35 7.970 7.970 8.466 -0.496 18093 10223 1 15 . 1 1 36 36 GLY N N 36 108.315 108.315 108.174 0.141 18093 10224 1 15 . 1 1 36 36 GLY C C 36 174.610 174.610 174.354 0.256 18093 10225 1 15 . 1 1 36 36 GLY CA C 36 46.004 46.004 44.849 1.155 18093 10226 1 15 . 1 1 36 36 GLY H H 36 8.120 8.120 7.842 0.278 18093 10227 1 15 . 1 1 37 37 GLU N N 37 121.347 121.347 121.467 -0.120 18093 10228 1 15 . 1 1 37 37 GLU HA H 37 4.047 4.047 3.935 0.112 18093 10229 1 15 . 1 1 37 37 GLU C C 37 177.338 177.338 177.692 -0.354 18093 10230 1 15 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.306 -0.799 18093 10231 1 15 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.637 -0.067 18093 10232 1 15 . 1 1 37 37 GLU H H 37 8.423 8.423 8.448 -0.025 18093 10233 1 15 . 1 1 38 38 LYS N N 38 123.788 123.788 118.843 4.945 18093 10234 1 15 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.188 0.008 18093 10235 1 15 . 1 1 38 38 LYS C C 38 177.976 177.976 179.102 -1.126 18093 10236 1 15 . 1 1 38 38 LYS CA C 38 58.273 58.273 58.963 -0.690 18093 10237 1 15 . 1 1 38 38 LYS CB C 38 31.649 31.649 31.770 -0.121 18093 10238 1 15 . 1 1 38 38 LYS H H 38 8.211 8.211 8.406 -0.195 18093 10239 1 15 . 1 1 39 39 ILE N N 39 115.675 115.675 120.144 -4.469 18093 10240 1 15 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.767 -0.159 18093 10241 1 15 . 1 1 39 39 ILE C C 39 177.204 177.204 178.020 -0.816 18093 10242 1 15 . 1 1 39 39 ILE CA C 39 65.501 65.501 65.272 0.229 18093 10243 1 15 . 1 1 39 39 ILE H H 39 7.933 7.933 7.330 0.603 18093 10244 1 15 . 1 1 40 40 THR N N 40 117.411 117.411 115.678 1.733 18093 10245 1 15 . 1 1 40 40 THR HA H 40 3.844 3.844 3.984 -0.140 18093 10246 1 15 . 1 1 40 40 THR C C 40 175.983 175.983 176.597 -0.614 18093 10247 1 15 . 1 1 40 40 THR CA C 40 67.360 67.360 66.280 1.080 18093 10248 1 15 . 1 1 40 40 THR H H 40 8.362 8.362 7.772 0.590 18093 10249 1 15 . 1 1 41 41 LEU N N 41 123.059 123.059 122.671 0.388 18093 10250 1 15 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.089 -0.073 18093 10251 1 15 . 1 1 41 41 LEU C C 41 178.914 178.914 177.863 1.051 18093 10252 1 15 . 1 1 41 41 LEU CA C 41 58.366 58.366 58.383 -0.016 18093 10253 1 15 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.884 0.166 18093 10254 1 15 . 1 1 41 41 LEU H H 41 8.282 8.282 7.547 0.735 18093 10255 1 15 . 1 1 42 42 CYS N N 42 118.762 118.762 117.821 0.941 18093 10256 1 15 . 1 1 42 42 CYS HA H 42 3.936 3.936 3.996 -0.060 18093 10257 1 15 . 1 1 42 42 CYS C C 42 176.607 176.607 176.750 -0.143 18093 10258 1 15 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.437 0.880 18093 10259 1 15 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.310 -0.391 18093 10260 1 15 . 1 1 42 42 CYS H H 42 8.195 8.195 7.696 0.499 18093 10261 1 15 . 1 1 43 43 ILE N N 43 117.589 117.589 120.393 -2.804 18093 10262 1 15 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.631 -0.024 18093 10263 1 15 . 1 1 43 43 ILE C C 43 177.323 177.323 177.736 -0.413 18093 10264 1 15 . 1 1 43 43 ILE CA C 43 65.249 65.249 65.168 0.080 18093 10265 1 15 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.588 0.450 18093 10266 1 15 . 1 1 43 43 ILE H H 43 8.428 8.428 7.616 0.812 18093 10267 1 15 . 1 1 44 44 SER N N 44 115.950 115.950 116.287 -0.337 18093 10268 1 15 . 1 1 44 44 SER HA H 44 4.012 4.012 4.107 -0.095 18093 10269 1 15 . 1 1 44 44 SER C C 44 176.965 176.965 176.575 0.390 18093 10270 1 15 . 1 1 44 44 SER CA C 44 63.575 63.575 62.719 0.856 18093 10271 1 15 . 1 1 44 44 SER H H 44 7.984 7.984 7.719 0.265 18093 10272 1 15 . 1 1 45 45 VAL N N 45 123.544 123.544 119.153 4.391 18093 10273 1 15 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.755 -0.207 18093 10274 1 15 . 1 1 45 45 VAL C C 45 177.139 177.139 177.591 -0.452 18093 10275 1 15 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.021 1.212 18093 10276 1 15 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.379 0.263 18093 10277 1 15 . 1 1 45 45 VAL H H 45 8.280 8.280 7.648 0.632 18093 10278 1 15 . 1 1 46 46 LEU N N 46 119.883 119.883 120.067 -0.184 18093 10279 1 15 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.101 -0.158 18093 10280 1 15 . 1 1 46 46 LEU C C 46 180.125 180.125 179.089 1.036 18093 10281 1 15 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.283 1.317 18093 10282 1 15 . 1 1 46 46 LEU CB C 46 42.012 42.012 40.533 1.479 18093 10283 1 15 . 1 1 46 46 LEU H H 46 8.117 8.117 7.428 0.689 18093 10284 1 15 . 1 1 47 47 LEU N N 47 120.193 120.193 120.756 -0.563 18093 10285 1 15 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.876 0.128 18093 10286 1 15 . 1 1 47 47 LEU C C 47 178.370 178.370 178.880 -0.510 18093 10287 1 15 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.771 -0.345 18093 10288 1 15 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.775 0.280 18093 10289 1 15 . 1 1 47 47 LEU H H 47 8.933 8.933 8.225 0.708 18093 10290 1 15 . 1 1 48 48 SER N N 48 115.861 115.861 114.082 1.779 18093 10291 1 15 . 1 1 48 48 SER HA H 48 4.013 4.013 4.251 -0.238 18093 10292 1 15 . 1 1 48 48 SER C C 48 175.642 175.642 176.766 -1.124 18093 10293 1 15 . 1 1 48 48 SER CA C 48 63.571 63.571 61.479 2.092 18093 10294 1 15 . 1 1 48 48 SER CB C 48 62.879 62.879 63.291 -0.412 18093 10295 1 15 . 1 1 48 48 SER H H 48 7.996 7.996 7.650 0.346 18093 10296 1 15 . 1 1 49 49 LEU N N 49 120.673 120.673 123.107 -2.434 18093 10297 1 15 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.282 -0.247 18093 10298 1 15 . 1 1 49 49 LEU C C 49 178.229 178.229 178.299 -0.070 18093 10299 1 15 . 1 1 49 49 LEU CA C 49 58.283 58.283 57.948 0.335 18093 10300 1 15 . 1 1 49 49 LEU CB C 49 41.946 41.946 41.974 -0.028 18093 10301 1 15 . 1 1 49 49 LEU H H 49 8.352 8.352 8.011 0.341 18093 10302 1 15 . 1 1 50 50 THR N N 50 115.582 115.582 115.199 0.383 18093 10303 1 15 . 1 1 50 50 THR HA H 50 3.672 3.672 3.994 -0.322 18093 10304 1 15 . 1 1 50 50 THR C C 50 175.877 175.877 176.446 -0.569 18093 10305 1 15 . 1 1 50 50 THR CA C 50 68.628 68.628 66.624 2.003 18093 10306 1 15 . 1 1 50 50 THR H H 50 7.937 7.937 8.149 -0.212 18093 10307 1 15 . 1 1 51 51 VAL N N 51 119.774 119.774 122.227 -2.453 18093 10308 1 15 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.816 -0.318 18093 10309 1 15 . 1 1 51 51 VAL C C 51 177.162 177.162 177.360 -0.198 18093 10310 1 15 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.460 1.125 18093 10311 1 15 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.695 -0.174 18093 10312 1 15 . 1 1 51 51 VAL H H 51 8.115 8.115 7.588 0.527 18093 10313 1 15 . 1 1 52 52 PHE N N 52 118.808 118.808 120.532 -1.724 18093 10314 1 15 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.340 -0.218 18093 10315 1 15 . 1 1 52 52 PHE C C 52 176.697 176.697 176.812 -0.115 18093 10316 1 15 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.387 1.384 18093 10317 1 15 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.185 0.077 18093 10318 1 15 . 1 1 52 52 PHE H H 52 8.256 8.256 8.328 -0.072 18093 10319 1 15 . 1 1 53 53 LEU N N 53 117.267 117.267 121.154 -3.887 18093 10320 1 15 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.530 0.363 18093 10321 1 15 . 1 1 53 53 LEU C C 53 179.319 179.319 177.866 1.453 18093 10322 1 15 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.785 0.200 18093 10323 1 15 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.352 0.475 18093 10324 1 15 . 1 1 53 53 LEU H H 53 8.443 8.443 7.714 0.729 18093 10325 1 15 . 1 1 54 54 LEU N N 54 119.762 119.762 118.933 0.829 18093 10326 1 15 . 1 1 54 54 LEU HA H 54 4.054 4.054 4.028 0.026 18093 10327 1 15 . 1 1 54 54 LEU C C 54 178.827 178.827 178.934 -0.107 18093 10328 1 15 . 1 1 54 54 LEU CA C 54 58.105 58.105 57.904 0.202 18093 10329 1 15 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.946 0.001 18093 10330 1 15 . 1 1 54 54 LEU H H 54 8.205 8.205 7.348 0.857 18093 10331 1 15 . 1 1 55 55 LEU N N 55 118.585 118.585 118.962 -0.377 18093 10332 1 15 . 1 1 55 55 LEU HA H 55 4.077 4.077 4.196 -0.119 18093 10333 1 15 . 1 1 55 55 LEU C C 55 178.909 178.909 178.804 0.105 18093 10334 1 15 . 1 1 55 55 LEU CA C 55 58.108 58.108 58.328 -0.220 18093 10335 1 15 . 1 1 55 55 LEU CB C 55 41.979 41.979 42.042 -0.063 18093 10336 1 15 . 1 1 55 55 LEU H H 55 8.179 8.179 7.544 0.635 18093 10337 1 15 . 1 1 56 56 ILE N N 56 116.079 116.079 116.215 -0.136 18093 10338 1 15 . 1 1 56 56 ILE HA H 56 3.729 3.729 4.015 -0.286 18093 10339 1 15 . 1 1 56 56 ILE C C 56 176.988 176.988 176.935 0.053 18093 10340 1 15 . 1 1 56 56 ILE CA C 56 64.257 64.257 62.883 1.374 18093 10341 1 15 . 1 1 56 56 ILE CB C 56 37.417 37.417 37.030 0.387 18093 10342 1 15 . 1 1 56 56 ILE H H 56 8.040 8.040 7.221 0.819 18093 10343 1 15 . 1 1 57 57 THR N N 57 110.105 110.105 109.103 1.002 18093 10344 1 15 . 1 1 57 57 THR HA H 57 4.015 4.015 4.202 -0.187 18093 10345 1 15 . 1 1 57 57 THR C C 57 175.435 175.435 175.927 -0.492 18093 10346 1 15 . 1 1 57 57 THR CA C 57 65.067 65.067 64.445 0.622 18093 10347 1 15 . 1 1 57 57 THR CB C 57 69.179 69.179 68.962 0.217 18093 10348 1 15 . 1 1 57 57 THR H H 57 7.655 7.655 7.204 0.451 18093 10349 1 15 . 1 1 58 58 GLU N N 58 117.313 117.313 121.282 -3.969 18093 10350 1 15 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.260 0.073 18093 10351 1 15 . 1 1 58 58 GLU C C 58 176.940 176.940 178.160 -1.220 18093 10352 1 15 . 1 1 58 58 GLU CA C 58 57.068 57.068 57.676 -0.608 18093 10353 1 15 . 1 1 58 58 GLU CB C 58 29.396 29.396 29.738 -0.341 18093 10354 1 15 . 1 1 58 58 GLU H H 58 7.521 7.521 8.408 -0.887 18093 10355 1 15 . 1 1 59 59 ILE N N 59 114.870 114.870 114.193 0.677 18093 10356 1 15 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.115 -0.026 18093 10357 1 15 . 1 1 59 59 ILE C C 59 175.456 175.456 176.039 -0.583 18093 10358 1 15 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.050 0.384 18093 10359 1 15 . 1 1 59 59 ILE CB C 59 38.657 38.657 39.133 -0.476 18093 10360 1 15 . 1 1 59 59 ILE H H 59 7.579 7.579 7.383 0.196 18093 10361 1 15 . 1 1 60 60 ILE N N 60 119.354 119.354 118.507 0.847 18093 10362 1 15 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.947 0.357 18093 10363 1 15 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.514 -1.897 18093 10364 1 15 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.529 2.333 18093 10365 1 15 . 1 1 60 60 ILE H H 60 7.629 7.629 7.560 0.069 18093 10366 1 15 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.373 0.027 18093 10367 1 15 . 1 1 61 61 PRO C C 61 177.144 177.144 177.261 -0.117 18093 10368 1 15 . 1 1 61 61 PRO CA C 61 63.808 63.808 64.160 -0.352 18093 10369 1 15 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.078 -0.196 18093 10370 1 15 . 1 1 62 62 SER N N 62 114.474 114.474 113.538 0.936 18093 10371 1 15 . 1 1 62 62 SER HA H 62 4.434 4.434 4.509 -0.075 18093 10372 1 15 . 1 1 62 62 SER C C 62 175.161 175.161 174.376 0.785 18093 10373 1 15 . 1 1 62 62 SER CA C 62 59.047 59.047 57.184 1.863 18093 10374 1 15 . 1 1 62 62 SER CB C 62 63.704 63.704 61.278 2.426 18093 10375 1 15 . 1 1 62 62 SER H H 62 8.186 8.186 8.030 0.156 18093 10376 1 15 . 1 1 63 63 THR N N 63 113.573 113.573 115.992 -2.419 18093 10377 1 15 . 1 1 63 63 THR HA H 63 4.319 4.319 4.372 -0.053 18093 10378 1 15 . 1 1 63 63 THR C C 63 174.834 174.834 173.705 1.129 18093 10379 1 15 . 1 1 63 63 THR CA C 63 62.377 62.377 62.616 -0.239 18093 10380 1 15 . 1 1 63 63 THR CB C 63 69.422 69.422 69.216 0.206 18093 10381 1 15 . 1 1 63 63 THR H H 63 7.963 7.963 7.783 0.180 18093 10382 1 15 . 1 1 64 64 SER N N 64 116.598 116.598 115.229 1.369 18093 10383 1 15 . 1 1 64 64 SER HA H 64 4.428 4.428 4.646 -0.218 18093 10384 1 15 . 1 1 64 64 SER C C 64 174.618 174.618 173.798 0.820 18093 10385 1 15 . 1 1 64 64 SER CA C 64 59.045 59.045 57.978 1.067 18093 10386 1 15 . 1 1 64 64 SER CB C 64 63.700 63.700 64.252 -0.552 18093 10387 1 15 . 1 1 64 64 SER H H 64 8.052 8.052 7.493 0.559 18093 10388 1 15 . 1 1 65 65 SER N N 65 116.673 116.673 117.836 -1.163 18093 10389 1 15 . 1 1 65 65 SER HA H 65 4.432 4.432 4.792 -0.360 18093 10390 1 15 . 1 1 65 65 SER C C 65 174.335 174.335 175.427 -1.092 18093 10391 1 15 . 1 1 65 65 SER CA C 65 58.927 58.927 57.735 1.192 18093 10392 1 15 . 1 1 65 65 SER CB C 65 63.621 63.621 63.167 0.454 18093 10393 1 15 . 1 1 65 65 SER H H 65 8.114 8.114 8.707 -0.593 18093 10394 1 15 . 1 1 66 66 VAL N N 66 119.054 119.054 116.558 2.496 18093 10395 1 15 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.095 0.075 18093 10396 1 15 . 1 1 66 66 VAL C C 66 175.278 175.278 176.151 -0.873 18093 10397 1 15 . 1 1 66 66 VAL CA C 66 62.062 62.062 63.462 -1.400 18093 10398 1 15 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.246 0.383 18093 10399 1 15 . 1 1 66 66 VAL H H 66 7.740 7.740 7.719 0.021 18093 10400 1 15 . 1 1 67 67 SER N N 67 118.882 118.882 114.557 4.325 18093 10401 1 15 . 1 1 67 67 SER HA H 67 4.704 4.704 4.770 -0.066 18093 10402 1 15 . 1 1 67 67 SER CA C 67 56.715 56.715 56.209 0.506 18093 10403 1 15 . 1 1 67 67 SER CB C 67 63.624 63.624 64.817 -1.193 18093 10404 1 15 . 1 1 67 67 SER H H 67 8.060 8.060 7.477 0.583 18093 10405 1 15 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.455 -0.055 18093 10406 1 15 . 1 1 68 68 PRO C C 68 176.925 176.925 176.632 0.293 18093 10407 1 15 . 1 1 68 68 PRO CA C 68 63.748 63.748 63.393 0.355 18093 10408 1 15 . 1 1 68 68 PRO CB C 68 32.005 32.005 31.989 0.016 18093 10409 1 15 . 1 1 69 69 SER N N 69 114.930 114.930 112.204 2.726 18093 10410 1 15 . 1 1 69 69 SER HA H 69 4.422 4.422 4.152 0.270 18093 10411 1 15 . 1 1 69 69 SER C C 69 175.617 175.617 175.792 -0.175 18093 10412 1 15 . 1 1 69 69 SER CA C 69 58.697 58.697 59.411 -0.714 18093 10413 1 15 . 1 1 69 69 SER CB C 69 63.804 63.804 63.880 -0.076 18093 10414 1 15 . 1 1 69 69 SER H H 69 8.205 8.205 7.829 0.376 18093 10415 1 15 . 1 1 70 70 ILE N N 70 120.840 120.840 122.015 -1.175 18093 10416 1 15 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.149 -0.157 18093 10417 1 15 . 1 1 70 70 ILE C C 70 177.524 177.524 176.828 0.696 18093 10418 1 15 . 1 1 70 70 ILE CA C 70 64.335 64.335 62.652 1.683 18093 10419 1 15 . 1 1 70 70 ILE CB C 70 37.460 37.460 37.784 -0.324 18093 10420 1 15 . 1 1 70 70 ILE H H 70 8.283 8.283 8.794 -0.511 18093 10421 1 15 . 1 1 71 71 GLY N N 71 107.823 107.823 108.227 -0.404 18093 10422 1 15 . 1 1 71 71 GLY C C 71 175.296 175.296 176.388 -1.092 18093 10423 1 15 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.352 0.103 18093 10424 1 15 . 1 1 71 71 GLY H H 71 8.557 8.557 8.821 -0.264 18093 10425 1 15 . 1 1 72 72 GLU N N 72 120.835 120.835 120.664 0.171 18093 10426 1 15 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.257 -0.410 18093 10427 1 15 . 1 1 72 72 GLU C C 72 178.198 178.198 178.398 -0.200 18093 10428 1 15 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.258 1.859 18093 10429 1 15 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.458 -0.065 18093 10430 1 15 . 1 1 72 72 GLU H H 72 7.922 7.922 7.829 0.093 18093 10431 1 15 . 1 1 73 73 TYR N N 73 117.375 117.375 122.136 -4.761 18093 10432 1 15 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.610 -0.448 18093 10433 1 15 . 1 1 73 73 TYR C C 73 179.912 179.912 177.672 2.240 18093 10434 1 15 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.408 0.747 18093 10435 1 15 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.774 -0.008 18093 10436 1 15 . 1 1 73 73 TYR H H 73 8.062 8.062 7.884 0.178 18093 10437 1 15 . 1 1 74 74 LEU N N 74 121.493 121.493 118.808 2.685 18093 10438 1 15 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.798 0.251 18093 10439 1 15 . 1 1 74 74 LEU C C 74 178.063 178.063 178.261 -0.198 18093 10440 1 15 . 1 1 74 74 LEU CA C 74 58.495 58.495 56.543 1.952 18093 10441 1 15 . 1 1 74 74 LEU CB C 74 41.847 41.847 42.061 -0.214 18093 10442 1 15 . 1 1 74 74 LEU H H 74 8.552 8.552 8.830 -0.278 18093 10443 1 15 . 1 1 75 75 LEU N N 75 120.375 120.375 122.297 -1.922 18093 10444 1 15 . 1 1 75 75 LEU HA H 75 4.040 4.040 3.983 0.057 18093 10445 1 15 . 1 1 75 75 LEU C C 75 178.515 178.515 177.648 0.867 18093 10446 1 15 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.454 0.184 18093 10447 1 15 . 1 1 75 75 LEU CB C 75 42.039 42.039 42.054 -0.015 18093 10448 1 15 . 1 1 75 75 LEU H H 75 8.276 8.276 7.575 0.701 18093 10449 1 15 . 1 1 76 76 PHE N N 76 116.626 116.626 115.895 0.731 18093 10450 1 15 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.267 -0.188 18093 10451 1 15 . 1 1 76 76 PHE C C 76 177.399 177.399 177.100 0.299 18093 10452 1 15 . 1 1 76 76 PHE CA C 76 61.734 61.734 60.102 1.631 18093 10453 1 15 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.047 0.694 18093 10454 1 15 . 1 1 76 76 PHE H H 76 8.454 8.454 7.958 0.496 18093 10455 1 15 . 1 1 77 77 THR N N 77 116.080 116.080 117.414 -1.334 18093 10456 1 15 . 1 1 77 77 THR HA H 77 3.687 3.687 3.058 0.629 18093 10457 1 15 . 1 1 77 77 THR C C 77 176.018 176.018 176.284 -0.266 18093 10458 1 15 . 1 1 77 77 THR CA C 77 68.640 68.640 66.472 2.168 18093 10459 1 15 . 1 1 77 77 THR H H 77 8.224 8.224 7.062 1.162 18093 10460 1 15 . 1 1 78 78 MET N N 78 119.394 119.394 120.191 -0.797 18093 10461 1 15 . 1 1 78 78 MET HA H 78 4.129 4.129 3.985 0.144 18093 10462 1 15 . 1 1 78 78 MET C C 78 179.608 179.608 178.852 0.756 18093 10463 1 15 . 1 1 78 78 MET CA C 78 58.831 58.831 59.572 -0.741 18093 10464 1 15 . 1 1 78 78 MET CB C 78 31.590 31.590 32.459 -0.869 18093 10465 1 15 . 1 1 78 78 MET H H 78 8.372 8.372 7.755 0.617 18093 10466 1 15 . 1 1 79 79 ILE N N 79 121.819 121.819 119.181 2.638 18093 10467 1 15 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.672 -0.122 18093 10468 1 15 . 1 1 79 79 ILE C C 79 176.426 176.426 177.553 -1.127 18093 10469 1 15 . 1 1 79 79 ILE CA C 79 65.876 65.876 64.829 1.048 18093 10470 1 15 . 1 1 79 79 ILE CB C 79 37.673 37.673 37.849 -0.176 18093 10471 1 15 . 1 1 79 79 ILE H H 79 8.391 8.391 7.406 0.985 18093 10472 1 15 . 1 1 80 80 PHE N N 80 119.916 119.916 120.755 -0.839 18093 10473 1 15 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.073 -0.020 18093 10474 1 15 . 1 1 80 80 PHE C C 80 178.568 178.568 177.223 1.345 18093 10475 1 15 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.072 0.235 18093 10476 1 15 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.543 -0.769 18093 10477 1 15 . 1 1 80 80 PHE H H 80 8.479 8.479 7.791 0.688 18093 10478 1 15 . 1 1 81 81 VAL N N 81 120.191 120.191 115.099 5.092 18093 10479 1 15 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.477 -0.024 18093 10480 1 15 . 1 1 81 81 VAL C C 81 178.225 178.225 177.559 0.666 18093 10481 1 15 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.338 1.070 18093 10482 1 15 . 1 1 81 81 VAL CB C 81 31.556 31.556 31.089 0.467 18093 10483 1 15 . 1 1 81 81 VAL H H 81 8.928 8.928 8.721 0.207 18093 10484 1 15 . 1 1 82 82 THR N N 82 115.930 115.930 117.671 -1.741 18093 10485 1 15 . 1 1 82 82 THR HA H 82 3.636 3.636 3.919 -0.283 18093 10486 1 15 . 1 1 82 82 THR C C 82 176.420 176.420 176.645 -0.225 18093 10487 1 15 . 1 1 82 82 THR CA C 82 68.570 68.570 66.795 1.775 18093 10488 1 15 . 1 1 82 82 THR CB C 82 68.202 68.202 68.699 -0.497 18093 10489 1 15 . 1 1 82 82 THR H H 82 7.969 7.969 7.326 0.643 18093 10490 1 15 . 1 1 83 83 LEU N N 83 119.780 119.780 120.491 -0.711 18093 10491 1 15 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.890 -0.043 18093 10492 1 15 . 1 1 83 83 LEU C C 83 178.214 178.214 178.624 -0.410 18093 10493 1 15 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.470 0.767 18093 10494 1 15 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.300 0.491 18093 10495 1 15 . 1 1 83 83 LEU H H 83 8.483 8.483 7.341 1.142 18093 10496 1 15 . 1 1 84 84 SER N N 84 114.559 114.559 115.720 -1.161 18093 10497 1 15 . 1 1 84 84 SER HA H 84 4.099 4.099 4.100 -0.001 18093 10498 1 15 . 1 1 84 84 SER C C 84 176.799 176.799 176.467 0.332 18093 10499 1 15 . 1 1 84 84 SER CA C 84 63.609 63.609 62.184 1.425 18093 10500 1 15 . 1 1 84 84 SER CB C 84 63.110 63.110 62.902 0.208 18093 10501 1 15 . 1 1 84 84 SER H H 84 8.023 8.023 7.537 0.486 18093 10502 1 15 . 1 1 85 85 ILE N N 85 123.962 123.962 121.211 2.751 18093 10503 1 15 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.838 -0.234 18093 10504 1 15 . 1 1 85 85 ILE C C 85 177.487 177.487 177.877 -0.390 18093 10505 1 15 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.131 0.628 18093 10506 1 15 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.875 0.012 18093 10507 1 15 . 1 1 85 85 ILE H H 85 8.054 8.054 7.911 0.143 18093 10508 1 15 . 1 1 86 86 VAL N N 86 118.744 118.744 120.784 -2.040 18093 10509 1 15 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.803 -0.284 18093 10510 1 15 . 1 1 86 86 VAL C C 86 177.557 177.557 177.904 -0.347 18093 10511 1 15 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.446 1.089 18093 10512 1 15 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.669 -0.203 18093 10513 1 15 . 1 1 86 86 VAL H H 86 8.158 8.158 7.267 0.891 18093 10514 1 15 . 1 1 87 87 ILE N N 87 117.206 117.206 119.545 -2.339 18093 10515 1 15 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.723 -0.119 18093 10516 1 15 . 1 1 87 87 ILE C C 87 177.283 177.283 178.464 -1.181 18093 10517 1 15 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.735 1.941 18093 10518 1 15 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.501 1.088 18093 10519 1 15 . 1 1 87 87 ILE H H 87 8.459 8.459 8.448 0.011 18093 10520 1 15 . 1 1 88 88 THR N N 88 116.158 116.158 116.753 -0.595 18093 10521 1 15 . 1 1 88 88 THR HA H 88 3.672 3.672 4.202 -0.529 18093 10522 1 15 . 1 1 88 88 THR C C 88 175.485 175.485 176.777 -1.292 18093 10523 1 15 . 1 1 88 88 THR CA C 88 68.549 68.549 67.472 1.077 18093 10524 1 15 . 1 1 88 88 THR CB C 88 68.127 68.127 68.948 -0.821 18093 10525 1 15 . 1 1 88 88 THR H H 88 7.776 7.776 8.353 -0.577 18093 10526 1 15 . 1 1 89 89 VAL N N 89 117.985 117.985 121.161 -3.176 18093 10527 1 15 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.871 -0.328 18093 10528 1 15 . 1 1 89 89 VAL C C 89 177.393 177.393 177.423 -0.030 18093 10529 1 15 . 1 1 89 89 VAL CA C 89 66.590 66.590 64.945 1.645 18093 10530 1 15 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.512 0.266 18093 10531 1 15 . 1 1 89 89 VAL H H 89 8.206 8.206 7.561 0.645 18093 10532 1 15 . 1 1 90 90 PHE N N 90 116.709 116.709 120.324 -3.615 18093 10533 1 15 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.237 0.141 18093 10534 1 15 . 1 1 90 90 PHE C C 90 177.305 177.305 177.837 -0.532 18093 10535 1 15 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.964 -0.845 18093 10536 1 15 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.568 0.817 18093 10537 1 15 . 1 1 90 90 PHE H H 90 7.956 7.956 7.811 0.145 18093 10538 1 15 . 1 1 91 91 VAL N N 91 116.565 116.565 118.912 -2.347 18093 10539 1 15 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.730 0.105 18093 10540 1 15 . 1 1 91 91 VAL C C 91 176.927 176.927 176.839 0.088 18093 10541 1 15 . 1 1 91 91 VAL CA C 91 65.347 65.347 65.886 -0.539 18093 10542 1 15 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.962 -0.095 18093 10543 1 15 . 1 1 91 91 VAL H H 91 8.239 8.239 7.577 0.662 18093 10544 1 15 . 1 1 92 92 LEU N N 92 117.443 117.443 116.953 0.490 18093 10545 1 15 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.291 -0.097 18093 10546 1 15 . 1 1 92 92 LEU C C 92 177.180 177.180 177.910 -0.730 18093 10547 1 15 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.012 0.172 18093 10548 1 15 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.447 -0.503 18093 10549 1 15 . 1 1 92 92 LEU H H 92 7.967 7.967 7.599 0.368 18093 10550 1 15 . 1 1 93 93 ASN N N 93 116.705 116.705 116.714 -0.009 18093 10551 1 15 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.548 0.099 18093 10552 1 15 . 1 1 93 93 ASN C C 93 175.129 175.129 175.722 -0.593 18093 10553 1 15 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.330 -1.476 18093 10554 1 15 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.364 0.031 18093 10555 1 15 . 1 1 93 93 ASN H H 93 7.683 7.683 7.826 -0.143 18093 10556 1 15 . 1 1 94 94 VAL N N 94 118.224 118.224 119.103 -0.879 18093 10557 1 15 . 1 1 94 94 VAL HA H 94 3.961 3.961 4.232 -0.271 18093 10558 1 15 . 1 1 94 94 VAL C C 94 175.600 175.600 174.390 1.210 18093 10559 1 15 . 1 1 94 94 VAL CA C 94 62.825 62.825 60.911 1.914 18093 10560 1 15 . 1 1 94 94 VAL CB C 94 32.214 32.214 33.482 -1.268 18093 10561 1 15 . 1 1 94 94 VAL H H 94 7.627 7.627 7.424 0.203 18093 10562 1 15 . 1 1 95 95 HIS N N 95 120.999 120.999 122.280 -1.281 18093 10563 1 15 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.936 -0.343 18093 10564 1 15 . 1 1 95 95 HIS C C 95 174.146 174.146 173.970 0.176 18093 10565 1 15 . 1 1 95 95 HIS CA C 95 55.666 55.666 55.227 0.439 18093 10566 1 15 . 1 1 95 95 HIS CB C 95 29.736 29.736 29.548 0.188 18093 10567 1 15 . 1 1 95 95 HIS H H 95 8.263 8.263 8.397 -0.134 18093 10568 1 15 . 1 1 96 96 HIS N N 96 122.740 122.740 119.530 3.210 18093 10569 1 15 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.494 0.139 18093 10570 1 15 . 1 1 96 96 HIS CA C 96 55.895 55.895 56.725 -0.830 18093 10571 1 15 . 1 1 96 96 HIS CB C 96 29.750 29.750 30.531 -0.781 18093 10572 1 15 . 1 1 96 96 HIS H H 96 8.298 8.298 7.976 0.322 18093 10573 1 15 . 1 1 97 97 ARG N N 97 118.503 118.503 121.278 -2.775 18093 10574 1 15 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.586 -0.274 18093 10575 1 15 . 1 1 97 97 ARG C C 97 175.776 175.776 174.940 0.836 18093 10576 1 15 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.393 0.832 18093 10577 1 15 . 1 1 97 97 ARG CB C 97 30.912 30.912 29.429 1.483 18093 10578 1 15 . 1 1 97 97 ARG H H 97 8.250 8.250 8.406 -0.156 18093 10579 1 15 . 1 1 98 98 SER N N 98 118.482 118.482 116.764 1.718 18093 10580 1 15 . 1 1 98 98 SER HA H 98 4.722 4.722 4.946 -0.224 18093 10581 1 15 . 1 1 98 98 SER CA C 98 56.547 56.547 55.875 0.672 18093 10582 1 15 . 1 1 98 98 SER CB C 98 63.624 63.624 63.944 -0.320 18093 10583 1 15 . 1 1 98 98 SER H H 98 8.254 8.254 7.643 0.611 18093 10584 1 15 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.430 -0.027 18093 10585 1 15 . 1 1 99 99 PRO C C 99 176.899 176.899 176.633 0.266 18093 10586 1 15 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.111 -0.410 18093 10587 1 15 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.078 -0.129 18093 10588 1 15 . 1 1 100 100 GLU N N 100 120.187 120.187 118.204 1.983 18093 10589 1 15 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.018 0.270 18093 10590 1 15 . 1 1 100 100 GLU C C 100 176.593 176.593 175.328 1.265 18093 10591 1 15 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.710 0.012 18093 10592 1 15 . 1 1 100 100 GLU CB C 100 29.999 29.999 29.139 0.860 18093 10593 1 15 . 1 1 100 100 GLU H H 100 8.401 8.401 8.765 -0.364 18093 10594 1 15 . 1 1 101 101 THR N N 101 113.968 113.968 111.256 2.712 18093 10595 1 15 . 1 1 101 101 THR HA H 101 4.286 4.286 4.554 -0.268 18093 10596 1 15 . 1 1 101 101 THR C C 101 174.525 174.525 174.584 -0.059 18093 10597 1 15 . 1 1 101 101 THR CA C 101 61.956 61.956 61.309 0.647 18093 10598 1 15 . 1 1 101 101 THR CB C 101 69.697 69.697 70.070 -0.373 18093 10599 1 15 . 1 1 101 101 THR H H 101 7.945 7.945 7.902 0.043 18093 10600 1 15 . 1 1 102 102 HIS N N 102 120.322 120.322 117.170 3.152 18093 10601 1 15 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.781 -0.040 18093 10602 1 15 . 1 1 102 102 HIS C C 102 174.783 174.783 174.904 -0.121 18093 10603 1 15 . 1 1 102 102 HIS CA C 102 55.701 55.701 55.683 0.018 18093 10604 1 15 . 1 1 102 102 HIS CB C 102 29.093 29.093 29.957 -0.864 18093 10605 1 15 . 1 1 102 102 HIS H H 102 8.455 8.455 8.737 -0.282 18093 10606 1 15 . 1 1 103 103 THR N N 103 114.282 114.282 114.488 -0.206 18093 10607 1 15 . 1 1 103 103 THR HA H 103 4.352 4.352 4.536 -0.184 18093 10608 1 15 . 1 1 103 103 THR C C 103 175.104 175.104 175.198 -0.094 18093 10609 1 15 . 1 1 103 103 THR CA C 103 62.057 62.057 61.712 0.345 18093 10610 1 15 . 1 1 103 103 THR CB C 103 69.966 69.966 69.543 0.423 18093 10611 1 15 . 1 1 103 103 THR H H 103 8.069 8.069 7.523 0.546 18093 10612 1 15 . 1 1 104 104 GLY N N 104 111.159 111.159 115.068 -3.909 18093 10613 1 15 . 1 1 104 104 GLY C C 104 174.776 174.776 173.812 0.964 18093 10614 1 15 . 1 1 104 104 GLY CA C 104 45.588 45.588 45.515 0.073 18093 10615 1 15 . 1 1 104 104 GLY H H 104 8.393 8.393 8.530 -0.137 18093 10616 1 15 . 1 1 105 105 GLY N N 105 108.657 108.657 107.292 1.365 18093 10617 1 15 . 1 1 105 105 GLY C C 105 174.957 174.957 173.654 1.303 18093 10618 1 15 . 1 1 105 105 GLY CA C 105 45.612 45.612 44.169 1.442 18093 10619 1 15 . 1 1 105 105 GLY H H 105 8.275 8.275 8.047 0.228 18093 10620 1 15 . 1 1 106 106 GLY N N 106 108.870 108.870 108.316 0.554 18093 10621 1 15 . 1 1 106 106 GLY C C 106 174.877 174.877 173.788 1.089 18093 10622 1 15 . 1 1 106 106 GLY CA C 106 45.665 45.665 45.588 0.077 18093 10623 1 15 . 1 1 106 106 GLY H H 106 8.357 8.357 8.377 -0.020 18093 10624 1 15 . 1 1 107 107 GLY N N 107 108.476 108.476 110.579 -2.103 18093 10625 1 15 . 1 1 107 107 GLY C C 107 174.877 174.877 174.520 0.357 18093 10626 1 15 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.143 0.553 18093 10627 1 15 . 1 1 107 107 GLY H H 107 8.330 8.330 8.346 -0.016 18093 10628 1 15 . 1 1 108 108 GLY N N 108 108.486 108.486 112.167 -3.681 18093 10629 1 15 . 1 1 108 108 GLY C C 108 175.345 175.345 175.200 0.145 18093 10630 1 15 . 1 1 108 108 GLY CA C 108 45.763 45.763 45.968 -0.205 18093 10631 1 15 . 1 1 108 108 GLY H H 108 8.328 8.328 8.662 -0.334 18093 10632 1 15 . 1 1 109 109 ILE N N 109 120.433 120.433 118.342 2.091 18093 10633 1 15 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.902 0.066 18093 10634 1 15 . 1 1 109 109 ILE C C 109 176.127 176.127 177.337 -1.210 18093 10635 1 15 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.380 -0.645 18093 10636 1 15 . 1 1 109 109 ILE CB C 109 38.125 38.125 37.791 0.334 18093 10637 1 15 . 1 1 109 109 ILE H H 109 8.192 8.192 8.120 0.072 18093 10638 1 15 . 1 1 110 110 ASP N N 110 121.148 121.148 119.694 1.454 18093 10639 1 15 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.489 -0.183 18093 10640 1 15 . 1 1 110 110 ASP C C 110 177.651 177.651 178.306 -0.655 18093 10641 1 15 . 1 1 110 110 ASP CA C 110 56.776 56.776 58.009 -1.233 18093 10642 1 15 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.736 0.361 18093 10643 1 15 . 1 1 110 110 ASP H H 110 8.427 8.427 8.733 -0.306 18093 10644 1 15 . 1 1 111 111 ARG N N 111 119.228 119.228 118.108 1.120 18093 10645 1 15 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.199 -0.203 18093 10646 1 15 . 1 1 111 111 ARG C C 111 177.786 177.786 178.734 -0.948 18093 10647 1 15 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.080 -0.138 18093 10648 1 15 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.822 0.374 18093 10649 1 15 . 1 1 111 111 ARG H H 111 7.850 7.850 8.279 -0.429 18093 10650 1 15 . 1 1 112 112 ILE N N 112 118.000 118.000 119.643 -1.643 18093 10651 1 15 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.104 -0.291 18093 10652 1 15 . 1 1 112 112 ILE C C 112 177.496 177.496 177.960 -0.464 18093 10653 1 15 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.218 2.594 18093 10654 1 15 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.939 0.788 18093 10655 1 15 . 1 1 112 112 ILE H H 112 7.764 7.764 7.730 0.034 18093 10656 1 15 . 1 1 113 113 PHE N N 113 118.367 118.367 122.112 -3.745 18093 10657 1 15 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.260 -0.005 18093 10658 1 15 . 1 1 113 113 PHE C C 113 177.218 177.218 177.406 -0.188 18093 10659 1 15 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.374 -0.941 18093 10660 1 15 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.185 -0.379 18093 10661 1 15 . 1 1 113 113 PHE H H 113 7.963 7.963 8.022 -0.059 18093 10662 1 15 . 1 1 114 114 LEU N N 114 118.921 118.921 117.192 1.729 18093 10663 1 15 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.899 0.098 18093 10664 1 15 . 1 1 114 114 LEU C C 114 178.297 178.297 178.428 -0.131 18093 10665 1 15 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.156 0.455 18093 10666 1 15 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.259 0.693 18093 10667 1 15 . 1 1 114 114 LEU H H 114 7.939 7.939 8.092 -0.153 18093 10668 1 15 . 1 1 115 115 TRP N N 115 117.464 117.464 119.449 -1.985 18093 10669 1 15 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.370 0.004 18093 10670 1 15 . 1 1 115 115 TRP C C 115 178.572 178.572 178.246 0.326 18093 10671 1 15 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.772 1.150 18093 10672 1 15 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.763 -1.256 18093 10673 1 15 . 1 1 115 115 TRP H H 115 7.969 7.969 7.601 0.368 18093 10674 1 15 . 1 1 116 116 MET N N 116 117.069 117.069 118.921 -1.852 18093 10675 1 15 . 1 1 116 116 MET HA H 116 4.065 4.065 4.221 -0.156 18093 10676 1 15 . 1 1 116 116 MET C C 116 177.425 177.425 178.191 -0.766 18093 10677 1 15 . 1 1 116 116 MET CA C 116 59.289 59.289 59.095 0.194 18093 10678 1 15 . 1 1 116 116 MET CB C 116 31.692 31.692 32.529 -0.837 18093 10679 1 15 . 1 1 116 116 MET H H 116 8.465 8.465 7.713 0.752 18093 10680 1 15 . 1 1 117 117 PHE N N 117 118.755 118.755 118.236 0.519 18093 10681 1 15 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.103 -0.004 18093 10682 1 15 . 1 1 117 117 PHE C C 117 177.965 177.965 178.187 -0.222 18093 10683 1 15 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.265 -0.557 18093 10684 1 15 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.316 0.869 18093 10685 1 15 . 1 1 117 117 PHE H H 117 8.418 8.418 7.854 0.564 18093 10686 1 15 . 1 1 118 118 ILE N N 118 119.133 119.133 115.371 3.762 18093 10687 1 15 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.916 -0.572 18093 10688 1 15 . 1 1 118 118 ILE C C 118 177.244 177.244 177.637 -0.393 18093 10689 1 15 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.304 1.521 18093 10690 1 15 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.775 -0.227 18093 10691 1 15 . 1 1 118 118 ILE H H 118 8.266 8.266 7.722 0.544 18093 10692 1 15 . 1 1 119 119 ILE N N 119 118.846 118.846 121.550 -2.704 18093 10693 1 15 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.948 -0.376 18093 10694 1 15 . 1 1 119 119 ILE C C 119 177.523 177.523 177.440 0.083 18093 10695 1 15 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.233 0.656 18093 10696 1 15 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.257 -0.693 18093 10697 1 15 . 1 1 119 119 ILE H H 119 8.308 8.308 7.299 1.009 18093 10698 1 15 . 1 1 120 120 VAL N N 120 119.228 119.228 118.191 1.037 18093 10699 1 15 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.927 -0.419 18093 10700 1 15 . 1 1 120 120 VAL C C 120 177.651 177.651 177.589 0.062 18093 10701 1 15 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.590 2.011 18093 10702 1 15 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.823 0.583 18093 10703 1 15 . 1 1 120 120 VAL H H 120 8.399 8.399 7.999 0.400 18093 10704 1 15 . 1 1 121 121 CYS N N 121 117.151 117.151 118.953 -1.802 18093 10705 1 15 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.215 -0.312 18093 10706 1 15 . 1 1 121 121 CYS C C 121 177.719 177.719 176.496 1.223 18093 10707 1 15 . 1 1 121 121 CYS CA C 121 64.298 64.298 62.885 1.413 18093 10708 1 15 . 1 1 121 121 CYS CB C 121 26.677 26.677 26.424 0.253 18093 10709 1 15 . 1 1 121 121 CYS H H 121 8.008 8.008 7.581 0.427 18093 10710 1 15 . 1 1 122 122 LEU N N 122 121.402 121.402 119.080 2.322 18093 10711 1 15 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.224 -0.241 18093 10712 1 15 . 1 1 122 122 LEU C C 122 178.282 178.282 179.294 -1.012 18093 10713 1 15 . 1 1 122 122 LEU CA C 122 58.545 58.545 58.032 0.513 18093 10714 1 15 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.360 0.606 18093 10715 1 15 . 1 1 122 122 LEU H H 122 8.417 8.417 7.657 0.760 18093 10716 1 15 . 1 1 123 123 LEU N N 123 118.543 118.543 120.283 -1.740 18093 10717 1 15 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.053 -0.133 18093 10718 1 15 . 1 1 123 123 LEU C C 123 179.028 179.028 178.854 0.174 18093 10719 1 15 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.497 -0.380 18093 10720 1 15 . 1 1 123 123 LEU CB C 123 42.056 42.056 40.994 1.062 18093 10721 1 15 . 1 1 123 123 LEU H H 123 8.590 8.590 7.835 0.755 18093 10722 1 15 . 1 1 124 124 GLY N N 124 104.896 104.896 105.471 -0.575 18093 10723 1 15 . 1 1 124 124 GLY C C 124 173.932 173.932 176.052 -2.120 18093 10724 1 15 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.671 -0.444 18093 10725 1 15 . 1 1 124 124 GLY H H 124 8.601 8.601 8.365 0.236 18093 10726 1 15 . 1 1 125 125 THR N N 125 115.403 115.403 119.013 -3.610 18093 10727 1 15 . 1 1 125 125 THR HA H 125 3.686 3.686 4.022 -0.336 18093 10728 1 15 . 1 1 125 125 THR C C 125 176.407 176.407 176.684 -0.277 18093 10729 1 15 . 1 1 125 125 THR CA C 125 67.565 67.565 66.933 0.632 18093 10730 1 15 . 1 1 125 125 THR CB C 125 68.143 68.143 68.565 -0.422 18093 10731 1 15 . 1 1 125 125 THR H H 125 7.734 7.734 7.558 0.176 18093 10732 1 15 . 1 1 126 126 VAL N N 126 119.056 119.056 120.892 -1.836 18093 10733 1 15 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.747 -0.208 18093 10734 1 15 . 1 1 126 126 VAL C C 126 177.628 177.628 177.783 -0.155 18093 10735 1 15 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.461 0.140 18093 10736 1 15 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.608 -0.114 18093 10737 1 15 . 1 1 126 126 VAL H H 126 8.015 8.015 8.140 -0.125 18093 10738 1 15 . 1 1 127 127 GLY N N 127 104.644 104.644 107.786 -3.142 18093 10739 1 15 . 1 1 127 127 GLY C C 127 173.933 173.933 175.219 -1.286 18093 10740 1 15 . 1 1 127 127 GLY CA C 127 47.281 47.281 46.878 0.403 18093 10741 1 15 . 1 1 127 127 GLY H H 127 8.248 8.248 8.357 -0.109 18093 10742 1 15 . 1 1 128 128 LEU N N 128 117.354 117.354 120.751 -3.397 18093 10743 1 15 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.178 -0.166 18093 10744 1 15 . 1 1 128 128 LEU C C 128 177.443 177.443 177.938 -0.495 18093 10745 1 15 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.795 -0.169 18093 10746 1 15 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.699 0.561 18093 10747 1 15 . 1 1 128 128 LEU H H 128 7.568 7.568 7.568 -0.000 18093 10748 1 15 . 1 1 129 129 PHE N N 129 113.971 113.971 117.090 -3.119 18093 10749 1 15 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.210 0.248 18093 10750 1 15 . 1 1 129 129 PHE C C 129 176.216 176.216 176.936 -0.720 18093 10751 1 15 . 1 1 129 129 PHE CA C 129 58.385 58.385 61.279 -2.894 18093 10752 1 15 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.475 0.244 18093 10753 1 15 . 1 1 129 129 PHE H H 129 7.639 7.639 7.590 0.049 18093 10754 1 15 . 1 1 130 130 LEU N N 130 117.752 117.752 119.666 -1.914 18093 10755 1 15 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.656 -0.223 18093 10756 1 15 . 1 1 130 130 LEU CA C 130 54.156 54.156 53.041 1.115 18093 10757 1 15 . 1 1 130 130 LEU H H 130 8.099 8.099 7.709 0.390 18093 10758 1 15 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.627 -0.177 18093 10759 1 15 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.528 2.371 18093 10760 1 15 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.352 -0.090 18093 10761 1 15 . 1 1 132 132 PRO C C 132 177.616 177.616 177.855 -0.239 18093 10762 1 15 . 1 1 132 132 PRO CA C 132 64.980 64.980 63.100 1.880 18093 10763 1 15 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.651 -1.026 18093 10764 1 15 . 1 1 133 133 TRP N N 133 115.508 115.508 117.043 -1.535 18093 10765 1 15 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.236 0.356 18093 10766 1 15 . 1 1 133 133 TRP C C 133 176.842 176.842 175.432 1.410 18093 10767 1 15 . 1 1 133 133 TRP CA C 133 57.283 57.283 60.003 -2.720 18093 10768 1 15 . 1 1 133 133 TRP CB C 133 28.596 28.596 28.182 0.414 18093 10769 1 15 . 1 1 133 133 TRP H H 133 7.311 7.311 8.321 -1.010 18093 10770 1 15 . 1 1 134 134 LEU N N 134 119.570 119.570 119.467 0.103 18093 10771 1 15 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.523 -0.346 18093 10772 1 15 . 1 1 134 134 LEU C C 134 175.768 175.768 177.777 -2.009 18093 10773 1 15 . 1 1 134 134 LEU CA C 134 55.621 55.621 54.759 0.862 18093 10774 1 15 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.636 1.012 18093 10775 1 15 . 1 1 134 134 LEU H H 134 7.453 7.453 8.013 -0.560 18093 10776 1 15 . 1 1 135 135 ALA N N 135 119.004 119.004 120.939 -1.935 18093 10777 1 15 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.309 -0.086 18093 10778 1 15 . 1 1 135 135 ALA C C 135 177.170 177.170 177.058 0.112 18093 10779 1 15 . 1 1 135 135 ALA CA C 135 52.456 52.456 52.991 -0.535 18093 10780 1 15 . 1 1 135 135 ALA CB C 135 19.736 19.736 19.206 0.530 18093 10781 1 15 . 1 1 135 135 ALA H H 135 7.541 7.541 7.838 -0.297 18093 10782 1 15 . 1 1 136 136 GLY N N 136 105.879 105.879 105.851 0.028 18093 10783 1 15 . 1 1 136 136 GLY C C 136 173.042 173.042 174.099 -1.057 18093 10784 1 15 . 1 1 136 136 GLY CA C 136 45.693 45.693 44.778 0.915 18093 10785 1 15 . 1 1 136 136 GLY H H 136 7.846 7.846 7.474 0.372 18093 10786 1 16 . 1 1 5 5 GLU N N 5 119.627 119.627 118.273 1.354 18093 10787 1 16 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.381 -0.173 18093 10788 1 16 . 1 1 5 5 GLU C C 5 176.581 176.581 175.056 1.525 18093 10789 1 16 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.577 0.468 18093 10790 1 16 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.462 0.576 18093 10791 1 16 . 1 1 5 5 GLU H H 5 8.003 8.003 8.275 -0.272 18093 10792 1 16 . 1 1 6 6 LEU N N 6 121.267 121.267 122.615 -1.348 18093 10793 1 16 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.629 -0.204 18093 10794 1 16 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.174 2.461 18093 10795 1 16 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.533 -0.237 18093 10796 1 16 . 1 1 6 6 LEU H H 6 8.104 8.104 7.896 0.208 18093 10797 1 16 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.578 -0.179 18093 10798 1 16 . 1 1 7 7 PRO C C 7 178.408 178.408 177.999 0.409 18093 10799 1 16 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.125 2.587 18093 10800 1 16 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.787 -0.870 18093 10801 1 16 . 1 1 8 8 LEU N N 8 121.835 121.835 120.774 1.061 18093 10802 1 16 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.303 -0.214 18093 10803 1 16 . 1 1 8 8 LEU C C 8 177.902 177.902 178.398 -0.496 18093 10804 1 16 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.808 0.297 18093 10805 1 16 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.178 0.429 18093 10806 1 16 . 1 1 8 8 LEU H H 8 8.162 8.162 8.585 -0.423 18093 10807 1 16 . 1 1 9 9 PHE N N 9 118.342 118.342 118.239 0.103 18093 10808 1 16 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.155 0.034 18093 10809 1 16 . 1 1 9 9 PHE C C 9 177.596 177.596 176.449 1.147 18093 10810 1 16 . 1 1 9 9 PHE CA C 9 61.114 61.114 60.890 0.224 18093 10811 1 16 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.288 0.439 18093 10812 1 16 . 1 1 9 9 PHE H H 9 8.318 8.318 8.343 -0.025 18093 10813 1 16 . 1 1 10 10 TYR N N 10 117.584 117.584 118.620 -1.036 18093 10814 1 16 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.793 0.361 18093 10815 1 16 . 1 1 10 10 TYR C C 10 177.630 177.630 176.914 0.716 18093 10816 1 16 . 1 1 10 10 TYR CA C 10 61.036 61.036 61.351 -0.315 18093 10817 1 16 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.440 0.220 18093 10818 1 16 . 1 1 10 10 TYR H H 10 8.105 8.105 8.270 -0.165 18093 10819 1 16 . 1 1 11 11 THR N N 11 115.563 115.563 116.598 -1.035 18093 10820 1 16 . 1 1 11 11 THR HA H 11 3.871 3.871 4.033 -0.162 18093 10821 1 16 . 1 1 11 11 THR C C 11 175.955 175.955 176.452 -0.497 18093 10822 1 16 . 1 1 11 11 THR CA C 11 67.290 67.290 66.865 0.425 18093 10823 1 16 . 1 1 11 11 THR CB C 11 68.201 68.201 68.529 -0.328 18093 10824 1 16 . 1 1 11 11 THR H H 11 7.915 7.915 7.832 0.083 18093 10825 1 16 . 1 1 12 12 ILE N N 12 119.727 119.727 120.311 -0.584 18093 10826 1 16 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.878 -0.179 18093 10827 1 16 . 1 1 12 12 ILE C C 12 175.773 175.773 177.521 -1.748 18093 10828 1 16 . 1 1 12 12 ILE CA C 12 64.699 64.699 62.733 1.966 18093 10829 1 16 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.694 1.402 18093 10830 1 16 . 1 1 12 12 ILE H H 12 8.186 8.186 7.875 0.311 18093 10831 1 16 . 1 1 13 13 ASN N N 13 114.190 114.190 118.828 -4.638 18093 10832 1 16 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.449 -0.027 18093 10833 1 16 . 1 1 13 13 ASN C C 13 174.786 174.786 176.882 -2.096 18093 10834 1 16 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.613 -0.058 18093 10835 1 16 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.246 1.112 18093 10836 1 16 . 1 1 13 13 ASN H H 13 7.601 7.601 7.352 0.249 18093 10837 1 16 . 1 1 14 14 LEU N N 14 115.031 115.031 116.825 -1.794 18093 10838 1 16 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.174 0.022 18093 10839 1 16 . 1 1 14 14 LEU C C 14 177.540 177.540 177.903 -0.363 18093 10840 1 16 . 1 1 14 14 LEU CA C 14 56.407 56.407 57.279 -0.872 18093 10841 1 16 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.019 -0.177 18093 10842 1 16 . 1 1 14 14 LEU H H 14 7.390 7.390 7.352 0.038 18093 10843 1 16 . 1 1 15 15 ILE N N 15 118.223 118.223 119.970 -1.747 18093 10844 1 16 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.715 -0.102 18093 10845 1 16 . 1 1 15 15 ILE CA C 15 65.720 65.720 63.011 2.709 18093 10846 1 16 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.309 -0.697 18093 10847 1 16 . 1 1 15 15 ILE H H 15 8.123 8.123 7.481 0.642 18093 10848 1 16 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.243 -0.174 18093 10849 1 16 . 1 1 17 17 PRO C C 17 177.721 177.721 178.491 -0.770 18093 10850 1 16 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.449 1.312 18093 10851 1 16 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.619 0.123 18093 10852 1 16 . 1 1 18 18 CYS N N 18 113.538 113.538 117.122 -3.584 18093 10853 1 16 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.002 0.006 18093 10854 1 16 . 1 1 18 18 CYS C C 18 177.683 177.683 177.051 0.632 18093 10855 1 16 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.344 1.156 18093 10856 1 16 . 1 1 18 18 CYS CB C 18 26.873 26.873 27.486 -0.613 18093 10857 1 16 . 1 1 18 18 CYS H H 18 7.410 7.410 7.310 0.100 18093 10858 1 16 . 1 1 19 19 LEU N N 19 122.545 122.545 119.085 3.460 18093 10859 1 16 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.067 -0.068 18093 10860 1 16 . 1 1 19 19 LEU C C 19 178.608 178.608 178.822 -0.214 18093 10861 1 16 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.361 1.060 18093 10862 1 16 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.425 0.419 18093 10863 1 16 . 1 1 19 19 LEU H H 19 8.635 8.635 7.383 1.252 18093 10864 1 16 . 1 1 20 20 LEU N N 20 119.404 119.404 121.283 -1.879 18093 10865 1 16 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.942 0.064 18093 10866 1 16 . 1 1 20 20 LEU C C 20 178.540 178.540 178.746 -0.206 18093 10867 1 16 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.317 0.482 18093 10868 1 16 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.835 0.164 18093 10869 1 16 . 1 1 20 20 LEU H H 20 8.392 8.392 7.522 0.870 18093 10870 1 16 . 1 1 21 21 ILE N N 21 117.335 117.335 114.358 2.977 18093 10871 1 16 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.689 -0.038 18093 10872 1 16 . 1 1 21 21 ILE C C 21 177.249 177.249 177.861 -0.612 18093 10873 1 16 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.969 0.292 18093 10874 1 16 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.033 0.927 18093 10875 1 16 . 1 1 21 21 ILE H H 21 8.403 8.403 8.301 0.102 18093 10876 1 16 . 1 1 22 22 SER N N 22 116.385 116.385 117.170 -0.785 18093 10877 1 16 . 1 1 22 22 SER HA H 22 4.056 4.056 4.330 -0.274 18093 10878 1 16 . 1 1 22 22 SER C C 22 176.813 176.813 176.761 0.052 18093 10879 1 16 . 1 1 22 22 SER CA C 22 63.866 63.866 62.019 1.847 18093 10880 1 16 . 1 1 22 22 SER CB C 22 62.898 62.898 62.420 0.478 18093 10881 1 16 . 1 1 22 22 SER H H 22 8.271 8.271 7.657 0.615 18093 10882 1 16 . 1 1 23 23 CYS N N 23 119.001 119.001 121.157 -2.156 18093 10883 1 16 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.078 -0.088 18093 10884 1 16 . 1 1 23 23 CYS C C 23 177.594 177.594 176.379 1.215 18093 10885 1 16 . 1 1 23 23 CYS CA C 23 64.429 64.429 63.478 0.951 18093 10886 1 16 . 1 1 23 23 CYS CB C 23 26.940 26.940 27.326 -0.386 18093 10887 1 16 . 1 1 23 23 CYS H H 23 8.161 8.161 8.440 -0.279 18093 10888 1 16 . 1 1 24 24 LEU N N 24 117.814 117.814 121.797 -3.983 18093 10889 1 16 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.839 0.138 18093 10890 1 16 . 1 1 24 24 LEU C C 24 177.944 177.944 178.215 -0.271 18093 10891 1 16 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.746 -0.459 18093 10892 1 16 . 1 1 24 24 LEU CB C 24 41.903 41.903 42.099 -0.196 18093 10893 1 16 . 1 1 24 24 LEU H H 24 8.106 8.106 7.770 0.336 18093 10894 1 16 . 1 1 25 25 THR N N 25 115.670 115.670 115.261 0.409 18093 10895 1 16 . 1 1 25 25 THR HA H 25 3.687 3.687 3.952 -0.265 18093 10896 1 16 . 1 1 25 25 THR C C 25 175.845 175.845 176.695 -0.850 18093 10897 1 16 . 1 1 25 25 THR CA C 25 68.306 68.306 67.300 1.006 18093 10898 1 16 . 1 1 25 25 THR H H 25 7.924 7.924 7.509 0.415 18093 10899 1 16 . 1 1 26 26 VAL N N 26 118.809 118.809 121.444 -2.635 18093 10900 1 16 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.763 -0.248 18093 10901 1 16 . 1 1 26 26 VAL C C 26 177.530 177.530 177.434 0.096 18093 10902 1 16 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.560 0.721 18093 10903 1 16 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.289 0.435 18093 10904 1 16 . 1 1 26 26 VAL H H 26 7.764 7.764 7.400 0.364 18093 10905 1 16 . 1 1 27 27 LEU N N 27 117.958 117.958 120.384 -2.426 18093 10906 1 16 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.016 0.020 18093 10907 1 16 . 1 1 27 27 LEU C C 27 178.163 178.163 179.804 -1.641 18093 10908 1 16 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.189 0.320 18093 10909 1 16 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.841 1.078 18093 10910 1 16 . 1 1 27 27 LEU H H 27 7.912 7.912 8.049 -0.137 18093 10911 1 16 . 1 1 28 28 VAL N N 28 114.472 114.472 119.258 -4.786 18093 10912 1 16 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.715 -0.180 18093 10913 1 16 . 1 1 28 28 VAL C C 28 176.871 176.871 178.931 -2.060 18093 10914 1 16 . 1 1 28 28 VAL CA C 28 65.977 65.977 66.712 -0.735 18093 10915 1 16 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.077 0.857 18093 10916 1 16 . 1 1 28 28 VAL H H 28 7.892 7.892 7.636 0.256 18093 10917 1 16 . 1 1 29 29 PHE N N 29 115.206 115.206 119.816 -4.610 18093 10918 1 16 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.151 0.052 18093 10919 1 16 . 1 1 29 29 PHE C C 29 176.614 176.614 176.635 -0.021 18093 10920 1 16 . 1 1 29 29 PHE CA C 29 60.964 60.964 61.480 -0.516 18093 10921 1 16 . 1 1 29 29 PHE CB C 29 39.752 39.752 38.577 1.175 18093 10922 1 16 . 1 1 29 29 PHE H H 29 7.748 7.748 7.871 -0.123 18093 10923 1 16 . 1 1 30 30 TYR N N 30 115.975 115.975 118.088 -2.113 18093 10924 1 16 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.442 -0.120 18093 10925 1 16 . 1 1 30 30 TYR C C 30 175.553 175.553 175.069 0.484 18093 10926 1 16 . 1 1 30 30 TYR CA C 30 59.598 59.598 58.644 0.954 18093 10927 1 16 . 1 1 30 30 TYR CB C 30 39.763 39.763 39.421 0.342 18093 10928 1 16 . 1 1 30 30 TYR H H 30 7.985 7.985 7.639 0.346 18093 10929 1 16 . 1 1 31 31 LEU N N 31 120.780 120.780 121.038 -0.258 18093 10930 1 16 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.615 -0.188 18093 10931 1 16 . 1 1 31 31 LEU CA C 31 54.665 54.665 52.807 1.858 18093 10932 1 16 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.728 -1.340 18093 10933 1 16 . 1 1 31 31 LEU H H 31 7.643 7.643 7.751 -0.108 18093 10934 1 16 . 1 1 34 34 GLU C C 34 176.271 176.271 176.782 -0.511 18093 10935 1 16 . 1 1 34 34 GLU CA C 34 57.590 57.590 56.940 0.650 18093 10936 1 16 . 1 1 35 35 CYS N N 35 116.430 116.430 118.733 -2.303 18093 10937 1 16 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.404 -0.037 18093 10938 1 16 . 1 1 35 35 CYS C C 35 175.198 175.198 175.824 -0.626 18093 10939 1 16 . 1 1 35 35 CYS CA C 35 60.293 60.293 60.017 0.276 18093 10940 1 16 . 1 1 35 35 CYS CB C 35 28.130 28.130 28.645 -0.515 18093 10941 1 16 . 1 1 35 35 CYS H H 35 7.970 7.970 7.864 0.106 18093 10942 1 16 . 1 1 36 36 GLY N N 36 108.315 108.315 108.557 -0.242 18093 10943 1 16 . 1 1 36 36 GLY C C 36 174.610 174.610 175.128 -0.518 18093 10944 1 16 . 1 1 36 36 GLY CA C 36 46.004 46.004 45.018 0.986 18093 10945 1 16 . 1 1 36 36 GLY H H 36 8.120 8.120 7.818 0.302 18093 10946 1 16 . 1 1 37 37 GLU N N 37 121.347 121.347 119.782 1.565 18093 10947 1 16 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.109 -0.062 18093 10948 1 16 . 1 1 37 37 GLU C C 37 177.338 177.338 178.019 -0.681 18093 10949 1 16 . 1 1 37 37 GLU CA C 37 58.507 58.507 58.773 -0.266 18093 10950 1 16 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.645 -0.075 18093 10951 1 16 . 1 1 37 37 GLU H H 37 8.423 8.423 8.770 -0.347 18093 10952 1 16 . 1 1 38 38 LYS N N 38 123.788 123.788 119.668 4.120 18093 10953 1 16 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.100 0.096 18093 10954 1 16 . 1 1 38 38 LYS C C 38 177.976 177.976 179.080 -1.104 18093 10955 1 16 . 1 1 38 38 LYS CA C 38 58.273 58.273 59.448 -1.175 18093 10956 1 16 . 1 1 38 38 LYS CB C 38 31.649 31.649 31.873 -0.225 18093 10957 1 16 . 1 1 38 38 LYS H H 38 8.211 8.211 8.462 -0.251 18093 10958 1 16 . 1 1 39 39 ILE N N 39 115.675 115.675 118.549 -2.874 18093 10959 1 16 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.767 -0.159 18093 10960 1 16 . 1 1 39 39 ILE C C 39 177.204 177.204 178.012 -0.808 18093 10961 1 16 . 1 1 39 39 ILE CA C 39 65.501 65.501 65.098 0.403 18093 10962 1 16 . 1 1 39 39 ILE H H 39 7.933 7.933 7.597 0.336 18093 10963 1 16 . 1 1 40 40 THR N N 40 117.411 117.411 116.189 1.222 18093 10964 1 16 . 1 1 40 40 THR HA H 40 3.844 3.844 3.920 -0.076 18093 10965 1 16 . 1 1 40 40 THR C C 40 175.983 175.983 176.374 -0.391 18093 10966 1 16 . 1 1 40 40 THR CA C 40 67.360 67.360 66.903 0.457 18093 10967 1 16 . 1 1 40 40 THR H H 40 8.362 8.362 7.559 0.803 18093 10968 1 16 . 1 1 41 41 LEU N N 41 123.059 123.059 122.707 0.352 18093 10969 1 16 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.053 -0.037 18093 10970 1 16 . 1 1 41 41 LEU C C 41 178.914 178.914 178.006 0.908 18093 10971 1 16 . 1 1 41 41 LEU CA C 41 58.366 58.366 58.504 -0.138 18093 10972 1 16 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.828 0.222 18093 10973 1 16 . 1 1 41 41 LEU H H 41 8.282 8.282 7.838 0.444 18093 10974 1 16 . 1 1 42 42 CYS N N 42 118.762 118.762 118.136 0.626 18093 10975 1 16 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.004 -0.068 18093 10976 1 16 . 1 1 42 42 CYS C C 42 176.607 176.607 176.988 -0.381 18093 10977 1 16 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.400 0.917 18093 10978 1 16 . 1 1 42 42 CYS CB C 42 26.919 26.919 26.786 0.133 18093 10979 1 16 . 1 1 42 42 CYS H H 42 8.195 8.195 7.650 0.545 18093 10980 1 16 . 1 1 43 43 ILE N N 43 117.589 117.589 120.900 -3.311 18093 10981 1 16 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.598 0.009 18093 10982 1 16 . 1 1 43 43 ILE C C 43 177.323 177.323 178.053 -0.730 18093 10983 1 16 . 1 1 43 43 ILE CA C 43 65.249 65.249 65.451 -0.202 18093 10984 1 16 . 1 1 43 43 ILE CB C 43 38.038 38.038 38.033 0.005 18093 10985 1 16 . 1 1 43 43 ILE H H 43 8.428 8.428 7.681 0.747 18093 10986 1 16 . 1 1 44 44 SER N N 44 115.950 115.950 116.761 -0.811 18093 10987 1 16 . 1 1 44 44 SER HA H 44 4.012 4.012 4.114 -0.102 18093 10988 1 16 . 1 1 44 44 SER C C 44 176.965 176.965 176.859 0.106 18093 10989 1 16 . 1 1 44 44 SER CA C 44 63.575 63.575 62.585 0.990 18093 10990 1 16 . 1 1 44 44 SER H H 44 7.984 7.984 8.304 -0.320 18093 10991 1 16 . 1 1 45 45 VAL N N 45 123.544 123.544 121.225 2.319 18093 10992 1 16 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.735 -0.187 18093 10993 1 16 . 1 1 45 45 VAL C C 45 177.139 177.139 178.069 -0.930 18093 10994 1 16 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.415 0.818 18093 10995 1 16 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.406 0.236 18093 10996 1 16 . 1 1 45 45 VAL H H 45 8.280 8.280 8.372 -0.092 18093 10997 1 16 . 1 1 46 46 LEU N N 46 119.883 119.883 120.150 -0.267 18093 10998 1 16 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.046 -0.103 18093 10999 1 16 . 1 1 46 46 LEU C C 46 180.125 180.125 178.720 1.405 18093 11000 1 16 . 1 1 46 46 LEU CA C 46 58.600 58.600 58.315 0.285 18093 11001 1 16 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.710 0.302 18093 11002 1 16 . 1 1 46 46 LEU H H 46 8.117 8.117 7.547 0.570 18093 11003 1 16 . 1 1 47 47 LEU N N 47 120.193 120.193 120.106 0.087 18093 11004 1 16 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.859 0.145 18093 11005 1 16 . 1 1 47 47 LEU C C 47 178.370 178.370 178.771 -0.401 18093 11006 1 16 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.477 -0.051 18093 11007 1 16 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.662 0.393 18093 11008 1 16 . 1 1 47 47 LEU H H 47 8.933 8.933 8.332 0.601 18093 11009 1 16 . 1 1 48 48 SER N N 48 115.861 115.861 114.981 0.880 18093 11010 1 16 . 1 1 48 48 SER HA H 48 4.013 4.013 4.128 -0.115 18093 11011 1 16 . 1 1 48 48 SER C C 48 175.642 175.642 176.980 -1.338 18093 11012 1 16 . 1 1 48 48 SER CA C 48 63.571 63.571 62.107 1.464 18093 11013 1 16 . 1 1 48 48 SER CB C 48 62.879 62.879 63.034 -0.155 18093 11014 1 16 . 1 1 48 48 SER H H 48 7.996 7.996 7.843 0.153 18093 11015 1 16 . 1 1 49 49 LEU N N 49 120.673 120.673 122.769 -2.096 18093 11016 1 16 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.031 0.004 18093 11017 1 16 . 1 1 49 49 LEU C C 49 178.229 178.229 178.823 -0.594 18093 11018 1 16 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.151 0.133 18093 11019 1 16 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.258 -0.312 18093 11020 1 16 . 1 1 49 49 LEU H H 49 8.352 8.352 7.925 0.427 18093 11021 1 16 . 1 1 50 50 THR N N 50 115.582 115.582 114.721 0.861 18093 11022 1 16 . 1 1 50 50 THR HA H 50 3.672 3.672 3.956 -0.284 18093 11023 1 16 . 1 1 50 50 THR C C 50 175.877 175.877 176.492 -0.615 18093 11024 1 16 . 1 1 50 50 THR CA C 50 68.628 68.628 66.548 2.080 18093 11025 1 16 . 1 1 50 50 THR H H 50 7.937 7.937 7.914 0.023 18093 11026 1 16 . 1 1 51 51 VAL N N 51 119.774 119.774 122.264 -2.490 18093 11027 1 16 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.815 -0.317 18093 11028 1 16 . 1 1 51 51 VAL C C 51 177.162 177.162 177.389 -0.227 18093 11029 1 16 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.606 0.980 18093 11030 1 16 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.580 -0.059 18093 11031 1 16 . 1 1 51 51 VAL H H 51 8.115 8.115 7.986 0.129 18093 11032 1 16 . 1 1 52 52 PHE N N 52 118.808 118.808 120.730 -1.922 18093 11033 1 16 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.290 -0.168 18093 11034 1 16 . 1 1 52 52 PHE C C 52 176.697 176.697 177.367 -0.670 18093 11035 1 16 . 1 1 52 52 PHE CA C 52 61.771 61.771 61.329 0.442 18093 11036 1 16 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.425 -0.163 18093 11037 1 16 . 1 1 52 52 PHE H H 52 8.256 8.256 8.544 -0.288 18093 11038 1 16 . 1 1 53 53 LEU N N 53 117.267 117.267 122.905 -5.638 18093 11039 1 16 . 1 1 53 53 LEU HA H 53 3.893 3.893 4.090 -0.197 18093 11040 1 16 . 1 1 53 53 LEU C C 53 179.319 179.319 177.617 1.702 18093 11041 1 16 . 1 1 53 53 LEU CA C 53 57.985 57.985 58.311 -0.326 18093 11042 1 16 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.609 0.217 18093 11043 1 16 . 1 1 53 53 LEU H H 53 8.443 8.443 8.284 0.159 18093 11044 1 16 . 1 1 54 54 LEU N N 54 119.762 119.762 118.921 0.841 18093 11045 1 16 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.971 0.083 18093 11046 1 16 . 1 1 54 54 LEU C C 54 178.827 178.827 178.992 -0.165 18093 11047 1 16 . 1 1 54 54 LEU CA C 54 58.105 58.105 57.841 0.264 18093 11048 1 16 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.899 0.048 18093 11049 1 16 . 1 1 54 54 LEU H H 54 8.205 8.205 7.424 0.781 18093 11050 1 16 . 1 1 55 55 LEU N N 55 118.585 118.585 118.154 0.431 18093 11051 1 16 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.885 0.192 18093 11052 1 16 . 1 1 55 55 LEU C C 55 178.909 178.909 178.769 0.140 18093 11053 1 16 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.936 0.172 18093 11054 1 16 . 1 1 55 55 LEU CB C 55 41.979 41.979 40.681 1.298 18093 11055 1 16 . 1 1 55 55 LEU H H 55 8.179 8.179 7.402 0.777 18093 11056 1 16 . 1 1 56 56 ILE N N 56 116.079 116.079 115.756 0.323 18093 11057 1 16 . 1 1 56 56 ILE HA H 56 3.729 3.729 3.836 -0.107 18093 11058 1 16 . 1 1 56 56 ILE C C 56 176.988 176.988 178.171 -1.183 18093 11059 1 16 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.893 0.364 18093 11060 1 16 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.748 0.669 18093 11061 1 16 . 1 1 56 56 ILE H H 56 8.040 8.040 7.363 0.677 18093 11062 1 16 . 1 1 57 57 THR N N 57 110.105 110.105 109.205 0.900 18093 11063 1 16 . 1 1 57 57 THR HA H 57 4.015 4.015 4.222 -0.207 18093 11064 1 16 . 1 1 57 57 THR C C 57 175.435 175.435 175.713 -0.278 18093 11065 1 16 . 1 1 57 57 THR CA C 57 65.067 65.067 64.305 0.763 18093 11066 1 16 . 1 1 57 57 THR CB C 57 69.179 69.179 68.772 0.407 18093 11067 1 16 . 1 1 57 57 THR H H 57 7.655 7.655 7.820 -0.165 18093 11068 1 16 . 1 1 58 58 GLU N N 58 117.313 117.313 121.408 -4.095 18093 11069 1 16 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.289 0.044 18093 11070 1 16 . 1 1 58 58 GLU C C 58 176.940 176.940 178.111 -1.171 18093 11071 1 16 . 1 1 58 58 GLU CA C 58 57.068 57.068 58.108 -1.040 18093 11072 1 16 . 1 1 58 58 GLU CB C 58 29.396 29.396 30.293 -0.897 18093 11073 1 16 . 1 1 58 58 GLU H H 58 7.521 7.521 7.788 -0.267 18093 11074 1 16 . 1 1 59 59 ILE N N 59 114.870 114.870 113.884 0.986 18093 11075 1 16 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.098 -0.009 18093 11076 1 16 . 1 1 59 59 ILE C C 59 175.456 175.456 176.299 -0.843 18093 11077 1 16 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.211 0.223 18093 11078 1 16 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.739 -0.081 18093 11079 1 16 . 1 1 59 59 ILE H H 59 7.579 7.579 7.330 0.249 18093 11080 1 16 . 1 1 60 60 ILE N N 60 119.354 119.354 118.417 0.937 18093 11081 1 16 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.852 0.452 18093 11082 1 16 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.434 -1.817 18093 11083 1 16 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.745 2.117 18093 11084 1 16 . 1 1 60 60 ILE H H 60 7.629 7.629 7.540 0.089 18093 11085 1 16 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.512 -0.112 18093 11086 1 16 . 1 1 61 61 PRO C C 61 177.144 177.144 175.903 1.241 18093 11087 1 16 . 1 1 61 61 PRO CA C 61 63.808 63.808 63.880 -0.072 18093 11088 1 16 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.575 -0.694 18093 11089 1 16 . 1 1 62 62 SER N N 62 114.474 114.474 111.053 3.421 18093 11090 1 16 . 1 1 62 62 SER HA H 62 4.434 4.434 4.557 -0.123 18093 11091 1 16 . 1 1 62 62 SER C C 62 175.161 175.161 174.070 1.091 18093 11092 1 16 . 1 1 62 62 SER CA C 62 59.047 59.047 57.811 1.236 18093 11093 1 16 . 1 1 62 62 SER CB C 62 63.704 63.704 64.277 -0.573 18093 11094 1 16 . 1 1 62 62 SER H H 62 8.186 8.186 7.755 0.431 18093 11095 1 16 . 1 1 63 63 THR N N 63 113.573 113.573 119.710 -6.137 18093 11096 1 16 . 1 1 63 63 THR HA H 63 4.319 4.319 4.643 -0.324 18093 11097 1 16 . 1 1 63 63 THR C C 63 174.834 174.834 174.398 0.436 18093 11098 1 16 . 1 1 63 63 THR CA C 63 62.377 62.377 62.132 0.245 18093 11099 1 16 . 1 1 63 63 THR CB C 63 69.422 69.422 68.256 1.166 18093 11100 1 16 . 1 1 63 63 THR H H 63 7.963 7.963 8.469 -0.506 18093 11101 1 16 . 1 1 64 64 SER N N 64 116.598 116.598 116.175 0.423 18093 11102 1 16 . 1 1 64 64 SER HA H 64 4.428 4.428 4.840 -0.412 18093 11103 1 16 . 1 1 64 64 SER C C 64 174.618 174.618 173.530 1.088 18093 11104 1 16 . 1 1 64 64 SER CA C 64 59.045 59.045 57.500 1.545 18093 11105 1 16 . 1 1 64 64 SER CB C 64 63.700 63.700 65.413 -1.713 18093 11106 1 16 . 1 1 64 64 SER H H 64 8.052 8.052 7.430 0.622 18093 11107 1 16 . 1 1 65 65 SER N N 65 116.673 116.673 115.598 1.075 18093 11108 1 16 . 1 1 65 65 SER HA H 65 4.432 4.432 4.825 -0.393 18093 11109 1 16 . 1 1 65 65 SER C C 65 174.335 174.335 174.618 -0.283 18093 11110 1 16 . 1 1 65 65 SER CA C 65 58.927 58.927 57.977 0.950 18093 11111 1 16 . 1 1 65 65 SER CB C 65 63.621 63.621 63.753 -0.132 18093 11112 1 16 . 1 1 65 65 SER H H 65 8.114 8.114 8.464 -0.350 18093 11113 1 16 . 1 1 66 66 VAL N N 66 119.054 119.054 117.609 1.445 18093 11114 1 16 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.197 -0.027 18093 11115 1 16 . 1 1 66 66 VAL C C 66 175.278 175.278 175.482 -0.204 18093 11116 1 16 . 1 1 66 66 VAL CA C 66 62.062 62.062 62.707 -0.645 18093 11117 1 16 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.513 0.116 18093 11118 1 16 . 1 1 66 66 VAL H H 66 7.740 7.740 7.785 -0.045 18093 11119 1 16 . 1 1 67 67 SER N N 67 118.882 118.882 115.702 3.180 18093 11120 1 16 . 1 1 67 67 SER HA H 67 4.704 4.704 4.807 -0.103 18093 11121 1 16 . 1 1 67 67 SER CA C 67 56.715 56.715 55.667 1.048 18093 11122 1 16 . 1 1 67 67 SER CB C 67 63.624 63.624 64.506 -0.882 18093 11123 1 16 . 1 1 67 67 SER H H 67 8.060 8.060 7.671 0.389 18093 11124 1 16 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.531 -0.131 18093 11125 1 16 . 1 1 68 68 PRO C C 68 176.925 176.925 176.164 0.761 18093 11126 1 16 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.942 0.806 18093 11127 1 16 . 1 1 68 68 PRO CB C 68 32.005 32.005 32.073 -0.068 18093 11128 1 16 . 1 1 69 69 SER N N 69 114.930 114.930 116.400 -1.470 18093 11129 1 16 . 1 1 69 69 SER HA H 69 4.422 4.422 4.615 -0.193 18093 11130 1 16 . 1 1 69 69 SER C C 69 175.617 175.617 175.454 0.163 18093 11131 1 16 . 1 1 69 69 SER CA C 69 58.697 58.697 56.956 1.741 18093 11132 1 16 . 1 1 69 69 SER CB C 69 63.804 63.804 66.180 -2.376 18093 11133 1 16 . 1 1 69 69 SER H H 69 8.205 8.205 7.963 0.242 18093 11134 1 16 . 1 1 70 70 ILE N N 70 120.840 120.840 123.333 -2.493 18093 11135 1 16 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.044 -0.052 18093 11136 1 16 . 1 1 70 70 ILE C C 70 177.524 177.524 176.526 0.998 18093 11137 1 16 . 1 1 70 70 ILE CA C 70 64.335 64.335 62.615 1.720 18093 11138 1 16 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.251 -0.791 18093 11139 1 16 . 1 1 70 70 ILE H H 70 8.283 8.283 8.696 -0.413 18093 11140 1 16 . 1 1 71 71 GLY N N 71 107.823 107.823 107.548 0.275 18093 11141 1 16 . 1 1 71 71 GLY C C 71 175.296 175.296 176.149 -0.853 18093 11142 1 16 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.131 0.324 18093 11143 1 16 . 1 1 71 71 GLY H H 71 8.557 8.557 8.565 -0.008 18093 11144 1 16 . 1 1 72 72 GLU N N 72 120.835 120.835 120.740 0.095 18093 11145 1 16 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.224 -0.377 18093 11146 1 16 . 1 1 72 72 GLU C C 72 178.198 178.198 178.204 -0.006 18093 11147 1 16 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.404 1.713 18093 11148 1 16 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.767 -0.374 18093 11149 1 16 . 1 1 72 72 GLU H H 72 7.922 7.922 7.813 0.109 18093 11150 1 16 . 1 1 73 73 TYR N N 73 117.375 117.375 122.520 -5.145 18093 11151 1 16 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.269 -0.107 18093 11152 1 16 . 1 1 73 73 TYR C C 73 179.912 179.912 177.183 2.729 18093 11153 1 16 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.514 0.641 18093 11154 1 16 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.683 0.083 18093 11155 1 16 . 1 1 73 73 TYR H H 73 8.062 8.062 7.898 0.164 18093 11156 1 16 . 1 1 74 74 LEU N N 74 121.493 121.493 119.240 2.253 18093 11157 1 16 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.750 0.299 18093 11158 1 16 . 1 1 74 74 LEU C C 74 178.063 178.063 179.007 -0.944 18093 11159 1 16 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.969 0.526 18093 11160 1 16 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.905 -0.058 18093 11161 1 16 . 1 1 74 74 LEU H H 74 8.552 8.552 8.835 -0.283 18093 11162 1 16 . 1 1 75 75 LEU N N 75 120.375 120.375 120.200 0.175 18093 11163 1 16 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.053 -0.013 18093 11164 1 16 . 1 1 75 75 LEU C C 75 178.515 178.515 178.322 0.193 18093 11165 1 16 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.047 0.591 18093 11166 1 16 . 1 1 75 75 LEU CB C 75 42.039 42.039 42.095 -0.056 18093 11167 1 16 . 1 1 75 75 LEU H H 75 8.276 8.276 7.428 0.848 18093 11168 1 16 . 1 1 76 76 PHE N N 76 116.626 116.626 118.314 -1.688 18093 11169 1 16 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.090 -0.011 18093 11170 1 16 . 1 1 76 76 PHE C C 76 177.399 177.399 178.040 -0.641 18093 11171 1 16 . 1 1 76 76 PHE CA C 76 61.734 61.734 61.688 0.046 18093 11172 1 16 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.571 0.170 18093 11173 1 16 . 1 1 76 76 PHE H H 76 8.454 8.454 8.071 0.383 18093 11174 1 16 . 1 1 77 77 THR N N 77 116.080 116.080 115.532 0.548 18093 11175 1 16 . 1 1 77 77 THR HA H 77 3.687 3.687 3.789 -0.102 18093 11176 1 16 . 1 1 77 77 THR C C 77 176.018 176.018 176.641 -0.623 18093 11177 1 16 . 1 1 77 77 THR CA C 77 68.640 68.640 67.078 1.562 18093 11178 1 16 . 1 1 77 77 THR H H 77 8.224 8.224 8.532 -0.308 18093 11179 1 16 . 1 1 78 78 MET N N 78 119.394 119.394 119.737 -0.343 18093 11180 1 16 . 1 1 78 78 MET HA H 78 4.129 4.129 4.110 0.019 18093 11181 1 16 . 1 1 78 78 MET C C 78 179.608 179.608 178.531 1.077 18093 11182 1 16 . 1 1 78 78 MET CA C 78 58.831 58.831 59.672 -0.841 18093 11183 1 16 . 1 1 78 78 MET CB C 78 31.590 31.590 32.542 -0.952 18093 11184 1 16 . 1 1 78 78 MET H H 78 8.372 8.372 7.438 0.934 18093 11185 1 16 . 1 1 79 79 ILE N N 79 121.819 121.819 118.567 3.252 18093 11186 1 16 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.717 -0.167 18093 11187 1 16 . 1 1 79 79 ILE C C 79 176.426 176.426 177.705 -1.279 18093 11188 1 16 . 1 1 79 79 ILE CA C 79 65.876 65.876 64.202 1.674 18093 11189 1 16 . 1 1 79 79 ILE CB C 79 37.673 37.673 37.583 0.090 18093 11190 1 16 . 1 1 79 79 ILE H H 79 8.391 8.391 7.208 1.183 18093 11191 1 16 . 1 1 80 80 PHE N N 80 119.916 119.916 121.414 -1.498 18093 11192 1 16 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.115 -0.062 18093 11193 1 16 . 1 1 80 80 PHE C C 80 178.568 178.568 177.055 1.513 18093 11194 1 16 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.293 0.014 18093 11195 1 16 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.771 -0.997 18093 11196 1 16 . 1 1 80 80 PHE H H 80 8.479 8.479 7.852 0.627 18093 11197 1 16 . 1 1 81 81 VAL N N 81 120.191 120.191 115.892 4.299 18093 11198 1 16 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.565 -0.112 18093 11199 1 16 . 1 1 81 81 VAL C C 81 178.225 178.225 177.657 0.568 18093 11200 1 16 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.700 0.708 18093 11201 1 16 . 1 1 81 81 VAL CB C 81 31.556 31.556 31.567 -0.011 18093 11202 1 16 . 1 1 81 81 VAL H H 81 8.928 8.928 8.716 0.212 18093 11203 1 16 . 1 1 82 82 THR N N 82 115.930 115.930 117.048 -1.118 18093 11204 1 16 . 1 1 82 82 THR HA H 82 3.636 3.636 3.960 -0.324 18093 11205 1 16 . 1 1 82 82 THR C C 82 176.420 176.420 176.681 -0.261 18093 11206 1 16 . 1 1 82 82 THR CA C 82 68.570 68.570 66.584 1.986 18093 11207 1 16 . 1 1 82 82 THR CB C 82 68.202 68.202 68.512 -0.310 18093 11208 1 16 . 1 1 82 82 THR H H 82 7.969 7.969 7.445 0.524 18093 11209 1 16 . 1 1 83 83 LEU N N 83 119.780 119.780 120.675 -0.895 18093 11210 1 16 . 1 1 83 83 LEU HA H 83 3.847 3.847 4.032 -0.185 18093 11211 1 16 . 1 1 83 83 LEU C C 83 178.214 178.214 178.761 -0.547 18093 11212 1 16 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.346 0.891 18093 11213 1 16 . 1 1 83 83 LEU CB C 83 41.791 41.791 40.585 1.206 18093 11214 1 16 . 1 1 83 83 LEU H H 83 8.483 8.483 7.478 1.005 18093 11215 1 16 . 1 1 84 84 SER N N 84 114.559 114.559 116.007 -1.448 18093 11216 1 16 . 1 1 84 84 SER HA H 84 4.099 4.099 4.083 0.016 18093 11217 1 16 . 1 1 84 84 SER C C 84 176.799 176.799 176.662 0.137 18093 11218 1 16 . 1 1 84 84 SER CA C 84 63.609 63.609 61.701 1.908 18093 11219 1 16 . 1 1 84 84 SER CB C 84 63.110 63.110 62.776 0.334 18093 11220 1 16 . 1 1 84 84 SER H H 84 8.023 8.023 7.469 0.554 18093 11221 1 16 . 1 1 85 85 ILE N N 85 123.962 123.962 121.273 2.689 18093 11222 1 16 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.814 -0.210 18093 11223 1 16 . 1 1 85 85 ILE C C 85 177.487 177.487 177.985 -0.498 18093 11224 1 16 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.162 0.597 18093 11225 1 16 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.959 -0.072 18093 11226 1 16 . 1 1 85 85 ILE H H 85 8.054 8.054 7.635 0.419 18093 11227 1 16 . 1 1 86 86 VAL N N 86 118.744 118.744 120.590 -1.846 18093 11228 1 16 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.695 -0.176 18093 11229 1 16 . 1 1 86 86 VAL C C 86 177.557 177.557 177.692 -0.135 18093 11230 1 16 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.544 0.991 18093 11231 1 16 . 1 1 86 86 VAL CB C 86 31.466 31.466 32.027 -0.561 18093 11232 1 16 . 1 1 86 86 VAL H H 86 8.158 8.158 7.228 0.930 18093 11233 1 16 . 1 1 87 87 ILE N N 87 117.206 117.206 119.557 -2.351 18093 11234 1 16 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.726 -0.122 18093 11235 1 16 . 1 1 87 87 ILE C C 87 177.283 177.283 178.386 -1.103 18093 11236 1 16 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.387 2.289 18093 11237 1 16 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.372 1.217 18093 11238 1 16 . 1 1 87 87 ILE H H 87 8.459 8.459 8.400 0.059 18093 11239 1 16 . 1 1 88 88 THR N N 88 116.158 116.158 117.122 -0.964 18093 11240 1 16 . 1 1 88 88 THR HA H 88 3.672 3.672 4.269 -0.597 18093 11241 1 16 . 1 1 88 88 THR C C 88 175.485 175.485 176.698 -1.213 18093 11242 1 16 . 1 1 88 88 THR CA C 88 68.549 68.549 67.066 1.483 18093 11243 1 16 . 1 1 88 88 THR CB C 88 68.127 68.127 68.678 -0.551 18093 11244 1 16 . 1 1 88 88 THR H H 88 7.776 7.776 8.407 -0.631 18093 11245 1 16 . 1 1 89 89 VAL N N 89 117.985 117.985 121.408 -3.423 18093 11246 1 16 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.828 -0.285 18093 11247 1 16 . 1 1 89 89 VAL C C 89 177.393 177.393 177.322 0.071 18093 11248 1 16 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.713 0.877 18093 11249 1 16 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.934 -0.156 18093 11250 1 16 . 1 1 89 89 VAL H H 89 8.206 8.206 7.562 0.644 18093 11251 1 16 . 1 1 90 90 PHE N N 90 116.709 116.709 119.682 -2.973 18093 11252 1 16 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.141 0.237 18093 11253 1 16 . 1 1 90 90 PHE C C 90 177.305 177.305 177.317 -0.012 18093 11254 1 16 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.217 -0.097 18093 11255 1 16 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.586 0.799 18093 11256 1 16 . 1 1 90 90 PHE H H 90 7.956 7.956 7.759 0.197 18093 11257 1 16 . 1 1 91 91 VAL N N 91 116.565 116.565 119.330 -2.765 18093 11258 1 16 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.762 0.073 18093 11259 1 16 . 1 1 91 91 VAL C C 91 176.927 176.927 177.525 -0.598 18093 11260 1 16 . 1 1 91 91 VAL CA C 91 65.347 65.347 65.863 -0.516 18093 11261 1 16 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.710 0.157 18093 11262 1 16 . 1 1 91 91 VAL H H 91 8.239 8.239 7.584 0.655 18093 11263 1 16 . 1 1 92 92 LEU N N 92 117.443 117.443 119.122 -1.679 18093 11264 1 16 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.215 -0.021 18093 11265 1 16 . 1 1 92 92 LEU C C 92 177.180 177.180 178.183 -1.003 18093 11266 1 16 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.724 -0.540 18093 11267 1 16 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.391 -0.447 18093 11268 1 16 . 1 1 92 92 LEU H H 92 7.967 7.967 7.711 0.256 18093 11269 1 16 . 1 1 93 93 ASN N N 93 116.705 116.705 116.227 0.478 18093 11270 1 16 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.604 0.043 18093 11271 1 16 . 1 1 93 93 ASN C C 93 175.129 175.129 175.516 -0.387 18093 11272 1 16 . 1 1 93 93 ASN CA C 93 53.854 53.854 54.136 -0.282 18093 11273 1 16 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.533 -0.138 18093 11274 1 16 . 1 1 93 93 ASN H H 93 7.683 7.683 7.769 -0.086 18093 11275 1 16 . 1 1 94 94 VAL N N 94 118.224 118.224 118.260 -0.036 18093 11276 1 16 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.732 0.229 18093 11277 1 16 . 1 1 94 94 VAL C C 94 175.600 175.600 173.976 1.624 18093 11278 1 16 . 1 1 94 94 VAL CA C 94 62.825 62.825 63.858 -1.034 18093 11279 1 16 . 1 1 94 94 VAL CB C 94 32.214 32.214 31.006 1.208 18093 11280 1 16 . 1 1 94 94 VAL H H 94 7.627 7.627 8.042 -0.415 18093 11281 1 16 . 1 1 95 95 HIS N N 95 120.999 120.999 123.812 -2.813 18093 11282 1 16 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.386 0.207 18093 11283 1 16 . 1 1 95 95 HIS C C 95 174.146 174.146 173.568 0.578 18093 11284 1 16 . 1 1 95 95 HIS CA C 95 55.666 55.666 55.202 0.464 18093 11285 1 16 . 1 1 95 95 HIS CB C 95 29.736 29.736 31.476 -1.740 18093 11286 1 16 . 1 1 95 95 HIS H H 95 8.263 8.263 8.267 -0.004 18093 11287 1 16 . 1 1 96 96 HIS N N 96 122.740 122.740 118.026 4.714 18093 11288 1 16 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.670 -0.037 18093 11289 1 16 . 1 1 96 96 HIS CA C 96 55.895 55.895 55.910 -0.015 18093 11290 1 16 . 1 1 96 96 HIS CB C 96 29.750 29.750 29.974 -0.224 18093 11291 1 16 . 1 1 96 96 HIS H H 96 8.298 8.298 7.838 0.460 18093 11292 1 16 . 1 1 97 97 ARG N N 97 118.503 118.503 121.328 -2.825 18093 11293 1 16 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.297 0.015 18093 11294 1 16 . 1 1 97 97 ARG C C 97 175.776 175.776 175.912 -0.136 18093 11295 1 16 . 1 1 97 97 ARG CA C 97 56.225 56.225 56.907 -0.682 18093 11296 1 16 . 1 1 97 97 ARG CB C 97 30.912 30.912 30.436 0.476 18093 11297 1 16 . 1 1 97 97 ARG H H 97 8.250 8.250 8.294 -0.044 18093 11298 1 16 . 1 1 98 98 SER N N 98 118.482 118.482 118.000 0.482 18093 11299 1 16 . 1 1 98 98 SER HA H 98 4.722 4.722 4.231 0.491 18093 11300 1 16 . 1 1 98 98 SER CA C 98 56.547 56.547 57.950 -1.403 18093 11301 1 16 . 1 1 98 98 SER CB C 98 63.624 63.624 63.827 -0.203 18093 11302 1 16 . 1 1 98 98 SER H H 98 8.254 8.254 8.625 -0.371 18093 11303 1 16 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.368 0.035 18093 11304 1 16 . 1 1 99 99 PRO C C 99 176.899 176.899 176.541 0.358 18093 11305 1 16 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.079 -0.378 18093 11306 1 16 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.161 -0.212 18093 11307 1 16 . 1 1 100 100 GLU N N 100 120.187 120.187 118.840 1.347 18093 11308 1 16 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.121 0.167 18093 11309 1 16 . 1 1 100 100 GLU C C 100 176.593 176.593 175.475 1.118 18093 11310 1 16 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.619 0.103 18093 11311 1 16 . 1 1 100 100 GLU CB C 100 29.999 29.999 29.424 0.575 18093 11312 1 16 . 1 1 100 100 GLU H H 100 8.401 8.401 8.506 -0.105 18093 11313 1 16 . 1 1 101 101 THR N N 101 113.968 113.968 113.727 0.241 18093 11314 1 16 . 1 1 101 101 THR HA H 101 4.286 4.286 4.688 -0.402 18093 11315 1 16 . 1 1 101 101 THR C C 101 174.525 174.525 174.390 0.135 18093 11316 1 16 . 1 1 101 101 THR CA C 101 61.956 61.956 61.755 0.201 18093 11317 1 16 . 1 1 101 101 THR CB C 101 69.697 69.697 68.740 0.957 18093 11318 1 16 . 1 1 101 101 THR H H 101 7.945 7.945 8.278 -0.333 18093 11319 1 16 . 1 1 102 102 HIS N N 102 120.322 120.322 121.251 -0.929 18093 11320 1 16 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.849 -0.108 18093 11321 1 16 . 1 1 102 102 HIS C C 102 174.783 174.783 174.544 0.239 18093 11322 1 16 . 1 1 102 102 HIS CA C 102 55.701 55.701 54.004 1.697 18093 11323 1 16 . 1 1 102 102 HIS CB C 102 29.093 29.093 30.913 -1.820 18093 11324 1 16 . 1 1 102 102 HIS H H 102 8.455 8.455 8.133 0.322 18093 11325 1 16 . 1 1 103 103 THR N N 103 114.282 114.282 112.416 1.866 18093 11326 1 16 . 1 1 103 103 THR HA H 103 4.352 4.352 4.352 0.000 18093 11327 1 16 . 1 1 103 103 THR C C 103 175.104 175.104 174.045 1.059 18093 11328 1 16 . 1 1 103 103 THR CA C 103 62.057 62.057 61.245 0.812 18093 11329 1 16 . 1 1 103 103 THR CB C 103 69.966 69.966 69.675 0.291 18093 11330 1 16 . 1 1 103 103 THR H H 103 8.069 8.069 8.197 -0.128 18093 11331 1 16 . 1 1 104 104 GLY N N 104 111.159 111.159 111.843 -0.684 18093 11332 1 16 . 1 1 104 104 GLY C C 104 174.776 174.776 173.871 0.905 18093 11333 1 16 . 1 1 104 104 GLY CA C 104 45.588 45.588 45.529 0.059 18093 11334 1 16 . 1 1 104 104 GLY H H 104 8.393 8.393 8.352 0.041 18093 11335 1 16 . 1 1 105 105 GLY N N 105 108.657 108.657 110.502 -1.845 18093 11336 1 16 . 1 1 105 105 GLY C C 105 174.957 174.957 174.562 0.395 18093 11337 1 16 . 1 1 105 105 GLY CA C 105 45.612 45.612 45.035 0.577 18093 11338 1 16 . 1 1 105 105 GLY H H 105 8.275 8.275 8.359 -0.084 18093 11339 1 16 . 1 1 106 106 GLY N N 106 108.870 108.870 108.483 0.387 18093 11340 1 16 . 1 1 106 106 GLY C C 106 174.877 174.877 174.131 0.746 18093 11341 1 16 . 1 1 106 106 GLY CA C 106 45.665 45.665 44.528 1.137 18093 11342 1 16 . 1 1 106 106 GLY H H 106 8.357 8.357 8.142 0.215 18093 11343 1 16 . 1 1 107 107 GLY N N 107 108.476 108.476 110.703 -2.227 18093 11344 1 16 . 1 1 107 107 GLY C C 107 174.877 174.877 174.975 -0.098 18093 11345 1 16 . 1 1 107 107 GLY CA C 107 45.696 45.696 46.199 -0.503 18093 11346 1 16 . 1 1 107 107 GLY H H 107 8.330 8.330 7.960 0.370 18093 11347 1 16 . 1 1 108 108 GLY N N 108 108.486 108.486 109.394 -0.908 18093 11348 1 16 . 1 1 108 108 GLY C C 108 175.345 175.345 175.123 0.222 18093 11349 1 16 . 1 1 108 108 GLY CA C 108 45.763 45.763 44.540 1.223 18093 11350 1 16 . 1 1 108 108 GLY H H 108 8.328 8.328 8.781 -0.453 18093 11351 1 16 . 1 1 109 109 ILE N N 109 120.433 120.433 120.050 0.383 18093 11352 1 16 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.964 0.004 18093 11353 1 16 . 1 1 109 109 ILE C C 109 176.127 176.127 177.061 -0.934 18093 11354 1 16 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.389 -0.654 18093 11355 1 16 . 1 1 109 109 ILE CB C 109 38.125 38.125 38.106 0.019 18093 11356 1 16 . 1 1 109 109 ILE H H 109 8.192 8.192 7.934 0.258 18093 11357 1 16 . 1 1 110 110 ASP N N 110 121.148 121.148 119.600 1.548 18093 11358 1 16 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.665 -0.359 18093 11359 1 16 . 1 1 110 110 ASP C C 110 177.651 177.651 178.306 -0.655 18093 11360 1 16 . 1 1 110 110 ASP CA C 110 56.776 56.776 57.978 -1.202 18093 11361 1 16 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.952 0.145 18093 11362 1 16 . 1 1 110 110 ASP H H 110 8.427 8.427 8.612 -0.185 18093 11363 1 16 . 1 1 111 111 ARG N N 111 119.228 119.228 119.049 0.179 18093 11364 1 16 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.271 -0.275 18093 11365 1 16 . 1 1 111 111 ARG C C 111 177.786 177.786 178.968 -1.182 18093 11366 1 16 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.078 -0.136 18093 11367 1 16 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.970 0.226 18093 11368 1 16 . 1 1 111 111 ARG H H 111 7.850 7.850 8.475 -0.625 18093 11369 1 16 . 1 1 112 112 ILE N N 112 118.000 118.000 119.673 -1.673 18093 11370 1 16 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.112 -0.299 18093 11371 1 16 . 1 1 112 112 ILE C C 112 177.496 177.496 177.933 -0.437 18093 11372 1 16 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.235 2.577 18093 11373 1 16 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.913 0.814 18093 11374 1 16 . 1 1 112 112 ILE H H 112 7.764 7.764 7.760 0.004 18093 11375 1 16 . 1 1 113 113 PHE N N 113 118.367 118.367 122.083 -3.716 18093 11376 1 16 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.262 -0.007 18093 11377 1 16 . 1 1 113 113 PHE C C 113 177.218 177.218 177.350 -0.132 18093 11378 1 16 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.353 -0.920 18093 11379 1 16 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.178 -0.371 18093 11380 1 16 . 1 1 113 113 PHE H H 113 7.963 7.963 7.923 0.040 18093 11381 1 16 . 1 1 114 114 LEU N N 114 118.921 118.921 117.827 1.094 18093 11382 1 16 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.957 0.040 18093 11383 1 16 . 1 1 114 114 LEU C C 114 178.297 178.297 178.379 -0.082 18093 11384 1 16 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.215 0.396 18093 11385 1 16 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.203 0.749 18093 11386 1 16 . 1 1 114 114 LEU H H 114 7.939 7.939 7.997 -0.058 18093 11387 1 16 . 1 1 115 115 TRP N N 115 117.464 117.464 119.462 -1.998 18093 11388 1 16 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.371 0.003 18093 11389 1 16 . 1 1 115 115 TRP C C 115 178.572 178.572 178.255 0.317 18093 11390 1 16 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.795 1.127 18093 11391 1 16 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.763 -1.256 18093 11392 1 16 . 1 1 115 115 TRP H H 115 7.969 7.969 7.612 0.357 18093 11393 1 16 . 1 1 116 116 MET N N 116 117.069 117.069 118.889 -1.820 18093 11394 1 16 . 1 1 116 116 MET HA H 116 4.065 4.065 4.225 -0.160 18093 11395 1 16 . 1 1 116 116 MET C C 116 177.425 177.425 178.194 -0.769 18093 11396 1 16 . 1 1 116 116 MET CA C 116 59.289 59.289 59.089 0.201 18093 11397 1 16 . 1 1 116 116 MET CB C 116 31.692 31.692 32.520 -0.828 18093 11398 1 16 . 1 1 116 116 MET H H 116 8.465 8.465 7.710 0.755 18093 11399 1 16 . 1 1 117 117 PHE N N 117 118.755 118.755 117.823 0.932 18093 11400 1 16 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.095 0.004 18093 11401 1 16 . 1 1 117 117 PHE C C 117 177.965 177.965 178.219 -0.254 18093 11402 1 16 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.407 -0.699 18093 11403 1 16 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.166 1.019 18093 11404 1 16 . 1 1 117 117 PHE H H 117 8.418 8.418 7.794 0.624 18093 11405 1 16 . 1 1 118 118 ILE N N 118 119.133 119.133 114.800 4.333 18093 11406 1 16 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.905 -0.561 18093 11407 1 16 . 1 1 118 118 ILE C C 118 177.244 177.244 177.451 -0.207 18093 11408 1 16 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.021 1.804 18093 11409 1 16 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.750 -0.202 18093 11410 1 16 . 1 1 118 118 ILE H H 118 8.266 8.266 7.658 0.608 18093 11411 1 16 . 1 1 119 119 ILE N N 119 118.846 118.846 121.375 -2.529 18093 11412 1 16 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.961 -0.389 18093 11413 1 16 . 1 1 119 119 ILE C C 119 177.523 177.523 177.621 -0.098 18093 11414 1 16 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.096 0.793 18093 11415 1 16 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.321 -0.757 18093 11416 1 16 . 1 1 119 119 ILE H H 119 8.308 8.308 7.311 0.997 18093 11417 1 16 . 1 1 120 120 VAL N N 120 119.228 119.228 117.510 1.718 18093 11418 1 16 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.830 -0.322 18093 11419 1 16 . 1 1 120 120 VAL C C 120 177.651 177.651 177.585 0.066 18093 11420 1 16 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.677 1.924 18093 11421 1 16 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.547 0.859 18093 11422 1 16 . 1 1 120 120 VAL H H 120 8.399 8.399 8.011 0.388 18093 11423 1 16 . 1 1 121 121 CYS N N 121 117.151 117.151 119.962 -2.811 18093 11424 1 16 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.099 -0.196 18093 11425 1 16 . 1 1 121 121 CYS C C 121 177.719 177.719 177.286 0.433 18093 11426 1 16 . 1 1 121 121 CYS CA C 121 64.298 64.298 63.877 0.421 18093 11427 1 16 . 1 1 121 121 CYS CB C 121 26.677 26.677 26.992 -0.315 18093 11428 1 16 . 1 1 121 121 CYS H H 121 8.008 8.008 7.586 0.422 18093 11429 1 16 . 1 1 122 122 LEU N N 122 121.402 121.402 120.507 0.895 18093 11430 1 16 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.169 -0.186 18093 11431 1 16 . 1 1 122 122 LEU C C 122 178.282 178.282 178.971 -0.689 18093 11432 1 16 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.791 0.753 18093 11433 1 16 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.276 0.690 18093 11434 1 16 . 1 1 122 122 LEU H H 122 8.417 8.417 7.593 0.824 18093 11435 1 16 . 1 1 123 123 LEU N N 123 118.543 118.543 119.939 -1.396 18093 11436 1 16 . 1 1 123 123 LEU HA H 123 3.920 3.920 3.984 -0.064 18093 11437 1 16 . 1 1 123 123 LEU C C 123 179.028 179.028 178.767 0.261 18093 11438 1 16 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.462 -0.345 18093 11439 1 16 . 1 1 123 123 LEU CB C 123 42.056 42.056 40.966 1.090 18093 11440 1 16 . 1 1 123 123 LEU H H 123 8.590 8.590 7.695 0.895 18093 11441 1 16 . 1 1 124 124 GLY N N 124 104.896 104.896 105.116 -0.220 18093 11442 1 16 . 1 1 124 124 GLY C C 124 173.932 173.932 175.906 -1.974 18093 11443 1 16 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.445 -0.218 18093 11444 1 16 . 1 1 124 124 GLY H H 124 8.601 8.601 8.318 0.283 18093 11445 1 16 . 1 1 125 125 THR N N 125 115.403 115.403 119.180 -3.777 18093 11446 1 16 . 1 1 125 125 THR HA H 125 3.686 3.686 3.821 -0.135 18093 11447 1 16 . 1 1 125 125 THR C C 125 176.407 176.407 176.618 -0.211 18093 11448 1 16 . 1 1 125 125 THR CA C 125 67.565 67.565 67.200 0.365 18093 11449 1 16 . 1 1 125 125 THR CB C 125 68.143 68.143 68.792 -0.649 18093 11450 1 16 . 1 1 125 125 THR H H 125 7.734 7.734 7.426 0.308 18093 11451 1 16 . 1 1 126 126 VAL N N 126 119.056 119.056 121.339 -2.283 18093 11452 1 16 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.656 -0.117 18093 11453 1 16 . 1 1 126 126 VAL C C 126 177.628 177.628 177.915 -0.287 18093 11454 1 16 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.827 -0.226 18093 11455 1 16 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.707 -0.213 18093 11456 1 16 . 1 1 126 126 VAL H H 126 8.015 8.015 7.928 0.087 18093 11457 1 16 . 1 1 127 127 GLY N N 127 104.644 104.644 107.639 -2.995 18093 11458 1 16 . 1 1 127 127 GLY C C 127 173.933 173.933 175.626 -1.693 18093 11459 1 16 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.196 0.085 18093 11460 1 16 . 1 1 127 127 GLY H H 127 8.248 8.248 8.177 0.071 18093 11461 1 16 . 1 1 128 128 LEU N N 128 117.354 117.354 120.298 -2.944 18093 11462 1 16 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.193 -0.181 18093 11463 1 16 . 1 1 128 128 LEU C C 128 177.443 177.443 177.844 -0.401 18093 11464 1 16 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.470 0.156 18093 11465 1 16 . 1 1 128 128 LEU CB C 128 42.260 42.260 42.143 0.117 18093 11466 1 16 . 1 1 128 128 LEU H H 128 7.568 7.568 7.838 -0.270 18093 11467 1 16 . 1 1 129 129 PHE N N 129 113.971 113.971 118.177 -4.206 18093 11468 1 16 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.249 0.209 18093 11469 1 16 . 1 1 129 129 PHE C C 129 176.216 176.216 176.393 -0.177 18093 11470 1 16 . 1 1 129 129 PHE CA C 129 58.385 58.385 61.086 -2.700 18093 11471 1 16 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.922 -0.203 18093 11472 1 16 . 1 1 129 129 PHE H H 129 7.639 7.639 7.598 0.041 18093 11473 1 16 . 1 1 130 130 LEU N N 130 117.752 117.752 118.758 -1.006 18093 11474 1 16 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.129 0.304 18093 11475 1 16 . 1 1 130 130 LEU CA C 130 54.156 54.156 54.257 -0.101 18093 11476 1 16 . 1 1 130 130 LEU H H 130 8.099 8.099 7.724 0.375 18093 11477 1 16 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.798 -0.348 18093 11478 1 16 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.794 2.105 18093 11479 1 16 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.445 -0.183 18093 11480 1 16 . 1 1 132 132 PRO C C 132 177.616 177.616 176.414 1.202 18093 11481 1 16 . 1 1 132 132 PRO CA C 132 64.980 64.980 63.113 1.867 18093 11482 1 16 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.559 -0.934 18093 11483 1 16 . 1 1 133 133 TRP N N 133 115.508 115.508 120.275 -4.767 18093 11484 1 16 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.286 0.306 18093 11485 1 16 . 1 1 133 133 TRP C C 133 176.842 176.842 176.106 0.736 18093 11486 1 16 . 1 1 133 133 TRP CA C 133 57.283 57.283 57.710 -0.427 18093 11487 1 16 . 1 1 133 133 TRP CB C 133 28.596 28.596 27.628 0.968 18093 11488 1 16 . 1 1 133 133 TRP H H 133 7.311 7.311 8.403 -1.092 18093 11489 1 16 . 1 1 134 134 LEU N N 134 119.570 119.570 121.006 -1.436 18093 11490 1 16 . 1 1 134 134 LEU HA H 134 4.177 4.177 3.862 0.315 18093 11491 1 16 . 1 1 134 134 LEU C C 134 175.768 175.768 176.327 -0.559 18093 11492 1 16 . 1 1 134 134 LEU CA C 134 55.621 55.621 55.914 -0.293 18093 11493 1 16 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.255 1.393 18093 11494 1 16 . 1 1 134 134 LEU H H 134 7.453 7.453 8.927 -1.474 18093 11495 1 16 . 1 1 135 135 ALA N N 135 119.004 119.004 121.935 -2.931 18093 11496 1 16 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.211 0.012 18093 11497 1 16 . 1 1 135 135 ALA C C 135 177.170 177.170 178.134 -0.964 18093 11498 1 16 . 1 1 135 135 ALA CA C 135 52.456 52.456 54.048 -1.592 18093 11499 1 16 . 1 1 135 135 ALA CB C 135 19.736 19.736 19.333 0.403 18093 11500 1 16 . 1 1 135 135 ALA H H 135 7.541 7.541 8.160 -0.619 18093 11501 1 16 . 1 1 136 136 GLY N N 136 105.879 105.879 106.021 -0.142 18093 11502 1 16 . 1 1 136 136 GLY C C 136 173.042 173.042 173.971 -0.929 18093 11503 1 16 . 1 1 136 136 GLY CA C 136 45.693 45.693 44.943 0.750 18093 11504 1 16 . 1 1 136 136 GLY H H 136 7.846 7.846 8.291 -0.445 18093 11505 1 17 . 1 1 5 5 GLU N N 5 119.627 119.627 118.120 1.507 18093 11506 1 17 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.355 -0.147 18093 11507 1 17 . 1 1 5 5 GLU C C 5 176.581 176.581 174.968 1.613 18093 11508 1 17 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.452 0.593 18093 11509 1 17 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.327 0.711 18093 11510 1 17 . 1 1 5 5 GLU H H 5 8.003 8.003 8.292 -0.289 18093 11511 1 17 . 1 1 6 6 LEU N N 6 121.267 121.267 121.626 -0.359 18093 11512 1 17 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.417 0.008 18093 11513 1 17 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.397 2.238 18093 11514 1 17 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.325 -0.029 18093 11515 1 17 . 1 1 6 6 LEU H H 6 8.104 8.104 7.827 0.277 18093 11516 1 17 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.563 -0.164 18093 11517 1 17 . 1 1 7 7 PRO C C 7 178.408 178.408 177.590 0.818 18093 11518 1 17 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.123 2.589 18093 11519 1 17 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.696 -0.778 18093 11520 1 17 . 1 1 8 8 LEU N N 8 121.835 121.835 120.107 1.728 18093 11521 1 17 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.263 -0.174 18093 11522 1 17 . 1 1 8 8 LEU C C 8 177.902 177.902 178.550 -0.648 18093 11523 1 17 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.548 0.557 18093 11524 1 17 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.201 0.406 18093 11525 1 17 . 1 1 8 8 LEU H H 8 8.162 8.162 8.471 -0.309 18093 11526 1 17 . 1 1 9 9 PHE N N 9 118.342 118.342 118.654 -0.312 18093 11527 1 17 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.173 0.016 18093 11528 1 17 . 1 1 9 9 PHE C C 9 177.596 177.596 177.038 0.558 18093 11529 1 17 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.236 -0.122 18093 11530 1 17 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.194 0.533 18093 11531 1 17 . 1 1 9 9 PHE H H 9 8.318 8.318 8.356 -0.038 18093 11532 1 17 . 1 1 10 10 TYR N N 10 117.584 117.584 117.682 -0.098 18093 11533 1 17 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.812 0.342 18093 11534 1 17 . 1 1 10 10 TYR C C 10 177.630 177.630 177.394 0.236 18093 11535 1 17 . 1 1 10 10 TYR CA C 10 61.036 61.036 60.873 0.163 18093 11536 1 17 . 1 1 10 10 TYR CB C 10 38.660 38.660 37.951 0.709 18093 11537 1 17 . 1 1 10 10 TYR H H 10 8.105 8.105 7.677 0.428 18093 11538 1 17 . 1 1 11 11 THR N N 11 115.563 115.563 116.619 -1.056 18093 11539 1 17 . 1 1 11 11 THR HA H 11 3.871 3.871 4.024 -0.153 18093 11540 1 17 . 1 1 11 11 THR C C 11 175.955 175.955 176.542 -0.587 18093 11541 1 17 . 1 1 11 11 THR CA C 11 67.290 67.290 66.755 0.535 18093 11542 1 17 . 1 1 11 11 THR CB C 11 68.201 68.201 68.582 -0.381 18093 11543 1 17 . 1 1 11 11 THR H H 11 7.915 7.915 7.819 0.096 18093 11544 1 17 . 1 1 12 12 ILE N N 12 119.727 119.727 120.149 -0.422 18093 11545 1 17 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.900 -0.201 18093 11546 1 17 . 1 1 12 12 ILE C C 12 175.773 175.773 177.469 -1.696 18093 11547 1 17 . 1 1 12 12 ILE CA C 12 64.699 64.699 62.371 2.328 18093 11548 1 17 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.757 1.339 18093 11549 1 17 . 1 1 12 12 ILE H H 12 8.186 8.186 7.907 0.279 18093 11550 1 17 . 1 1 13 13 ASN N N 13 114.190 114.190 118.809 -4.619 18093 11551 1 17 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.478 -0.056 18093 11552 1 17 . 1 1 13 13 ASN C C 13 174.786 174.786 176.861 -2.075 18093 11553 1 17 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.836 -0.281 18093 11554 1 17 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.607 0.751 18093 11555 1 17 . 1 1 13 13 ASN H H 13 7.601 7.601 7.410 0.191 18093 11556 1 17 . 1 1 14 14 LEU N N 14 115.031 115.031 116.813 -1.782 18093 11557 1 17 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.154 0.042 18093 11558 1 17 . 1 1 14 14 LEU C C 14 177.540 177.540 177.797 -0.257 18093 11559 1 17 . 1 1 14 14 LEU CA C 14 56.407 56.407 57.346 -0.939 18093 11560 1 17 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.142 -0.300 18093 11561 1 17 . 1 1 14 14 LEU H H 14 7.390 7.390 7.463 -0.073 18093 11562 1 17 . 1 1 15 15 ILE N N 15 118.223 118.223 119.593 -1.370 18093 11563 1 17 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.703 -0.090 18093 11564 1 17 . 1 1 15 15 ILE CA C 15 65.720 65.720 63.434 2.286 18093 11565 1 17 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.591 -0.979 18093 11566 1 17 . 1 1 15 15 ILE H H 15 8.123 8.123 7.503 0.620 18093 11567 1 17 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.322 -0.253 18093 11568 1 17 . 1 1 17 17 PRO C C 17 177.721 177.721 178.932 -1.211 18093 11569 1 17 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.417 1.344 18093 11570 1 17 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.719 0.023 18093 11571 1 17 . 1 1 18 18 CYS N N 18 113.538 113.538 117.392 -3.854 18093 11572 1 17 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.068 -0.060 18093 11573 1 17 . 1 1 18 18 CYS C C 18 177.683 177.683 177.295 0.388 18093 11574 1 17 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.574 0.926 18093 11575 1 17 . 1 1 18 18 CYS CB C 18 26.873 26.873 27.111 -0.238 18093 11576 1 17 . 1 1 18 18 CYS H H 18 7.410 7.410 7.412 -0.002 18093 11577 1 17 . 1 1 19 19 LEU N N 19 122.545 122.545 119.522 3.023 18093 11578 1 17 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.079 -0.080 18093 11579 1 17 . 1 1 19 19 LEU C C 19 178.608 178.608 178.918 -0.310 18093 11580 1 17 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.329 1.092 18093 11581 1 17 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.370 0.474 18093 11582 1 17 . 1 1 19 19 LEU H H 19 8.635 8.635 7.397 1.238 18093 11583 1 17 . 1 1 20 20 LEU N N 20 119.404 119.404 120.900 -1.496 18093 11584 1 17 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.882 0.124 18093 11585 1 17 . 1 1 20 20 LEU C C 20 178.540 178.540 179.138 -0.598 18093 11586 1 17 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.265 0.534 18093 11587 1 17 . 1 1 20 20 LEU CB C 20 41.999 41.999 42.116 -0.117 18093 11588 1 17 . 1 1 20 20 LEU H H 20 8.392 8.392 7.480 0.912 18093 11589 1 17 . 1 1 21 21 ILE N N 21 117.335 117.335 114.048 3.287 18093 11590 1 17 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.704 -0.053 18093 11591 1 17 . 1 1 21 21 ILE C C 21 177.249 177.249 177.387 -0.138 18093 11592 1 17 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.525 0.736 18093 11593 1 17 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.238 0.722 18093 11594 1 17 . 1 1 21 21 ILE H H 21 8.403 8.403 8.345 0.058 18093 11595 1 17 . 1 1 22 22 SER N N 22 116.385 116.385 117.875 -1.490 18093 11596 1 17 . 1 1 22 22 SER HA H 22 4.056 4.056 4.140 -0.084 18093 11597 1 17 . 1 1 22 22 SER C C 22 176.813 176.813 176.653 0.160 18093 11598 1 17 . 1 1 22 22 SER CA C 22 63.866 63.866 61.545 2.321 18093 11599 1 17 . 1 1 22 22 SER CB C 22 62.898 62.898 63.221 -0.323 18093 11600 1 17 . 1 1 22 22 SER H H 22 8.271 8.271 7.554 0.717 18093 11601 1 17 . 1 1 23 23 CYS N N 23 119.001 119.001 121.347 -2.346 18093 11602 1 17 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.099 -0.109 18093 11603 1 17 . 1 1 23 23 CYS C C 23 177.594 177.594 176.993 0.601 18093 11604 1 17 . 1 1 23 23 CYS CA C 23 64.429 64.429 62.970 1.459 18093 11605 1 17 . 1 1 23 23 CYS CB C 23 26.940 26.940 26.136 0.804 18093 11606 1 17 . 1 1 23 23 CYS H H 23 8.161 8.161 8.666 -0.505 18093 11607 1 17 . 1 1 24 24 LEU N N 24 117.814 117.814 121.249 -3.435 18093 11608 1 17 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.898 0.079 18093 11609 1 17 . 1 1 24 24 LEU C C 24 177.944 177.944 178.927 -0.983 18093 11610 1 17 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.694 -0.407 18093 11611 1 17 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.103 0.800 18093 11612 1 17 . 1 1 24 24 LEU H H 24 8.106 8.106 7.680 0.426 18093 11613 1 17 . 1 1 25 25 THR N N 25 115.670 115.670 114.567 1.103 18093 11614 1 17 . 1 1 25 25 THR HA H 25 3.687 3.687 3.883 -0.196 18093 11615 1 17 . 1 1 25 25 THR C C 25 175.845 175.845 176.951 -1.106 18093 11616 1 17 . 1 1 25 25 THR CA C 25 68.306 68.306 66.268 2.038 18093 11617 1 17 . 1 1 25 25 THR H H 25 7.924 7.924 7.577 0.347 18093 11618 1 17 . 1 1 26 26 VAL N N 26 118.809 118.809 121.090 -2.281 18093 11619 1 17 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.831 -0.316 18093 11620 1 17 . 1 1 26 26 VAL C C 26 177.530 177.530 177.481 0.049 18093 11621 1 17 . 1 1 26 26 VAL CA C 26 67.281 67.281 65.762 1.519 18093 11622 1 17 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.262 0.462 18093 11623 1 17 . 1 1 26 26 VAL H H 26 7.764 7.764 7.269 0.495 18093 11624 1 17 . 1 1 27 27 LEU N N 27 117.958 117.958 121.482 -3.524 18093 11625 1 17 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.068 -0.032 18093 11626 1 17 . 1 1 27 27 LEU C C 27 178.163 178.163 178.891 -0.728 18093 11627 1 17 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.402 0.107 18093 11628 1 17 . 1 1 27 27 LEU CB C 27 41.919 41.919 41.080 0.839 18093 11629 1 17 . 1 1 27 27 LEU H H 27 7.912 7.912 7.996 -0.084 18093 11630 1 17 . 1 1 28 28 VAL N N 28 114.472 114.472 117.600 -3.128 18093 11631 1 17 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.755 -0.220 18093 11632 1 17 . 1 1 28 28 VAL C C 28 176.871 176.871 177.274 -0.403 18093 11633 1 17 . 1 1 28 28 VAL CA C 28 65.977 65.977 65.829 0.148 18093 11634 1 17 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.569 0.365 18093 11635 1 17 . 1 1 28 28 VAL H H 28 7.892 7.892 7.497 0.395 18093 11636 1 17 . 1 1 29 29 PHE N N 29 115.206 115.206 115.553 -0.347 18093 11637 1 17 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.199 0.004 18093 11638 1 17 . 1 1 29 29 PHE C C 29 176.614 176.614 176.554 0.060 18093 11639 1 17 . 1 1 29 29 PHE CA C 29 60.964 60.964 59.488 1.476 18093 11640 1 17 . 1 1 29 29 PHE CB C 29 39.752 39.752 38.424 1.328 18093 11641 1 17 . 1 1 29 29 PHE H H 29 7.748 7.748 7.714 0.034 18093 11642 1 17 . 1 1 30 30 TYR N N 30 115.975 115.975 119.023 -3.048 18093 11643 1 17 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.563 -0.241 18093 11644 1 17 . 1 1 30 30 TYR C C 30 175.553 175.553 176.018 -0.465 18093 11645 1 17 . 1 1 30 30 TYR CA C 30 59.598 59.598 59.737 -0.139 18093 11646 1 17 . 1 1 30 30 TYR CB C 30 39.763 39.763 40.233 -0.470 18093 11647 1 17 . 1 1 30 30 TYR H H 30 7.985 7.985 7.635 0.350 18093 11648 1 17 . 1 1 31 31 LEU N N 31 120.780 120.780 120.266 0.514 18093 11649 1 17 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.642 -0.215 18093 11650 1 17 . 1 1 31 31 LEU CA C 31 54.665 54.665 52.758 1.907 18093 11651 1 17 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.668 -1.280 18093 11652 1 17 . 1 1 31 31 LEU H H 31 7.643 7.643 7.621 0.022 18093 11653 1 17 . 1 1 34 34 GLU C C 34 176.271 176.271 175.549 0.722 18093 11654 1 17 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.746 1.844 18093 11655 1 17 . 1 1 35 35 CYS N N 35 116.430 116.430 120.856 -4.426 18093 11656 1 17 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.667 -0.300 18093 11657 1 17 . 1 1 35 35 CYS C C 35 175.198 175.198 176.198 -1.000 18093 11658 1 17 . 1 1 35 35 CYS CA C 35 60.293 60.293 58.649 1.644 18093 11659 1 17 . 1 1 35 35 CYS CB C 35 28.130 28.130 28.640 -0.510 18093 11660 1 17 . 1 1 35 35 CYS H H 35 7.970 7.970 8.585 -0.615 18093 11661 1 17 . 1 1 36 36 GLY N N 36 108.315 108.315 109.359 -1.044 18093 11662 1 17 . 1 1 36 36 GLY C C 36 174.610 174.610 175.306 -0.696 18093 11663 1 17 . 1 1 36 36 GLY CA C 36 46.004 46.004 46.522 -0.518 18093 11664 1 17 . 1 1 36 36 GLY H H 36 8.120 8.120 8.269 -0.149 18093 11665 1 17 . 1 1 37 37 GLU N N 37 121.347 121.347 120.604 0.743 18093 11666 1 17 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.050 -0.003 18093 11667 1 17 . 1 1 37 37 GLU C C 37 177.338 177.338 179.038 -1.700 18093 11668 1 17 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.713 -1.206 18093 11669 1 17 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.460 0.110 18093 11670 1 17 . 1 1 37 37 GLU H H 37 8.423 8.423 8.786 -0.363 18093 11671 1 17 . 1 1 38 38 LYS N N 38 123.788 123.788 119.611 4.177 18093 11672 1 17 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.143 0.053 18093 11673 1 17 . 1 1 38 38 LYS C C 38 177.976 177.976 178.972 -0.996 18093 11674 1 17 . 1 1 38 38 LYS CA C 38 58.273 58.273 59.925 -1.652 18093 11675 1 17 . 1 1 38 38 LYS CB C 38 31.649 31.649 32.054 -0.405 18093 11676 1 17 . 1 1 38 38 LYS H H 38 8.211 8.211 8.262 -0.051 18093 11677 1 17 . 1 1 39 39 ILE N N 39 115.675 115.675 119.015 -3.340 18093 11678 1 17 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.860 -0.252 18093 11679 1 17 . 1 1 39 39 ILE C C 39 177.204 177.204 178.260 -1.056 18093 11680 1 17 . 1 1 39 39 ILE CA C 39 65.501 65.501 64.225 1.276 18093 11681 1 17 . 1 1 39 39 ILE H H 39 7.933 7.933 7.582 0.351 18093 11682 1 17 . 1 1 40 40 THR N N 40 117.411 117.411 116.168 1.243 18093 11683 1 17 . 1 1 40 40 THR HA H 40 3.844 3.844 4.001 -0.157 18093 11684 1 17 . 1 1 40 40 THR C C 40 175.983 175.983 176.934 -0.951 18093 11685 1 17 . 1 1 40 40 THR CA C 40 67.360 67.360 66.130 1.230 18093 11686 1 17 . 1 1 40 40 THR H H 40 8.362 8.362 7.804 0.558 18093 11687 1 17 . 1 1 41 41 LEU N N 41 123.059 123.059 123.038 0.021 18093 11688 1 17 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.108 -0.092 18093 11689 1 17 . 1 1 41 41 LEU C C 41 178.914 178.914 177.945 0.969 18093 11690 1 17 . 1 1 41 41 LEU CA C 41 58.366 58.366 58.240 0.126 18093 11691 1 17 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.948 0.102 18093 11692 1 17 . 1 1 41 41 LEU H H 41 8.282 8.282 8.029 0.253 18093 11693 1 17 . 1 1 42 42 CYS N N 42 118.762 118.762 118.232 0.530 18093 11694 1 17 . 1 1 42 42 CYS HA H 42 3.936 3.936 3.965 -0.029 18093 11695 1 17 . 1 1 42 42 CYS C C 42 176.607 176.607 176.659 -0.052 18093 11696 1 17 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.987 0.330 18093 11697 1 17 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.566 -0.647 18093 11698 1 17 . 1 1 42 42 CYS H H 42 8.195 8.195 7.805 0.390 18093 11699 1 17 . 1 1 43 43 ILE N N 43 117.589 117.589 120.081 -2.492 18093 11700 1 17 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.620 -0.013 18093 11701 1 17 . 1 1 43 43 ILE C C 43 177.323 177.323 178.241 -0.918 18093 11702 1 17 . 1 1 43 43 ILE CA C 43 65.249 65.249 65.646 -0.397 18093 11703 1 17 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.728 0.310 18093 11704 1 17 . 1 1 43 43 ILE H H 43 8.428 8.428 7.645 0.783 18093 11705 1 17 . 1 1 44 44 SER N N 44 115.950 115.950 115.992 -0.042 18093 11706 1 17 . 1 1 44 44 SER HA H 44 4.012 4.012 4.214 -0.202 18093 11707 1 17 . 1 1 44 44 SER C C 44 176.965 176.965 176.882 0.083 18093 11708 1 17 . 1 1 44 44 SER CA C 44 63.575 63.575 62.083 1.492 18093 11709 1 17 . 1 1 44 44 SER H H 44 7.984 7.984 7.549 0.435 18093 11710 1 17 . 1 1 45 45 VAL N N 45 123.544 123.544 121.896 1.648 18093 11711 1 17 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.865 -0.317 18093 11712 1 17 . 1 1 45 45 VAL C C 45 177.139 177.139 179.078 -1.939 18093 11713 1 17 . 1 1 45 45 VAL CA C 45 67.233 67.233 65.640 1.593 18093 11714 1 17 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.444 0.198 18093 11715 1 17 . 1 1 45 45 VAL H H 45 8.280 8.280 8.271 0.009 18093 11716 1 17 . 1 1 46 46 LEU N N 46 119.883 119.883 120.773 -0.890 18093 11717 1 17 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.082 -0.139 18093 11718 1 17 . 1 1 46 46 LEU C C 46 180.125 180.125 178.452 1.673 18093 11719 1 17 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.838 0.762 18093 11720 1 17 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.948 0.064 18093 11721 1 17 . 1 1 46 46 LEU H H 46 8.117 8.117 7.968 0.149 18093 11722 1 17 . 1 1 47 47 LEU N N 47 120.193 120.193 119.484 0.709 18093 11723 1 17 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.917 0.087 18093 11724 1 17 . 1 1 47 47 LEU C C 47 178.370 178.370 178.421 -0.051 18093 11725 1 17 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.303 0.123 18093 11726 1 17 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.733 0.323 18093 11727 1 17 . 1 1 47 47 LEU H H 47 8.933 8.933 7.878 1.055 18093 11728 1 17 . 1 1 48 48 SER N N 48 115.861 115.861 115.652 0.209 18093 11729 1 17 . 1 1 48 48 SER HA H 48 4.013 4.013 4.163 -0.150 18093 11730 1 17 . 1 1 48 48 SER C C 48 175.642 175.642 176.604 -0.962 18093 11731 1 17 . 1 1 48 48 SER CA C 48 63.571 63.571 62.111 1.460 18093 11732 1 17 . 1 1 48 48 SER CB C 48 62.879 62.879 62.615 0.264 18093 11733 1 17 . 1 1 48 48 SER H H 48 7.996 7.996 7.748 0.248 18093 11734 1 17 . 1 1 49 49 LEU N N 49 120.673 120.673 122.515 -1.842 18093 11735 1 17 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.048 -0.013 18093 11736 1 17 . 1 1 49 49 LEU C C 49 178.229 178.229 178.831 -0.602 18093 11737 1 17 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.283 0.000 18093 11738 1 17 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.115 -0.169 18093 11739 1 17 . 1 1 49 49 LEU H H 49 8.352 8.352 7.690 0.662 18093 11740 1 17 . 1 1 50 50 THR N N 50 115.582 115.582 114.523 1.059 18093 11741 1 17 . 1 1 50 50 THR HA H 50 3.672 3.672 4.081 -0.409 18093 11742 1 17 . 1 1 50 50 THR C C 50 175.877 175.877 176.310 -0.433 18093 11743 1 17 . 1 1 50 50 THR CA C 50 68.628 68.628 66.284 2.344 18093 11744 1 17 . 1 1 50 50 THR H H 50 7.937 7.937 7.650 0.287 18093 11745 1 17 . 1 1 51 51 VAL N N 51 119.774 119.774 122.825 -3.051 18093 11746 1 17 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.801 -0.303 18093 11747 1 17 . 1 1 51 51 VAL C C 51 177.162 177.162 177.061 0.101 18093 11748 1 17 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.490 1.095 18093 11749 1 17 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.743 -0.222 18093 11750 1 17 . 1 1 51 51 VAL H H 51 8.115 8.115 7.805 0.310 18093 11751 1 17 . 1 1 52 52 PHE N N 52 118.808 118.808 119.888 -1.080 18093 11752 1 17 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.294 -0.172 18093 11753 1 17 . 1 1 52 52 PHE C C 52 176.697 176.697 177.073 -0.376 18093 11754 1 17 . 1 1 52 52 PHE CA C 52 61.771 61.771 61.257 0.514 18093 11755 1 17 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.441 -0.180 18093 11756 1 17 . 1 1 52 52 PHE H H 52 8.256 8.256 8.573 -0.317 18093 11757 1 17 . 1 1 53 53 LEU N N 53 117.267 117.267 121.306 -4.039 18093 11758 1 17 . 1 1 53 53 LEU HA H 53 3.893 3.893 4.160 -0.267 18093 11759 1 17 . 1 1 53 53 LEU C C 53 179.319 179.319 177.946 1.373 18093 11760 1 17 . 1 1 53 53 LEU CA C 53 57.985 57.985 58.187 -0.202 18093 11761 1 17 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.499 0.328 18093 11762 1 17 . 1 1 53 53 LEU H H 53 8.443 8.443 7.703 0.740 18093 11763 1 17 . 1 1 54 54 LEU N N 54 119.762 119.762 119.131 0.631 18093 11764 1 17 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.954 0.100 18093 11765 1 17 . 1 1 54 54 LEU C C 54 178.827 178.827 178.967 -0.140 18093 11766 1 17 . 1 1 54 54 LEU CA C 54 58.105 58.105 58.137 -0.032 18093 11767 1 17 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.829 0.118 18093 11768 1 17 . 1 1 54 54 LEU H H 54 8.205 8.205 7.416 0.789 18093 11769 1 17 . 1 1 55 55 LEU N N 55 118.585 118.585 118.363 0.222 18093 11770 1 17 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.813 0.264 18093 11771 1 17 . 1 1 55 55 LEU C C 55 178.909 178.909 178.643 0.266 18093 11772 1 17 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.758 0.350 18093 11773 1 17 . 1 1 55 55 LEU CB C 55 41.979 41.979 41.545 0.434 18093 11774 1 17 . 1 1 55 55 LEU H H 55 8.179 8.179 7.339 0.840 18093 11775 1 17 . 1 1 56 56 ILE N N 56 116.079 116.079 115.011 1.068 18093 11776 1 17 . 1 1 56 56 ILE HA H 56 3.729 3.729 3.873 -0.144 18093 11777 1 17 . 1 1 56 56 ILE C C 56 176.988 176.988 177.980 -0.992 18093 11778 1 17 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.561 0.696 18093 11779 1 17 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.846 0.571 18093 11780 1 17 . 1 1 56 56 ILE H H 56 8.040 8.040 7.405 0.635 18093 11781 1 17 . 1 1 57 57 THR N N 57 110.105 110.105 109.074 1.031 18093 11782 1 17 . 1 1 57 57 THR HA H 57 4.015 4.015 4.229 -0.214 18093 11783 1 17 . 1 1 57 57 THR C C 57 175.435 175.435 175.785 -0.350 18093 11784 1 17 . 1 1 57 57 THR CA C 57 65.067 65.067 64.272 0.795 18093 11785 1 17 . 1 1 57 57 THR CB C 57 69.179 69.179 68.824 0.355 18093 11786 1 17 . 1 1 57 57 THR H H 57 7.655 7.655 7.779 -0.124 18093 11787 1 17 . 1 1 58 58 GLU N N 58 117.313 117.313 121.464 -4.151 18093 11788 1 17 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.273 0.060 18093 11789 1 17 . 1 1 58 58 GLU C C 58 176.940 176.940 178.139 -1.199 18093 11790 1 17 . 1 1 58 58 GLU CA C 58 57.068 57.068 58.183 -1.115 18093 11791 1 17 . 1 1 58 58 GLU CB C 58 29.396 29.396 30.256 -0.860 18093 11792 1 17 . 1 1 58 58 GLU H H 58 7.521 7.521 7.821 -0.300 18093 11793 1 17 . 1 1 59 59 ILE N N 59 114.870 114.870 113.876 0.994 18093 11794 1 17 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.038 0.051 18093 11795 1 17 . 1 1 59 59 ILE C C 59 175.456 175.456 176.062 -0.606 18093 11796 1 17 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.028 0.406 18093 11797 1 17 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.641 0.016 18093 11798 1 17 . 1 1 59 59 ILE H H 59 7.579 7.579 7.203 0.376 18093 11799 1 17 . 1 1 60 60 ILE N N 60 119.354 119.354 117.679 1.675 18093 11800 1 17 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.820 0.484 18093 11801 1 17 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.480 -1.863 18093 11802 1 17 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.522 2.340 18093 11803 1 17 . 1 1 60 60 ILE H H 60 7.629 7.629 7.540 0.089 18093 11804 1 17 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.463 -0.063 18093 11805 1 17 . 1 1 61 61 PRO C C 61 177.144 177.144 177.155 -0.011 18093 11806 1 17 . 1 1 61 61 PRO CA C 61 63.808 63.808 65.106 -1.298 18093 11807 1 17 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.509 -0.627 18093 11808 1 17 . 1 1 62 62 SER N N 62 114.474 114.474 109.063 5.411 18093 11809 1 17 . 1 1 62 62 SER HA H 62 4.434 4.434 4.403 0.031 18093 11810 1 17 . 1 1 62 62 SER C C 62 175.161 175.161 173.346 1.815 18093 11811 1 17 . 1 1 62 62 SER CA C 62 59.047 59.047 59.089 -0.042 18093 11812 1 17 . 1 1 62 62 SER CB C 62 63.704 63.704 63.555 0.149 18093 11813 1 17 . 1 1 62 62 SER H H 62 8.186 8.186 7.906 0.280 18093 11814 1 17 . 1 1 63 63 THR N N 63 113.573 113.573 113.800 -0.227 18093 11815 1 17 . 1 1 63 63 THR HA H 63 4.319 4.319 4.032 0.287 18093 11816 1 17 . 1 1 63 63 THR C C 63 174.834 174.834 174.269 0.565 18093 11817 1 17 . 1 1 63 63 THR CA C 63 62.377 62.377 63.307 -0.930 18093 11818 1 17 . 1 1 63 63 THR CB C 63 69.422 69.422 67.434 1.988 18093 11819 1 17 . 1 1 63 63 THR H H 63 7.963 7.963 8.088 -0.125 18093 11820 1 17 . 1 1 64 64 SER N N 64 116.598 116.598 115.856 0.742 18093 11821 1 17 . 1 1 64 64 SER HA H 64 4.428 4.428 4.677 -0.249 18093 11822 1 17 . 1 1 64 64 SER C C 64 174.618 174.618 174.745 -0.127 18093 11823 1 17 . 1 1 64 64 SER CA C 64 59.045 59.045 56.859 2.186 18093 11824 1 17 . 1 1 64 64 SER CB C 64 63.700 63.700 65.249 -1.549 18093 11825 1 17 . 1 1 64 64 SER H H 64 8.052 8.052 7.855 0.197 18093 11826 1 17 . 1 1 65 65 SER N N 65 116.673 116.673 117.269 -0.596 18093 11827 1 17 . 1 1 65 65 SER HA H 65 4.432 4.432 4.687 -0.255 18093 11828 1 17 . 1 1 65 65 SER C C 65 174.335 174.335 174.825 -0.490 18093 11829 1 17 . 1 1 65 65 SER CA C 65 58.927 58.927 58.382 0.545 18093 11830 1 17 . 1 1 65 65 SER CB C 65 63.621 63.621 63.843 -0.222 18093 11831 1 17 . 1 1 65 65 SER H H 65 8.114 8.114 8.639 -0.525 18093 11832 1 17 . 1 1 66 66 VAL N N 66 119.054 119.054 118.595 0.459 18093 11833 1 17 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.303 -0.133 18093 11834 1 17 . 1 1 66 66 VAL C C 66 175.278 175.278 175.303 -0.025 18093 11835 1 17 . 1 1 66 66 VAL CA C 66 62.062 62.062 61.475 0.587 18093 11836 1 17 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.964 -0.335 18093 11837 1 17 . 1 1 66 66 VAL H H 66 7.740 7.740 7.414 0.326 18093 11838 1 17 . 1 1 67 67 SER N N 67 118.882 118.882 113.050 5.832 18093 11839 1 17 . 1 1 67 67 SER HA H 67 4.704 4.704 4.250 0.454 18093 11840 1 17 . 1 1 67 67 SER CA C 67 56.715 56.715 58.284 -1.569 18093 11841 1 17 . 1 1 67 67 SER CB C 67 63.624 63.624 63.124 0.500 18093 11842 1 17 . 1 1 67 67 SER H H 67 8.060 8.060 8.217 -0.157 18093 11843 1 17 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.394 0.006 18093 11844 1 17 . 1 1 68 68 PRO C C 68 176.925 176.925 176.189 0.736 18093 11845 1 17 . 1 1 68 68 PRO CA C 68 63.748 63.748 63.251 0.497 18093 11846 1 17 . 1 1 68 68 PRO CB C 68 32.005 32.005 31.547 0.458 18093 11847 1 17 . 1 1 69 69 SER N N 69 114.930 114.930 117.275 -2.345 18093 11848 1 17 . 1 1 69 69 SER HA H 69 4.422 4.422 4.712 -0.290 18093 11849 1 17 . 1 1 69 69 SER C C 69 175.617 175.617 174.761 0.856 18093 11850 1 17 . 1 1 69 69 SER CA C 69 58.697 58.697 57.436 1.261 18093 11851 1 17 . 1 1 69 69 SER CB C 69 63.804 63.804 66.093 -2.289 18093 11852 1 17 . 1 1 69 69 SER H H 69 8.205 8.205 7.958 0.247 18093 11853 1 17 . 1 1 70 70 ILE N N 70 120.840 120.840 123.982 -3.142 18093 11854 1 17 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.014 -0.022 18093 11855 1 17 . 1 1 70 70 ILE C C 70 177.524 177.524 176.410 1.114 18093 11856 1 17 . 1 1 70 70 ILE CA C 70 64.335 64.335 62.282 2.053 18093 11857 1 17 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.184 -0.724 18093 11858 1 17 . 1 1 70 70 ILE H H 70 8.283 8.283 8.709 -0.426 18093 11859 1 17 . 1 1 71 71 GLY N N 71 107.823 107.823 107.868 -0.045 18093 11860 1 17 . 1 1 71 71 GLY C C 71 175.296 175.296 176.061 -0.765 18093 11861 1 17 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.125 0.330 18093 11862 1 17 . 1 1 71 71 GLY H H 71 8.557 8.557 8.632 -0.075 18093 11863 1 17 . 1 1 72 72 GLU N N 72 120.835 120.835 121.115 -0.280 18093 11864 1 17 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.232 -0.385 18093 11865 1 17 . 1 1 72 72 GLU C C 72 178.198 178.198 178.285 -0.087 18093 11866 1 17 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.297 1.821 18093 11867 1 17 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.752 -0.359 18093 11868 1 17 . 1 1 72 72 GLU H H 72 7.922 7.922 7.743 0.179 18093 11869 1 17 . 1 1 73 73 TYR N N 73 117.375 117.375 122.142 -4.767 18093 11870 1 17 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.218 -0.056 18093 11871 1 17 . 1 1 73 73 TYR C C 73 179.912 179.912 177.191 2.721 18093 11872 1 17 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.330 0.825 18093 11873 1 17 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.548 0.218 18093 11874 1 17 . 1 1 73 73 TYR H H 73 8.062 8.062 7.872 0.190 18093 11875 1 17 . 1 1 74 74 LEU N N 74 121.493 121.493 118.996 2.497 18093 11876 1 17 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.668 0.381 18093 11877 1 17 . 1 1 74 74 LEU C C 74 178.063 178.063 178.936 -0.873 18093 11878 1 17 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.779 0.716 18093 11879 1 17 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.778 0.069 18093 11880 1 17 . 1 1 74 74 LEU H H 74 8.552 8.552 8.635 -0.083 18093 11881 1 17 . 1 1 75 75 LEU N N 75 120.375 120.375 120.516 -0.141 18093 11882 1 17 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.074 -0.034 18093 11883 1 17 . 1 1 75 75 LEU C C 75 178.515 178.515 178.222 0.293 18093 11884 1 17 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.197 0.441 18093 11885 1 17 . 1 1 75 75 LEU CB C 75 42.039 42.039 42.044 -0.005 18093 11886 1 17 . 1 1 75 75 LEU H H 75 8.276 8.276 7.521 0.755 18093 11887 1 17 . 1 1 76 76 PHE N N 76 116.626 116.626 117.712 -1.086 18093 11888 1 17 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.170 -0.091 18093 11889 1 17 . 1 1 76 76 PHE C C 76 177.399 177.399 177.871 -0.472 18093 11890 1 17 . 1 1 76 76 PHE CA C 76 61.734 61.734 61.738 -0.004 18093 11891 1 17 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.538 0.203 18093 11892 1 17 . 1 1 76 76 PHE H H 76 8.454 8.454 8.293 0.161 18093 11893 1 17 . 1 1 77 77 THR N N 77 116.080 116.080 116.435 -0.355 18093 11894 1 17 . 1 1 77 77 THR HA H 77 3.687 3.687 3.957 -0.270 18093 11895 1 17 . 1 1 77 77 THR C C 77 176.018 176.018 176.101 -0.083 18093 11896 1 17 . 1 1 77 77 THR CA C 77 68.640 68.640 66.905 1.735 18093 11897 1 17 . 1 1 77 77 THR H H 77 8.224 8.224 8.396 -0.172 18093 11898 1 17 . 1 1 78 78 MET N N 78 119.394 119.394 120.771 -1.377 18093 11899 1 17 . 1 1 78 78 MET HA H 78 4.129 4.129 4.030 0.099 18093 11900 1 17 . 1 1 78 78 MET C C 78 179.608 179.608 178.625 0.983 18093 11901 1 17 . 1 1 78 78 MET CA C 78 58.831 58.831 59.721 -0.890 18093 11902 1 17 . 1 1 78 78 MET CB C 78 31.590 31.590 32.533 -0.943 18093 11903 1 17 . 1 1 78 78 MET H H 78 8.372 8.372 7.550 0.822 18093 11904 1 17 . 1 1 79 79 ILE N N 79 121.819 121.819 118.635 3.184 18093 11905 1 17 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.721 -0.171 18093 11906 1 17 . 1 1 79 79 ILE C C 79 176.426 176.426 177.517 -1.091 18093 11907 1 17 . 1 1 79 79 ILE CA C 79 65.876 65.876 64.745 1.131 18093 11908 1 17 . 1 1 79 79 ILE CB C 79 37.673 37.673 37.665 0.008 18093 11909 1 17 . 1 1 79 79 ILE H H 79 8.391 8.391 7.642 0.749 18093 11910 1 17 . 1 1 80 80 PHE N N 80 119.916 119.916 121.005 -1.089 18093 11911 1 17 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.181 -0.128 18093 11912 1 17 . 1 1 80 80 PHE C C 80 178.568 178.568 177.028 1.540 18093 11913 1 17 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.126 0.181 18093 11914 1 17 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.391 -0.617 18093 11915 1 17 . 1 1 80 80 PHE H H 80 8.479 8.479 7.296 1.183 18093 11916 1 17 . 1 1 81 81 VAL N N 81 120.191 120.191 116.531 3.660 18093 11917 1 17 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.658 -0.205 18093 11918 1 17 . 1 1 81 81 VAL C C 81 178.225 178.225 177.686 0.539 18093 11919 1 17 . 1 1 81 81 VAL CA C 81 67.408 67.408 65.815 1.593 18093 11920 1 17 . 1 1 81 81 VAL CB C 81 31.556 31.556 30.307 1.249 18093 11921 1 17 . 1 1 81 81 VAL H H 81 8.928 8.928 8.585 0.343 18093 11922 1 17 . 1 1 82 82 THR N N 82 115.930 115.930 117.578 -1.648 18093 11923 1 17 . 1 1 82 82 THR HA H 82 3.636 3.636 3.943 -0.307 18093 11924 1 17 . 1 1 82 82 THR C C 82 176.420 176.420 176.676 -0.256 18093 11925 1 17 . 1 1 82 82 THR CA C 82 68.570 68.570 66.811 1.758 18093 11926 1 17 . 1 1 82 82 THR CB C 82 68.202 68.202 68.624 -0.422 18093 11927 1 17 . 1 1 82 82 THR H H 82 7.969 7.969 7.422 0.547 18093 11928 1 17 . 1 1 83 83 LEU N N 83 119.780 119.780 120.268 -0.488 18093 11929 1 17 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.903 -0.056 18093 11930 1 17 . 1 1 83 83 LEU C C 83 178.214 178.214 178.304 -0.090 18093 11931 1 17 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.301 0.936 18093 11932 1 17 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.292 0.499 18093 11933 1 17 . 1 1 83 83 LEU H H 83 8.483 8.483 7.393 1.090 18093 11934 1 17 . 1 1 84 84 SER N N 84 114.559 114.559 116.223 -1.664 18093 11935 1 17 . 1 1 84 84 SER HA H 84 4.099 4.099 4.029 0.070 18093 11936 1 17 . 1 1 84 84 SER C C 84 176.799 176.799 176.731 0.068 18093 11937 1 17 . 1 1 84 84 SER CA C 84 63.609 63.609 61.771 1.838 18093 11938 1 17 . 1 1 84 84 SER CB C 84 63.110 63.110 63.106 0.004 18093 11939 1 17 . 1 1 84 84 SER H H 84 8.023 8.023 8.094 -0.071 18093 11940 1 17 . 1 1 85 85 ILE N N 85 123.962 123.962 122.341 1.621 18093 11941 1 17 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.906 -0.302 18093 11942 1 17 . 1 1 85 85 ILE C C 85 177.487 177.487 178.093 -0.606 18093 11943 1 17 . 1 1 85 85 ILE CA C 85 65.759 65.759 64.988 0.771 18093 11944 1 17 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.822 0.066 18093 11945 1 17 . 1 1 85 85 ILE H H 85 8.054 8.054 8.333 -0.279 18093 11946 1 17 . 1 1 86 86 VAL N N 86 118.744 118.744 120.667 -1.923 18093 11947 1 17 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.818 -0.299 18093 11948 1 17 . 1 1 86 86 VAL C C 86 177.557 177.557 177.911 -0.354 18093 11949 1 17 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.415 1.120 18093 11950 1 17 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.688 -0.222 18093 11951 1 17 . 1 1 86 86 VAL H H 86 8.158 8.158 7.326 0.832 18093 11952 1 17 . 1 1 87 87 ILE N N 87 117.206 117.206 119.759 -2.553 18093 11953 1 17 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.719 -0.115 18093 11954 1 17 . 1 1 87 87 ILE C C 87 177.283 177.283 178.476 -1.193 18093 11955 1 17 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.665 2.011 18093 11956 1 17 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.330 1.259 18093 11957 1 17 . 1 1 87 87 ILE H H 87 8.459 8.459 8.337 0.122 18093 11958 1 17 . 1 1 88 88 THR N N 88 116.158 116.158 117.309 -1.151 18093 11959 1 17 . 1 1 88 88 THR HA H 88 3.672 3.672 4.246 -0.574 18093 11960 1 17 . 1 1 88 88 THR C C 88 175.485 175.485 176.699 -1.214 18093 11961 1 17 . 1 1 88 88 THR CA C 88 68.549 68.549 67.304 1.245 18093 11962 1 17 . 1 1 88 88 THR CB C 88 68.127 68.127 68.693 -0.566 18093 11963 1 17 . 1 1 88 88 THR H H 88 7.776 7.776 8.495 -0.719 18093 11964 1 17 . 1 1 89 89 VAL N N 89 117.985 117.985 121.152 -3.167 18093 11965 1 17 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.822 -0.279 18093 11966 1 17 . 1 1 89 89 VAL C C 89 177.393 177.393 177.307 0.086 18093 11967 1 17 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.525 1.065 18093 11968 1 17 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.935 -0.157 18093 11969 1 17 . 1 1 89 89 VAL H H 89 8.206 8.206 7.538 0.668 18093 11970 1 17 . 1 1 90 90 PHE N N 90 116.709 116.709 119.717 -3.008 18093 11971 1 17 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.189 0.189 18093 11972 1 17 . 1 1 90 90 PHE C C 90 177.305 177.305 177.594 -0.289 18093 11973 1 17 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.878 -0.759 18093 11974 1 17 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.326 1.059 18093 11975 1 17 . 1 1 90 90 PHE H H 90 7.956 7.956 7.782 0.174 18093 11976 1 17 . 1 1 91 91 VAL N N 91 116.565 116.565 119.634 -3.069 18093 11977 1 17 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.794 0.041 18093 11978 1 17 . 1 1 91 91 VAL C C 91 176.927 176.927 177.002 -0.075 18093 11979 1 17 . 1 1 91 91 VAL CA C 91 65.347 65.347 65.774 -0.427 18093 11980 1 17 . 1 1 91 91 VAL CB C 91 31.867 31.867 32.097 -0.230 18093 11981 1 17 . 1 1 91 91 VAL H H 91 8.239 8.239 7.685 0.554 18093 11982 1 17 . 1 1 92 92 LEU N N 92 117.443 117.443 118.322 -0.879 18093 11983 1 17 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.207 -0.013 18093 11984 1 17 . 1 1 92 92 LEU C C 92 177.180 177.180 178.118 -0.938 18093 11985 1 17 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.300 -0.116 18093 11986 1 17 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.243 -0.299 18093 11987 1 17 . 1 1 92 92 LEU H H 92 7.967 7.967 7.698 0.269 18093 11988 1 17 . 1 1 93 93 ASN N N 93 116.705 116.705 117.299 -0.594 18093 11989 1 17 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.532 0.115 18093 11990 1 17 . 1 1 93 93 ASN C C 93 175.129 175.129 176.100 -0.971 18093 11991 1 17 . 1 1 93 93 ASN CA C 93 53.854 53.854 54.794 -0.940 18093 11992 1 17 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.706 -0.311 18093 11993 1 17 . 1 1 93 93 ASN H H 93 7.683 7.683 7.743 -0.060 18093 11994 1 17 . 1 1 94 94 VAL N N 94 118.224 118.224 117.739 0.485 18093 11995 1 17 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.761 0.200 18093 11996 1 17 . 1 1 94 94 VAL C C 94 175.600 175.600 174.664 0.936 18093 11997 1 17 . 1 1 94 94 VAL CA C 94 62.825 62.825 63.876 -1.051 18093 11998 1 17 . 1 1 94 94 VAL CB C 94 32.214 32.214 31.645 0.569 18093 11999 1 17 . 1 1 94 94 VAL H H 94 7.627 7.627 8.105 -0.478 18093 12000 1 17 . 1 1 95 95 HIS N N 95 120.999 120.999 123.312 -2.313 18093 12001 1 17 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.318 0.275 18093 12002 1 17 . 1 1 95 95 HIS C C 95 174.146 174.146 174.604 -0.458 18093 12003 1 17 . 1 1 95 95 HIS CA C 95 55.666 55.666 56.078 -0.412 18093 12004 1 17 . 1 1 95 95 HIS CB C 95 29.736 29.736 30.496 -0.760 18093 12005 1 17 . 1 1 95 95 HIS H H 95 8.263 8.263 8.595 -0.332 18093 12006 1 17 . 1 1 96 96 HIS N N 96 122.740 122.740 116.997 5.743 18093 12007 1 17 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.622 0.011 18093 12008 1 17 . 1 1 96 96 HIS CA C 96 55.895 55.895 56.487 -0.592 18093 12009 1 17 . 1 1 96 96 HIS CB C 96 29.750 29.750 31.631 -1.881 18093 12010 1 17 . 1 1 96 96 HIS H H 96 8.298 8.298 8.363 -0.065 18093 12011 1 17 . 1 1 97 97 ARG N N 97 118.503 118.503 122.850 -4.347 18093 12012 1 17 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.370 -0.058 18093 12013 1 17 . 1 1 97 97 ARG C C 97 175.776 175.776 176.342 -0.566 18093 12014 1 17 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.475 0.750 18093 12015 1 17 . 1 1 97 97 ARG CB C 97 30.912 30.912 28.865 2.047 18093 12016 1 17 . 1 1 97 97 ARG H H 97 8.250 8.250 8.446 -0.196 18093 12017 1 17 . 1 1 98 98 SER N N 98 118.482 118.482 122.583 -4.101 18093 12018 1 17 . 1 1 98 98 SER HA H 98 4.722 4.722 4.536 0.186 18093 12019 1 17 . 1 1 98 98 SER CA C 98 56.547 56.547 57.823 -1.276 18093 12020 1 17 . 1 1 98 98 SER CB C 98 63.624 63.624 63.285 0.339 18093 12021 1 17 . 1 1 98 98 SER H H 98 8.254 8.254 8.019 0.235 18093 12022 1 17 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.274 0.129 18093 12023 1 17 . 1 1 99 99 PRO C C 99 176.899 176.899 176.506 0.393 18093 12024 1 17 . 1 1 99 99 PRO CA C 99 63.701 63.701 63.912 -0.211 18093 12025 1 17 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.046 -0.097 18093 12026 1 17 . 1 1 100 100 GLU N N 100 120.187 120.187 119.894 0.293 18093 12027 1 17 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.105 0.183 18093 12028 1 17 . 1 1 100 100 GLU C C 100 176.593 176.593 175.192 1.401 18093 12029 1 17 . 1 1 100 100 GLU CA C 100 56.722 56.722 57.001 -0.279 18093 12030 1 17 . 1 1 100 100 GLU CB C 100 29.999 29.999 28.829 1.170 18093 12031 1 17 . 1 1 100 100 GLU H H 100 8.401 8.401 8.641 -0.240 18093 12032 1 17 . 1 1 101 101 THR N N 101 113.968 113.968 111.822 2.146 18093 12033 1 17 . 1 1 101 101 THR HA H 101 4.286 4.286 4.578 -0.292 18093 12034 1 17 . 1 1 101 101 THR C C 101 174.525 174.525 174.557 -0.032 18093 12035 1 17 . 1 1 101 101 THR CA C 101 61.956 61.956 61.136 0.820 18093 12036 1 17 . 1 1 101 101 THR CB C 101 69.697 69.697 70.321 -0.624 18093 12037 1 17 . 1 1 101 101 THR H H 101 7.945 7.945 7.829 0.116 18093 12038 1 17 . 1 1 102 102 HIS N N 102 120.322 120.322 123.218 -2.896 18093 12039 1 17 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.461 0.280 18093 12040 1 17 . 1 1 102 102 HIS C C 102 174.783 174.783 174.895 -0.112 18093 12041 1 17 . 1 1 102 102 HIS CA C 102 55.701 55.701 56.971 -1.270 18093 12042 1 17 . 1 1 102 102 HIS CB C 102 29.093 29.093 30.108 -1.015 18093 12043 1 17 . 1 1 102 102 HIS H H 102 8.455 8.455 8.598 -0.143 18093 12044 1 17 . 1 1 103 103 THR N N 103 114.282 114.282 116.425 -2.143 18093 12045 1 17 . 1 1 103 103 THR HA H 103 4.352 4.352 3.931 0.421 18093 12046 1 17 . 1 1 103 103 THR C C 103 175.104 175.104 173.881 1.223 18093 12047 1 17 . 1 1 103 103 THR CA C 103 62.057 62.057 62.104 -0.047 18093 12048 1 17 . 1 1 103 103 THR CB C 103 69.966 69.966 68.812 1.154 18093 12049 1 17 . 1 1 103 103 THR H H 103 8.069 8.069 8.341 -0.272 18093 12050 1 17 . 1 1 104 104 GLY N N 104 111.159 111.159 107.144 4.015 18093 12051 1 17 . 1 1 104 104 GLY C C 104 174.776 174.776 174.360 0.416 18093 12052 1 17 . 1 1 104 104 GLY CA C 104 45.588 45.588 44.993 0.595 18093 12053 1 17 . 1 1 104 104 GLY H H 104 8.393 8.393 8.221 0.172 18093 12054 1 17 . 1 1 105 105 GLY N N 105 108.657 108.657 107.399 1.258 18093 12055 1 17 . 1 1 105 105 GLY C C 105 174.957 174.957 174.657 0.300 18093 12056 1 17 . 1 1 105 105 GLY CA C 105 45.612 45.612 44.259 1.353 18093 12057 1 17 . 1 1 105 105 GLY H H 105 8.275 8.275 8.166 0.109 18093 12058 1 17 . 1 1 106 106 GLY N N 106 108.870 108.870 108.454 0.416 18093 12059 1 17 . 1 1 106 106 GLY C C 106 174.877 174.877 174.085 0.792 18093 12060 1 17 . 1 1 106 106 GLY CA C 106 45.665 45.665 44.761 0.904 18093 12061 1 17 . 1 1 106 106 GLY H H 106 8.357 8.357 8.318 0.039 18093 12062 1 17 . 1 1 107 107 GLY N N 107 108.476 108.476 110.956 -2.480 18093 12063 1 17 . 1 1 107 107 GLY C C 107 174.877 174.877 175.247 -0.370 18093 12064 1 17 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.873 -0.177 18093 12065 1 17 . 1 1 107 107 GLY H H 107 8.330 8.330 8.611 -0.281 18093 12066 1 17 . 1 1 108 108 GLY N N 108 108.486 108.486 109.424 -0.938 18093 12067 1 17 . 1 1 108 108 GLY C C 108 175.345 175.345 175.219 0.126 18093 12068 1 17 . 1 1 108 108 GLY CA C 108 45.763 45.763 44.600 1.163 18093 12069 1 17 . 1 1 108 108 GLY H H 108 8.328 8.328 8.778 -0.450 18093 12070 1 17 . 1 1 109 109 ILE N N 109 120.433 120.433 120.550 -0.117 18093 12071 1 17 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.962 0.007 18093 12072 1 17 . 1 1 109 109 ILE C C 109 176.127 176.127 177.184 -1.057 18093 12073 1 17 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.701 -0.966 18093 12074 1 17 . 1 1 109 109 ILE CB C 109 38.125 38.125 37.903 0.222 18093 12075 1 17 . 1 1 109 109 ILE H H 109 8.192 8.192 7.895 0.297 18093 12076 1 17 . 1 1 110 110 ASP N N 110 121.148 121.148 119.187 1.961 18093 12077 1 17 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.499 -0.193 18093 12078 1 17 . 1 1 110 110 ASP C C 110 177.651 177.651 178.249 -0.598 18093 12079 1 17 . 1 1 110 110 ASP CA C 110 56.776 56.776 58.246 -1.470 18093 12080 1 17 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.635 0.463 18093 12081 1 17 . 1 1 110 110 ASP H H 110 8.427 8.427 8.669 -0.242 18093 12082 1 17 . 1 1 111 111 ARG N N 111 119.228 119.228 119.376 -0.148 18093 12083 1 17 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.282 -0.286 18093 12084 1 17 . 1 1 111 111 ARG C C 111 177.786 177.786 178.966 -1.180 18093 12085 1 17 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.127 -0.185 18093 12086 1 17 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.996 0.200 18093 12087 1 17 . 1 1 111 111 ARG H H 111 7.850 7.850 8.399 -0.549 18093 12088 1 17 . 1 1 112 112 ILE N N 112 118.000 118.000 119.763 -1.763 18093 12089 1 17 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.131 -0.318 18093 12090 1 17 . 1 1 112 112 ILE C C 112 177.496 177.496 177.996 -0.500 18093 12091 1 17 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.296 2.516 18093 12092 1 17 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.945 0.782 18093 12093 1 17 . 1 1 112 112 ILE H H 112 7.764 7.764 7.798 -0.034 18093 12094 1 17 . 1 1 113 113 PHE N N 113 118.367 118.367 122.144 -3.777 18093 12095 1 17 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.303 -0.048 18093 12096 1 17 . 1 1 113 113 PHE C C 113 177.218 177.218 177.433 -0.215 18093 12097 1 17 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.435 -1.002 18093 12098 1 17 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.229 -0.422 18093 12099 1 17 . 1 1 113 113 PHE H H 113 7.963 7.963 8.060 -0.097 18093 12100 1 17 . 1 1 114 114 LEU N N 114 118.921 118.921 118.020 0.901 18093 12101 1 17 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.979 0.018 18093 12102 1 17 . 1 1 114 114 LEU C C 114 178.297 178.297 178.408 -0.111 18093 12103 1 17 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.325 0.286 18093 12104 1 17 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.285 0.667 18093 12105 1 17 . 1 1 114 114 LEU H H 114 7.939 7.939 8.111 -0.172 18093 12106 1 17 . 1 1 115 115 TRP N N 115 117.464 117.464 119.490 -2.026 18093 12107 1 17 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.394 -0.020 18093 12108 1 17 . 1 1 115 115 TRP C C 115 178.572 178.572 178.269 0.303 18093 12109 1 17 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.808 1.114 18093 12110 1 17 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.789 -1.282 18093 12111 1 17 . 1 1 115 115 TRP H H 115 7.969 7.969 7.646 0.323 18093 12112 1 17 . 1 1 116 116 MET N N 116 117.069 117.069 118.925 -1.856 18093 12113 1 17 . 1 1 116 116 MET HA H 116 4.065 4.065 4.234 -0.169 18093 12114 1 17 . 1 1 116 116 MET C C 116 177.425 177.425 178.200 -0.775 18093 12115 1 17 . 1 1 116 116 MET CA C 116 59.289 59.289 59.107 0.182 18093 12116 1 17 . 1 1 116 116 MET CB C 116 31.692 31.692 32.539 -0.847 18093 12117 1 17 . 1 1 116 116 MET H H 116 8.465 8.465 7.737 0.728 18093 12118 1 17 . 1 1 117 117 PHE N N 117 118.755 118.755 118.246 0.509 18093 12119 1 17 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.089 0.010 18093 12120 1 17 . 1 1 117 117 PHE C C 117 177.965 177.965 178.175 -0.210 18093 12121 1 17 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.258 -0.550 18093 12122 1 17 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.313 0.872 18093 12123 1 17 . 1 1 117 117 PHE H H 117 8.418 8.418 7.869 0.549 18093 12124 1 17 . 1 1 118 118 ILE N N 118 119.133 119.133 115.360 3.773 18093 12125 1 17 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.897 -0.553 18093 12126 1 17 . 1 1 118 118 ILE C C 118 177.244 177.244 177.603 -0.359 18093 12127 1 17 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.311 1.514 18093 12128 1 17 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.770 -0.222 18093 12129 1 17 . 1 1 118 118 ILE H H 118 8.266 8.266 7.725 0.541 18093 12130 1 17 . 1 1 119 119 ILE N N 119 118.846 118.846 121.409 -2.563 18093 12131 1 17 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.965 -0.393 18093 12132 1 17 . 1 1 119 119 ILE C C 119 177.523 177.523 177.623 -0.100 18093 12133 1 17 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.104 0.785 18093 12134 1 17 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.317 -0.753 18093 12135 1 17 . 1 1 119 119 ILE H H 119 8.308 8.308 7.318 0.990 18093 12136 1 17 . 1 1 120 120 VAL N N 120 119.228 119.228 117.670 1.558 18093 12137 1 17 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.839 -0.331 18093 12138 1 17 . 1 1 120 120 VAL C C 120 177.651 177.651 177.683 -0.032 18093 12139 1 17 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.803 1.798 18093 12140 1 17 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.533 0.873 18093 12141 1 17 . 1 1 120 120 VAL H H 120 8.399 8.399 8.021 0.378 18093 12142 1 17 . 1 1 121 121 CYS N N 121 117.151 117.151 119.964 -2.813 18093 12143 1 17 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.115 -0.212 18093 12144 1 17 . 1 1 121 121 CYS C C 121 177.719 177.719 177.243 0.476 18093 12145 1 17 . 1 1 121 121 CYS CA C 121 64.298 64.298 63.638 0.660 18093 12146 1 17 . 1 1 121 121 CYS CB C 121 26.677 26.677 26.183 0.494 18093 12147 1 17 . 1 1 121 121 CYS H H 121 8.008 8.008 7.563 0.445 18093 12148 1 17 . 1 1 122 122 LEU N N 122 121.402 121.402 120.680 0.722 18093 12149 1 17 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.186 -0.203 18093 12150 1 17 . 1 1 122 122 LEU C C 122 178.282 178.282 179.000 -0.718 18093 12151 1 17 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.849 0.696 18093 12152 1 17 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.186 0.780 18093 12153 1 17 . 1 1 122 122 LEU H H 122 8.417 8.417 7.639 0.778 18093 12154 1 17 . 1 1 123 123 LEU N N 123 118.543 118.543 119.870 -1.327 18093 12155 1 17 . 1 1 123 123 LEU HA H 123 3.920 3.920 3.986 -0.066 18093 12156 1 17 . 1 1 123 123 LEU C C 123 179.028 179.028 178.791 0.237 18093 12157 1 17 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.475 -0.358 18093 12158 1 17 . 1 1 123 123 LEU CB C 123 42.056 42.056 40.955 1.101 18093 12159 1 17 . 1 1 123 123 LEU H H 123 8.590 8.590 7.682 0.908 18093 12160 1 17 . 1 1 124 124 GLY N N 124 104.896 104.896 105.419 -0.523 18093 12161 1 17 . 1 1 124 124 GLY C C 124 173.932 173.932 176.052 -2.120 18093 12162 1 17 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.386 -0.159 18093 12163 1 17 . 1 1 124 124 GLY H H 124 8.601 8.601 8.264 0.337 18093 12164 1 17 . 1 1 125 125 THR N N 125 115.403 115.403 119.195 -3.792 18093 12165 1 17 . 1 1 125 125 THR HA H 125 3.686 3.686 3.835 -0.149 18093 12166 1 17 . 1 1 125 125 THR C C 125 176.407 176.407 176.888 -0.481 18093 12167 1 17 . 1 1 125 125 THR CA C 125 67.565 67.565 67.228 0.337 18093 12168 1 17 . 1 1 125 125 THR CB C 125 68.143 68.143 68.651 -0.508 18093 12169 1 17 . 1 1 125 125 THR H H 125 7.734 7.734 7.478 0.256 18093 12170 1 17 . 1 1 126 126 VAL N N 126 119.056 119.056 121.046 -1.990 18093 12171 1 17 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.804 -0.265 18093 12172 1 17 . 1 1 126 126 VAL C C 126 177.628 177.628 178.394 -0.766 18093 12173 1 17 . 1 1 126 126 VAL CA C 126 66.601 66.601 67.025 -0.424 18093 12174 1 17 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.404 0.090 18093 12175 1 17 . 1 1 126 126 VAL H H 126 8.015 8.015 8.010 0.005 18093 12176 1 17 . 1 1 127 127 GLY N N 127 104.644 104.644 106.969 -2.325 18093 12177 1 17 . 1 1 127 127 GLY C C 127 173.933 173.933 175.578 -1.645 18093 12178 1 17 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.179 0.102 18093 12179 1 17 . 1 1 127 127 GLY H H 127 8.248 8.248 8.463 -0.215 18093 12180 1 17 . 1 1 128 128 LEU N N 128 117.354 117.354 121.419 -4.065 18093 12181 1 17 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.110 -0.098 18093 12182 1 17 . 1 1 128 128 LEU C C 128 177.443 177.443 177.452 -0.009 18093 12183 1 17 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.932 -0.306 18093 12184 1 17 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.671 0.589 18093 12185 1 17 . 1 1 128 128 LEU H H 128 7.568 7.568 7.569 -0.001 18093 12186 1 17 . 1 1 129 129 PHE N N 129 113.971 113.971 116.344 -2.373 18093 12187 1 17 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.265 0.193 18093 12188 1 17 . 1 1 129 129 PHE C C 129 176.216 176.216 176.805 -0.589 18093 12189 1 17 . 1 1 129 129 PHE CA C 129 58.385 58.385 60.476 -2.091 18093 12190 1 17 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.511 0.207 18093 12191 1 17 . 1 1 129 129 PHE H H 129 7.639 7.639 7.616 0.023 18093 12192 1 17 . 1 1 130 130 LEU N N 130 117.752 117.752 120.138 -2.386 18093 12193 1 17 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.802 -0.369 18093 12194 1 17 . 1 1 130 130 LEU CA C 130 54.156 54.156 52.343 1.812 18093 12195 1 17 . 1 1 130 130 LEU H H 130 8.099 8.099 7.490 0.609 18093 12196 1 17 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.732 -0.282 18093 12197 1 17 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.437 2.462 18093 12198 1 17 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.347 -0.085 18093 12199 1 17 . 1 1 132 132 PRO C C 132 177.616 177.616 176.102 1.514 18093 12200 1 17 . 1 1 132 132 PRO CA C 132 64.980 64.980 63.084 1.896 18093 12201 1 17 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.469 -0.844 18093 12202 1 17 . 1 1 133 133 TRP N N 133 115.508 115.508 119.512 -4.004 18093 12203 1 17 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.377 0.215 18093 12204 1 17 . 1 1 133 133 TRP C C 133 176.842 176.842 176.049 0.793 18093 12205 1 17 . 1 1 133 133 TRP CA C 133 57.283 57.283 57.503 -0.220 18093 12206 1 17 . 1 1 133 133 TRP CB C 133 28.596 28.596 28.541 0.055 18093 12207 1 17 . 1 1 133 133 TRP H H 133 7.311 7.311 8.167 -0.856 18093 12208 1 17 . 1 1 134 134 LEU N N 134 119.570 119.570 120.929 -1.359 18093 12209 1 17 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.002 0.175 18093 12210 1 17 . 1 1 134 134 LEU C C 134 175.768 175.768 176.177 -0.409 18093 12211 1 17 . 1 1 134 134 LEU CA C 134 55.621 55.621 55.794 -0.173 18093 12212 1 17 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.325 1.323 18093 12213 1 17 . 1 1 134 134 LEU H H 134 7.453 7.453 8.262 -0.809 18093 12214 1 17 . 1 1 135 135 ALA N N 135 119.004 119.004 121.684 -2.680 18093 12215 1 17 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.218 0.005 18093 12216 1 17 . 1 1 135 135 ALA C C 135 177.170 177.170 178.380 -1.210 18093 12217 1 17 . 1 1 135 135 ALA CA C 135 52.456 52.456 54.068 -1.612 18093 12218 1 17 . 1 1 135 135 ALA CB C 135 19.736 19.736 19.186 0.550 18093 12219 1 17 . 1 1 135 135 ALA H H 135 7.541 7.541 8.070 -0.529 18093 12220 1 17 . 1 1 136 136 GLY N N 136 105.879 105.879 104.761 1.118 18093 12221 1 17 . 1 1 136 136 GLY C C 136 173.042 173.042 174.535 -1.493 18093 12222 1 17 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.141 0.552 18093 12223 1 17 . 1 1 136 136 GLY H H 136 7.846 7.846 8.465 -0.619 18093 12224 1 18 . 1 1 5 5 GLU N N 5 119.627 119.627 118.904 0.723 18093 12225 1 18 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.460 -0.252 18093 12226 1 18 . 1 1 5 5 GLU C C 5 176.581 176.581 175.408 1.173 18093 12227 1 18 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.517 0.528 18093 12228 1 18 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.314 0.724 18093 12229 1 18 . 1 1 5 5 GLU H H 5 8.003 8.003 8.446 -0.443 18093 12230 1 18 . 1 1 6 6 LEU N N 6 121.267 121.267 122.347 -1.080 18093 12231 1 18 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.729 -0.304 18093 12232 1 18 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.495 2.140 18093 12233 1 18 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.593 -0.297 18093 12234 1 18 . 1 1 6 6 LEU H H 6 8.104 8.104 7.869 0.235 18093 12235 1 18 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.574 -0.175 18093 12236 1 18 . 1 1 7 7 PRO C C 7 178.408 178.408 177.917 0.491 18093 12237 1 18 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.108 2.604 18093 12238 1 18 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.772 -0.855 18093 12239 1 18 . 1 1 8 8 LEU N N 8 121.835 121.835 120.146 1.689 18093 12240 1 18 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.275 -0.186 18093 12241 1 18 . 1 1 8 8 LEU C C 8 177.902 177.902 178.138 -0.236 18093 12242 1 18 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.341 0.764 18093 12243 1 18 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.260 0.347 18093 12244 1 18 . 1 1 8 8 LEU H H 8 8.162 8.162 8.469 -0.307 18093 12245 1 18 . 1 1 9 9 PHE N N 9 118.342 118.342 119.680 -1.338 18093 12246 1 18 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.137 0.052 18093 12247 1 18 . 1 1 9 9 PHE C C 9 177.596 177.596 176.987 0.609 18093 12248 1 18 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.756 -0.642 18093 12249 1 18 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.419 0.308 18093 12250 1 18 . 1 1 9 9 PHE H H 9 8.318 8.318 8.128 0.190 18093 12251 1 18 . 1 1 10 10 TYR N N 10 117.584 117.584 118.741 -1.157 18093 12252 1 18 . 1 1 10 10 TYR HA H 10 4.154 4.154 4.002 0.152 18093 12253 1 18 . 1 1 10 10 TYR C C 10 177.630 177.630 177.283 0.347 18093 12254 1 18 . 1 1 10 10 TYR CA C 10 61.036 61.036 61.687 -0.651 18093 12255 1 18 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.137 0.523 18093 12256 1 18 . 1 1 10 10 TYR H H 10 8.105 8.105 8.223 -0.118 18093 12257 1 18 . 1 1 11 11 THR N N 11 115.563 115.563 113.842 1.721 18093 12258 1 18 . 1 1 11 11 THR HA H 11 3.871 3.871 4.066 -0.195 18093 12259 1 18 . 1 1 11 11 THR C C 11 175.955 175.955 175.814 0.141 18093 12260 1 18 . 1 1 11 11 THR CA C 11 67.290 67.290 66.163 1.127 18093 12261 1 18 . 1 1 11 11 THR CB C 11 68.201 68.201 68.795 -0.594 18093 12262 1 18 . 1 1 11 11 THR H H 11 7.915 7.915 7.757 0.158 18093 12263 1 18 . 1 1 12 12 ILE N N 12 119.727 119.727 121.221 -1.494 18093 12264 1 18 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.826 -0.127 18093 12265 1 18 . 1 1 12 12 ILE C C 12 175.773 175.773 177.087 -1.314 18093 12266 1 18 . 1 1 12 12 ILE CA C 12 64.699 64.699 62.545 2.154 18093 12267 1 18 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.708 1.388 18093 12268 1 18 . 1 1 12 12 ILE H H 12 8.186 8.186 7.605 0.581 18093 12269 1 18 . 1 1 13 13 ASN N N 13 114.190 114.190 119.796 -5.606 18093 12270 1 18 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.236 0.186 18093 12271 1 18 . 1 1 13 13 ASN C C 13 174.786 174.786 176.603 -1.817 18093 12272 1 18 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.648 -0.092 18093 12273 1 18 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.713 0.645 18093 12274 1 18 . 1 1 13 13 ASN H H 13 7.601 7.601 7.947 -0.346 18093 12275 1 18 . 1 1 14 14 LEU N N 14 115.031 115.031 116.630 -1.599 18093 12276 1 18 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.183 0.013 18093 12277 1 18 . 1 1 14 14 LEU C C 14 177.540 177.540 178.061 -0.521 18093 12278 1 18 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.831 -0.424 18093 12279 1 18 . 1 1 14 14 LEU CB C 14 41.842 41.842 41.946 -0.104 18093 12280 1 18 . 1 1 14 14 LEU H H 14 7.390 7.390 7.184 0.206 18093 12281 1 18 . 1 1 15 15 ILE N N 15 118.223 118.223 119.640 -1.417 18093 12282 1 18 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.714 -0.101 18093 12283 1 18 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.673 3.046 18093 12284 1 18 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.421 -0.809 18093 12285 1 18 . 1 1 15 15 ILE H H 15 8.123 8.123 7.557 0.566 18093 12286 1 18 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.318 -0.249 18093 12287 1 18 . 1 1 17 17 PRO C C 17 177.721 177.721 178.891 -1.170 18093 12288 1 18 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.509 1.252 18093 12289 1 18 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.753 -0.011 18093 12290 1 18 . 1 1 18 18 CYS N N 18 113.538 113.538 117.111 -3.573 18093 12291 1 18 . 1 1 18 18 CYS HA H 18 4.008 4.008 3.948 0.060 18093 12292 1 18 . 1 1 18 18 CYS C C 18 177.683 177.683 176.799 0.884 18093 12293 1 18 . 1 1 18 18 CYS CA C 18 64.500 64.500 64.243 0.257 18093 12294 1 18 . 1 1 18 18 CYS CB C 18 26.873 26.873 27.547 -0.674 18093 12295 1 18 . 1 1 18 18 CYS H H 18 7.410 7.410 7.372 0.038 18093 12296 1 18 . 1 1 19 19 LEU N N 19 122.545 122.545 119.470 3.075 18093 12297 1 18 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.000 -0.001 18093 12298 1 18 . 1 1 19 19 LEU C C 19 178.608 178.608 178.700 -0.092 18093 12299 1 18 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.387 1.034 18093 12300 1 18 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.353 0.491 18093 12301 1 18 . 1 1 19 19 LEU H H 19 8.635 8.635 7.374 1.261 18093 12302 1 18 . 1 1 20 20 LEU N N 20 119.404 119.404 120.648 -1.244 18093 12303 1 18 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.863 0.143 18093 12304 1 18 . 1 1 20 20 LEU C C 20 178.540 178.540 179.069 -0.529 18093 12305 1 18 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.328 0.471 18093 12306 1 18 . 1 1 20 20 LEU CB C 20 41.999 41.999 42.080 -0.081 18093 12307 1 18 . 1 1 20 20 LEU H H 20 8.392 8.392 7.452 0.940 18093 12308 1 18 . 1 1 21 21 ILE N N 21 117.335 117.335 114.548 2.787 18093 12309 1 18 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.661 -0.010 18093 12310 1 18 . 1 1 21 21 ILE C C 21 177.249 177.249 177.600 -0.351 18093 12311 1 18 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.782 0.479 18093 12312 1 18 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.196 0.764 18093 12313 1 18 . 1 1 21 21 ILE H H 21 8.403 8.403 8.262 0.141 18093 12314 1 18 . 1 1 22 22 SER N N 22 116.385 116.385 118.262 -1.877 18093 12315 1 18 . 1 1 22 22 SER HA H 22 4.056 4.056 4.214 -0.158 18093 12316 1 18 . 1 1 22 22 SER C C 22 176.813 176.813 176.713 0.100 18093 12317 1 18 . 1 1 22 22 SER CA C 22 63.866 63.866 61.747 2.119 18093 12318 1 18 . 1 1 22 22 SER CB C 22 62.898 62.898 62.734 0.163 18093 12319 1 18 . 1 1 22 22 SER H H 22 8.271 8.271 7.631 0.640 18093 12320 1 18 . 1 1 23 23 CYS N N 23 119.001 119.001 121.067 -2.066 18093 12321 1 18 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.144 -0.154 18093 12322 1 18 . 1 1 23 23 CYS C C 23 177.594 177.594 176.707 0.887 18093 12323 1 18 . 1 1 23 23 CYS CA C 23 64.429 64.429 63.446 0.983 18093 12324 1 18 . 1 1 23 23 CYS CB C 23 26.940 26.940 27.036 -0.096 18093 12325 1 18 . 1 1 23 23 CYS H H 23 8.161 8.161 8.397 -0.236 18093 12326 1 18 . 1 1 24 24 LEU N N 24 117.814 117.814 122.145 -4.331 18093 12327 1 18 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.869 0.108 18093 12328 1 18 . 1 1 24 24 LEU C C 24 177.944 177.944 178.165 -0.221 18093 12329 1 18 . 1 1 24 24 LEU CA C 24 58.287 58.287 59.206 -0.919 18093 12330 1 18 . 1 1 24 24 LEU CB C 24 41.903 41.903 42.069 -0.166 18093 12331 1 18 . 1 1 24 24 LEU H H 24 8.106 8.106 7.767 0.339 18093 12332 1 18 . 1 1 25 25 THR N N 25 115.670 115.670 113.062 2.608 18093 12333 1 18 . 1 1 25 25 THR HA H 25 3.687 3.687 3.949 -0.262 18093 12334 1 18 . 1 1 25 25 THR C C 25 175.845 175.845 176.636 -0.791 18093 12335 1 18 . 1 1 25 25 THR CA C 25 68.306 68.306 65.738 2.568 18093 12336 1 18 . 1 1 25 25 THR H H 25 7.924 7.924 7.583 0.341 18093 12337 1 18 . 1 1 26 26 VAL N N 26 118.809 118.809 121.920 -3.111 18093 12338 1 18 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.657 -0.142 18093 12339 1 18 . 1 1 26 26 VAL C C 26 177.530 177.530 178.001 -0.471 18093 12340 1 18 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.187 1.094 18093 12341 1 18 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.568 0.156 18093 12342 1 18 . 1 1 26 26 VAL H H 26 7.764 7.764 7.308 0.456 18093 12343 1 18 . 1 1 27 27 LEU N N 27 117.958 117.958 120.639 -2.681 18093 12344 1 18 . 1 1 27 27 LEU HA H 27 4.036 4.036 3.957 0.079 18093 12345 1 18 . 1 1 27 27 LEU C C 27 178.163 178.163 179.252 -1.089 18093 12346 1 18 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.095 0.414 18093 12347 1 18 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.851 1.068 18093 12348 1 18 . 1 1 27 27 LEU H H 27 7.912 7.912 8.039 -0.127 18093 12349 1 18 . 1 1 28 28 VAL N N 28 114.472 114.472 118.347 -3.875 18093 12350 1 18 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.638 -0.103 18093 12351 1 18 . 1 1 28 28 VAL C C 28 176.871 176.871 179.055 -2.184 18093 12352 1 18 . 1 1 28 28 VAL CA C 28 65.977 65.977 66.765 -0.788 18093 12353 1 18 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.815 0.119 18093 12354 1 18 . 1 1 28 28 VAL H H 28 7.892 7.892 7.541 0.351 18093 12355 1 18 . 1 1 29 29 PHE N N 29 115.206 115.206 117.834 -2.628 18093 12356 1 18 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.145 0.058 18093 12357 1 18 . 1 1 29 29 PHE C C 29 176.614 176.614 176.903 -0.289 18093 12358 1 18 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.145 0.819 18093 12359 1 18 . 1 1 29 29 PHE CB C 29 39.752 39.752 38.484 1.268 18093 12360 1 18 . 1 1 29 29 PHE H H 29 7.748 7.748 7.857 -0.109 18093 12361 1 18 . 1 1 30 30 TYR N N 30 115.975 115.975 118.325 -2.350 18093 12362 1 18 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.404 -0.082 18093 12363 1 18 . 1 1 30 30 TYR C C 30 175.553 175.553 176.043 -0.490 18093 12364 1 18 . 1 1 30 30 TYR CA C 30 59.598 59.598 60.338 -0.740 18093 12365 1 18 . 1 1 30 30 TYR CB C 30 39.763 39.763 39.716 0.047 18093 12366 1 18 . 1 1 30 30 TYR H H 30 7.985 7.985 7.597 0.388 18093 12367 1 18 . 1 1 31 31 LEU N N 31 120.780 120.780 119.347 1.433 18093 12368 1 18 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.755 -0.328 18093 12369 1 18 . 1 1 31 31 LEU CA C 31 54.665 54.665 52.787 1.878 18093 12370 1 18 . 1 1 31 31 LEU CB C 31 42.388 42.388 44.457 -2.069 18093 12371 1 18 . 1 1 31 31 LEU H H 31 7.643 7.643 7.520 0.123 18093 12372 1 18 . 1 1 34 34 GLU C C 34 176.271 176.271 176.890 -0.619 18093 12373 1 18 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.508 2.083 18093 12374 1 18 . 1 1 35 35 CYS N N 35 116.430 116.430 125.430 -9.000 18093 12375 1 18 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.281 0.086 18093 12376 1 18 . 1 1 35 35 CYS C C 35 175.198 175.198 176.584 -1.386 18093 12377 1 18 . 1 1 35 35 CYS CA C 35 60.293 60.293 60.863 -0.570 18093 12378 1 18 . 1 1 35 35 CYS CB C 35 28.130 28.130 27.255 0.875 18093 12379 1 18 . 1 1 35 35 CYS H H 35 7.970 7.970 9.222 -1.252 18093 12380 1 18 . 1 1 36 36 GLY N N 36 108.315 108.315 106.212 2.103 18093 12381 1 18 . 1 1 36 36 GLY C C 36 174.610 174.610 175.307 -0.697 18093 12382 1 18 . 1 1 36 36 GLY CA C 36 46.004 46.004 45.626 0.378 18093 12383 1 18 . 1 1 36 36 GLY H H 36 8.120 8.120 8.421 -0.301 18093 12384 1 18 . 1 1 37 37 GLU N N 37 121.347 121.347 121.611 -0.264 18093 12385 1 18 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.154 -0.107 18093 12386 1 18 . 1 1 37 37 GLU C C 37 177.338 177.338 178.155 -0.817 18093 12387 1 18 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.395 -0.888 18093 12388 1 18 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.928 -0.358 18093 12389 1 18 . 1 1 37 37 GLU H H 37 8.423 8.423 7.777 0.646 18093 12390 1 18 . 1 1 38 38 LYS N N 38 123.788 123.788 119.945 3.843 18093 12391 1 18 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.224 -0.028 18093 12392 1 18 . 1 1 38 38 LYS C C 38 177.976 177.976 178.696 -0.720 18093 12393 1 18 . 1 1 38 38 LYS CA C 38 58.273 58.273 58.664 -0.391 18093 12394 1 18 . 1 1 38 38 LYS CB C 38 31.649 31.649 31.981 -0.332 18093 12395 1 18 . 1 1 38 38 LYS H H 38 8.211 8.211 7.454 0.758 18093 12396 1 18 . 1 1 39 39 ILE N N 39 115.675 115.675 118.676 -3.001 18093 12397 1 18 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.767 -0.159 18093 12398 1 18 . 1 1 39 39 ILE C C 39 177.204 177.204 178.110 -0.906 18093 12399 1 18 . 1 1 39 39 ILE CA C 39 65.501 65.501 64.418 1.083 18093 12400 1 18 . 1 1 39 39 ILE H H 39 7.933 7.933 8.050 -0.117 18093 12401 1 18 . 1 1 40 40 THR N N 40 117.411 117.411 114.278 3.133 18093 12402 1 18 . 1 1 40 40 THR HA H 40 3.844 3.844 3.967 -0.123 18093 12403 1 18 . 1 1 40 40 THR C C 40 175.983 175.983 176.918 -0.935 18093 12404 1 18 . 1 1 40 40 THR CA C 40 67.360 67.360 66.173 1.187 18093 12405 1 18 . 1 1 40 40 THR H H 40 8.362 8.362 7.894 0.468 18093 12406 1 18 . 1 1 41 41 LEU N N 41 123.059 123.059 122.651 0.408 18093 12407 1 18 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.123 -0.107 18093 12408 1 18 . 1 1 41 41 LEU C C 41 178.914 178.914 178.750 0.164 18093 12409 1 18 . 1 1 41 41 LEU CA C 41 58.366 58.366 58.330 0.036 18093 12410 1 18 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.750 0.300 18093 12411 1 18 . 1 1 41 41 LEU H H 41 8.282 8.282 7.780 0.502 18093 12412 1 18 . 1 1 42 42 CYS N N 42 118.762 118.762 118.707 0.055 18093 12413 1 18 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.060 -0.124 18093 12414 1 18 . 1 1 42 42 CYS C C 42 176.607 176.607 177.421 -0.814 18093 12415 1 18 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.544 0.773 18093 12416 1 18 . 1 1 42 42 CYS CB C 42 26.919 26.919 26.854 0.066 18093 12417 1 18 . 1 1 42 42 CYS H H 42 8.195 8.195 8.518 -0.323 18093 12418 1 18 . 1 1 43 43 ILE N N 43 117.589 117.589 120.101 -2.512 18093 12419 1 18 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.891 -0.284 18093 12420 1 18 . 1 1 43 43 ILE C C 43 177.323 177.323 178.300 -0.977 18093 12421 1 18 . 1 1 43 43 ILE CA C 43 65.249 65.249 63.737 1.512 18093 12422 1 18 . 1 1 43 43 ILE CB C 43 38.038 38.038 36.720 1.318 18093 12423 1 18 . 1 1 43 43 ILE H H 43 8.428 8.428 7.652 0.776 18093 12424 1 18 . 1 1 44 44 SER N N 44 115.950 115.950 116.549 -0.599 18093 12425 1 18 . 1 1 44 44 SER HA H 44 4.012 4.012 4.226 -0.214 18093 12426 1 18 . 1 1 44 44 SER C C 44 176.965 176.965 176.815 0.150 18093 12427 1 18 . 1 1 44 44 SER CA C 44 63.575 63.575 61.922 1.653 18093 12428 1 18 . 1 1 44 44 SER H H 44 7.984 7.984 7.856 0.128 18093 12429 1 18 . 1 1 45 45 VAL N N 45 123.544 123.544 121.013 2.531 18093 12430 1 18 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.684 -0.136 18093 12431 1 18 . 1 1 45 45 VAL C C 45 177.139 177.139 177.656 -0.517 18093 12432 1 18 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.639 0.594 18093 12433 1 18 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.672 -0.030 18093 12434 1 18 . 1 1 45 45 VAL H H 45 8.280 8.280 8.446 -0.166 18093 12435 1 18 . 1 1 46 46 LEU N N 46 119.883 119.883 119.714 0.169 18093 12436 1 18 . 1 1 46 46 LEU HA H 46 3.943 3.943 3.942 0.001 18093 12437 1 18 . 1 1 46 46 LEU C C 46 180.125 180.125 178.725 1.400 18093 12438 1 18 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.977 0.623 18093 12439 1 18 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.818 0.194 18093 12440 1 18 . 1 1 46 46 LEU H H 46 8.117 8.117 7.278 0.839 18093 12441 1 18 . 1 1 47 47 LEU N N 47 120.193 120.193 119.080 1.113 18093 12442 1 18 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.942 0.062 18093 12443 1 18 . 1 1 47 47 LEU C C 47 178.370 178.370 178.692 -0.322 18093 12444 1 18 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.319 0.107 18093 12445 1 18 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.492 0.563 18093 12446 1 18 . 1 1 47 47 LEU H H 47 8.933 8.933 7.611 1.322 18093 12447 1 18 . 1 1 48 48 SER N N 48 115.861 115.861 115.502 0.359 18093 12448 1 18 . 1 1 48 48 SER HA H 48 4.013 4.013 4.101 -0.088 18093 12449 1 18 . 1 1 48 48 SER C C 48 175.642 175.642 176.953 -1.311 18093 12450 1 18 . 1 1 48 48 SER CA C 48 63.571 63.571 61.701 1.870 18093 12451 1 18 . 1 1 48 48 SER CB C 48 62.879 62.879 63.120 -0.241 18093 12452 1 18 . 1 1 48 48 SER H H 48 7.996 7.996 7.655 0.341 18093 12453 1 18 . 1 1 49 49 LEU N N 49 120.673 120.673 122.823 -2.150 18093 12454 1 18 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.210 -0.175 18093 12455 1 18 . 1 1 49 49 LEU C C 49 178.229 178.229 178.750 -0.521 18093 12456 1 18 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.162 0.121 18093 12457 1 18 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.311 -0.365 18093 12458 1 18 . 1 1 49 49 LEU H H 49 8.352 8.352 7.749 0.603 18093 12459 1 18 . 1 1 50 50 THR N N 50 115.582 115.582 115.152 0.430 18093 12460 1 18 . 1 1 50 50 THR HA H 50 3.672 3.672 4.109 -0.437 18093 12461 1 18 . 1 1 50 50 THR C C 50 175.877 175.877 176.745 -0.868 18093 12462 1 18 . 1 1 50 50 THR CA C 50 68.628 68.628 66.297 2.331 18093 12463 1 18 . 1 1 50 50 THR H H 50 7.937 7.937 7.696 0.241 18093 12464 1 18 . 1 1 51 51 VAL N N 51 119.774 119.774 122.736 -2.962 18093 12465 1 18 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.833 -0.335 18093 12466 1 18 . 1 1 51 51 VAL C C 51 177.162 177.162 177.066 0.096 18093 12467 1 18 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.587 0.998 18093 12468 1 18 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.746 -0.225 18093 12469 1 18 . 1 1 51 51 VAL H H 51 8.115 8.115 8.009 0.106 18093 12470 1 18 . 1 1 52 52 PHE N N 52 118.808 118.808 120.384 -1.576 18093 12471 1 18 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.352 -0.230 18093 12472 1 18 . 1 1 52 52 PHE C C 52 176.697 176.697 176.792 -0.095 18093 12473 1 18 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.898 0.873 18093 12474 1 18 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.203 0.059 18093 12475 1 18 . 1 1 52 52 PHE H H 52 8.256 8.256 8.470 -0.214 18093 12476 1 18 . 1 1 53 53 LEU N N 53 117.267 117.267 122.650 -5.383 18093 12477 1 18 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.490 0.403 18093 12478 1 18 . 1 1 53 53 LEU C C 53 179.319 179.319 177.597 1.722 18093 12479 1 18 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.847 0.138 18093 12480 1 18 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.405 0.422 18093 12481 1 18 . 1 1 53 53 LEU H H 53 8.443 8.443 7.592 0.851 18093 12482 1 18 . 1 1 54 54 LEU N N 54 119.762 119.762 118.930 0.832 18093 12483 1 18 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.882 0.172 18093 12484 1 18 . 1 1 54 54 LEU C C 54 178.827 178.827 178.999 -0.172 18093 12485 1 18 . 1 1 54 54 LEU CA C 54 58.105 58.105 57.975 0.130 18093 12486 1 18 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.867 0.079 18093 12487 1 18 . 1 1 54 54 LEU H H 54 8.205 8.205 7.329 0.876 18093 12488 1 18 . 1 1 55 55 LEU N N 55 118.585 118.585 118.237 0.348 18093 12489 1 18 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.890 0.187 18093 12490 1 18 . 1 1 55 55 LEU C C 55 178.909 178.909 178.718 0.191 18093 12491 1 18 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.762 0.346 18093 12492 1 18 . 1 1 55 55 LEU CB C 55 41.979 41.979 41.830 0.149 18093 12493 1 18 . 1 1 55 55 LEU H H 55 8.179 8.179 7.352 0.827 18093 12494 1 18 . 1 1 56 56 ILE N N 56 116.079 116.079 115.661 0.418 18093 12495 1 18 . 1 1 56 56 ILE HA H 56 3.729 3.729 3.905 -0.176 18093 12496 1 18 . 1 1 56 56 ILE C C 56 176.988 176.988 177.984 -0.996 18093 12497 1 18 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.727 0.530 18093 12498 1 18 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.522 0.895 18093 12499 1 18 . 1 1 56 56 ILE H H 56 8.040 8.040 7.352 0.688 18093 12500 1 18 . 1 1 57 57 THR N N 57 110.105 110.105 110.562 -0.457 18093 12501 1 18 . 1 1 57 57 THR HA H 57 4.015 4.015 4.198 -0.183 18093 12502 1 18 . 1 1 57 57 THR C C 57 175.435 175.435 175.666 -0.231 18093 12503 1 18 . 1 1 57 57 THR CA C 57 65.067 65.067 64.322 0.745 18093 12504 1 18 . 1 1 57 57 THR CB C 57 69.179 69.179 68.592 0.587 18093 12505 1 18 . 1 1 57 57 THR H H 57 7.655 7.655 7.721 -0.066 18093 12506 1 18 . 1 1 58 58 GLU N N 58 117.313 117.313 120.563 -3.250 18093 12507 1 18 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.298 0.035 18093 12508 1 18 . 1 1 58 58 GLU C C 58 176.940 176.940 177.844 -0.904 18093 12509 1 18 . 1 1 58 58 GLU CA C 58 57.068 57.068 58.108 -1.040 18093 12510 1 18 . 1 1 58 58 GLU CB C 58 29.396 29.396 30.219 -0.823 18093 12511 1 18 . 1 1 58 58 GLU H H 58 7.521 7.521 7.743 -0.222 18093 12512 1 18 . 1 1 59 59 ILE N N 59 114.870 114.870 114.183 0.687 18093 12513 1 18 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.091 -0.002 18093 12514 1 18 . 1 1 59 59 ILE C C 59 175.456 175.456 175.963 -0.507 18093 12515 1 18 . 1 1 59 59 ILE CA C 59 62.434 62.434 61.880 0.554 18093 12516 1 18 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.565 0.093 18093 12517 1 18 . 1 1 59 59 ILE H H 59 7.579 7.579 7.220 0.359 18093 12518 1 18 . 1 1 60 60 ILE N N 60 119.354 119.354 119.105 0.249 18093 12519 1 18 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.895 0.409 18093 12520 1 18 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.571 -1.954 18093 12521 1 18 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.550 2.312 18093 12522 1 18 . 1 1 60 60 ILE H H 60 7.629 7.629 7.660 -0.031 18093 12523 1 18 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.262 0.138 18093 12524 1 18 . 1 1 61 61 PRO C C 61 177.144 177.144 176.764 0.380 18093 12525 1 18 . 1 1 61 61 PRO CA C 61 63.808 63.808 63.606 0.202 18093 12526 1 18 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.193 -0.311 18093 12527 1 18 . 1 1 62 62 SER N N 62 114.474 114.474 113.618 0.856 18093 12528 1 18 . 1 1 62 62 SER HA H 62 4.434 4.434 4.222 0.212 18093 12529 1 18 . 1 1 62 62 SER C C 62 175.161 175.161 173.589 1.572 18093 12530 1 18 . 1 1 62 62 SER CA C 62 59.047 59.047 58.960 0.087 18093 12531 1 18 . 1 1 62 62 SER CB C 62 63.704 63.704 63.206 0.497 18093 12532 1 18 . 1 1 62 62 SER H H 62 8.186 8.186 7.952 0.234 18093 12533 1 18 . 1 1 63 63 THR N N 63 113.573 113.573 119.876 -6.303 18093 12534 1 18 . 1 1 63 63 THR HA H 63 4.319 4.319 4.635 -0.316 18093 12535 1 18 . 1 1 63 63 THR C C 63 174.834 174.834 173.944 0.890 18093 12536 1 18 . 1 1 63 63 THR CA C 63 62.377 62.377 61.276 1.101 18093 12537 1 18 . 1 1 63 63 THR CB C 63 69.422 69.422 70.233 -0.811 18093 12538 1 18 . 1 1 63 63 THR H H 63 7.963 7.963 8.304 -0.341 18093 12539 1 18 . 1 1 64 64 SER N N 64 116.598 116.598 120.023 -3.425 18093 12540 1 18 . 1 1 64 64 SER HA H 64 4.428 4.428 4.743 -0.315 18093 12541 1 18 . 1 1 64 64 SER C C 64 174.618 174.618 174.063 0.555 18093 12542 1 18 . 1 1 64 64 SER CA C 64 59.045 59.045 57.191 1.854 18093 12543 1 18 . 1 1 64 64 SER CB C 64 63.700 63.700 64.908 -1.208 18093 12544 1 18 . 1 1 64 64 SER H H 64 8.052 8.052 8.524 -0.472 18093 12545 1 18 . 1 1 65 65 SER N N 65 116.673 116.673 117.527 -0.854 18093 12546 1 18 . 1 1 65 65 SER HA H 65 4.432 4.432 4.284 0.148 18093 12547 1 18 . 1 1 65 65 SER C C 65 174.335 174.335 175.318 -0.983 18093 12548 1 18 . 1 1 65 65 SER CA C 65 58.927 58.927 61.376 -2.449 18093 12549 1 18 . 1 1 65 65 SER CB C 65 63.621 63.621 63.017 0.604 18093 12550 1 18 . 1 1 65 65 SER H H 65 8.114 8.114 8.478 -0.364 18093 12551 1 18 . 1 1 66 66 VAL N N 66 119.054 119.054 118.123 0.931 18093 12552 1 18 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.012 0.158 18093 12553 1 18 . 1 1 66 66 VAL C C 66 175.278 175.278 175.520 -0.242 18093 12554 1 18 . 1 1 66 66 VAL CA C 66 62.062 62.062 64.288 -2.226 18093 12555 1 18 . 1 1 66 66 VAL CB C 66 32.629 32.629 31.649 0.980 18093 12556 1 18 . 1 1 66 66 VAL H H 66 7.740 7.740 8.048 -0.308 18093 12557 1 18 . 1 1 67 67 SER N N 67 118.882 118.882 116.375 2.507 18093 12558 1 18 . 1 1 67 67 SER HA H 67 4.704 4.704 4.906 -0.202 18093 12559 1 18 . 1 1 67 67 SER CA C 67 56.715 56.715 55.136 1.579 18093 12560 1 18 . 1 1 67 67 SER CB C 67 63.624 63.624 63.249 0.375 18093 12561 1 18 . 1 1 67 67 SER H H 67 8.060 8.060 7.811 0.249 18093 12562 1 18 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.719 -0.319 18093 12563 1 18 . 1 1 68 68 PRO C C 68 176.925 176.925 176.795 0.130 18093 12564 1 18 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.462 1.286 18093 12565 1 18 . 1 1 68 68 PRO CB C 68 32.005 32.005 30.623 1.382 18093 12566 1 18 . 1 1 69 69 SER N N 69 114.930 114.930 120.348 -5.418 18093 12567 1 18 . 1 1 69 69 SER HA H 69 4.422 4.422 4.226 0.196 18093 12568 1 18 . 1 1 69 69 SER C C 69 175.617 175.617 176.253 -0.636 18093 12569 1 18 . 1 1 69 69 SER CA C 69 58.697 58.697 57.410 1.287 18093 12570 1 18 . 1 1 69 69 SER CB C 69 63.804 63.804 64.615 -0.811 18093 12571 1 18 . 1 1 69 69 SER H H 69 8.205 8.205 7.803 0.402 18093 12572 1 18 . 1 1 70 70 ILE N N 70 120.840 120.840 121.701 -0.861 18093 12573 1 18 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.107 -0.115 18093 12574 1 18 . 1 1 70 70 ILE C C 70 177.524 177.524 177.156 0.368 18093 12575 1 18 . 1 1 70 70 ILE CA C 70 64.335 64.335 62.298 2.037 18093 12576 1 18 . 1 1 70 70 ILE CB C 70 37.460 37.460 37.833 -0.373 18093 12577 1 18 . 1 1 70 70 ILE H H 70 8.283 8.283 8.778 -0.495 18093 12578 1 18 . 1 1 71 71 GLY N N 71 107.823 107.823 108.350 -0.527 18093 12579 1 18 . 1 1 71 71 GLY C C 71 175.296 175.296 176.166 -0.870 18093 12580 1 18 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.288 0.167 18093 12581 1 18 . 1 1 71 71 GLY H H 71 8.557 8.557 8.444 0.113 18093 12582 1 18 . 1 1 72 72 GLU N N 72 120.835 120.835 120.784 0.051 18093 12583 1 18 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.227 -0.380 18093 12584 1 18 . 1 1 72 72 GLU C C 72 178.198 178.198 178.318 -0.120 18093 12585 1 18 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.822 1.296 18093 12586 1 18 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.718 -0.325 18093 12587 1 18 . 1 1 72 72 GLU H H 72 7.922 7.922 7.796 0.126 18093 12588 1 18 . 1 1 73 73 TYR N N 73 117.375 117.375 122.112 -4.737 18093 12589 1 18 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.286 -0.124 18093 12590 1 18 . 1 1 73 73 TYR C C 73 179.912 179.912 178.023 1.889 18093 12591 1 18 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.252 0.903 18093 12592 1 18 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.623 0.143 18093 12593 1 18 . 1 1 73 73 TYR H H 73 8.062 8.062 7.924 0.138 18093 12594 1 18 . 1 1 74 74 LEU N N 74 121.493 121.493 119.239 2.254 18093 12595 1 18 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.661 0.388 18093 12596 1 18 . 1 1 74 74 LEU C C 74 178.063 178.063 178.611 -0.548 18093 12597 1 18 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.602 0.892 18093 12598 1 18 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.776 0.071 18093 12599 1 18 . 1 1 74 74 LEU H H 74 8.552 8.552 8.829 -0.277 18093 12600 1 18 . 1 1 75 75 LEU N N 75 120.375 120.375 120.651 -0.276 18093 12601 1 18 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.015 0.025 18093 12602 1 18 . 1 1 75 75 LEU C C 75 178.515 178.515 178.246 0.269 18093 12603 1 18 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.238 0.400 18093 12604 1 18 . 1 1 75 75 LEU CB C 75 42.039 42.039 42.042 -0.003 18093 12605 1 18 . 1 1 75 75 LEU H H 75 8.276 8.276 7.444 0.832 18093 12606 1 18 . 1 1 76 76 PHE N N 76 116.626 116.626 118.095 -1.469 18093 12607 1 18 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.099 -0.020 18093 12608 1 18 . 1 1 76 76 PHE C C 76 177.399 177.399 178.011 -0.612 18093 12609 1 18 . 1 1 76 76 PHE CA C 76 61.734 61.734 61.846 -0.112 18093 12610 1 18 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.617 0.124 18093 12611 1 18 . 1 1 76 76 PHE H H 76 8.454 8.454 7.975 0.479 18093 12612 1 18 . 1 1 77 77 THR N N 77 116.080 116.080 115.252 0.828 18093 12613 1 18 . 1 1 77 77 THR HA H 77 3.687 3.687 3.945 -0.258 18093 12614 1 18 . 1 1 77 77 THR C C 77 176.018 176.018 176.532 -0.514 18093 12615 1 18 . 1 1 77 77 THR CA C 77 68.640 68.640 66.214 2.426 18093 12616 1 18 . 1 1 77 77 THR H H 77 8.224 8.224 8.641 -0.417 18093 12617 1 18 . 1 1 78 78 MET N N 78 119.394 119.394 121.043 -1.649 18093 12618 1 18 . 1 1 78 78 MET HA H 78 4.129 4.129 4.040 0.089 18093 12619 1 18 . 1 1 78 78 MET C C 78 179.608 179.608 178.430 1.178 18093 12620 1 18 . 1 1 78 78 MET CA C 78 58.831 58.831 60.003 -1.172 18093 12621 1 18 . 1 1 78 78 MET CB C 78 31.590 31.590 32.499 -0.909 18093 12622 1 18 . 1 1 78 78 MET H H 78 8.372 8.372 7.581 0.791 18093 12623 1 18 . 1 1 79 79 ILE N N 79 121.819 121.819 118.307 3.512 18093 12624 1 18 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.730 -0.180 18093 12625 1 18 . 1 1 79 79 ILE C C 79 176.426 176.426 177.689 -1.263 18093 12626 1 18 . 1 1 79 79 ILE CA C 79 65.876 65.876 64.458 1.418 18093 12627 1 18 . 1 1 79 79 ILE CB C 79 37.673 37.673 37.473 0.200 18093 12628 1 18 . 1 1 79 79 ILE H H 79 8.391 8.391 7.689 0.702 18093 12629 1 18 . 1 1 80 80 PHE N N 80 119.916 119.916 121.601 -1.685 18093 12630 1 18 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.128 -0.075 18093 12631 1 18 . 1 1 80 80 PHE C C 80 178.568 178.568 177.239 1.329 18093 12632 1 18 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.121 0.186 18093 12633 1 18 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.536 -0.762 18093 12634 1 18 . 1 1 80 80 PHE H H 80 8.479 8.479 7.761 0.718 18093 12635 1 18 . 1 1 81 81 VAL N N 81 120.191 120.191 115.683 4.508 18093 12636 1 18 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.633 -0.180 18093 12637 1 18 . 1 1 81 81 VAL C C 81 178.225 178.225 177.530 0.695 18093 12638 1 18 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.123 1.285 18093 12639 1 18 . 1 1 81 81 VAL CB C 81 31.556 31.556 30.529 1.027 18093 12640 1 18 . 1 1 81 81 VAL H H 81 8.928 8.928 8.761 0.167 18093 12641 1 18 . 1 1 82 82 THR N N 82 115.930 115.930 118.237 -2.307 18093 12642 1 18 . 1 1 82 82 THR HA H 82 3.636 3.636 3.887 -0.251 18093 12643 1 18 . 1 1 82 82 THR C C 82 176.420 176.420 176.663 -0.243 18093 12644 1 18 . 1 1 82 82 THR CA C 82 68.570 68.570 66.908 1.662 18093 12645 1 18 . 1 1 82 82 THR CB C 82 68.202 68.202 68.708 -0.506 18093 12646 1 18 . 1 1 82 82 THR H H 82 7.969 7.969 7.489 0.480 18093 12647 1 18 . 1 1 83 83 LEU N N 83 119.780 119.780 118.816 0.964 18093 12648 1 18 . 1 1 83 83 LEU HA H 83 3.847 3.847 4.048 -0.201 18093 12649 1 18 . 1 1 83 83 LEU C C 83 178.214 178.214 178.395 -0.181 18093 12650 1 18 . 1 1 83 83 LEU CA C 83 58.237 58.237 58.003 0.234 18093 12651 1 18 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.101 0.690 18093 12652 1 18 . 1 1 83 83 LEU H H 83 8.483 8.483 7.384 1.099 18093 12653 1 18 . 1 1 84 84 SER N N 84 114.559 114.559 116.794 -2.235 18093 12654 1 18 . 1 1 84 84 SER HA H 84 4.099 4.099 4.034 0.065 18093 12655 1 18 . 1 1 84 84 SER C C 84 176.799 176.799 176.899 -0.100 18093 12656 1 18 . 1 1 84 84 SER CA C 84 63.609 63.609 62.295 1.314 18093 12657 1 18 . 1 1 84 84 SER CB C 84 63.110 63.110 62.779 0.331 18093 12658 1 18 . 1 1 84 84 SER H H 84 8.023 8.023 7.312 0.711 18093 12659 1 18 . 1 1 85 85 ILE N N 85 123.962 123.962 121.348 2.614 18093 12660 1 18 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.832 -0.228 18093 12661 1 18 . 1 1 85 85 ILE C C 85 177.487 177.487 178.115 -0.628 18093 12662 1 18 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.203 0.557 18093 12663 1 18 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.930 -0.043 18093 12664 1 18 . 1 1 85 85 ILE H H 85 8.054 8.054 8.222 -0.168 18093 12665 1 18 . 1 1 86 86 VAL N N 86 118.744 118.744 120.585 -1.841 18093 12666 1 18 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.723 -0.204 18093 12667 1 18 . 1 1 86 86 VAL C C 86 177.557 177.557 177.745 -0.188 18093 12668 1 18 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.499 1.036 18093 12669 1 18 . 1 1 86 86 VAL CB C 86 31.466 31.466 32.075 -0.609 18093 12670 1 18 . 1 1 86 86 VAL H H 86 8.158 8.158 7.241 0.917 18093 12671 1 18 . 1 1 87 87 ILE N N 87 117.206 117.206 119.474 -2.268 18093 12672 1 18 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.767 -0.163 18093 12673 1 18 . 1 1 87 87 ILE C C 87 177.283 177.283 178.295 -1.012 18093 12674 1 18 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.492 2.184 18093 12675 1 18 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.594 0.995 18093 12676 1 18 . 1 1 87 87 ILE H H 87 8.459 8.459 8.489 -0.030 18093 12677 1 18 . 1 1 88 88 THR N N 88 116.158 116.158 117.171 -1.013 18093 12678 1 18 . 1 1 88 88 THR HA H 88 3.672 3.672 4.255 -0.583 18093 12679 1 18 . 1 1 88 88 THR C C 88 175.485 175.485 176.966 -1.481 18093 12680 1 18 . 1 1 88 88 THR CA C 88 68.549 68.549 67.786 0.763 18093 12681 1 18 . 1 1 88 88 THR CB C 88 68.127 68.127 68.914 -0.787 18093 12682 1 18 . 1 1 88 88 THR H H 88 7.776 7.776 8.372 -0.596 18093 12683 1 18 . 1 1 89 89 VAL N N 89 117.985 117.985 121.268 -3.283 18093 12684 1 18 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.946 -0.403 18093 12685 1 18 . 1 1 89 89 VAL C C 89 177.393 177.393 177.642 -0.249 18093 12686 1 18 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.629 0.961 18093 12687 1 18 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.977 -0.199 18093 12688 1 18 . 1 1 89 89 VAL H H 89 8.206 8.206 7.650 0.556 18093 12689 1 18 . 1 1 90 90 PHE N N 90 116.709 116.709 119.871 -3.162 18093 12690 1 18 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.259 0.119 18093 12691 1 18 . 1 1 90 90 PHE C C 90 177.305 177.305 177.477 -0.172 18093 12692 1 18 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.570 -0.451 18093 12693 1 18 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.736 0.649 18093 12694 1 18 . 1 1 90 90 PHE H H 90 7.956 7.956 7.724 0.232 18093 12695 1 18 . 1 1 91 91 VAL N N 91 116.565 116.565 119.449 -2.884 18093 12696 1 18 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.698 0.137 18093 12697 1 18 . 1 1 91 91 VAL C C 91 176.927 176.927 177.566 -0.639 18093 12698 1 18 . 1 1 91 91 VAL CA C 91 65.347 65.347 66.206 -0.858 18093 12699 1 18 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.861 0.006 18093 12700 1 18 . 1 1 91 91 VAL H H 91 8.239 8.239 7.790 0.449 18093 12701 1 18 . 1 1 92 92 LEU N N 92 117.443 117.443 117.279 0.164 18093 12702 1 18 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.232 -0.038 18093 12703 1 18 . 1 1 92 92 LEU C C 92 177.180 177.180 177.543 -0.363 18093 12704 1 18 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.453 -0.269 18093 12705 1 18 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.215 -0.271 18093 12706 1 18 . 1 1 92 92 LEU H H 92 7.967 7.967 7.631 0.336 18093 12707 1 18 . 1 1 93 93 ASN N N 93 116.705 116.705 116.388 0.317 18093 12708 1 18 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.562 0.085 18093 12709 1 18 . 1 1 93 93 ASN C C 93 175.129 175.129 176.248 -1.119 18093 12710 1 18 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.155 -1.301 18093 12711 1 18 . 1 1 93 93 ASN CB C 93 39.395 39.395 38.925 0.470 18093 12712 1 18 . 1 1 93 93 ASN H H 93 7.683 7.683 7.740 -0.057 18093 12713 1 18 . 1 1 94 94 VAL N N 94 118.224 118.224 121.836 -3.612 18093 12714 1 18 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.990 -0.029 18093 12715 1 18 . 1 1 94 94 VAL C C 94 175.600 175.600 174.635 0.965 18093 12716 1 18 . 1 1 94 94 VAL CA C 94 62.825 62.825 62.337 0.488 18093 12717 1 18 . 1 1 94 94 VAL CB C 94 32.214 32.214 32.679 -0.465 18093 12718 1 18 . 1 1 94 94 VAL H H 94 7.627 7.627 7.968 -0.341 18093 12719 1 18 . 1 1 95 95 HIS N N 95 120.999 120.999 122.584 -1.585 18093 12720 1 18 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.883 -0.290 18093 12721 1 18 . 1 1 95 95 HIS C C 95 174.146 174.146 173.925 0.221 18093 12722 1 18 . 1 1 95 95 HIS CA C 95 55.666 55.666 54.223 1.443 18093 12723 1 18 . 1 1 95 95 HIS CB C 95 29.736 29.736 29.049 0.687 18093 12724 1 18 . 1 1 95 95 HIS H H 95 8.263 8.263 7.866 0.397 18093 12725 1 18 . 1 1 96 96 HIS N N 96 122.740 122.740 119.927 2.813 18093 12726 1 18 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.722 -0.089 18093 12727 1 18 . 1 1 96 96 HIS CA C 96 55.895 55.895 56.407 -0.512 18093 12728 1 18 . 1 1 96 96 HIS CB C 96 29.750 29.750 30.016 -0.266 18093 12729 1 18 . 1 1 96 96 HIS H H 96 8.298 8.298 8.433 -0.135 18093 12730 1 18 . 1 1 97 97 ARG N N 97 118.503 118.503 118.740 -0.237 18093 12731 1 18 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.627 -0.315 18093 12732 1 18 . 1 1 97 97 ARG C C 97 175.776 175.776 175.050 0.726 18093 12733 1 18 . 1 1 97 97 ARG CA C 97 56.225 56.225 54.986 1.239 18093 12734 1 18 . 1 1 97 97 ARG CB C 97 30.912 30.912 29.416 1.496 18093 12735 1 18 . 1 1 97 97 ARG H H 97 8.250 8.250 8.155 0.095 18093 12736 1 18 . 1 1 98 98 SER N N 98 118.482 118.482 116.348 2.134 18093 12737 1 18 . 1 1 98 98 SER HA H 98 4.722 4.722 4.966 -0.244 18093 12738 1 18 . 1 1 98 98 SER CA C 98 56.547 56.547 55.658 0.889 18093 12739 1 18 . 1 1 98 98 SER CB C 98 63.624 63.624 65.145 -1.521 18093 12740 1 18 . 1 1 98 98 SER H H 98 8.254 8.254 7.596 0.658 18093 12741 1 18 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.344 0.059 18093 12742 1 18 . 1 1 99 99 PRO C C 99 176.899 176.899 176.548 0.351 18093 12743 1 18 . 1 1 99 99 PRO CA C 99 63.701 63.701 63.580 0.121 18093 12744 1 18 . 1 1 99 99 PRO CB C 99 31.949 31.949 31.953 -0.005 18093 12745 1 18 . 1 1 100 100 GLU N N 100 120.187 120.187 116.740 3.447 18093 12746 1 18 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.033 0.255 18093 12747 1 18 . 1 1 100 100 GLU C C 100 176.593 176.593 176.451 0.142 18093 12748 1 18 . 1 1 100 100 GLU CA C 100 56.722 56.722 57.456 -0.734 18093 12749 1 18 . 1 1 100 100 GLU CB C 100 29.999 29.999 29.062 0.937 18093 12750 1 18 . 1 1 100 100 GLU H H 100 8.401 8.401 8.530 -0.129 18093 12751 1 18 . 1 1 101 101 THR N N 101 113.968 113.968 112.357 1.611 18093 12752 1 18 . 1 1 101 101 THR HA H 101 4.286 4.286 4.232 0.054 18093 12753 1 18 . 1 1 101 101 THR C C 101 174.525 174.525 175.037 -0.512 18093 12754 1 18 . 1 1 101 101 THR CA C 101 61.956 61.956 63.344 -1.388 18093 12755 1 18 . 1 1 101 101 THR CB C 101 69.697 69.697 69.066 0.631 18093 12756 1 18 . 1 1 101 101 THR H H 101 7.945 7.945 8.147 -0.202 18093 12757 1 18 . 1 1 102 102 HIS N N 102 120.322 120.322 117.903 2.419 18093 12758 1 18 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.648 0.093 18093 12759 1 18 . 1 1 102 102 HIS C C 102 174.783 174.783 174.268 0.515 18093 12760 1 18 . 1 1 102 102 HIS CA C 102 55.701 55.701 56.025 -0.324 18093 12761 1 18 . 1 1 102 102 HIS CB C 102 29.093 29.093 31.128 -2.035 18093 12762 1 18 . 1 1 102 102 HIS H H 102 8.455 8.455 7.894 0.561 18093 12763 1 18 . 1 1 103 103 THR N N 103 114.282 114.282 114.861 -0.579 18093 12764 1 18 . 1 1 103 103 THR HA H 103 4.352 4.352 4.514 -0.162 18093 12765 1 18 . 1 1 103 103 THR C C 103 175.104 175.104 174.312 0.792 18093 12766 1 18 . 1 1 103 103 THR CA C 103 62.057 62.057 61.269 0.788 18093 12767 1 18 . 1 1 103 103 THR CB C 103 69.966 69.966 69.750 0.216 18093 12768 1 18 . 1 1 103 103 THR H H 103 8.069 8.069 8.035 0.034 18093 12769 1 18 . 1 1 104 104 GLY N N 104 111.159 111.159 109.802 1.357 18093 12770 1 18 . 1 1 104 104 GLY C C 104 174.776 174.776 173.819 0.957 18093 12771 1 18 . 1 1 104 104 GLY CA C 104 45.588 45.588 45.282 0.306 18093 12772 1 18 . 1 1 104 104 GLY H H 104 8.393 8.393 8.161 0.232 18093 12773 1 18 . 1 1 105 105 GLY N N 105 108.657 108.657 109.576 -0.919 18093 12774 1 18 . 1 1 105 105 GLY C C 105 174.957 174.957 174.700 0.257 18093 12775 1 18 . 1 1 105 105 GLY CA C 105 45.612 45.612 45.314 0.298 18093 12776 1 18 . 1 1 105 105 GLY H H 105 8.275 8.275 8.578 -0.303 18093 12777 1 18 . 1 1 106 106 GLY N N 106 108.870 108.870 108.955 -0.085 18093 12778 1 18 . 1 1 106 106 GLY C C 106 174.877 174.877 173.370 1.507 18093 12779 1 18 . 1 1 106 106 GLY CA C 106 45.665 45.665 44.956 0.709 18093 12780 1 18 . 1 1 106 106 GLY H H 106 8.357 8.357 8.101 0.256 18093 12781 1 18 . 1 1 107 107 GLY N N 107 108.476 108.476 110.292 -1.816 18093 12782 1 18 . 1 1 107 107 GLY C C 107 174.877 174.877 174.295 0.582 18093 12783 1 18 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.892 -0.196 18093 12784 1 18 . 1 1 107 107 GLY H H 107 8.330 8.330 8.386 -0.056 18093 12785 1 18 . 1 1 108 108 GLY N N 108 108.486 108.486 110.546 -2.060 18093 12786 1 18 . 1 1 108 108 GLY C C 108 175.345 175.345 175.275 0.070 18093 12787 1 18 . 1 1 108 108 GLY CA C 108 45.763 45.763 44.343 1.420 18093 12788 1 18 . 1 1 108 108 GLY H H 108 8.328 8.328 8.432 -0.104 18093 12789 1 18 . 1 1 109 109 ILE N N 109 120.433 120.433 120.747 -0.314 18093 12790 1 18 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.939 0.029 18093 12791 1 18 . 1 1 109 109 ILE C C 109 176.127 176.127 177.171 -1.044 18093 12792 1 18 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.435 -0.700 18093 12793 1 18 . 1 1 109 109 ILE CB C 109 38.125 38.125 38.206 -0.081 18093 12794 1 18 . 1 1 109 109 ILE H H 109 8.192 8.192 7.871 0.321 18093 12795 1 18 . 1 1 110 110 ASP N N 110 121.148 121.148 119.341 1.807 18093 12796 1 18 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.489 -0.183 18093 12797 1 18 . 1 1 110 110 ASP C C 110 177.651 177.651 178.259 -0.608 18093 12798 1 18 . 1 1 110 110 ASP CA C 110 56.776 56.776 57.885 -1.109 18093 12799 1 18 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.630 0.467 18093 12800 1 18 . 1 1 110 110 ASP H H 110 8.427 8.427 8.624 -0.197 18093 12801 1 18 . 1 1 111 111 ARG N N 111 119.228 119.228 118.969 0.259 18093 12802 1 18 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.314 -0.318 18093 12803 1 18 . 1 1 111 111 ARG C C 111 177.786 177.786 178.940 -1.154 18093 12804 1 18 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.079 -0.137 18093 12805 1 18 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.930 0.266 18093 12806 1 18 . 1 1 111 111 ARG H H 111 7.850 7.850 8.437 -0.587 18093 12807 1 18 . 1 1 112 112 ILE N N 112 118.000 118.000 119.653 -1.653 18093 12808 1 18 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.127 -0.314 18093 12809 1 18 . 1 1 112 112 ILE C C 112 177.496 177.496 177.975 -0.479 18093 12810 1 18 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.266 2.546 18093 12811 1 18 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.971 0.756 18093 12812 1 18 . 1 1 112 112 ILE H H 112 7.764 7.764 7.748 0.016 18093 12813 1 18 . 1 1 113 113 PHE N N 113 118.367 118.367 122.102 -3.735 18093 12814 1 18 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.284 -0.029 18093 12815 1 18 . 1 1 113 113 PHE C C 113 177.218 177.218 177.447 -0.229 18093 12816 1 18 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.393 -0.960 18093 12817 1 18 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.214 -0.407 18093 12818 1 18 . 1 1 113 113 PHE H H 113 7.963 7.963 8.017 -0.054 18093 12819 1 18 . 1 1 114 114 LEU N N 114 118.921 118.921 117.954 0.967 18093 12820 1 18 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.997 0.000 18093 12821 1 18 . 1 1 114 114 LEU C C 114 178.297 178.297 178.431 -0.134 18093 12822 1 18 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.371 0.240 18093 12823 1 18 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.326 0.626 18093 12824 1 18 . 1 1 114 114 LEU H H 114 7.939 7.939 8.202 -0.263 18093 12825 1 18 . 1 1 115 115 TRP N N 115 117.464 117.464 119.498 -2.034 18093 12826 1 18 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.408 -0.034 18093 12827 1 18 . 1 1 115 115 TRP C C 115 178.572 178.572 178.276 0.296 18093 12828 1 18 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.809 1.113 18093 12829 1 18 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.795 -1.288 18093 12830 1 18 . 1 1 115 115 TRP H H 115 7.969 7.969 7.650 0.319 18093 12831 1 18 . 1 1 116 116 MET N N 116 117.069 117.069 118.941 -1.872 18093 12832 1 18 . 1 1 116 116 MET HA H 116 4.065 4.065 4.241 -0.176 18093 12833 1 18 . 1 1 116 116 MET C C 116 177.425 177.425 178.215 -0.790 18093 12834 1 18 . 1 1 116 116 MET CA C 116 59.289 59.289 59.109 0.180 18093 12835 1 18 . 1 1 116 116 MET CB C 116 31.692 31.692 32.526 -0.834 18093 12836 1 18 . 1 1 116 116 MET H H 116 8.465 8.465 7.739 0.726 18093 12837 1 18 . 1 1 117 117 PHE N N 117 118.755 118.755 117.591 1.164 18093 12838 1 18 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.109 -0.010 18093 12839 1 18 . 1 1 117 117 PHE C C 117 177.965 177.965 178.230 -0.265 18093 12840 1 18 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.218 -0.510 18093 12841 1 18 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.268 0.917 18093 12842 1 18 . 1 1 117 117 PHE H H 117 8.418 8.418 7.870 0.548 18093 12843 1 18 . 1 1 118 118 ILE N N 118 119.133 119.133 115.393 3.740 18093 12844 1 18 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.928 -0.584 18093 12845 1 18 . 1 1 118 118 ILE C C 118 177.244 177.244 177.647 -0.403 18093 12846 1 18 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.329 1.496 18093 12847 1 18 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.793 -0.245 18093 12848 1 18 . 1 1 118 118 ILE H H 118 8.266 8.266 7.748 0.518 18093 12849 1 18 . 1 1 119 119 ILE N N 119 118.846 118.846 121.534 -2.688 18093 12850 1 18 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.916 -0.344 18093 12851 1 18 . 1 1 119 119 ILE C C 119 177.523 177.523 177.657 -0.134 18093 12852 1 18 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.201 0.688 18093 12853 1 18 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.295 -0.731 18093 12854 1 18 . 1 1 119 119 ILE H H 119 8.308 8.308 7.336 0.972 18093 12855 1 18 . 1 1 120 120 VAL N N 120 119.228 119.228 117.174 2.054 18093 12856 1 18 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.800 -0.292 18093 12857 1 18 . 1 1 120 120 VAL C C 120 177.651 177.651 177.506 0.145 18093 12858 1 18 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.885 1.716 18093 12859 1 18 . 1 1 120 120 VAL CB C 120 31.406 31.406 31.462 -0.056 18093 12860 1 18 . 1 1 120 120 VAL H H 120 8.399 8.399 8.021 0.378 18093 12861 1 18 . 1 1 121 121 CYS N N 121 117.151 117.151 119.455 -2.304 18093 12862 1 18 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.131 -0.228 18093 12863 1 18 . 1 1 121 121 CYS C C 121 177.719 177.719 177.039 0.680 18093 12864 1 18 . 1 1 121 121 CYS CA C 121 64.298 64.298 64.306 -0.008 18093 12865 1 18 . 1 1 121 121 CYS CB C 121 26.677 26.677 27.250 -0.573 18093 12866 1 18 . 1 1 121 121 CYS H H 121 8.008 8.008 7.553 0.455 18093 12867 1 18 . 1 1 122 122 LEU N N 122 121.402 121.402 120.738 0.664 18093 12868 1 18 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.222 -0.239 18093 12869 1 18 . 1 1 122 122 LEU C C 122 178.282 178.282 178.761 -0.479 18093 12870 1 18 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.669 0.876 18093 12871 1 18 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.486 0.480 18093 12872 1 18 . 1 1 122 122 LEU H H 122 8.417 8.417 7.670 0.747 18093 12873 1 18 . 1 1 123 123 LEU N N 123 118.543 118.543 120.194 -1.651 18093 12874 1 18 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.074 -0.154 18093 12875 1 18 . 1 1 123 123 LEU C C 123 179.028 179.028 178.721 0.307 18093 12876 1 18 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.434 -0.318 18093 12877 1 18 . 1 1 123 123 LEU CB C 123 42.056 42.056 41.023 1.033 18093 12878 1 18 . 1 1 123 123 LEU H H 123 8.590 8.590 7.770 0.820 18093 12879 1 18 . 1 1 124 124 GLY N N 124 104.896 104.896 105.732 -0.836 18093 12880 1 18 . 1 1 124 124 GLY C C 124 173.932 173.932 176.028 -2.096 18093 12881 1 18 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.480 -0.253 18093 12882 1 18 . 1 1 124 124 GLY H H 124 8.601 8.601 8.492 0.109 18093 12883 1 18 . 1 1 125 125 THR N N 125 115.403 115.403 118.942 -3.539 18093 12884 1 18 . 1 1 125 125 THR HA H 125 3.686 3.686 3.837 -0.151 18093 12885 1 18 . 1 1 125 125 THR C C 125 176.407 176.407 176.602 -0.195 18093 12886 1 18 . 1 1 125 125 THR CA C 125 67.565 67.565 67.311 0.254 18093 12887 1 18 . 1 1 125 125 THR CB C 125 68.143 68.143 68.698 -0.555 18093 12888 1 18 . 1 1 125 125 THR H H 125 7.734 7.734 7.419 0.315 18093 12889 1 18 . 1 1 126 126 VAL N N 126 119.056 119.056 121.081 -2.025 18093 12890 1 18 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.734 -0.195 18093 12891 1 18 . 1 1 126 126 VAL C C 126 177.628 177.628 178.020 -0.392 18093 12892 1 18 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.683 -0.082 18093 12893 1 18 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.711 -0.217 18093 12894 1 18 . 1 1 126 126 VAL H H 126 8.015 8.015 7.830 0.185 18093 12895 1 18 . 1 1 127 127 GLY N N 127 104.644 104.644 107.338 -2.694 18093 12896 1 18 . 1 1 127 127 GLY C C 127 173.933 173.933 175.772 -1.839 18093 12897 1 18 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.122 0.159 18093 12898 1 18 . 1 1 127 127 GLY H H 127 8.248 8.248 8.503 -0.255 18093 12899 1 18 . 1 1 128 128 LEU N N 128 117.354 117.354 120.532 -3.178 18093 12900 1 18 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.056 -0.044 18093 12901 1 18 . 1 1 128 128 LEU C C 128 177.443 177.443 177.994 -0.551 18093 12902 1 18 . 1 1 128 128 LEU CA C 128 56.626 56.626 57.124 -0.498 18093 12903 1 18 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.864 0.396 18093 12904 1 18 . 1 1 128 128 LEU H H 128 7.568 7.568 7.845 -0.277 18093 12905 1 18 . 1 1 129 129 PHE N N 129 113.971 113.971 117.717 -3.746 18093 12906 1 18 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.326 0.132 18093 12907 1 18 . 1 1 129 129 PHE C C 129 176.216 176.216 176.368 -0.152 18093 12908 1 18 . 1 1 129 129 PHE CA C 129 58.385 58.385 61.623 -3.238 18093 12909 1 18 . 1 1 129 129 PHE CB C 129 39.719 39.719 40.069 -0.350 18093 12910 1 18 . 1 1 129 129 PHE H H 129 7.639 7.639 7.439 0.200 18093 12911 1 18 . 1 1 130 130 LEU N N 130 117.752 117.752 118.544 -0.792 18093 12912 1 18 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.825 -0.392 18093 12913 1 18 . 1 1 130 130 LEU CA C 130 54.156 54.156 52.463 1.693 18093 12914 1 18 . 1 1 130 130 LEU H H 130 8.099 8.099 7.834 0.265 18093 12915 1 18 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.874 -0.424 18093 12916 1 18 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.484 2.415 18093 12917 1 18 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.435 -0.173 18093 12918 1 18 . 1 1 132 132 PRO C C 132 177.616 177.616 177.597 0.019 18093 12919 1 18 . 1 1 132 132 PRO CA C 132 64.980 64.980 63.165 1.815 18093 12920 1 18 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.562 -0.937 18093 12921 1 18 . 1 1 133 133 TRP N N 133 115.508 115.508 118.160 -2.652 18093 12922 1 18 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.280 0.312 18093 12923 1 18 . 1 1 133 133 TRP C C 133 176.842 176.842 176.600 0.242 18093 12924 1 18 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.654 -2.371 18093 12925 1 18 . 1 1 133 133 TRP CB C 133 28.596 28.596 27.863 0.734 18093 12926 1 18 . 1 1 133 133 TRP H H 133 7.311 7.311 8.400 -1.089 18093 12927 1 18 . 1 1 134 134 LEU N N 134 119.570 119.570 119.984 -0.414 18093 12928 1 18 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.202 -0.025 18093 12929 1 18 . 1 1 134 134 LEU C C 134 175.768 175.768 178.077 -2.309 18093 12930 1 18 . 1 1 134 134 LEU CA C 134 55.621 55.621 54.489 1.132 18093 12931 1 18 . 1 1 134 134 LEU CB C 134 42.648 42.648 42.117 0.531 18093 12932 1 18 . 1 1 134 134 LEU H H 134 7.453 7.453 8.290 -0.837 18093 12933 1 18 . 1 1 135 135 ALA N N 135 119.004 119.004 121.186 -2.182 18093 12934 1 18 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.088 0.135 18093 12935 1 18 . 1 1 135 135 ALA C C 135 177.170 177.170 178.254 -1.084 18093 12936 1 18 . 1 1 135 135 ALA CA C 135 52.456 52.456 54.154 -1.698 18093 12937 1 18 . 1 1 135 135 ALA CB C 135 19.736 19.736 18.904 0.832 18093 12938 1 18 . 1 1 135 135 ALA H H 135 7.541 7.541 7.911 -0.370 18093 12939 1 18 . 1 1 136 136 GLY N N 136 105.879 105.879 105.482 0.397 18093 12940 1 18 . 1 1 136 136 GLY C C 136 173.042 173.042 174.416 -1.374 18093 12941 1 18 . 1 1 136 136 GLY CA C 136 45.693 45.693 44.990 0.703 18093 12942 1 18 . 1 1 136 136 GLY H H 136 7.846 7.846 8.038 -0.192 18093 12943 1 19 . 1 1 5 5 GLU N N 5 119.627 119.627 120.258 -0.631 18093 12944 1 19 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.405 -0.197 18093 12945 1 19 . 1 1 5 5 GLU C C 5 176.581 176.581 175.103 1.478 18093 12946 1 19 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.315 0.730 18093 12947 1 19 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.926 0.112 18093 12948 1 19 . 1 1 5 5 GLU H H 5 8.003 8.003 8.326 -0.323 18093 12949 1 19 . 1 1 6 6 LEU N N 6 121.267 121.267 122.166 -0.899 18093 12950 1 19 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.705 -0.280 18093 12951 1 19 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.678 1.957 18093 12952 1 19 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.457 -0.161 18093 12953 1 19 . 1 1 6 6 LEU H H 6 8.104 8.104 7.898 0.206 18093 12954 1 19 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.582 -0.183 18093 12955 1 19 . 1 1 7 7 PRO C C 7 178.408 178.408 177.972 0.436 18093 12956 1 19 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.071 2.641 18093 12957 1 19 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.797 -0.881 18093 12958 1 19 . 1 1 8 8 LEU N N 8 121.835 121.835 120.975 0.860 18093 12959 1 19 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.109 -0.020 18093 12960 1 19 . 1 1 8 8 LEU C C 8 177.902 177.902 178.330 -0.428 18093 12961 1 19 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.616 0.489 18093 12962 1 19 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.162 0.445 18093 12963 1 19 . 1 1 8 8 LEU H H 8 8.162 8.162 8.558 -0.396 18093 12964 1 19 . 1 1 9 9 PHE N N 9 118.342 118.342 119.036 -0.694 18093 12965 1 19 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.154 0.035 18093 12966 1 19 . 1 1 9 9 PHE C C 9 177.596 177.596 177.084 0.512 18093 12967 1 19 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.176 -0.062 18093 12968 1 19 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.222 0.505 18093 12969 1 19 . 1 1 9 9 PHE H H 9 8.318 8.318 8.209 0.109 18093 12970 1 19 . 1 1 10 10 TYR N N 10 117.584 117.584 118.762 -1.178 18093 12971 1 19 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.802 0.352 18093 12972 1 19 . 1 1 10 10 TYR C C 10 177.630 177.630 177.061 0.569 18093 12973 1 19 . 1 1 10 10 TYR CA C 10 61.036 61.036 60.009 1.027 18093 12974 1 19 . 1 1 10 10 TYR CB C 10 38.660 38.660 37.984 0.676 18093 12975 1 19 . 1 1 10 10 TYR H H 10 8.105 8.105 8.339 -0.234 18093 12976 1 19 . 1 1 11 11 THR N N 11 115.563 115.563 116.341 -0.778 18093 12977 1 19 . 1 1 11 11 THR HA H 11 3.871 3.871 3.853 0.018 18093 12978 1 19 . 1 1 11 11 THR C C 11 175.955 175.955 176.494 -0.539 18093 12979 1 19 . 1 1 11 11 THR CA C 11 67.290 67.290 66.690 0.600 18093 12980 1 19 . 1 1 11 11 THR CB C 11 68.201 68.201 68.452 -0.251 18093 12981 1 19 . 1 1 11 11 THR H H 11 7.915 7.915 7.667 0.248 18093 12982 1 19 . 1 1 12 12 ILE N N 12 119.727 119.727 120.123 -0.396 18093 12983 1 19 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.846 -0.147 18093 12984 1 19 . 1 1 12 12 ILE C C 12 175.773 175.773 177.240 -1.467 18093 12985 1 19 . 1 1 12 12 ILE CA C 12 64.699 64.699 62.948 1.751 18093 12986 1 19 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.639 1.458 18093 12987 1 19 . 1 1 12 12 ILE H H 12 8.186 8.186 7.844 0.342 18093 12988 1 19 . 1 1 13 13 ASN N N 13 114.190 114.190 118.527 -4.337 18093 12989 1 19 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.497 -0.075 18093 12990 1 19 . 1 1 13 13 ASN C C 13 174.786 174.786 176.622 -1.836 18093 12991 1 19 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.513 0.042 18093 12992 1 19 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.880 0.478 18093 12993 1 19 . 1 1 13 13 ASN H H 13 7.601 7.601 7.306 0.295 18093 12994 1 19 . 1 1 14 14 LEU N N 14 115.031 115.031 118.874 -3.843 18093 12995 1 19 . 1 1 14 14 LEU HA H 14 4.196 4.196 3.978 0.218 18093 12996 1 19 . 1 1 14 14 LEU C C 14 177.540 177.540 178.064 -0.524 18093 12997 1 19 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.178 0.229 18093 12998 1 19 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.124 -0.282 18093 12999 1 19 . 1 1 14 14 LEU H H 14 7.390 7.390 7.260 0.130 18093 13000 1 19 . 1 1 15 15 ILE N N 15 118.223 118.223 120.420 -2.197 18093 13001 1 19 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.652 -0.039 18093 13002 1 19 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.631 3.089 18093 13003 1 19 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.208 -0.596 18093 13004 1 19 . 1 1 15 15 ILE H H 15 8.123 8.123 7.287 0.836 18093 13005 1 19 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.262 -0.193 18093 13006 1 19 . 1 1 17 17 PRO C C 17 177.721 177.721 178.590 -0.869 18093 13007 1 19 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.557 1.204 18093 13008 1 19 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.708 0.034 18093 13009 1 19 . 1 1 18 18 CYS N N 18 113.538 113.538 116.843 -3.305 18093 13010 1 19 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.041 -0.033 18093 13011 1 19 . 1 1 18 18 CYS C C 18 177.683 177.683 177.446 0.237 18093 13012 1 19 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.771 0.729 18093 13013 1 19 . 1 1 18 18 CYS CB C 18 26.873 26.873 27.303 -0.430 18093 13014 1 19 . 1 1 18 18 CYS H H 18 7.410 7.410 7.381 0.029 18093 13015 1 19 . 1 1 19 19 LEU N N 19 122.545 122.545 119.873 2.672 18093 13016 1 19 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.141 -0.142 18093 13017 1 19 . 1 1 19 19 LEU C C 19 178.608 178.608 178.677 -0.069 18093 13018 1 19 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.350 1.071 18093 13019 1 19 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.520 0.324 18093 13020 1 19 . 1 1 19 19 LEU H H 19 8.635 8.635 7.446 1.189 18093 13021 1 19 . 1 1 20 20 LEU N N 20 119.404 119.404 120.260 -0.856 18093 13022 1 19 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.923 0.083 18093 13023 1 19 . 1 1 20 20 LEU C C 20 178.540 178.540 179.453 -0.913 18093 13024 1 19 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.546 0.253 18093 13025 1 19 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.878 0.121 18093 13026 1 19 . 1 1 20 20 LEU H H 20 8.392 8.392 7.505 0.887 18093 13027 1 19 . 1 1 21 21 ILE N N 21 117.335 117.335 114.010 3.325 18093 13028 1 19 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.917 -0.266 18093 13029 1 19 . 1 1 21 21 ILE C C 21 177.249 177.249 177.474 -0.225 18093 13030 1 19 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.548 0.713 18093 13031 1 19 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.465 0.495 18093 13032 1 19 . 1 1 21 21 ILE H H 21 8.403 8.403 8.417 -0.014 18093 13033 1 19 . 1 1 22 22 SER N N 22 116.385 116.385 119.198 -2.813 18093 13034 1 19 . 1 1 22 22 SER HA H 22 4.056 4.056 4.295 -0.239 18093 13035 1 19 . 1 1 22 22 SER C C 22 176.813 176.813 176.711 0.102 18093 13036 1 19 . 1 1 22 22 SER CA C 22 63.866 63.866 61.773 2.093 18093 13037 1 19 . 1 1 22 22 SER CB C 22 62.898 62.898 63.265 -0.367 18093 13038 1 19 . 1 1 22 22 SER H H 22 8.271 8.271 7.645 0.626 18093 13039 1 19 . 1 1 23 23 CYS N N 23 119.001 119.001 120.753 -1.752 18093 13040 1 19 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.212 -0.222 18093 13041 1 19 . 1 1 23 23 CYS C C 23 177.594 177.594 177.117 0.477 18093 13042 1 19 . 1 1 23 23 CYS CA C 23 64.429 64.429 63.373 1.056 18093 13043 1 19 . 1 1 23 23 CYS CB C 23 26.940 26.940 26.610 0.330 18093 13044 1 19 . 1 1 23 23 CYS H H 23 8.161 8.161 8.787 -0.626 18093 13045 1 19 . 1 1 24 24 LEU N N 24 117.814 117.814 121.882 -4.068 18093 13046 1 19 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.918 0.059 18093 13047 1 19 . 1 1 24 24 LEU C C 24 177.944 177.944 178.648 -0.704 18093 13048 1 19 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.821 -0.534 18093 13049 1 19 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.708 0.195 18093 13050 1 19 . 1 1 24 24 LEU H H 24 8.106 8.106 7.719 0.387 18093 13051 1 19 . 1 1 25 25 THR N N 25 115.670 115.670 114.889 0.781 18093 13052 1 19 . 1 1 25 25 THR HA H 25 3.687 3.687 3.992 -0.305 18093 13053 1 19 . 1 1 25 25 THR C C 25 175.845 175.845 177.206 -1.361 18093 13054 1 19 . 1 1 25 25 THR CA C 25 68.306 68.306 66.897 1.409 18093 13055 1 19 . 1 1 25 25 THR H H 25 7.924 7.924 7.539 0.385 18093 13056 1 19 . 1 1 26 26 VAL N N 26 118.809 118.809 121.675 -2.866 18093 13057 1 19 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.661 -0.146 18093 13058 1 19 . 1 1 26 26 VAL C C 26 177.530 177.530 178.246 -0.716 18093 13059 1 19 . 1 1 26 26 VAL CA C 26 67.281 67.281 65.730 1.551 18093 13060 1 19 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.249 0.475 18093 13061 1 19 . 1 1 26 26 VAL H H 26 7.764 7.764 7.423 0.341 18093 13062 1 19 . 1 1 27 27 LEU N N 27 117.958 117.958 121.602 -3.644 18093 13063 1 19 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.139 -0.103 18093 13064 1 19 . 1 1 27 27 LEU C C 27 178.163 178.163 178.993 -0.830 18093 13065 1 19 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.097 0.412 18093 13066 1 19 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.655 1.264 18093 13067 1 19 . 1 1 27 27 LEU H H 27 7.912 7.912 8.031 -0.119 18093 13068 1 19 . 1 1 28 28 VAL N N 28 114.472 114.472 118.983 -4.511 18093 13069 1 19 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.602 -0.067 18093 13070 1 19 . 1 1 28 28 VAL C C 28 176.871 176.871 178.310 -1.439 18093 13071 1 19 . 1 1 28 28 VAL CA C 28 65.977 65.977 66.707 -0.730 18093 13072 1 19 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.422 0.511 18093 13073 1 19 . 1 1 28 28 VAL H H 28 7.892 7.892 7.610 0.282 18093 13074 1 19 . 1 1 29 29 PHE N N 29 115.206 115.206 116.635 -1.429 18093 13075 1 19 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.136 0.067 18093 13076 1 19 . 1 1 29 29 PHE C C 29 176.614 176.614 177.185 -0.571 18093 13077 1 19 . 1 1 29 29 PHE CA C 29 60.964 60.964 61.544 -0.580 18093 13078 1 19 . 1 1 29 29 PHE CB C 29 39.752 39.752 38.935 0.817 18093 13079 1 19 . 1 1 29 29 PHE H H 29 7.748 7.748 7.757 -0.009 18093 13080 1 19 . 1 1 30 30 TYR N N 30 115.975 115.975 119.982 -4.007 18093 13081 1 19 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.393 -0.071 18093 13082 1 19 . 1 1 30 30 TYR C C 30 175.553 175.553 175.750 -0.197 18093 13083 1 19 . 1 1 30 30 TYR CA C 30 59.598 59.598 60.086 -0.488 18093 13084 1 19 . 1 1 30 30 TYR CB C 30 39.763 39.763 39.982 -0.219 18093 13085 1 19 . 1 1 30 30 TYR H H 30 7.985 7.985 7.584 0.401 18093 13086 1 19 . 1 1 31 31 LEU N N 31 120.780 120.780 120.606 0.174 18093 13087 1 19 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.710 -0.283 18093 13088 1 19 . 1 1 31 31 LEU CA C 31 54.665 54.665 51.532 3.133 18093 13089 1 19 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.701 -1.313 18093 13090 1 19 . 1 1 31 31 LEU H H 31 7.643 7.643 8.238 -0.595 18093 13091 1 19 . 1 1 34 34 GLU C C 34 176.271 176.271 175.973 0.298 18093 13092 1 19 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.796 1.794 18093 13093 1 19 . 1 1 35 35 CYS N N 35 116.430 116.430 119.867 -3.437 18093 13094 1 19 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.618 -0.251 18093 13095 1 19 . 1 1 35 35 CYS C C 35 175.198 175.198 176.605 -1.407 18093 13096 1 19 . 1 1 35 35 CYS CA C 35 60.293 60.293 59.105 1.188 18093 13097 1 19 . 1 1 35 35 CYS CB C 35 28.130 28.130 29.065 -0.935 18093 13098 1 19 . 1 1 35 35 CYS H H 35 7.970 7.970 8.508 -0.538 18093 13099 1 19 . 1 1 36 36 GLY N N 36 108.315 108.315 110.323 -2.008 18093 13100 1 19 . 1 1 36 36 GLY C C 36 174.610 174.610 175.798 -1.188 18093 13101 1 19 . 1 1 36 36 GLY CA C 36 46.004 46.004 46.479 -0.475 18093 13102 1 19 . 1 1 36 36 GLY H H 36 8.120 8.120 8.379 -0.259 18093 13103 1 19 . 1 1 37 37 GLU N N 37 121.347 121.347 121.332 0.015 18093 13104 1 19 . 1 1 37 37 GLU HA H 37 4.047 4.047 3.985 0.062 18093 13105 1 19 . 1 1 37 37 GLU C C 37 177.338 177.338 178.989 -1.651 18093 13106 1 19 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.024 -0.517 18093 13107 1 19 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.298 0.272 18093 13108 1 19 . 1 1 37 37 GLU H H 37 8.423 8.423 8.674 -0.251 18093 13109 1 19 . 1 1 38 38 LYS N N 38 123.788 123.788 119.307 4.481 18093 13110 1 19 . 1 1 38 38 LYS HA H 38 4.196 4.196 3.960 0.236 18093 13111 1 19 . 1 1 38 38 LYS C C 38 177.976 177.976 179.012 -1.036 18093 13112 1 19 . 1 1 38 38 LYS CA C 38 58.273 58.273 58.893 -0.620 18093 13113 1 19 . 1 1 38 38 LYS CB C 38 31.649 31.649 31.760 -0.111 18093 13114 1 19 . 1 1 38 38 LYS H H 38 8.211 8.211 7.714 0.497 18093 13115 1 19 . 1 1 39 39 ILE N N 39 115.675 115.675 118.867 -3.192 18093 13116 1 19 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.756 -0.148 18093 13117 1 19 . 1 1 39 39 ILE C C 39 177.204 177.204 177.947 -0.743 18093 13118 1 19 . 1 1 39 39 ILE CA C 39 65.501 65.501 64.805 0.696 18093 13119 1 19 . 1 1 39 39 ILE H H 39 7.933 7.933 7.605 0.328 18093 13120 1 19 . 1 1 40 40 THR N N 40 117.411 117.411 115.733 1.678 18093 13121 1 19 . 1 1 40 40 THR HA H 40 3.844 3.844 3.913 -0.069 18093 13122 1 19 . 1 1 40 40 THR C C 40 175.983 175.983 176.355 -0.372 18093 13123 1 19 . 1 1 40 40 THR CA C 40 67.360 67.360 66.392 0.968 18093 13124 1 19 . 1 1 40 40 THR H H 40 8.362 8.362 7.537 0.825 18093 13125 1 19 . 1 1 41 41 LEU N N 41 123.059 123.059 122.820 0.239 18093 13126 1 19 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.120 -0.104 18093 13127 1 19 . 1 1 41 41 LEU C C 41 178.914 178.914 177.816 1.098 18093 13128 1 19 . 1 1 41 41 LEU CA C 41 58.366 58.366 58.102 0.264 18093 13129 1 19 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.900 0.150 18093 13130 1 19 . 1 1 41 41 LEU H H 41 8.282 8.282 7.587 0.695 18093 13131 1 19 . 1 1 42 42 CYS N N 42 118.762 118.762 117.983 0.779 18093 13132 1 19 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.059 -0.123 18093 13133 1 19 . 1 1 42 42 CYS C C 42 176.607 176.607 177.166 -0.559 18093 13134 1 19 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.581 0.736 18093 13135 1 19 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.321 -0.402 18093 13136 1 19 . 1 1 42 42 CYS H H 42 8.195 8.195 7.633 0.562 18093 13137 1 19 . 1 1 43 43 ILE N N 43 117.589 117.589 120.554 -2.965 18093 13138 1 19 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.686 -0.079 18093 13139 1 19 . 1 1 43 43 ILE C C 43 177.323 177.323 177.845 -0.522 18093 13140 1 19 . 1 1 43 43 ILE CA C 43 65.249 65.249 65.219 0.030 18093 13141 1 19 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.868 0.170 18093 13142 1 19 . 1 1 43 43 ILE H H 43 8.428 8.428 7.518 0.910 18093 13143 1 19 . 1 1 44 44 SER N N 44 115.950 115.950 116.479 -0.529 18093 13144 1 19 . 1 1 44 44 SER HA H 44 4.012 4.012 4.207 -0.195 18093 13145 1 19 . 1 1 44 44 SER C C 44 176.965 176.965 176.879 0.086 18093 13146 1 19 . 1 1 44 44 SER CA C 44 63.575 63.575 62.078 1.497 18093 13147 1 19 . 1 1 44 44 SER H H 44 7.984 7.984 7.725 0.259 18093 13148 1 19 . 1 1 45 45 VAL N N 45 123.544 123.544 121.162 2.382 18093 13149 1 19 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.786 -0.238 18093 13150 1 19 . 1 1 45 45 VAL C C 45 177.139 177.139 178.440 -1.301 18093 13151 1 19 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.614 0.619 18093 13152 1 19 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.313 0.329 18093 13153 1 19 . 1 1 45 45 VAL H H 45 8.280 8.280 8.539 -0.259 18093 13154 1 19 . 1 1 46 46 LEU N N 46 119.883 119.883 119.755 0.128 18093 13155 1 19 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.231 -0.288 18093 13156 1 19 . 1 1 46 46 LEU C C 46 180.125 180.125 178.374 1.751 18093 13157 1 19 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.266 1.334 18093 13158 1 19 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.648 0.364 18093 13159 1 19 . 1 1 46 46 LEU H H 46 8.117 8.117 7.618 0.499 18093 13160 1 19 . 1 1 47 47 LEU N N 47 120.193 120.193 120.111 0.082 18093 13161 1 19 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.832 0.172 18093 13162 1 19 . 1 1 47 47 LEU C C 47 178.370 178.370 178.607 -0.237 18093 13163 1 19 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.810 -0.384 18093 13164 1 19 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.660 0.396 18093 13165 1 19 . 1 1 47 47 LEU H H 47 8.933 8.933 7.524 1.409 18093 13166 1 19 . 1 1 48 48 SER N N 48 115.861 115.861 114.460 1.401 18093 13167 1 19 . 1 1 48 48 SER HA H 48 4.013 4.013 4.116 -0.103 18093 13168 1 19 . 1 1 48 48 SER C C 48 175.642 175.642 176.849 -1.207 18093 13169 1 19 . 1 1 48 48 SER CA C 48 63.571 63.571 61.536 2.035 18093 13170 1 19 . 1 1 48 48 SER CB C 48 62.879 62.879 63.119 -0.240 18093 13171 1 19 . 1 1 48 48 SER H H 48 7.996 7.996 7.652 0.344 18093 13172 1 19 . 1 1 49 49 LEU N N 49 120.673 120.673 124.133 -3.460 18093 13173 1 19 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.217 -0.182 18093 13174 1 19 . 1 1 49 49 LEU C C 49 178.229 178.229 178.438 -0.209 18093 13175 1 19 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.370 -0.087 18093 13176 1 19 . 1 1 49 49 LEU CB C 49 41.946 41.946 41.822 0.124 18093 13177 1 19 . 1 1 49 49 LEU H H 49 8.352 8.352 7.589 0.763 18093 13178 1 19 . 1 1 50 50 THR N N 50 115.582 115.582 115.081 0.501 18093 13179 1 19 . 1 1 50 50 THR HA H 50 3.672 3.672 4.051 -0.379 18093 13180 1 19 . 1 1 50 50 THR C C 50 175.877 175.877 177.062 -1.185 18093 13181 1 19 . 1 1 50 50 THR CA C 50 68.628 68.628 66.628 2.000 18093 13182 1 19 . 1 1 50 50 THR H H 50 7.937 7.937 8.506 -0.569 18093 13183 1 19 . 1 1 51 51 VAL N N 51 119.774 119.774 122.284 -2.510 18093 13184 1 19 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.829 -0.331 18093 13185 1 19 . 1 1 51 51 VAL C C 51 177.162 177.162 177.182 -0.020 18093 13186 1 19 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.461 1.124 18093 13187 1 19 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.726 -0.205 18093 13188 1 19 . 1 1 51 51 VAL H H 51 8.115 8.115 7.610 0.505 18093 13189 1 19 . 1 1 52 52 PHE N N 52 118.808 118.808 121.076 -2.268 18093 13190 1 19 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.324 -0.202 18093 13191 1 19 . 1 1 52 52 PHE C C 52 176.697 176.697 176.789 -0.092 18093 13192 1 19 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.489 1.282 18093 13193 1 19 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.340 -0.078 18093 13194 1 19 . 1 1 52 52 PHE H H 52 8.256 8.256 8.447 -0.191 18093 13195 1 19 . 1 1 53 53 LEU N N 53 117.267 117.267 121.025 -3.758 18093 13196 1 19 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.498 0.395 18093 13197 1 19 . 1 1 53 53 LEU C C 53 179.319 179.319 178.012 1.307 18093 13198 1 19 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.819 0.166 18093 13199 1 19 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.358 0.469 18093 13200 1 19 . 1 1 53 53 LEU H H 53 8.443 8.443 8.047 0.396 18093 13201 1 19 . 1 1 54 54 LEU N N 54 119.762 119.762 118.991 0.771 18093 13202 1 19 . 1 1 54 54 LEU HA H 54 4.054 4.054 4.023 0.031 18093 13203 1 19 . 1 1 54 54 LEU C C 54 178.827 178.827 178.930 -0.103 18093 13204 1 19 . 1 1 54 54 LEU CA C 54 58.105 58.105 57.861 0.244 18093 13205 1 19 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.823 0.124 18093 13206 1 19 . 1 1 54 54 LEU H H 54 8.205 8.205 7.379 0.826 18093 13207 1 19 . 1 1 55 55 LEU N N 55 118.585 118.585 118.228 0.357 18093 13208 1 19 . 1 1 55 55 LEU HA H 55 4.077 4.077 4.250 -0.173 18093 13209 1 19 . 1 1 55 55 LEU C C 55 178.909 178.909 178.668 0.241 18093 13210 1 19 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.769 0.339 18093 13211 1 19 . 1 1 55 55 LEU CB C 55 41.979 41.979 42.018 -0.039 18093 13212 1 19 . 1 1 55 55 LEU H H 55 8.179 8.179 7.542 0.637 18093 13213 1 19 . 1 1 56 56 ILE N N 56 116.079 116.079 115.740 0.339 18093 13214 1 19 . 1 1 56 56 ILE HA H 56 3.729 3.729 4.062 -0.333 18093 13215 1 19 . 1 1 56 56 ILE C C 56 176.988 176.988 177.563 -0.575 18093 13216 1 19 . 1 1 56 56 ILE CA C 56 64.257 64.257 62.489 1.769 18093 13217 1 19 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.725 0.692 18093 13218 1 19 . 1 1 56 56 ILE H H 56 8.040 8.040 7.356 0.684 18093 13219 1 19 . 1 1 57 57 THR N N 57 110.105 110.105 111.360 -1.255 18093 13220 1 19 . 1 1 57 57 THR HA H 57 4.015 4.015 4.197 -0.182 18093 13221 1 19 . 1 1 57 57 THR C C 57 175.435 175.435 175.778 -0.343 18093 13222 1 19 . 1 1 57 57 THR CA C 57 65.067 65.067 65.039 0.028 18093 13223 1 19 . 1 1 57 57 THR CB C 57 69.179 69.179 69.199 -0.020 18093 13224 1 19 . 1 1 57 57 THR H H 57 7.655 7.655 7.739 -0.084 18093 13225 1 19 . 1 1 58 58 GLU N N 58 117.313 117.313 121.200 -3.887 18093 13226 1 19 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.264 0.069 18093 13227 1 19 . 1 1 58 58 GLU C C 58 176.940 176.940 178.178 -1.238 18093 13228 1 19 . 1 1 58 58 GLU CA C 58 57.068 57.068 57.683 -0.615 18093 13229 1 19 . 1 1 58 58 GLU CB C 58 29.396 29.396 29.699 -0.303 18093 13230 1 19 . 1 1 58 58 GLU H H 58 7.521 7.521 8.273 -0.752 18093 13231 1 19 . 1 1 59 59 ILE N N 59 114.870 114.870 114.323 0.547 18093 13232 1 19 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.107 -0.018 18093 13233 1 19 . 1 1 59 59 ILE C C 59 175.456 175.456 176.078 -0.622 18093 13234 1 19 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.073 0.361 18093 13235 1 19 . 1 1 59 59 ILE CB C 59 38.657 38.657 39.093 -0.436 18093 13236 1 19 . 1 1 59 59 ILE H H 59 7.579 7.579 7.377 0.202 18093 13237 1 19 . 1 1 60 60 ILE N N 60 119.354 119.354 118.348 1.006 18093 13238 1 19 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.872 0.432 18093 13239 1 19 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.502 -1.885 18093 13240 1 19 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.643 2.219 18093 13241 1 19 . 1 1 60 60 ILE H H 60 7.629 7.629 7.570 0.059 18093 13242 1 19 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.400 -0.000 18093 13243 1 19 . 1 1 61 61 PRO C C 61 177.144 177.144 177.125 0.019 18093 13244 1 19 . 1 1 61 61 PRO CA C 61 63.808 63.808 63.263 0.545 18093 13245 1 19 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.323 -0.441 18093 13246 1 19 . 1 1 62 62 SER N N 62 114.474 114.474 113.534 0.940 18093 13247 1 19 . 1 1 62 62 SER HA H 62 4.434 4.434 4.245 0.189 18093 13248 1 19 . 1 1 62 62 SER C C 62 175.161 175.161 173.588 1.573 18093 13249 1 19 . 1 1 62 62 SER CA C 62 59.047 59.047 58.522 0.525 18093 13250 1 19 . 1 1 62 62 SER CB C 62 63.704 63.704 63.398 0.306 18093 13251 1 19 . 1 1 62 62 SER H H 62 8.186 8.186 8.039 0.147 18093 13252 1 19 . 1 1 63 63 THR N N 63 113.573 113.573 118.513 -4.940 18093 13253 1 19 . 1 1 63 63 THR HA H 63 4.319 4.319 4.307 0.012 18093 13254 1 19 . 1 1 63 63 THR C C 63 174.834 174.834 173.576 1.258 18093 13255 1 19 . 1 1 63 63 THR CA C 63 62.377 62.377 61.861 0.516 18093 13256 1 19 . 1 1 63 63 THR CB C 63 69.422 69.422 69.273 0.149 18093 13257 1 19 . 1 1 63 63 THR H H 63 7.963 7.963 8.329 -0.366 18093 13258 1 19 . 1 1 64 64 SER N N 64 116.598 116.598 121.916 -5.318 18093 13259 1 19 . 1 1 64 64 SER HA H 64 4.428 4.428 4.739 -0.311 18093 13260 1 19 . 1 1 64 64 SER C C 64 174.618 174.618 172.966 1.652 18093 13261 1 19 . 1 1 64 64 SER CA C 64 59.045 59.045 57.248 1.797 18093 13262 1 19 . 1 1 64 64 SER CB C 64 63.700 63.700 66.159 -2.458 18093 13263 1 19 . 1 1 64 64 SER H H 64 8.052 8.052 8.660 -0.608 18093 13264 1 19 . 1 1 65 65 SER N N 65 116.673 116.673 117.642 -0.969 18093 13265 1 19 . 1 1 65 65 SER HA H 65 4.432 4.432 4.732 -0.300 18093 13266 1 19 . 1 1 65 65 SER C C 65 174.335 174.335 176.076 -1.741 18093 13267 1 19 . 1 1 65 65 SER CA C 65 58.927 58.927 59.989 -1.062 18093 13268 1 19 . 1 1 65 65 SER CB C 65 63.621 63.621 63.588 0.033 18093 13269 1 19 . 1 1 65 65 SER H H 65 8.114 8.114 8.589 -0.475 18093 13270 1 19 . 1 1 66 66 VAL N N 66 119.054 119.054 116.055 2.999 18093 13271 1 19 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.050 0.120 18093 13272 1 19 . 1 1 66 66 VAL C C 66 175.278 175.278 176.019 -0.741 18093 13273 1 19 . 1 1 66 66 VAL CA C 66 62.062 62.062 63.475 -1.413 18093 13274 1 19 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.130 0.499 18093 13275 1 19 . 1 1 66 66 VAL H H 66 7.740 7.740 7.711 0.029 18093 13276 1 19 . 1 1 67 67 SER N N 67 118.882 118.882 114.673 4.209 18093 13277 1 19 . 1 1 67 67 SER HA H 67 4.704 4.704 4.862 -0.158 18093 13278 1 19 . 1 1 67 67 SER CA C 67 56.715 56.715 55.460 1.255 18093 13279 1 19 . 1 1 67 67 SER CB C 67 63.624 63.624 64.990 -1.366 18093 13280 1 19 . 1 1 67 67 SER H H 67 8.060 8.060 7.598 0.462 18093 13281 1 19 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.518 -0.118 18093 13282 1 19 . 1 1 68 68 PRO C C 68 176.925 176.925 175.589 1.336 18093 13283 1 19 . 1 1 68 68 PRO CA C 68 63.748 63.748 63.174 0.574 18093 13284 1 19 . 1 1 68 68 PRO CB C 68 32.005 32.005 31.850 0.155 18093 13285 1 19 . 1 1 69 69 SER N N 69 114.930 114.930 117.780 -2.850 18093 13286 1 19 . 1 1 69 69 SER HA H 69 4.422 4.422 4.694 -0.272 18093 13287 1 19 . 1 1 69 69 SER C C 69 175.617 175.617 175.173 0.444 18093 13288 1 19 . 1 1 69 69 SER CA C 69 58.697 58.697 57.004 1.693 18093 13289 1 19 . 1 1 69 69 SER CB C 69 63.804 63.804 66.546 -2.742 18093 13290 1 19 . 1 1 69 69 SER H H 69 8.205 8.205 7.932 0.273 18093 13291 1 19 . 1 1 70 70 ILE N N 70 120.840 120.840 124.018 -3.178 18093 13292 1 19 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.131 -0.139 18093 13293 1 19 . 1 1 70 70 ILE C C 70 177.524 177.524 177.071 0.453 18093 13294 1 19 . 1 1 70 70 ILE CA C 70 64.335 64.335 61.811 2.524 18093 13295 1 19 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.207 -0.747 18093 13296 1 19 . 1 1 70 70 ILE H H 70 8.283 8.283 8.762 -0.479 18093 13297 1 19 . 1 1 71 71 GLY N N 71 107.823 107.823 107.749 0.074 18093 13298 1 19 . 1 1 71 71 GLY C C 71 175.296 175.296 175.981 -0.685 18093 13299 1 19 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.111 0.344 18093 13300 1 19 . 1 1 71 71 GLY H H 71 8.557 8.557 8.688 -0.131 18093 13301 1 19 . 1 1 72 72 GLU N N 72 120.835 120.835 120.629 0.206 18093 13302 1 19 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.199 -0.351 18093 13303 1 19 . 1 1 72 72 GLU C C 72 178.198 178.198 178.212 -0.014 18093 13304 1 19 . 1 1 72 72 GLU CA C 72 60.117 60.117 57.908 2.209 18093 13305 1 19 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.618 -0.225 18093 13306 1 19 . 1 1 72 72 GLU H H 72 7.922 7.922 7.771 0.151 18093 13307 1 19 . 1 1 73 73 TYR N N 73 117.375 117.375 122.265 -4.890 18093 13308 1 19 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.286 -0.124 18093 13309 1 19 . 1 1 73 73 TYR C C 73 179.912 179.912 176.991 2.921 18093 13310 1 19 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.047 1.108 18093 13311 1 19 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.900 -0.134 18093 13312 1 19 . 1 1 73 73 TYR H H 73 8.062 8.062 7.814 0.248 18093 13313 1 19 . 1 1 74 74 LEU N N 74 121.493 121.493 120.370 1.123 18093 13314 1 19 . 1 1 74 74 LEU HA H 74 4.049 4.049 4.026 0.023 18093 13315 1 19 . 1 1 74 74 LEU C C 74 178.063 178.063 178.973 -0.910 18093 13316 1 19 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.262 1.233 18093 13317 1 19 . 1 1 74 74 LEU CB C 74 41.847 41.847 42.136 -0.289 18093 13318 1 19 . 1 1 74 74 LEU H H 74 8.552 8.552 8.879 -0.327 18093 13319 1 19 . 1 1 75 75 LEU N N 75 120.375 120.375 119.591 0.784 18093 13320 1 19 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.041 -0.001 18093 13321 1 19 . 1 1 75 75 LEU C C 75 178.515 178.515 178.932 -0.417 18093 13322 1 19 . 1 1 75 75 LEU CA C 75 58.638 58.638 57.634 1.004 18093 13323 1 19 . 1 1 75 75 LEU CB C 75 42.039 42.039 42.048 -0.009 18093 13324 1 19 . 1 1 75 75 LEU H H 75 8.276 8.276 7.501 0.775 18093 13325 1 19 . 1 1 76 76 PHE N N 76 116.626 116.626 119.210 -2.584 18093 13326 1 19 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.209 -0.130 18093 13327 1 19 . 1 1 76 76 PHE C C 76 177.399 177.399 177.796 -0.397 18093 13328 1 19 . 1 1 76 76 PHE CA C 76 61.734 61.734 61.705 0.029 18093 13329 1 19 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.523 0.218 18093 13330 1 19 . 1 1 76 76 PHE H H 76 8.454 8.454 8.160 0.294 18093 13331 1 19 . 1 1 77 77 THR N N 77 116.080 116.080 113.438 2.642 18093 13332 1 19 . 1 1 77 77 THR HA H 77 3.687 3.687 3.871 -0.184 18093 13333 1 19 . 1 1 77 77 THR C C 77 176.018 176.018 177.012 -0.994 18093 13334 1 19 . 1 1 77 77 THR CA C 77 68.640 68.640 65.959 2.681 18093 13335 1 19 . 1 1 77 77 THR H H 77 8.224 8.224 8.341 -0.117 18093 13336 1 19 . 1 1 78 78 MET N N 78 119.394 119.394 120.913 -1.519 18093 13337 1 19 . 1 1 78 78 MET HA H 78 4.129 4.129 4.136 -0.007 18093 13338 1 19 . 1 1 78 78 MET C C 78 179.608 179.608 178.552 1.056 18093 13339 1 19 . 1 1 78 78 MET CA C 78 58.831 58.831 59.595 -0.764 18093 13340 1 19 . 1 1 78 78 MET CB C 78 31.590 31.590 32.365 -0.775 18093 13341 1 19 . 1 1 78 78 MET H H 78 8.372 8.372 7.444 0.928 18093 13342 1 19 . 1 1 79 79 ILE N N 79 121.819 121.819 118.604 3.215 18093 13343 1 19 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.720 -0.170 18093 13344 1 19 . 1 1 79 79 ILE C C 79 176.426 176.426 177.812 -1.386 18093 13345 1 19 . 1 1 79 79 ILE CA C 79 65.876 65.876 64.518 1.358 18093 13346 1 19 . 1 1 79 79 ILE CB C 79 37.673 37.673 37.667 0.006 18093 13347 1 19 . 1 1 79 79 ILE H H 79 8.391 8.391 7.604 0.787 18093 13348 1 19 . 1 1 80 80 PHE N N 80 119.916 119.916 121.567 -1.651 18093 13349 1 19 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.122 -0.069 18093 13350 1 19 . 1 1 80 80 PHE C C 80 178.568 178.568 177.164 1.404 18093 13351 1 19 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.529 -0.222 18093 13352 1 19 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.534 -0.760 18093 13353 1 19 . 1 1 80 80 PHE H H 80 8.479 8.479 8.212 0.267 18093 13354 1 19 . 1 1 81 81 VAL N N 81 120.191 120.191 116.225 3.966 18093 13355 1 19 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.681 -0.228 18093 13356 1 19 . 1 1 81 81 VAL C C 81 178.225 178.225 177.591 0.634 18093 13357 1 19 . 1 1 81 81 VAL CA C 81 67.408 67.408 65.569 1.839 18093 13358 1 19 . 1 1 81 81 VAL CB C 81 31.556 31.556 30.539 1.017 18093 13359 1 19 . 1 1 81 81 VAL H H 81 8.928 8.928 8.585 0.343 18093 13360 1 19 . 1 1 82 82 THR N N 82 115.930 115.930 117.485 -1.555 18093 13361 1 19 . 1 1 82 82 THR HA H 82 3.636 3.636 3.937 -0.301 18093 13362 1 19 . 1 1 82 82 THR C C 82 176.420 176.420 176.627 -0.207 18093 13363 1 19 . 1 1 82 82 THR CA C 82 68.570 68.570 66.903 1.667 18093 13364 1 19 . 1 1 82 82 THR CB C 82 68.202 68.202 68.631 -0.429 18093 13365 1 19 . 1 1 82 82 THR H H 82 7.969 7.969 7.397 0.572 18093 13366 1 19 . 1 1 83 83 LEU N N 83 119.780 119.780 120.661 -0.881 18093 13367 1 19 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.810 0.037 18093 13368 1 19 . 1 1 83 83 LEU C C 83 178.214 178.214 178.582 -0.368 18093 13369 1 19 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.613 0.624 18093 13370 1 19 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.178 0.613 18093 13371 1 19 . 1 1 83 83 LEU H H 83 8.483 8.483 7.423 1.060 18093 13372 1 19 . 1 1 84 84 SER N N 84 114.559 114.559 115.923 -1.364 18093 13373 1 19 . 1 1 84 84 SER HA H 84 4.099 4.099 4.072 0.027 18093 13374 1 19 . 1 1 84 84 SER C C 84 176.799 176.799 176.617 0.182 18093 13375 1 19 . 1 1 84 84 SER CA C 84 63.609 63.609 62.076 1.533 18093 13376 1 19 . 1 1 84 84 SER CB C 84 63.110 63.110 63.053 0.056 18093 13377 1 19 . 1 1 84 84 SER H H 84 8.023 8.023 7.441 0.582 18093 13378 1 19 . 1 1 85 85 ILE N N 85 123.962 123.962 120.799 3.163 18093 13379 1 19 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.979 -0.375 18093 13380 1 19 . 1 1 85 85 ILE C C 85 177.487 177.487 178.464 -0.977 18093 13381 1 19 . 1 1 85 85 ILE CA C 85 65.759 65.759 63.143 2.616 18093 13382 1 19 . 1 1 85 85 ILE CB C 85 37.887 37.887 36.593 1.294 18093 13383 1 19 . 1 1 85 85 ILE H H 85 8.054 8.054 7.871 0.183 18093 13384 1 19 . 1 1 86 86 VAL N N 86 118.744 118.744 121.282 -2.538 18093 13385 1 19 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.818 -0.299 18093 13386 1 19 . 1 1 86 86 VAL C C 86 177.557 177.557 178.235 -0.678 18093 13387 1 19 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.445 1.090 18093 13388 1 19 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.630 -0.164 18093 13389 1 19 . 1 1 86 86 VAL H H 86 8.158 8.158 7.451 0.707 18093 13390 1 19 . 1 1 87 87 ILE N N 87 117.206 117.206 119.749 -2.543 18093 13391 1 19 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.749 -0.145 18093 13392 1 19 . 1 1 87 87 ILE C C 87 177.283 177.283 178.558 -1.275 18093 13393 1 19 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.759 1.917 18093 13394 1 19 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.340 1.249 18093 13395 1 19 . 1 1 87 87 ILE H H 87 8.459 8.459 8.544 -0.085 18093 13396 1 19 . 1 1 88 88 THR N N 88 116.158 116.158 117.269 -1.111 18093 13397 1 19 . 1 1 88 88 THR HA H 88 3.672 3.672 4.214 -0.542 18093 13398 1 19 . 1 1 88 88 THR C C 88 175.485 175.485 176.661 -1.176 18093 13399 1 19 . 1 1 88 88 THR CA C 88 68.549 68.549 66.927 1.622 18093 13400 1 19 . 1 1 88 88 THR CB C 88 68.127 68.127 68.498 -0.371 18093 13401 1 19 . 1 1 88 88 THR H H 88 7.776 7.776 8.474 -0.698 18093 13402 1 19 . 1 1 89 89 VAL N N 89 117.985 117.985 121.433 -3.448 18093 13403 1 19 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.887 -0.344 18093 13404 1 19 . 1 1 89 89 VAL C C 89 177.393 177.393 177.416 -0.023 18093 13405 1 19 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.648 0.942 18093 13406 1 19 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.977 -0.199 18093 13407 1 19 . 1 1 89 89 VAL H H 89 8.206 8.206 7.610 0.596 18093 13408 1 19 . 1 1 90 90 PHE N N 90 116.709 116.709 119.680 -2.971 18093 13409 1 19 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.247 0.131 18093 13410 1 19 . 1 1 90 90 PHE C C 90 177.305 177.305 177.542 -0.237 18093 13411 1 19 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.772 -0.653 18093 13412 1 19 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.305 1.080 18093 13413 1 19 . 1 1 90 90 PHE H H 90 7.956 7.956 7.967 -0.011 18093 13414 1 19 . 1 1 91 91 VAL N N 91 116.565 116.565 119.414 -2.849 18093 13415 1 19 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.735 0.100 18093 13416 1 19 . 1 1 91 91 VAL C C 91 176.927 176.927 176.909 0.018 18093 13417 1 19 . 1 1 91 91 VAL CA C 91 65.347 65.347 66.186 -0.839 18093 13418 1 19 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.987 -0.120 18093 13419 1 19 . 1 1 91 91 VAL H H 91 8.239 8.239 7.646 0.593 18093 13420 1 19 . 1 1 92 92 LEU N N 92 117.443 117.443 116.374 1.069 18093 13421 1 19 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.215 -0.021 18093 13422 1 19 . 1 1 92 92 LEU C C 92 177.180 177.180 177.793 -0.613 18093 13423 1 19 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.506 -0.322 18093 13424 1 19 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.187 -0.243 18093 13425 1 19 . 1 1 92 92 LEU H H 92 7.967 7.967 7.600 0.367 18093 13426 1 19 . 1 1 93 93 ASN N N 93 116.705 116.705 117.329 -0.624 18093 13427 1 19 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.525 0.122 18093 13428 1 19 . 1 1 93 93 ASN C C 93 175.129 175.129 176.269 -1.140 18093 13429 1 19 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.389 -1.534 18093 13430 1 19 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.131 0.264 18093 13431 1 19 . 1 1 93 93 ASN H H 93 7.683 7.683 7.650 0.033 18093 13432 1 19 . 1 1 94 94 VAL N N 94 118.224 118.224 119.935 -1.711 18093 13433 1 19 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.781 0.180 18093 13434 1 19 . 1 1 94 94 VAL C C 94 175.600 175.600 173.811 1.789 18093 13435 1 19 . 1 1 94 94 VAL CA C 94 62.825 62.825 63.658 -0.833 18093 13436 1 19 . 1 1 94 94 VAL CB C 94 32.214 32.214 32.583 -0.369 18093 13437 1 19 . 1 1 94 94 VAL H H 94 7.627 7.627 7.632 -0.005 18093 13438 1 19 . 1 1 95 95 HIS N N 95 120.999 120.999 122.402 -1.403 18093 13439 1 19 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.717 -0.124 18093 13440 1 19 . 1 1 95 95 HIS C C 95 174.146 174.146 173.314 0.832 18093 13441 1 19 . 1 1 95 95 HIS CA C 95 55.666 55.666 54.139 1.527 18093 13442 1 19 . 1 1 95 95 HIS CB C 95 29.736 29.736 31.913 -2.177 18093 13443 1 19 . 1 1 95 95 HIS H H 95 8.263 8.263 7.464 0.799 18093 13444 1 19 . 1 1 96 96 HIS N N 96 122.740 122.740 119.545 3.195 18093 13445 1 19 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.912 -0.279 18093 13446 1 19 . 1 1 96 96 HIS CA C 96 55.895 55.895 56.014 -0.119 18093 13447 1 19 . 1 1 96 96 HIS CB C 96 29.750 29.750 32.066 -2.316 18093 13448 1 19 . 1 1 96 96 HIS H H 96 8.298 8.298 8.679 -0.381 18093 13449 1 19 . 1 1 97 97 ARG N N 97 118.503 118.503 122.949 -4.446 18093 13450 1 19 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.684 -0.372 18093 13451 1 19 . 1 1 97 97 ARG C C 97 175.776 175.776 175.642 0.134 18093 13452 1 19 . 1 1 97 97 ARG CA C 97 56.225 56.225 56.137 0.088 18093 13453 1 19 . 1 1 97 97 ARG CB C 97 30.912 30.912 31.379 -0.467 18093 13454 1 19 . 1 1 97 97 ARG H H 97 8.250 8.250 8.737 -0.487 18093 13455 1 19 . 1 1 98 98 SER N N 98 118.482 118.482 116.556 1.926 18093 13456 1 19 . 1 1 98 98 SER HA H 98 4.722 4.722 4.888 -0.166 18093 13457 1 19 . 1 1 98 98 SER CA C 98 56.547 56.547 56.040 0.507 18093 13458 1 19 . 1 1 98 98 SER CB C 98 63.624 63.624 64.915 -1.291 18093 13459 1 19 . 1 1 98 98 SER H H 98 8.254 8.254 8.156 0.098 18093 13460 1 19 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.391 0.012 18093 13461 1 19 . 1 1 99 99 PRO C C 99 176.899 176.899 176.907 -0.008 18093 13462 1 19 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.963 -1.262 18093 13463 1 19 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.207 -0.258 18093 13464 1 19 . 1 1 100 100 GLU N N 100 120.187 120.187 113.783 6.404 18093 13465 1 19 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.231 0.057 18093 13466 1 19 . 1 1 100 100 GLU C C 100 176.593 176.593 174.500 2.093 18093 13467 1 19 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.658 0.064 18093 13468 1 19 . 1 1 100 100 GLU CB C 100 29.999 29.999 30.316 -0.317 18093 13469 1 19 . 1 1 100 100 GLU H H 100 8.401 8.401 8.062 0.339 18093 13470 1 19 . 1 1 101 101 THR N N 101 113.968 113.968 115.300 -1.332 18093 13471 1 19 . 1 1 101 101 THR HA H 101 4.286 4.286 4.205 0.081 18093 13472 1 19 . 1 1 101 101 THR C C 101 174.525 174.525 175.093 -0.568 18093 13473 1 19 . 1 1 101 101 THR CA C 101 61.956 61.956 62.468 -0.512 18093 13474 1 19 . 1 1 101 101 THR CB C 101 69.697 69.697 68.534 1.163 18093 13475 1 19 . 1 1 101 101 THR H H 101 7.945 7.945 7.861 0.084 18093 13476 1 19 . 1 1 102 102 HIS N N 102 120.322 120.322 127.716 -7.394 18093 13477 1 19 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.685 0.056 18093 13478 1 19 . 1 1 102 102 HIS C C 102 174.783 174.783 174.981 -0.198 18093 13479 1 19 . 1 1 102 102 HIS CA C 102 55.701 55.701 55.449 0.252 18093 13480 1 19 . 1 1 102 102 HIS CB C 102 29.093 29.093 27.983 1.110 18093 13481 1 19 . 1 1 102 102 HIS H H 102 8.455 8.455 8.847 -0.392 18093 13482 1 19 . 1 1 103 103 THR N N 103 114.282 114.282 113.586 0.696 18093 13483 1 19 . 1 1 103 103 THR HA H 103 4.352 4.352 4.582 -0.230 18093 13484 1 19 . 1 1 103 103 THR C C 103 175.104 175.104 174.633 0.471 18093 13485 1 19 . 1 1 103 103 THR CA C 103 62.057 62.057 61.286 0.771 18093 13486 1 19 . 1 1 103 103 THR CB C 103 69.966 69.966 68.787 1.179 18093 13487 1 19 . 1 1 103 103 THR H H 103 8.069 8.069 7.736 0.333 18093 13488 1 19 . 1 1 104 104 GLY N N 104 111.159 111.159 112.961 -1.802 18093 13489 1 19 . 1 1 104 104 GLY C C 104 174.776 174.776 174.448 0.328 18093 13490 1 19 . 1 1 104 104 GLY CA C 104 45.588 45.588 45.343 0.245 18093 13491 1 19 . 1 1 104 104 GLY H H 104 8.393 8.393 8.298 0.095 18093 13492 1 19 . 1 1 105 105 GLY N N 105 108.657 108.657 110.333 -1.676 18093 13493 1 19 . 1 1 105 105 GLY C C 105 174.957 174.957 174.457 0.500 18093 13494 1 19 . 1 1 105 105 GLY CA C 105 45.612 45.612 45.414 0.198 18093 13495 1 19 . 1 1 105 105 GLY H H 105 8.275 8.275 8.351 -0.076 18093 13496 1 19 . 1 1 106 106 GLY N N 106 108.870 108.870 110.693 -1.823 18093 13497 1 19 . 1 1 106 106 GLY C C 106 174.877 174.877 172.997 1.880 18093 13498 1 19 . 1 1 106 106 GLY CA C 106 45.665 45.665 45.334 0.331 18093 13499 1 19 . 1 1 106 106 GLY H H 106 8.357 8.357 8.492 -0.135 18093 13500 1 19 . 1 1 107 107 GLY N N 107 108.476 108.476 107.828 0.648 18093 13501 1 19 . 1 1 107 107 GLY C C 107 174.877 174.877 174.435 0.442 18093 13502 1 19 . 1 1 107 107 GLY CA C 107 45.696 45.696 44.715 0.981 18093 13503 1 19 . 1 1 107 107 GLY H H 107 8.330 8.330 8.033 0.297 18093 13504 1 19 . 1 1 108 108 GLY N N 108 108.486 108.486 109.494 -1.008 18093 13505 1 19 . 1 1 108 108 GLY C C 108 175.345 175.345 175.261 0.084 18093 13506 1 19 . 1 1 108 108 GLY CA C 108 45.763 45.763 45.464 0.299 18093 13507 1 19 . 1 1 108 108 GLY H H 108 8.328 8.328 8.300 0.028 18093 13508 1 19 . 1 1 109 109 ILE N N 109 120.433 120.433 119.168 1.265 18093 13509 1 19 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.891 0.077 18093 13510 1 19 . 1 1 109 109 ILE C C 109 176.127 176.127 176.978 -0.851 18093 13511 1 19 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.101 -0.366 18093 13512 1 19 . 1 1 109 109 ILE CB C 109 38.125 38.125 38.099 0.027 18093 13513 1 19 . 1 1 109 109 ILE H H 109 8.192 8.192 8.047 0.145 18093 13514 1 19 . 1 1 110 110 ASP N N 110 121.148 121.148 120.915 0.233 18093 13515 1 19 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.636 -0.330 18093 13516 1 19 . 1 1 110 110 ASP C C 110 177.651 177.651 178.138 -0.487 18093 13517 1 19 . 1 1 110 110 ASP CA C 110 56.776 56.776 57.941 -1.165 18093 13518 1 19 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.041 1.056 18093 13519 1 19 . 1 1 110 110 ASP H H 110 8.427 8.427 8.560 -0.133 18093 13520 1 19 . 1 1 111 111 ARG N N 111 119.228 119.228 119.672 -0.444 18093 13521 1 19 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.228 -0.232 18093 13522 1 19 . 1 1 111 111 ARG C C 111 177.786 177.786 178.860 -1.074 18093 13523 1 19 . 1 1 111 111 ARG CA C 111 58.942 58.942 58.989 -0.047 18093 13524 1 19 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.911 0.285 18093 13525 1 19 . 1 1 111 111 ARG H H 111 7.850 7.850 8.493 -0.643 18093 13526 1 19 . 1 1 112 112 ILE N N 112 118.000 118.000 119.712 -1.712 18093 13527 1 19 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.088 -0.275 18093 13528 1 19 . 1 1 112 112 ILE C C 112 177.496 177.496 177.949 -0.453 18093 13529 1 19 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.269 2.543 18093 13530 1 19 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.882 0.845 18093 13531 1 19 . 1 1 112 112 ILE H H 112 7.764 7.764 7.727 0.037 18093 13532 1 19 . 1 1 113 113 PHE N N 113 118.367 118.367 122.065 -3.698 18093 13533 1 19 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.234 0.021 18093 13534 1 19 . 1 1 113 113 PHE C C 113 177.218 177.218 177.356 -0.138 18093 13535 1 19 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.358 -0.925 18093 13536 1 19 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.150 -0.343 18093 13537 1 19 . 1 1 113 113 PHE H H 113 7.963 7.963 7.982 -0.019 18093 13538 1 19 . 1 1 114 114 LEU N N 114 118.921 118.921 117.246 1.675 18093 13539 1 19 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.893 0.104 18093 13540 1 19 . 1 1 114 114 LEU C C 114 178.297 178.297 178.410 -0.113 18093 13541 1 19 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.123 0.488 18093 13542 1 19 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.217 0.735 18093 13543 1 19 . 1 1 114 114 LEU H H 114 7.939 7.939 7.983 -0.044 18093 13544 1 19 . 1 1 115 115 TRP N N 115 117.464 117.464 119.439 -1.975 18093 13545 1 19 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.352 0.022 18093 13546 1 19 . 1 1 115 115 TRP C C 115 178.572 178.572 178.238 0.334 18093 13547 1 19 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.770 1.152 18093 13548 1 19 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.752 -1.245 18093 13549 1 19 . 1 1 115 115 TRP H H 115 7.969 7.969 7.594 0.375 18093 13550 1 19 . 1 1 116 116 MET N N 116 117.069 117.069 118.900 -1.831 18093 13551 1 19 . 1 1 116 116 MET HA H 116 4.065 4.065 4.211 -0.146 18093 13552 1 19 . 1 1 116 116 MET C C 116 177.425 177.425 178.185 -0.760 18093 13553 1 19 . 1 1 116 116 MET CA C 116 59.289 59.289 59.102 0.187 18093 13554 1 19 . 1 1 116 116 MET CB C 116 31.692 31.692 32.504 -0.812 18093 13555 1 19 . 1 1 116 116 MET H H 116 8.465 8.465 7.696 0.769 18093 13556 1 19 . 1 1 117 117 PHE N N 117 118.755 118.755 117.899 0.856 18093 13557 1 19 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.089 0.010 18093 13558 1 19 . 1 1 117 117 PHE C C 117 177.965 177.965 178.447 -0.482 18093 13559 1 19 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.133 -0.425 18093 13560 1 19 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.283 0.902 18093 13561 1 19 . 1 1 117 117 PHE H H 117 8.418 8.418 7.831 0.587 18093 13562 1 19 . 1 1 118 118 ILE N N 118 119.133 119.133 115.179 3.954 18093 13563 1 19 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.887 -0.543 18093 13564 1 19 . 1 1 118 118 ILE C C 118 177.244 177.244 177.428 -0.184 18093 13565 1 19 . 1 1 118 118 ILE CA C 118 65.825 65.825 63.980 1.845 18093 13566 1 19 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.833 -0.285 18093 13567 1 19 . 1 1 118 118 ILE H H 118 8.266 8.266 7.671 0.595 18093 13568 1 19 . 1 1 119 119 ILE N N 119 118.846 118.846 121.554 -2.708 18093 13569 1 19 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.940 -0.368 18093 13570 1 19 . 1 1 119 119 ILE C C 119 177.523 177.523 177.435 0.088 18093 13571 1 19 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.228 0.661 18093 13572 1 19 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.254 -0.690 18093 13573 1 19 . 1 1 119 119 ILE H H 119 8.308 8.308 7.293 1.015 18093 13574 1 19 . 1 1 120 120 VAL N N 120 119.228 119.228 118.286 0.942 18093 13575 1 19 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.878 -0.370 18093 13576 1 19 . 1 1 120 120 VAL C C 120 177.651 177.651 177.139 0.512 18093 13577 1 19 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.148 2.453 18093 13578 1 19 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.669 0.737 18093 13579 1 19 . 1 1 120 120 VAL H H 120 8.399 8.399 7.954 0.445 18093 13580 1 19 . 1 1 121 121 CYS N N 121 117.151 117.151 119.271 -2.120 18093 13581 1 19 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.031 -0.128 18093 13582 1 19 . 1 1 121 121 CYS C C 121 177.719 177.719 176.618 1.101 18093 13583 1 19 . 1 1 121 121 CYS CA C 121 64.298 64.298 64.558 -0.260 18093 13584 1 19 . 1 1 121 121 CYS CB C 121 26.677 26.677 27.444 -0.767 18093 13585 1 19 . 1 1 121 121 CYS H H 121 8.008 8.008 7.478 0.530 18093 13586 1 19 . 1 1 122 122 LEU N N 122 121.402 121.402 119.798 1.604 18093 13587 1 19 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.124 -0.141 18093 13588 1 19 . 1 1 122 122 LEU C C 122 178.282 178.282 178.956 -0.674 18093 13589 1 19 . 1 1 122 122 LEU CA C 122 58.545 58.545 58.130 0.415 18093 13590 1 19 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.196 0.770 18093 13591 1 19 . 1 1 122 122 LEU H H 122 8.417 8.417 7.716 0.701 18093 13592 1 19 . 1 1 123 123 LEU N N 123 118.543 118.543 120.129 -1.586 18093 13593 1 19 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.008 -0.088 18093 13594 1 19 . 1 1 123 123 LEU C C 123 179.028 179.028 178.842 0.186 18093 13595 1 19 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.459 -0.342 18093 13596 1 19 . 1 1 123 123 LEU CB C 123 42.056 42.056 40.971 1.085 18093 13597 1 19 . 1 1 123 123 LEU H H 123 8.590 8.590 7.751 0.839 18093 13598 1 19 . 1 1 124 124 GLY N N 124 104.896 104.896 105.472 -0.576 18093 13599 1 19 . 1 1 124 124 GLY C C 124 173.932 173.932 176.071 -2.139 18093 13600 1 19 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.422 -0.195 18093 13601 1 19 . 1 1 124 124 GLY H H 124 8.601 8.601 8.184 0.417 18093 13602 1 19 . 1 1 125 125 THR N N 125 115.403 115.403 118.943 -3.540 18093 13603 1 19 . 1 1 125 125 THR HA H 125 3.686 3.686 3.852 -0.166 18093 13604 1 19 . 1 1 125 125 THR C C 125 176.407 176.407 176.810 -0.403 18093 13605 1 19 . 1 1 125 125 THR CA C 125 67.565 67.565 66.905 0.660 18093 13606 1 19 . 1 1 125 125 THR CB C 125 68.143 68.143 68.486 -0.343 18093 13607 1 19 . 1 1 125 125 THR H H 125 7.734 7.734 7.429 0.305 18093 13608 1 19 . 1 1 126 126 VAL N N 126 119.056 119.056 120.144 -1.088 18093 13609 1 19 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.729 -0.190 18093 13610 1 19 . 1 1 126 126 VAL C C 126 177.628 177.628 178.319 -0.691 18093 13611 1 19 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.642 -0.041 18093 13612 1 19 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.275 0.219 18093 13613 1 19 . 1 1 126 126 VAL H H 126 8.015 8.015 8.226 -0.211 18093 13614 1 19 . 1 1 127 127 GLY N N 127 104.644 104.644 107.587 -2.943 18093 13615 1 19 . 1 1 127 127 GLY C C 127 173.933 173.933 175.648 -1.715 18093 13616 1 19 . 1 1 127 127 GLY CA C 127 47.281 47.281 46.811 0.470 18093 13617 1 19 . 1 1 127 127 GLY H H 127 8.248 8.248 8.367 -0.119 18093 13618 1 19 . 1 1 128 128 LEU N N 128 117.354 117.354 121.681 -4.327 18093 13619 1 19 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.261 -0.249 18093 13620 1 19 . 1 1 128 128 LEU C C 128 177.443 177.443 177.438 0.005 18093 13621 1 19 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.968 -0.342 18093 13622 1 19 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.802 0.458 18093 13623 1 19 . 1 1 128 128 LEU H H 128 7.568 7.568 7.676 -0.108 18093 13624 1 19 . 1 1 129 129 PHE N N 129 113.971 113.971 116.037 -2.066 18093 13625 1 19 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.444 0.014 18093 13626 1 19 . 1 1 129 129 PHE C C 129 176.216 176.216 176.332 -0.116 18093 13627 1 19 . 1 1 129 129 PHE CA C 129 58.385 58.385 59.124 -0.739 18093 13628 1 19 . 1 1 129 129 PHE CB C 129 39.719 39.719 40.291 -0.572 18093 13629 1 19 . 1 1 129 129 PHE H H 129 7.639 7.639 7.596 0.043 18093 13630 1 19 . 1 1 130 130 LEU N N 130 117.752 117.752 120.345 -2.593 18093 13631 1 19 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.856 -0.423 18093 13632 1 19 . 1 1 130 130 LEU CA C 130 54.156 54.156 52.202 1.954 18093 13633 1 19 . 1 1 130 130 LEU H H 130 8.099 8.099 7.598 0.501 18093 13634 1 19 . 1 1 131 131 PRO HA H 131 4.450 4.450 5.069 -0.619 18093 13635 1 19 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.518 2.381 18093 13636 1 19 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.390 -0.128 18093 13637 1 19 . 1 1 132 132 PRO C C 132 177.616 177.616 178.674 -1.058 18093 13638 1 19 . 1 1 132 132 PRO CA C 132 64.980 64.980 64.675 0.305 18093 13639 1 19 . 1 1 132 132 PRO CB C 132 31.625 31.625 31.924 -0.299 18093 13640 1 19 . 1 1 133 133 TRP N N 133 115.508 115.508 119.809 -4.301 18093 13641 1 19 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.518 0.074 18093 13642 1 19 . 1 1 133 133 TRP C C 133 176.842 176.842 175.576 1.266 18093 13643 1 19 . 1 1 133 133 TRP CA C 133 57.283 57.283 58.871 -1.588 18093 13644 1 19 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.476 -0.880 18093 13645 1 19 . 1 1 133 133 TRP H H 133 7.311 7.311 8.340 -1.029 18093 13646 1 19 . 1 1 134 134 LEU N N 134 119.570 119.570 116.077 3.493 18093 13647 1 19 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.660 -0.483 18093 13648 1 19 . 1 1 134 134 LEU C C 134 175.768 175.768 176.947 -1.179 18093 13649 1 19 . 1 1 134 134 LEU CA C 134 55.621 55.621 54.170 1.451 18093 13650 1 19 . 1 1 134 134 LEU CB C 134 42.648 42.648 42.288 0.360 18093 13651 1 19 . 1 1 134 134 LEU H H 134 7.453 7.453 7.311 0.142 18093 13652 1 19 . 1 1 135 135 ALA N N 135 119.004 119.004 122.462 -3.458 18093 13653 1 19 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.281 -0.058 18093 13654 1 19 . 1 1 135 135 ALA C C 135 177.170 177.170 178.135 -0.965 18093 13655 1 19 . 1 1 135 135 ALA CA C 135 52.456 52.456 53.813 -1.357 18093 13656 1 19 . 1 1 135 135 ALA CB C 135 19.736 19.736 18.968 0.768 18093 13657 1 19 . 1 1 135 135 ALA H H 135 7.541 7.541 7.647 -0.106 18093 13658 1 19 . 1 1 136 136 GLY N N 136 105.879 105.879 107.469 -1.590 18093 13659 1 19 . 1 1 136 136 GLY C C 136 173.042 173.042 174.771 -1.729 18093 13660 1 19 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.224 0.469 18093 13661 1 19 . 1 1 136 136 GLY H H 136 7.846 7.846 8.432 -0.586 18093 13662 1 20 . 1 1 5 5 GLU N N 5 119.627 119.627 117.096 2.531 18093 13663 1 20 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.381 -0.173 18093 13664 1 20 . 1 1 5 5 GLU C C 5 176.581 176.581 174.563 2.018 18093 13665 1 20 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.665 0.380 18093 13666 1 20 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.032 1.006 18093 13667 1 20 . 1 1 5 5 GLU H H 5 8.003 8.003 8.456 -0.453 18093 13668 1 20 . 1 1 6 6 LEU N N 6 121.267 121.267 121.637 -0.370 18093 13669 1 20 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.369 0.056 18093 13670 1 20 . 1 1 6 6 LEU CA C 6 55.635 55.635 52.340 3.295 18093 13671 1 20 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.808 -0.512 18093 13672 1 20 . 1 1 6 6 LEU H H 6 8.104 8.104 7.840 0.264 18093 13673 1 20 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.656 -0.257 18093 13674 1 20 . 1 1 7 7 PRO C C 7 178.408 178.408 177.665 0.743 18093 13675 1 20 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.106 2.606 18093 13676 1 20 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.756 -0.839 18093 13677 1 20 . 1 1 8 8 LEU N N 8 121.835 121.835 120.173 1.662 18093 13678 1 20 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.240 -0.151 18093 13679 1 20 . 1 1 8 8 LEU C C 8 177.902 177.902 178.348 -0.446 18093 13680 1 20 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.333 0.772 18093 13681 1 20 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.003 0.604 18093 13682 1 20 . 1 1 8 8 LEU H H 8 8.162 8.162 8.489 -0.327 18093 13683 1 20 . 1 1 9 9 PHE N N 9 118.342 118.342 119.307 -0.965 18093 13684 1 20 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.168 0.021 18093 13685 1 20 . 1 1 9 9 PHE C C 9 177.596 177.596 177.134 0.462 18093 13686 1 20 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.183 -0.069 18093 13687 1 20 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.272 0.455 18093 13688 1 20 . 1 1 9 9 PHE H H 9 8.318 8.318 8.316 0.002 18093 13689 1 20 . 1 1 10 10 TYR N N 10 117.584 117.584 117.615 -0.031 18093 13690 1 20 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.938 0.216 18093 13691 1 20 . 1 1 10 10 TYR C C 10 177.630 177.630 177.883 -0.253 18093 13692 1 20 . 1 1 10 10 TYR CA C 10 61.036 61.036 60.419 0.617 18093 13693 1 20 . 1 1 10 10 TYR CB C 10 38.660 38.660 37.953 0.707 18093 13694 1 20 . 1 1 10 10 TYR H H 10 8.105 8.105 7.864 0.241 18093 13695 1 20 . 1 1 11 11 THR N N 11 115.563 115.563 117.207 -1.644 18093 13696 1 20 . 1 1 11 11 THR HA H 11 3.871 3.871 3.941 -0.070 18093 13697 1 20 . 1 1 11 11 THR C C 11 175.955 175.955 176.652 -0.697 18093 13698 1 20 . 1 1 11 11 THR CA C 11 67.290 67.290 66.741 0.549 18093 13699 1 20 . 1 1 11 11 THR CB C 11 68.201 68.201 68.756 -0.555 18093 13700 1 20 . 1 1 11 11 THR H H 11 7.915 7.915 7.587 0.328 18093 13701 1 20 . 1 1 12 12 ILE N N 12 119.727 119.727 120.409 -0.682 18093 13702 1 20 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.888 -0.189 18093 13703 1 20 . 1 1 12 12 ILE C C 12 175.773 175.773 177.461 -1.688 18093 13704 1 20 . 1 1 12 12 ILE CA C 12 64.699 64.699 63.190 1.509 18093 13705 1 20 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.955 1.141 18093 13706 1 20 . 1 1 12 12 ILE H H 12 8.186 8.186 7.998 0.188 18093 13707 1 20 . 1 1 13 13 ASN N N 13 114.190 114.190 118.622 -4.432 18093 13708 1 20 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.566 -0.144 18093 13709 1 20 . 1 1 13 13 ASN C C 13 174.786 174.786 176.748 -1.962 18093 13710 1 20 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.192 0.363 18093 13711 1 20 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.648 0.710 18093 13712 1 20 . 1 1 13 13 ASN H H 13 7.601 7.601 7.374 0.227 18093 13713 1 20 . 1 1 14 14 LEU N N 14 115.031 115.031 118.992 -3.961 18093 13714 1 20 . 1 1 14 14 LEU HA H 14 4.196 4.196 3.933 0.263 18093 13715 1 20 . 1 1 14 14 LEU C C 14 177.540 177.540 177.993 -0.453 18093 13716 1 20 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.516 -0.108 18093 13717 1 20 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.383 -0.541 18093 13718 1 20 . 1 1 14 14 LEU H H 14 7.390 7.390 7.600 -0.210 18093 13719 1 20 . 1 1 15 15 ILE N N 15 118.223 118.223 120.085 -1.862 18093 13720 1 20 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.654 -0.041 18093 13721 1 20 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.584 3.136 18093 13722 1 20 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.199 -0.587 18093 13723 1 20 . 1 1 15 15 ILE H H 15 8.123 8.123 7.634 0.489 18093 13724 1 20 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.348 -0.279 18093 13725 1 20 . 1 1 17 17 PRO C C 17 177.721 177.721 178.900 -1.179 18093 13726 1 20 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.458 1.303 18093 13727 1 20 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.721 0.021 18093 13728 1 20 . 1 1 18 18 CYS N N 18 113.538 113.538 117.694 -4.156 18093 13729 1 20 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.134 -0.126 18093 13730 1 20 . 1 1 18 18 CYS C C 18 177.683 177.683 176.957 0.726 18093 13731 1 20 . 1 1 18 18 CYS CA C 18 64.500 64.500 62.600 1.900 18093 13732 1 20 . 1 1 18 18 CYS CB C 18 26.873 26.873 26.437 0.436 18093 13733 1 20 . 1 1 18 18 CYS H H 18 7.410 7.410 7.423 -0.013 18093 13734 1 20 . 1 1 19 19 LEU N N 19 122.545 122.545 119.698 2.847 18093 13735 1 20 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.164 -0.165 18093 13736 1 20 . 1 1 19 19 LEU C C 19 178.608 178.608 179.028 -0.420 18093 13737 1 20 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.159 1.262 18093 13738 1 20 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.439 0.405 18093 13739 1 20 . 1 1 19 19 LEU H H 19 8.635 8.635 7.425 1.210 18093 13740 1 20 . 1 1 20 20 LEU N N 20 119.404 119.404 120.779 -1.375 18093 13741 1 20 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.928 0.078 18093 13742 1 20 . 1 1 20 20 LEU C C 20 178.540 178.540 179.337 -0.797 18093 13743 1 20 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.285 0.514 18093 13744 1 20 . 1 1 20 20 LEU CB C 20 41.999 41.999 42.151 -0.152 18093 13745 1 20 . 1 1 20 20 LEU H H 20 8.392 8.392 7.497 0.895 18093 13746 1 20 . 1 1 21 21 ILE N N 21 117.335 117.335 113.793 3.542 18093 13747 1 20 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.814 -0.163 18093 13748 1 20 . 1 1 21 21 ILE C C 21 177.249 177.249 177.131 0.118 18093 13749 1 20 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.034 1.227 18093 13750 1 20 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.319 0.641 18093 13751 1 20 . 1 1 21 21 ILE H H 21 8.403 8.403 8.340 0.063 18093 13752 1 20 . 1 1 22 22 SER N N 22 116.385 116.385 118.104 -1.719 18093 13753 1 20 . 1 1 22 22 SER HA H 22 4.056 4.056 4.259 -0.203 18093 13754 1 20 . 1 1 22 22 SER C C 22 176.813 176.813 176.568 0.245 18093 13755 1 20 . 1 1 22 22 SER CA C 22 63.866 63.866 61.597 2.269 18093 13756 1 20 . 1 1 22 22 SER CB C 22 62.898 62.898 63.223 -0.325 18093 13757 1 20 . 1 1 22 22 SER H H 22 8.271 8.271 7.554 0.717 18093 13758 1 20 . 1 1 23 23 CYS N N 23 119.001 119.001 120.933 -1.932 18093 13759 1 20 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.042 -0.052 18093 13760 1 20 . 1 1 23 23 CYS C C 23 177.594 177.594 176.725 0.869 18093 13761 1 20 . 1 1 23 23 CYS CA C 23 64.429 64.429 63.514 0.915 18093 13762 1 20 . 1 1 23 23 CYS CB C 23 26.940 26.940 27.267 -0.327 18093 13763 1 20 . 1 1 23 23 CYS H H 23 8.161 8.161 8.567 -0.406 18093 13764 1 20 . 1 1 24 24 LEU N N 24 117.814 117.814 120.521 -2.707 18093 13765 1 20 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.823 0.154 18093 13766 1 20 . 1 1 24 24 LEU C C 24 177.944 177.944 178.495 -0.551 18093 13767 1 20 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.340 -0.053 18093 13768 1 20 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.907 -0.004 18093 13769 1 20 . 1 1 24 24 LEU H H 24 8.106 8.106 7.578 0.528 18093 13770 1 20 . 1 1 25 25 THR N N 25 115.670 115.670 114.442 1.228 18093 13771 1 20 . 1 1 25 25 THR HA H 25 3.687 3.687 3.990 -0.303 18093 13772 1 20 . 1 1 25 25 THR C C 25 175.845 175.845 176.985 -1.140 18093 13773 1 20 . 1 1 25 25 THR CA C 25 68.306 68.306 66.132 2.174 18093 13774 1 20 . 1 1 25 25 THR H H 25 7.924 7.924 7.576 0.348 18093 13775 1 20 . 1 1 26 26 VAL N N 26 118.809 118.809 121.219 -2.410 18093 13776 1 20 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.828 -0.313 18093 13777 1 20 . 1 1 26 26 VAL C C 26 177.530 177.530 177.817 -0.287 18093 13778 1 20 . 1 1 26 26 VAL CA C 26 67.281 67.281 65.930 1.351 18093 13779 1 20 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.008 0.716 18093 13780 1 20 . 1 1 26 26 VAL H H 26 7.764 7.764 7.244 0.520 18093 13781 1 20 . 1 1 27 27 LEU N N 27 117.958 117.958 120.645 -2.687 18093 13782 1 20 . 1 1 27 27 LEU HA H 27 4.036 4.036 3.987 0.049 18093 13783 1 20 . 1 1 27 27 LEU C C 27 178.163 178.163 179.312 -1.149 18093 13784 1 20 . 1 1 27 27 LEU CA C 27 58.509 58.509 57.963 0.546 18093 13785 1 20 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.633 1.286 18093 13786 1 20 . 1 1 27 27 LEU H H 27 7.912 7.912 8.346 -0.434 18093 13787 1 20 . 1 1 28 28 VAL N N 28 114.472 114.472 118.320 -3.848 18093 13788 1 20 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.745 -0.210 18093 13789 1 20 . 1 1 28 28 VAL C C 28 176.871 176.871 178.142 -1.271 18093 13790 1 20 . 1 1 28 28 VAL CA C 28 65.977 65.977 66.338 -0.361 18093 13791 1 20 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.512 0.422 18093 13792 1 20 . 1 1 28 28 VAL H H 28 7.892 7.892 7.617 0.275 18093 13793 1 20 . 1 1 29 29 PHE N N 29 115.206 115.206 117.544 -2.338 18093 13794 1 20 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.117 0.086 18093 13795 1 20 . 1 1 29 29 PHE C C 29 176.614 176.614 176.603 0.011 18093 13796 1 20 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.998 -0.034 18093 13797 1 20 . 1 1 29 29 PHE CB C 29 39.752 39.752 38.859 0.893 18093 13798 1 20 . 1 1 29 29 PHE H H 29 7.748 7.748 7.666 0.082 18093 13799 1 20 . 1 1 30 30 TYR N N 30 115.975 115.975 118.984 -3.009 18093 13800 1 20 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.376 -0.054 18093 13801 1 20 . 1 1 30 30 TYR C C 30 175.553 175.553 176.016 -0.463 18093 13802 1 20 . 1 1 30 30 TYR CA C 30 59.598 59.598 60.094 -0.496 18093 13803 1 20 . 1 1 30 30 TYR CB C 30 39.763 39.763 40.600 -0.837 18093 13804 1 20 . 1 1 30 30 TYR H H 30 7.985 7.985 7.540 0.445 18093 13805 1 20 . 1 1 31 31 LEU N N 31 120.780 120.780 122.124 -1.344 18093 13806 1 20 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.836 -0.409 18093 13807 1 20 . 1 1 31 31 LEU CA C 31 54.665 54.665 51.729 2.936 18093 13808 1 20 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.207 -0.819 18093 13809 1 20 . 1 1 31 31 LEU H H 31 7.643 7.643 7.855 -0.212 18093 13810 1 20 . 1 1 34 34 GLU C C 34 176.271 176.271 175.487 0.784 18093 13811 1 20 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.803 1.788 18093 13812 1 20 . 1 1 35 35 CYS N N 35 116.430 116.430 121.598 -5.168 18093 13813 1 20 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.312 0.055 18093 13814 1 20 . 1 1 35 35 CYS C C 35 175.198 175.198 176.953 -1.755 18093 13815 1 20 . 1 1 35 35 CYS CA C 35 60.293 60.293 61.376 -1.083 18093 13816 1 20 . 1 1 35 35 CYS CB C 35 28.130 28.130 27.580 0.550 18093 13817 1 20 . 1 1 35 35 CYS H H 35 7.970 7.970 8.774 -0.804 18093 13818 1 20 . 1 1 36 36 GLY N N 36 108.315 108.315 107.761 0.554 18093 13819 1 20 . 1 1 36 36 GLY C C 36 174.610 174.610 175.657 -1.047 18093 13820 1 20 . 1 1 36 36 GLY CA C 36 46.004 46.004 46.760 -0.756 18093 13821 1 20 . 1 1 36 36 GLY H H 36 8.120 8.120 8.409 -0.289 18093 13822 1 20 . 1 1 37 37 GLU N N 37 121.347 121.347 120.822 0.525 18093 13823 1 20 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.054 -0.007 18093 13824 1 20 . 1 1 37 37 GLU C C 37 177.338 177.338 179.018 -1.680 18093 13825 1 20 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.920 -1.413 18093 13826 1 20 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.334 0.236 18093 13827 1 20 . 1 1 37 37 GLU H H 37 8.423 8.423 8.555 -0.132 18093 13828 1 20 . 1 1 38 38 LYS N N 38 123.788 123.788 119.531 4.257 18093 13829 1 20 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.129 0.067 18093 13830 1 20 . 1 1 38 38 LYS C C 38 177.976 177.976 179.277 -1.301 18093 13831 1 20 . 1 1 38 38 LYS CA C 38 58.273 58.273 58.874 -0.601 18093 13832 1 20 . 1 1 38 38 LYS CB C 38 31.649 31.649 31.868 -0.219 18093 13833 1 20 . 1 1 38 38 LYS H H 38 8.211 8.211 7.463 0.748 18093 13834 1 20 . 1 1 39 39 ILE N N 39 115.675 115.675 118.599 -2.924 18093 13835 1 20 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.827 -0.219 18093 13836 1 20 . 1 1 39 39 ILE C C 39 177.204 177.204 178.291 -1.087 18093 13837 1 20 . 1 1 39 39 ILE CA C 39 65.501 65.501 64.289 1.212 18093 13838 1 20 . 1 1 39 39 ILE H H 39 7.933 7.933 7.572 0.361 18093 13839 1 20 . 1 1 40 40 THR N N 40 117.411 117.411 116.397 1.014 18093 13840 1 20 . 1 1 40 40 THR HA H 40 3.844 3.844 3.962 -0.118 18093 13841 1 20 . 1 1 40 40 THR C C 40 175.983 175.983 176.579 -0.596 18093 13842 1 20 . 1 1 40 40 THR CA C 40 67.360 67.360 66.677 0.683 18093 13843 1 20 . 1 1 40 40 THR H H 40 8.362 8.362 7.611 0.751 18093 13844 1 20 . 1 1 41 41 LEU N N 41 123.059 123.059 123.313 -0.254 18093 13845 1 20 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.122 -0.106 18093 13846 1 20 . 1 1 41 41 LEU C C 41 178.914 178.914 178.100 0.814 18093 13847 1 20 . 1 1 41 41 LEU CA C 41 58.366 58.366 58.073 0.293 18093 13848 1 20 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.920 0.130 18093 13849 1 20 . 1 1 41 41 LEU H H 41 8.282 8.282 7.620 0.662 18093 13850 1 20 . 1 1 42 42 CYS N N 42 118.762 118.762 117.985 0.777 18093 13851 1 20 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.047 -0.111 18093 13852 1 20 . 1 1 42 42 CYS C C 42 176.607 176.607 176.976 -0.369 18093 13853 1 20 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.318 0.999 18093 13854 1 20 . 1 1 42 42 CYS CB C 42 26.919 26.919 26.569 0.350 18093 13855 1 20 . 1 1 42 42 CYS H H 42 8.195 8.195 7.631 0.564 18093 13856 1 20 . 1 1 43 43 ILE N N 43 117.589 117.589 119.241 -1.652 18093 13857 1 20 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.713 -0.106 18093 13858 1 20 . 1 1 43 43 ILE C C 43 177.323 177.323 177.660 -0.337 18093 13859 1 20 . 1 1 43 43 ILE CA C 43 65.249 65.249 64.944 0.305 18093 13860 1 20 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.844 0.194 18093 13861 1 20 . 1 1 43 43 ILE H H 43 8.428 8.428 7.551 0.877 18093 13862 1 20 . 1 1 44 44 SER N N 44 115.950 115.950 116.346 -0.396 18093 13863 1 20 . 1 1 44 44 SER HA H 44 4.012 4.012 4.195 -0.183 18093 13864 1 20 . 1 1 44 44 SER C C 44 176.965 176.965 176.681 0.284 18093 13865 1 20 . 1 1 44 44 SER CA C 44 63.575 63.575 61.822 1.753 18093 13866 1 20 . 1 1 44 44 SER H H 44 7.984 7.984 7.397 0.587 18093 13867 1 20 . 1 1 45 45 VAL N N 45 123.544 123.544 118.555 4.989 18093 13868 1 20 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.762 -0.214 18093 13869 1 20 . 1 1 45 45 VAL C C 45 177.139 177.139 177.588 -0.449 18093 13870 1 20 . 1 1 45 45 VAL CA C 45 67.233 67.233 65.819 1.415 18093 13871 1 20 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.229 0.413 18093 13872 1 20 . 1 1 45 45 VAL H H 45 8.280 8.280 7.809 0.471 18093 13873 1 20 . 1 1 46 46 LEU N N 46 119.883 119.883 121.628 -1.745 18093 13874 1 20 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.089 -0.146 18093 13875 1 20 . 1 1 46 46 LEU C C 46 180.125 180.125 178.580 1.545 18093 13876 1 20 . 1 1 46 46 LEU CA C 46 58.600 58.600 58.013 0.587 18093 13877 1 20 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.878 0.134 18093 13878 1 20 . 1 1 46 46 LEU H H 46 8.117 8.117 7.480 0.637 18093 13879 1 20 . 1 1 47 47 LEU N N 47 120.193 120.193 119.450 0.743 18093 13880 1 20 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.841 0.163 18093 13881 1 20 . 1 1 47 47 LEU C C 47 178.370 178.370 179.255 -0.885 18093 13882 1 20 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.380 0.046 18093 13883 1 20 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.666 0.389 18093 13884 1 20 . 1 1 47 47 LEU H H 47 8.933 8.933 7.911 1.022 18093 13885 1 20 . 1 1 48 48 SER N N 48 115.861 115.861 115.000 0.861 18093 13886 1 20 . 1 1 48 48 SER HA H 48 4.013 4.013 4.248 -0.235 18093 13887 1 20 . 1 1 48 48 SER C C 48 175.642 175.642 176.678 -1.036 18093 13888 1 20 . 1 1 48 48 SER CA C 48 63.571 63.571 61.854 1.717 18093 13889 1 20 . 1 1 48 48 SER CB C 48 62.879 62.879 62.983 -0.103 18093 13890 1 20 . 1 1 48 48 SER H H 48 7.996 7.996 7.584 0.412 18093 13891 1 20 . 1 1 49 49 LEU N N 49 120.673 120.673 123.284 -2.611 18093 13892 1 20 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.004 0.031 18093 13893 1 20 . 1 1 49 49 LEU C C 49 178.229 178.229 178.685 -0.456 18093 13894 1 20 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.598 -0.315 18093 13895 1 20 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.241 -0.295 18093 13896 1 20 . 1 1 49 49 LEU H H 49 8.352 8.352 8.058 0.294 18093 13897 1 20 . 1 1 50 50 THR N N 50 115.582 115.582 114.550 1.032 18093 13898 1 20 . 1 1 50 50 THR HA H 50 3.672 3.672 4.040 -0.368 18093 13899 1 20 . 1 1 50 50 THR C C 50 175.877 175.877 176.815 -0.938 18093 13900 1 20 . 1 1 50 50 THR CA C 50 68.628 68.628 66.632 1.996 18093 13901 1 20 . 1 1 50 50 THR H H 50 7.937 7.937 8.017 -0.080 18093 13902 1 20 . 1 1 51 51 VAL N N 51 119.774 119.774 122.863 -3.089 18093 13903 1 20 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.717 -0.219 18093 13904 1 20 . 1 1 51 51 VAL C C 51 177.162 177.162 177.252 -0.090 18093 13905 1 20 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.657 0.928 18093 13906 1 20 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.950 -0.429 18093 13907 1 20 . 1 1 51 51 VAL H H 51 8.115 8.115 7.408 0.707 18093 13908 1 20 . 1 1 52 52 PHE N N 52 118.808 118.808 119.695 -0.887 18093 13909 1 20 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.281 -0.159 18093 13910 1 20 . 1 1 52 52 PHE C C 52 176.697 176.697 177.201 -0.504 18093 13911 1 20 . 1 1 52 52 PHE CA C 52 61.771 61.771 61.214 0.557 18093 13912 1 20 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.444 -0.182 18093 13913 1 20 . 1 1 52 52 PHE H H 52 8.256 8.256 8.654 -0.398 18093 13914 1 20 . 1 1 53 53 LEU N N 53 117.267 117.267 121.437 -4.170 18093 13915 1 20 . 1 1 53 53 LEU HA H 53 3.893 3.893 4.168 -0.275 18093 13916 1 20 . 1 1 53 53 LEU C C 53 179.319 179.319 177.986 1.333 18093 13917 1 20 . 1 1 53 53 LEU CA C 53 57.985 57.985 58.330 -0.345 18093 13918 1 20 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.497 0.330 18093 13919 1 20 . 1 1 53 53 LEU H H 53 8.443 8.443 7.909 0.534 18093 13920 1 20 . 1 1 54 54 LEU N N 54 119.762 119.762 118.937 0.825 18093 13921 1 20 . 1 1 54 54 LEU HA H 54 4.054 4.054 4.005 0.049 18093 13922 1 20 . 1 1 54 54 LEU C C 54 178.827 178.827 179.011 -0.184 18093 13923 1 20 . 1 1 54 54 LEU CA C 54 58.105 58.105 57.937 0.168 18093 13924 1 20 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.821 0.126 18093 13925 1 20 . 1 1 54 54 LEU H H 54 8.205 8.205 7.425 0.780 18093 13926 1 20 . 1 1 55 55 LEU N N 55 118.585 118.585 118.612 -0.027 18093 13927 1 20 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.864 0.213 18093 13928 1 20 . 1 1 55 55 LEU C C 55 178.909 178.909 178.964 -0.055 18093 13929 1 20 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.787 0.321 18093 13930 1 20 . 1 1 55 55 LEU CB C 55 41.979 41.979 40.722 1.257 18093 13931 1 20 . 1 1 55 55 LEU H H 55 8.179 8.179 7.391 0.788 18093 13932 1 20 . 1 1 56 56 ILE N N 56 116.079 116.079 114.927 1.152 18093 13933 1 20 . 1 1 56 56 ILE HA H 56 3.729 3.729 3.966 -0.237 18093 13934 1 20 . 1 1 56 56 ILE C C 56 176.988 176.988 178.005 -1.017 18093 13935 1 20 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.817 0.440 18093 13936 1 20 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.963 0.454 18093 13937 1 20 . 1 1 56 56 ILE H H 56 8.040 8.040 7.590 0.450 18093 13938 1 20 . 1 1 57 57 THR N N 57 110.105 110.105 110.132 -0.027 18093 13939 1 20 . 1 1 57 57 THR HA H 57 4.015 4.015 4.234 -0.219 18093 13940 1 20 . 1 1 57 57 THR C C 57 175.435 175.435 175.695 -0.260 18093 13941 1 20 . 1 1 57 57 THR CA C 57 65.067 65.067 64.588 0.479 18093 13942 1 20 . 1 1 57 57 THR CB C 57 69.179 69.179 68.999 0.180 18093 13943 1 20 . 1 1 57 57 THR H H 57 7.655 7.655 7.805 -0.150 18093 13944 1 20 . 1 1 58 58 GLU N N 58 117.313 117.313 121.458 -4.145 18093 13945 1 20 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.314 0.019 18093 13946 1 20 . 1 1 58 58 GLU C C 58 176.940 176.940 178.103 -1.163 18093 13947 1 20 . 1 1 58 58 GLU CA C 58 57.068 57.068 58.032 -0.964 18093 13948 1 20 . 1 1 58 58 GLU CB C 58 29.396 29.396 30.345 -0.949 18093 13949 1 20 . 1 1 58 58 GLU H H 58 7.521 7.521 7.836 -0.315 18093 13950 1 20 . 1 1 59 59 ILE N N 59 114.870 114.870 113.958 0.912 18093 13951 1 20 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.090 -0.001 18093 13952 1 20 . 1 1 59 59 ILE C C 59 175.456 175.456 176.146 -0.690 18093 13953 1 20 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.209 0.225 18093 13954 1 20 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.737 -0.080 18093 13955 1 20 . 1 1 59 59 ILE H H 59 7.579 7.579 7.356 0.223 18093 13956 1 20 . 1 1 60 60 ILE N N 60 119.354 119.354 118.096 1.258 18093 13957 1 20 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.872 0.432 18093 13958 1 20 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.397 -1.780 18093 13959 1 20 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.773 2.089 18093 13960 1 20 . 1 1 60 60 ILE H H 60 7.629 7.629 7.564 0.065 18093 13961 1 20 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.465 -0.065 18093 13962 1 20 . 1 1 61 61 PRO C C 61 177.144 177.144 176.174 0.970 18093 13963 1 20 . 1 1 61 61 PRO CA C 61 63.808 63.808 64.236 -0.428 18093 13964 1 20 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.540 -0.658 18093 13965 1 20 . 1 1 62 62 SER N N 62 114.474 114.474 111.860 2.614 18093 13966 1 20 . 1 1 62 62 SER HA H 62 4.434 4.434 4.674 -0.240 18093 13967 1 20 . 1 1 62 62 SER C C 62 175.161 175.161 173.587 1.574 18093 13968 1 20 . 1 1 62 62 SER CA C 62 59.047 59.047 57.983 1.064 18093 13969 1 20 . 1 1 62 62 SER CB C 62 63.704 63.704 64.512 -0.808 18093 13970 1 20 . 1 1 62 62 SER H H 62 8.186 8.186 7.977 0.209 18093 13971 1 20 . 1 1 63 63 THR N N 63 113.573 113.573 116.973 -3.400 18093 13972 1 20 . 1 1 63 63 THR HA H 63 4.319 4.319 4.566 -0.247 18093 13973 1 20 . 1 1 63 63 THR C C 63 174.834 174.834 175.049 -0.215 18093 13974 1 20 . 1 1 63 63 THR CA C 63 62.377 62.377 62.192 0.185 18093 13975 1 20 . 1 1 63 63 THR CB C 63 69.422 69.422 68.919 0.503 18093 13976 1 20 . 1 1 63 63 THR H H 63 7.963 7.963 8.416 -0.453 18093 13977 1 20 . 1 1 64 64 SER N N 64 116.598 116.598 116.033 0.565 18093 13978 1 20 . 1 1 64 64 SER HA H 64 4.428 4.428 4.583 -0.155 18093 13979 1 20 . 1 1 64 64 SER C C 64 174.618 174.618 174.111 0.507 18093 13980 1 20 . 1 1 64 64 SER CA C 64 59.045 59.045 57.976 1.069 18093 13981 1 20 . 1 1 64 64 SER CB C 64 63.700 63.700 63.966 -0.266 18093 13982 1 20 . 1 1 64 64 SER H H 64 8.052 8.052 7.745 0.307 18093 13983 1 20 . 1 1 65 65 SER N N 65 116.673 116.673 115.747 0.926 18093 13984 1 20 . 1 1 65 65 SER HA H 65 4.432 4.432 4.324 0.108 18093 13985 1 20 . 1 1 65 65 SER C C 65 174.335 174.335 174.916 -0.581 18093 13986 1 20 . 1 1 65 65 SER CA C 65 58.927 58.927 59.020 -0.093 18093 13987 1 20 . 1 1 65 65 SER CB C 65 63.621 63.621 62.825 0.795 18093 13988 1 20 . 1 1 65 65 SER H H 65 8.114 8.114 8.094 0.020 18093 13989 1 20 . 1 1 66 66 VAL N N 66 119.054 119.054 114.660 4.394 18093 13990 1 20 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.318 -0.148 18093 13991 1 20 . 1 1 66 66 VAL C C 66 175.278 175.278 175.954 -0.676 18093 13992 1 20 . 1 1 66 66 VAL CA C 66 62.062 62.062 63.370 -1.308 18093 13993 1 20 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.312 0.317 18093 13994 1 20 . 1 1 66 66 VAL H H 66 7.740 7.740 7.920 -0.180 18093 13995 1 20 . 1 1 67 67 SER N N 67 118.882 118.882 116.254 2.628 18093 13996 1 20 . 1 1 67 67 SER HA H 67 4.704 4.704 4.766 -0.062 18093 13997 1 20 . 1 1 67 67 SER CA C 67 56.715 56.715 57.295 -0.580 18093 13998 1 20 . 1 1 67 67 SER CB C 67 63.624 63.624 63.742 -0.118 18093 13999 1 20 . 1 1 67 67 SER H H 67 8.060 8.060 7.825 0.235 18093 14000 1 20 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.650 -0.250 18093 14001 1 20 . 1 1 68 68 PRO C C 68 176.925 176.925 176.728 0.197 18093 14002 1 20 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.535 1.214 18093 14003 1 20 . 1 1 68 68 PRO CB C 68 32.005 32.005 32.364 -0.359 18093 14004 1 20 . 1 1 69 69 SER N N 69 114.930 114.930 118.293 -3.363 18093 14005 1 20 . 1 1 69 69 SER HA H 69 4.422 4.422 4.398 0.024 18093 14006 1 20 . 1 1 69 69 SER C C 69 175.617 175.617 176.312 -0.695 18093 14007 1 20 . 1 1 69 69 SER CA C 69 58.697 58.697 59.782 -1.085 18093 14008 1 20 . 1 1 69 69 SER CB C 69 63.804 63.804 63.596 0.208 18093 14009 1 20 . 1 1 69 69 SER H H 69 8.205 8.205 8.771 -0.566 18093 14010 1 20 . 1 1 70 70 ILE N N 70 120.840 120.840 123.139 -2.299 18093 14011 1 20 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.139 -0.147 18093 14012 1 20 . 1 1 70 70 ILE C C 70 177.524 177.524 176.724 0.800 18093 14013 1 20 . 1 1 70 70 ILE CA C 70 64.335 64.335 62.305 2.030 18093 14014 1 20 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.089 -0.629 18093 14015 1 20 . 1 1 70 70 ILE H H 70 8.283 8.283 8.379 -0.096 18093 14016 1 20 . 1 1 71 71 GLY N N 71 107.823 107.823 107.981 -0.158 18093 14017 1 20 . 1 1 71 71 GLY C C 71 175.296 175.296 175.968 -0.672 18093 14018 1 20 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.215 0.240 18093 14019 1 20 . 1 1 71 71 GLY H H 71 8.557 8.557 8.896 -0.339 18093 14020 1 20 . 1 1 72 72 GLU N N 72 120.835 120.835 120.953 -0.118 18093 14021 1 20 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.290 -0.443 18093 14022 1 20 . 1 1 72 72 GLU C C 72 178.198 178.198 178.260 -0.062 18093 14023 1 20 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.385 1.732 18093 14024 1 20 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.744 -0.351 18093 14025 1 20 . 1 1 72 72 GLU H H 72 7.922 7.922 7.777 0.145 18093 14026 1 20 . 1 1 73 73 TYR N N 73 117.375 117.375 122.417 -5.042 18093 14027 1 20 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.240 -0.078 18093 14028 1 20 . 1 1 73 73 TYR C C 73 179.912 179.912 177.346 2.566 18093 14029 1 20 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.293 0.862 18093 14030 1 20 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.610 0.156 18093 14031 1 20 . 1 1 73 73 TYR H H 73 8.062 8.062 7.906 0.156 18093 14032 1 20 . 1 1 74 74 LEU N N 74 121.493 121.493 118.954 2.539 18093 14033 1 20 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.729 0.320 18093 14034 1 20 . 1 1 74 74 LEU C C 74 178.063 178.063 178.959 -0.896 18093 14035 1 20 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.656 0.839 18093 14036 1 20 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.880 -0.034 18093 14037 1 20 . 1 1 74 74 LEU H H 74 8.552 8.552 8.670 -0.118 18093 14038 1 20 . 1 1 75 75 LEU N N 75 120.375 120.375 120.929 -0.554 18093 14039 1 20 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.106 -0.066 18093 14040 1 20 . 1 1 75 75 LEU C C 75 178.515 178.515 177.929 0.586 18093 14041 1 20 . 1 1 75 75 LEU CA C 75 58.638 58.638 57.881 0.757 18093 14042 1 20 . 1 1 75 75 LEU CB C 75 42.039 42.039 41.753 0.286 18093 14043 1 20 . 1 1 75 75 LEU H H 75 8.276 8.276 7.472 0.804 18093 14044 1 20 . 1 1 76 76 PHE N N 76 116.626 116.626 117.991 -1.365 18093 14045 1 20 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.066 0.013 18093 14046 1 20 . 1 1 76 76 PHE C C 76 177.399 177.399 178.086 -0.687 18093 14047 1 20 . 1 1 76 76 PHE CA C 76 61.734 61.734 62.299 -0.565 18093 14048 1 20 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.375 0.366 18093 14049 1 20 . 1 1 76 76 PHE H H 76 8.454 8.454 8.386 0.068 18093 14050 1 20 . 1 1 77 77 THR N N 77 116.080 116.080 115.690 0.390 18093 14051 1 20 . 1 1 77 77 THR HA H 77 3.687 3.687 3.843 -0.156 18093 14052 1 20 . 1 1 77 77 THR C C 77 176.018 176.018 176.605 -0.587 18093 14053 1 20 . 1 1 77 77 THR CA C 77 68.640 68.640 67.042 1.598 18093 14054 1 20 . 1 1 77 77 THR H H 77 8.224 8.224 8.409 -0.185 18093 14055 1 20 . 1 1 78 78 MET N N 78 119.394 119.394 120.704 -1.310 18093 14056 1 20 . 1 1 78 78 MET HA H 78 4.129 4.129 4.002 0.127 18093 14057 1 20 . 1 1 78 78 MET C C 78 179.608 179.608 178.590 1.018 18093 14058 1 20 . 1 1 78 78 MET CA C 78 58.831 58.831 59.727 -0.896 18093 14059 1 20 . 1 1 78 78 MET CB C 78 31.590 31.590 32.434 -0.844 18093 14060 1 20 . 1 1 78 78 MET H H 78 8.372 8.372 7.462 0.910 18093 14061 1 20 . 1 1 79 79 ILE N N 79 121.819 121.819 118.877 2.942 18093 14062 1 20 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.740 -0.190 18093 14063 1 20 . 1 1 79 79 ILE C C 79 176.426 176.426 177.969 -1.543 18093 14064 1 20 . 1 1 79 79 ILE CA C 79 65.876 65.876 63.361 2.515 18093 14065 1 20 . 1 1 79 79 ILE CB C 79 37.673 37.673 36.588 1.085 18093 14066 1 20 . 1 1 79 79 ILE H H 79 8.391 8.391 8.017 0.374 18093 14067 1 20 . 1 1 80 80 PHE N N 80 119.916 119.916 121.541 -1.625 18093 14068 1 20 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.066 -0.012 18093 14069 1 20 . 1 1 80 80 PHE C C 80 178.568 178.568 177.507 1.061 18093 14070 1 20 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.785 -0.478 18093 14071 1 20 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.325 -0.552 18093 14072 1 20 . 1 1 80 80 PHE H H 80 8.479 8.479 8.213 0.266 18093 14073 1 20 . 1 1 81 81 VAL N N 81 120.191 120.191 115.339 4.852 18093 14074 1 20 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.604 -0.151 18093 14075 1 20 . 1 1 81 81 VAL C C 81 178.225 178.225 177.562 0.663 18093 14076 1 20 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.641 0.766 18093 14077 1 20 . 1 1 81 81 VAL CB C 81 31.556 31.556 31.289 0.267 18093 14078 1 20 . 1 1 81 81 VAL H H 81 8.928 8.928 8.664 0.264 18093 14079 1 20 . 1 1 82 82 THR N N 82 115.930 115.930 116.708 -0.778 18093 14080 1 20 . 1 1 82 82 THR HA H 82 3.636 3.636 3.916 -0.280 18093 14081 1 20 . 1 1 82 82 THR C C 82 176.420 176.420 176.185 0.235 18093 14082 1 20 . 1 1 82 82 THR CA C 82 68.570 68.570 67.183 1.387 18093 14083 1 20 . 1 1 82 82 THR CB C 82 68.202 68.202 68.785 -0.583 18093 14084 1 20 . 1 1 82 82 THR H H 82 7.969 7.969 7.278 0.691 18093 14085 1 20 . 1 1 83 83 LEU N N 83 119.780 119.780 120.618 -0.838 18093 14086 1 20 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.940 -0.093 18093 14087 1 20 . 1 1 83 83 LEU C C 83 178.214 178.214 178.158 0.056 18093 14088 1 20 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.087 1.150 18093 14089 1 20 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.431 0.360 18093 14090 1 20 . 1 1 83 83 LEU H H 83 8.483 8.483 7.526 0.957 18093 14091 1 20 . 1 1 84 84 SER N N 84 114.559 114.559 116.077 -1.518 18093 14092 1 20 . 1 1 84 84 SER HA H 84 4.099 4.099 4.105 -0.006 18093 14093 1 20 . 1 1 84 84 SER C C 84 176.799 176.799 176.567 0.232 18093 14094 1 20 . 1 1 84 84 SER CA C 84 63.609 63.609 61.900 1.709 18093 14095 1 20 . 1 1 84 84 SER CB C 84 63.110 63.110 63.043 0.067 18093 14096 1 20 . 1 1 84 84 SER H H 84 8.023 8.023 7.662 0.361 18093 14097 1 20 . 1 1 85 85 ILE N N 85 123.962 123.962 121.920 2.042 18093 14098 1 20 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.853 -0.249 18093 14099 1 20 . 1 1 85 85 ILE C C 85 177.487 177.487 177.962 -0.475 18093 14100 1 20 . 1 1 85 85 ILE CA C 85 65.759 65.759 64.885 0.874 18093 14101 1 20 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.916 -0.028 18093 14102 1 20 . 1 1 85 85 ILE H H 85 8.054 8.054 7.669 0.385 18093 14103 1 20 . 1 1 86 86 VAL N N 86 118.744 118.744 120.570 -1.826 18093 14104 1 20 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.743 -0.224 18093 14105 1 20 . 1 1 86 86 VAL C C 86 177.557 177.557 177.527 0.030 18093 14106 1 20 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.446 1.089 18093 14107 1 20 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.835 -0.369 18093 14108 1 20 . 1 1 86 86 VAL H H 86 8.158 8.158 7.304 0.854 18093 14109 1 20 . 1 1 87 87 ILE N N 87 117.206 117.206 119.370 -2.164 18093 14110 1 20 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.775 -0.171 18093 14111 1 20 . 1 1 87 87 ILE C C 87 177.283 177.283 178.368 -1.085 18093 14112 1 20 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.479 2.197 18093 14113 1 20 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.510 1.079 18093 14114 1 20 . 1 1 87 87 ILE H H 87 8.459 8.459 8.234 0.225 18093 14115 1 20 . 1 1 88 88 THR N N 88 116.158 116.158 117.202 -1.044 18093 14116 1 20 . 1 1 88 88 THR HA H 88 3.672 3.672 4.278 -0.606 18093 14117 1 20 . 1 1 88 88 THR C C 88 175.485 175.485 176.637 -1.152 18093 14118 1 20 . 1 1 88 88 THR CA C 88 68.549 68.549 67.244 1.305 18093 14119 1 20 . 1 1 88 88 THR CB C 88 68.127 68.127 68.713 -0.586 18093 14120 1 20 . 1 1 88 88 THR H H 88 7.776 7.776 8.304 -0.528 18093 14121 1 20 . 1 1 89 89 VAL N N 89 117.985 117.985 121.036 -3.051 18093 14122 1 20 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.828 -0.285 18093 14123 1 20 . 1 1 89 89 VAL C C 89 177.393 177.393 176.734 0.659 18093 14124 1 20 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.433 1.157 18093 14125 1 20 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.837 -0.059 18093 14126 1 20 . 1 1 89 89 VAL H H 89 8.206 8.206 7.652 0.554 18093 14127 1 20 . 1 1 90 90 PHE N N 90 116.709 116.709 120.008 -3.299 18093 14128 1 20 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.286 0.092 18093 14129 1 20 . 1 1 90 90 PHE C C 90 177.305 177.305 177.564 -0.259 18093 14130 1 20 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.128 -0.009 18093 14131 1 20 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.444 0.941 18093 14132 1 20 . 1 1 90 90 PHE H H 90 7.956 7.956 7.752 0.204 18093 14133 1 20 . 1 1 91 91 VAL N N 91 116.565 116.565 119.772 -3.207 18093 14134 1 20 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.740 0.095 18093 14135 1 20 . 1 1 91 91 VAL C C 91 176.927 176.927 176.857 0.070 18093 14136 1 20 . 1 1 91 91 VAL CA C 91 65.347 65.347 66.136 -0.789 18093 14137 1 20 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.667 0.200 18093 14138 1 20 . 1 1 91 91 VAL H H 91 8.239 8.239 7.729 0.510 18093 14139 1 20 . 1 1 92 92 LEU N N 92 117.443 117.443 116.504 0.939 18093 14140 1 20 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.197 -0.003 18093 14141 1 20 . 1 1 92 92 LEU C C 92 177.180 177.180 177.792 -0.612 18093 14142 1 20 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.362 -0.178 18093 14143 1 20 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.365 -0.421 18093 14144 1 20 . 1 1 92 92 LEU H H 92 7.967 7.967 7.596 0.371 18093 14145 1 20 . 1 1 93 93 ASN N N 93 116.705 116.705 116.918 -0.213 18093 14146 1 20 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.431 0.216 18093 14147 1 20 . 1 1 93 93 ASN C C 93 175.129 175.129 176.298 -1.169 18093 14148 1 20 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.249 -1.395 18093 14149 1 20 . 1 1 93 93 ASN CB C 93 39.395 39.395 38.445 0.950 18093 14150 1 20 . 1 1 93 93 ASN H H 93 7.683 7.683 7.657 0.026 18093 14151 1 20 . 1 1 94 94 VAL N N 94 118.224 118.224 120.465 -2.241 18093 14152 1 20 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.631 0.330 18093 14153 1 20 . 1 1 94 94 VAL C C 94 175.600 175.600 175.654 -0.054 18093 14154 1 20 . 1 1 94 94 VAL CA C 94 62.825 62.825 63.073 -0.248 18093 14155 1 20 . 1 1 94 94 VAL CB C 94 32.214 32.214 32.651 -0.437 18093 14156 1 20 . 1 1 94 94 VAL H H 94 7.627 7.627 7.641 -0.014 18093 14157 1 20 . 1 1 95 95 HIS N N 95 120.999 120.999 123.076 -2.077 18093 14158 1 20 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.627 -0.034 18093 14159 1 20 . 1 1 95 95 HIS C C 95 174.146 174.146 175.177 -1.031 18093 14160 1 20 . 1 1 95 95 HIS CA C 95 55.666 55.666 57.104 -1.438 18093 14161 1 20 . 1 1 95 95 HIS CB C 95 29.736 29.736 30.157 -0.420 18093 14162 1 20 . 1 1 95 95 HIS H H 95 8.263 8.263 8.152 0.111 18093 14163 1 20 . 1 1 96 96 HIS N N 96 122.740 122.740 124.915 -2.175 18093 14164 1 20 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.494 0.139 18093 14165 1 20 . 1 1 96 96 HIS CA C 96 55.895 55.895 56.470 -0.575 18093 14166 1 20 . 1 1 96 96 HIS CB C 96 29.750 29.750 31.033 -1.283 18093 14167 1 20 . 1 1 96 96 HIS H H 96 8.298 8.298 8.570 -0.272 18093 14168 1 20 . 1 1 97 97 ARG N N 97 118.503 118.503 120.229 -1.726 18093 14169 1 20 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.144 0.168 18093 14170 1 20 . 1 1 97 97 ARG C C 97 175.776 175.776 174.734 1.042 18093 14171 1 20 . 1 1 97 97 ARG CA C 97 56.225 56.225 56.121 0.104 18093 14172 1 20 . 1 1 97 97 ARG CB C 97 30.912 30.912 28.292 2.620 18093 14173 1 20 . 1 1 97 97 ARG H H 97 8.250 8.250 8.439 -0.189 18093 14174 1 20 . 1 1 98 98 SER N N 98 118.482 118.482 117.397 1.085 18093 14175 1 20 . 1 1 98 98 SER HA H 98 4.722 4.722 4.752 -0.030 18093 14176 1 20 . 1 1 98 98 SER CA C 98 56.547 56.547 56.903 -0.355 18093 14177 1 20 . 1 1 98 98 SER CB C 98 63.624 63.624 64.060 -0.436 18093 14178 1 20 . 1 1 98 98 SER H H 98 8.254 8.254 8.309 -0.055 18093 14179 1 20 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.427 -0.024 18093 14180 1 20 . 1 1 99 99 PRO C C 99 176.899 176.899 176.893 0.006 18093 14181 1 20 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.461 -0.760 18093 14182 1 20 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.125 -0.176 18093 14183 1 20 . 1 1 100 100 GLU N N 100 120.187 120.187 115.391 4.796 18093 14184 1 20 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.329 -0.041 18093 14185 1 20 . 1 1 100 100 GLU C C 100 176.593 176.593 175.375 1.218 18093 14186 1 20 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.685 0.037 18093 14187 1 20 . 1 1 100 100 GLU CB C 100 29.999 29.999 30.177 -0.178 18093 14188 1 20 . 1 1 100 100 GLU H H 100 8.401 8.401 8.308 0.093 18093 14189 1 20 . 1 1 101 101 THR N N 101 113.968 113.968 112.879 1.089 18093 14190 1 20 . 1 1 101 101 THR HA H 101 4.286 4.286 4.288 -0.002 18093 14191 1 20 . 1 1 101 101 THR C C 101 174.525 174.525 173.110 1.415 18093 14192 1 20 . 1 1 101 101 THR CA C 101 61.956 61.956 60.768 1.188 18093 14193 1 20 . 1 1 101 101 THR CB C 101 69.697 69.697 70.356 -0.659 18093 14194 1 20 . 1 1 101 101 THR H H 101 7.945 7.945 7.707 0.238 18093 14195 1 20 . 1 1 102 102 HIS N N 102 120.322 120.322 118.486 1.836 18093 14196 1 20 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.866 -0.125 18093 14197 1 20 . 1 1 102 102 HIS C C 102 174.783 174.783 174.561 0.222 18093 14198 1 20 . 1 1 102 102 HIS CA C 102 55.701 55.701 55.526 0.175 18093 14199 1 20 . 1 1 102 102 HIS CB C 102 29.093 29.093 29.597 -0.504 18093 14200 1 20 . 1 1 102 102 HIS H H 102 8.455 8.455 8.338 0.117 18093 14201 1 20 . 1 1 103 103 THR N N 103 114.282 114.282 116.504 -2.222 18093 14202 1 20 . 1 1 103 103 THR HA H 103 4.352 4.352 4.288 0.064 18093 14203 1 20 . 1 1 103 103 THR C C 103 175.104 175.104 174.681 0.423 18093 14204 1 20 . 1 1 103 103 THR CA C 103 62.057 62.057 62.219 -0.162 18093 14205 1 20 . 1 1 103 103 THR CB C 103 69.966 69.966 69.704 0.262 18093 14206 1 20 . 1 1 103 103 THR H H 103 8.069 8.069 8.540 -0.471 18093 14207 1 20 . 1 1 104 104 GLY N N 104 111.159 111.159 111.202 -0.043 18093 14208 1 20 . 1 1 104 104 GLY C C 104 174.776 174.776 174.834 -0.058 18093 14209 1 20 . 1 1 104 104 GLY CA C 104 45.588 45.588 44.649 0.939 18093 14210 1 20 . 1 1 104 104 GLY H H 104 8.393 8.393 8.395 -0.002 18093 14211 1 20 . 1 1 105 105 GLY N N 105 108.657 108.657 107.956 0.701 18093 14212 1 20 . 1 1 105 105 GLY C C 105 174.957 174.957 174.820 0.137 18093 14213 1 20 . 1 1 105 105 GLY CA C 105 45.612 45.612 45.138 0.474 18093 14214 1 20 . 1 1 105 105 GLY H H 105 8.275 8.275 8.091 0.184 18093 14215 1 20 . 1 1 106 106 GLY N N 106 108.870 108.870 112.964 -4.094 18093 14216 1 20 . 1 1 106 106 GLY C C 106 174.877 174.877 173.342 1.535 18093 14217 1 20 . 1 1 106 106 GLY CA C 106 45.665 45.665 44.703 0.962 18093 14218 1 20 . 1 1 106 106 GLY H H 106 8.357 8.357 8.038 0.319 18093 14219 1 20 . 1 1 107 107 GLY N N 107 108.476 108.476 108.378 0.098 18093 14220 1 20 . 1 1 107 107 GLY C C 107 174.877 174.877 174.957 -0.080 18093 14221 1 20 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.200 0.496 18093 14222 1 20 . 1 1 107 107 GLY H H 107 8.330 8.330 8.175 0.155 18093 14223 1 20 . 1 1 108 108 GLY N N 108 108.486 108.486 112.389 -3.903 18093 14224 1 20 . 1 1 108 108 GLY C C 108 175.345 175.345 175.362 -0.017 18093 14225 1 20 . 1 1 108 108 GLY CA C 108 45.763 45.763 45.281 0.482 18093 14226 1 20 . 1 1 108 108 GLY H H 108 8.328 8.328 8.380 -0.052 18093 14227 1 20 . 1 1 109 109 ILE N N 109 120.433 120.433 119.529 0.904 18093 14228 1 20 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.968 0.000 18093 14229 1 20 . 1 1 109 109 ILE C C 109 176.127 176.127 176.727 -0.600 18093 14230 1 20 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.333 -0.598 18093 14231 1 20 . 1 1 109 109 ILE CB C 109 38.125 38.125 37.975 0.150 18093 14232 1 20 . 1 1 109 109 ILE H H 109 8.192 8.192 8.145 0.047 18093 14233 1 20 . 1 1 110 110 ASP N N 110 121.148 121.148 120.928 0.220 18093 14234 1 20 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.723 -0.417 18093 14235 1 20 . 1 1 110 110 ASP C C 110 177.651 177.651 178.319 -0.668 18093 14236 1 20 . 1 1 110 110 ASP CA C 110 56.776 56.776 57.948 -1.172 18093 14237 1 20 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.383 0.715 18093 14238 1 20 . 1 1 110 110 ASP H H 110 8.427 8.427 8.617 -0.190 18093 14239 1 20 . 1 1 111 111 ARG N N 111 119.228 119.228 119.691 -0.463 18093 14240 1 20 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.303 -0.307 18093 14241 1 20 . 1 1 111 111 ARG C C 111 177.786 177.786 179.002 -1.216 18093 14242 1 20 . 1 1 111 111 ARG CA C 111 58.942 58.942 58.945 -0.003 18093 14243 1 20 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.943 0.253 18093 14244 1 20 . 1 1 111 111 ARG H H 111 7.850 7.850 8.505 -0.655 18093 14245 1 20 . 1 1 112 112 ILE N N 112 118.000 118.000 119.559 -1.559 18093 14246 1 20 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.126 -0.313 18093 14247 1 20 . 1 1 112 112 ILE C C 112 177.496 177.496 177.885 -0.389 18093 14248 1 20 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.201 2.611 18093 14249 1 20 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.901 0.827 18093 14250 1 20 . 1 1 112 112 ILE H H 112 7.764 7.764 7.745 0.019 18093 14251 1 20 . 1 1 113 113 PHE N N 113 118.367 118.367 122.067 -3.700 18093 14252 1 20 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.269 -0.014 18093 14253 1 20 . 1 1 113 113 PHE C C 113 177.218 177.218 177.340 -0.122 18093 14254 1 20 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.321 -0.888 18093 14255 1 20 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.194 -0.387 18093 14256 1 20 . 1 1 113 113 PHE H H 113 7.963 7.963 7.865 0.098 18093 14257 1 20 . 1 1 114 114 LEU N N 114 118.921 118.921 117.902 1.019 18093 14258 1 20 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.944 0.053 18093 14259 1 20 . 1 1 114 114 LEU C C 114 178.297 178.297 178.382 -0.085 18093 14260 1 20 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.319 0.292 18093 14261 1 20 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.280 0.672 18093 14262 1 20 . 1 1 114 114 LEU H H 114 7.939 7.939 8.015 -0.076 18093 14263 1 20 . 1 1 115 115 TRP N N 115 117.464 117.464 119.501 -2.037 18093 14264 1 20 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.387 -0.013 18093 14265 1 20 . 1 1 115 115 TRP C C 115 178.572 178.572 178.262 0.310 18093 14266 1 20 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.804 1.118 18093 14267 1 20 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.783 -1.276 18093 14268 1 20 . 1 1 115 115 TRP H H 115 7.969 7.969 7.631 0.338 18093 14269 1 20 . 1 1 116 116 MET N N 116 117.069 117.069 118.906 -1.837 18093 14270 1 20 . 1 1 116 116 MET HA H 116 4.065 4.065 4.225 -0.160 18093 14271 1 20 . 1 1 116 116 MET C C 116 177.425 177.425 178.188 -0.763 18093 14272 1 20 . 1 1 116 116 MET CA C 116 59.289 59.289 59.100 0.189 18093 14273 1 20 . 1 1 116 116 MET CB C 116 31.692 31.692 32.522 -0.830 18093 14274 1 20 . 1 1 116 116 MET H H 116 8.465 8.465 7.717 0.748 18093 14275 1 20 . 1 1 117 117 PHE N N 117 118.755 118.755 118.227 0.528 18093 14276 1 20 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.075 0.024 18093 14277 1 20 . 1 1 117 117 PHE C C 117 177.965 177.965 178.170 -0.205 18093 14278 1 20 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.246 -0.538 18093 14279 1 20 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.300 0.885 18093 14280 1 20 . 1 1 117 117 PHE H H 117 8.418 8.418 7.844 0.574 18093 14281 1 20 . 1 1 118 118 ILE N N 118 119.133 119.133 115.241 3.892 18093 14282 1 20 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.907 -0.563 18093 14283 1 20 . 1 1 118 118 ILE C C 118 177.244 177.244 177.454 -0.210 18093 14284 1 20 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.054 1.771 18093 14285 1 20 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.839 -0.291 18093 14286 1 20 . 1 1 118 118 ILE H H 118 8.266 8.266 7.664 0.602 18093 14287 1 20 . 1 1 119 119 ILE N N 119 118.846 118.846 121.483 -2.637 18093 14288 1 20 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.887 -0.315 18093 14289 1 20 . 1 1 119 119 ILE C C 119 177.523 177.523 177.566 -0.043 18093 14290 1 20 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.173 0.716 18093 14291 1 20 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.277 -0.713 18093 14292 1 20 . 1 1 119 119 ILE H H 119 8.308 8.308 7.297 1.011 18093 14293 1 20 . 1 1 120 120 VAL N N 120 119.228 119.228 116.978 2.250 18093 14294 1 20 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.733 -0.225 18093 14295 1 20 . 1 1 120 120 VAL C C 120 177.651 177.651 177.555 0.096 18093 14296 1 20 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.750 1.851 18093 14297 1 20 . 1 1 120 120 VAL CB C 120 31.406 31.406 31.301 0.105 18093 14298 1 20 . 1 1 120 120 VAL H H 120 8.399 8.399 7.928 0.471 18093 14299 1 20 . 1 1 121 121 CYS N N 121 117.151 117.151 119.392 -2.241 18093 14300 1 20 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.068 -0.165 18093 14301 1 20 . 1 1 121 121 CYS C C 121 177.719 177.719 177.124 0.595 18093 14302 1 20 . 1 1 121 121 CYS CA C 121 64.298 64.298 63.954 0.344 18093 14303 1 20 . 1 1 121 121 CYS CB C 121 26.677 26.677 27.168 -0.491 18093 14304 1 20 . 1 1 121 121 CYS H H 121 8.008 8.008 7.513 0.495 18093 14305 1 20 . 1 1 122 122 LEU N N 122 121.402 121.402 120.548 0.854 18093 14306 1 20 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.177 -0.194 18093 14307 1 20 . 1 1 122 122 LEU C C 122 178.282 178.282 178.823 -0.541 18093 14308 1 20 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.873 0.672 18093 14309 1 20 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.408 0.558 18093 14310 1 20 . 1 1 122 122 LEU H H 122 8.417 8.417 7.600 0.817 18093 14311 1 20 . 1 1 123 123 LEU N N 123 118.543 118.543 119.925 -1.382 18093 14312 1 20 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.002 -0.082 18093 14313 1 20 . 1 1 123 123 LEU C C 123 179.028 179.028 178.767 0.261 18093 14314 1 20 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.498 -0.381 18093 14315 1 20 . 1 1 123 123 LEU CB C 123 42.056 42.056 40.967 1.089 18093 14316 1 20 . 1 1 123 123 LEU H H 123 8.590 8.590 7.723 0.867 18093 14317 1 20 . 1 1 124 124 GLY N N 124 104.896 104.896 105.171 -0.275 18093 14318 1 20 . 1 1 124 124 GLY C C 124 173.932 173.932 176.054 -2.122 18093 14319 1 20 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.408 -0.181 18093 14320 1 20 . 1 1 124 124 GLY H H 124 8.601 8.601 8.305 0.296 18093 14321 1 20 . 1 1 125 125 THR N N 125 115.403 115.403 119.446 -4.043 18093 14322 1 20 . 1 1 125 125 THR HA H 125 3.686 3.686 3.794 -0.108 18093 14323 1 20 . 1 1 125 125 THR C C 125 176.407 176.407 176.791 -0.384 18093 14324 1 20 . 1 1 125 125 THR CA C 125 67.565 67.565 66.878 0.687 18093 14325 1 20 . 1 1 125 125 THR CB C 125 68.143 68.143 68.669 -0.526 18093 14326 1 20 . 1 1 125 125 THR H H 125 7.734 7.734 7.392 0.342 18093 14327 1 20 . 1 1 126 126 VAL N N 126 119.056 119.056 120.993 -1.937 18093 14328 1 20 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.798 -0.259 18093 14329 1 20 . 1 1 126 126 VAL C C 126 177.628 177.628 178.306 -0.678 18093 14330 1 20 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.462 0.139 18093 14331 1 20 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.265 0.229 18093 14332 1 20 . 1 1 126 126 VAL H H 126 8.015 8.015 7.982 0.033 18093 14333 1 20 . 1 1 127 127 GLY N N 127 104.644 104.644 107.631 -2.987 18093 14334 1 20 . 1 1 127 127 GLY C C 127 173.933 173.933 175.636 -1.703 18093 14335 1 20 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.166 0.115 18093 14336 1 20 . 1 1 127 127 GLY H H 127 8.248 8.248 8.451 -0.203 18093 14337 1 20 . 1 1 128 128 LEU N N 128 117.354 117.354 120.544 -3.190 18093 14338 1 20 . 1 1 128 128 LEU HA H 128 4.012 4.012 3.969 0.043 18093 14339 1 20 . 1 1 128 128 LEU C C 128 177.443 177.443 177.393 0.050 18093 14340 1 20 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.999 -0.373 18093 14341 1 20 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.389 0.871 18093 14342 1 20 . 1 1 128 128 LEU H H 128 7.568 7.568 7.922 -0.354 18093 14343 1 20 . 1 1 129 129 PHE N N 129 113.971 113.971 115.835 -1.864 18093 14344 1 20 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.357 0.101 18093 14345 1 20 . 1 1 129 129 PHE C C 129 176.216 176.216 176.417 -0.201 18093 14346 1 20 . 1 1 129 129 PHE CA C 129 58.385 58.385 60.193 -1.808 18093 14347 1 20 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.936 -0.217 18093 14348 1 20 . 1 1 129 129 PHE H H 129 7.639 7.639 7.237 0.402 18093 14349 1 20 . 1 1 130 130 LEU N N 130 117.752 117.752 118.896 -1.144 18093 14350 1 20 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.849 -0.416 18093 14351 1 20 . 1 1 130 130 LEU CA C 130 54.156 54.156 52.398 1.758 18093 14352 1 20 . 1 1 130 130 LEU H H 130 8.099 8.099 7.775 0.324 18093 14353 1 20 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.742 -0.292 18093 14354 1 20 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.577 2.322 18093 14355 1 20 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.380 -0.118 18093 14356 1 20 . 1 1 132 132 PRO C C 132 177.616 177.616 176.565 1.051 18093 14357 1 20 . 1 1 132 132 PRO CA C 132 64.980 64.980 63.695 1.285 18093 14358 1 20 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.120 -0.495 18093 14359 1 20 . 1 1 133 133 TRP N N 133 115.508 115.508 120.569 -5.061 18093 14360 1 20 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.398 0.194 18093 14361 1 20 . 1 1 133 133 TRP C C 133 176.842 176.842 175.865 0.977 18093 14362 1 20 . 1 1 133 133 TRP CA C 133 57.283 57.283 57.639 -0.355 18093 14363 1 20 . 1 1 133 133 TRP CB C 133 28.596 28.596 28.234 0.362 18093 14364 1 20 . 1 1 133 133 TRP H H 133 7.311 7.311 8.252 -0.941 18093 14365 1 20 . 1 1 134 134 LEU N N 134 119.570 119.570 118.851 0.719 18093 14366 1 20 . 1 1 134 134 LEU HA H 134 4.177 4.177 3.943 0.234 18093 14367 1 20 . 1 1 134 134 LEU C C 134 175.768 175.768 176.613 -0.845 18093 14368 1 20 . 1 1 134 134 LEU CA C 134 55.621 55.621 55.175 0.446 18093 14369 1 20 . 1 1 134 134 LEU CB C 134 42.648 42.648 40.539 2.109 18093 14370 1 20 . 1 1 134 134 LEU H H 134 7.453 7.453 8.288 -0.835 18093 14371 1 20 . 1 1 135 135 ALA N N 135 119.004 119.004 122.239 -3.235 18093 14372 1 20 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.181 0.042 18093 14373 1 20 . 1 1 135 135 ALA C C 135 177.170 177.170 179.123 -1.953 18093 14374 1 20 . 1 1 135 135 ALA CA C 135 52.456 52.456 54.112 -1.656 18093 14375 1 20 . 1 1 135 135 ALA CB C 135 19.736 19.736 18.888 0.848 18093 14376 1 20 . 1 1 135 135 ALA H H 135 7.541 7.541 8.196 -0.655 18093 14377 1 20 . 1 1 136 136 GLY N N 136 105.879 105.879 107.799 -1.920 18093 14378 1 20 . 1 1 136 136 GLY C C 136 173.042 173.042 175.348 -2.306 18093 14379 1 20 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.947 -0.254 18093 14380 1 20 . 1 1 136 136 GLY H H 136 7.846 7.846 8.753 -0.907 18093 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 121 2.341 0.592 2.275 18093 2 1 1 "Average Difference" HA 130 0.224 0.094 0.205 18093 3 1 1 "Average Difference" C 120 0.818 0.249 0.782 18093 4 1 1 "Average Difference" CA 129 1.203 -0.505 1.096 18093 5 1 1 "Average Difference" CB 110 0.722 -0.050 0.723 18093 6 1 1 "Average Difference" HN 121 0.503 -0.159 0.480 18093 7 1 2 "Average Difference" N 121 2.420 0.650 2.341 18093 8 1 2 "Average Difference" HA 130 0.207 0.090 0.187 18093 9 1 2 "Average Difference" C 120 0.873 0.216 0.850 18093 10 1 2 "Average Difference" CA 129 1.165 -0.530 1.042 18093 11 1 2 "Average Difference" CB 110 0.676 -0.074 0.675 18093 12 1 2 "Average Difference" HN 121 0.483 -0.199 0.442 18093 13 1 3 "Average Difference" N 121 2.528 0.669 2.448 18093 14 1 3 "Average Difference" HA 130 0.213 0.088 0.195 18093 15 1 3 "Average Difference" C 120 0.841 0.197 0.821 18093 16 1 3 "Average Difference" CA 129 1.162 -0.497 1.055 18093 17 1 3 "Average Difference" CB 110 0.738 -0.076 0.737 18093 18 1 3 "Average Difference" HN 121 0.472 -0.157 0.447 18093 19 1 4 "Average Difference" N 121 2.404 0.782 2.283 18093 20 1 4 "Average Difference" HA 130 0.222 0.095 0.201 18093 21 1 4 "Average Difference" C 120 0.850 0.254 0.814 18093 22 1 4 "Average Difference" CA 129 1.185 -0.456 1.098 18093 23 1 4 "Average Difference" CB 110 0.743 -0.007 0.747 18093 24 1 4 "Average Difference" HN 121 0.459 -0.173 0.427 18093 25 1 5 "Average Difference" N 121 2.540 0.591 2.481 18093 26 1 5 "Average Difference" HA 130 0.208 0.087 0.190 18093 27 1 5 "Average Difference" C 120 0.932 0.206 0.913 18093 28 1 5 "Average Difference" CA 129 1.178 -0.549 1.047 18093 29 1 5 "Average Difference" CB 110 0.736 -0.075 0.735 18093 30 1 5 "Average Difference" HN 121 0.474 -0.187 0.438 18093 31 1 6 "Average Difference" N 121 2.561 0.690 2.477 18093 32 1 6 "Average Difference" HA 130 0.224 0.092 0.205 18093 33 1 6 "Average Difference" C 120 0.872 0.184 0.856 18093 34 1 6 "Average Difference" CA 129 1.222 -0.499 1.120 18093 35 1 6 "Average Difference" CB 110 0.855 0.019 0.858 18093 36 1 6 "Average Difference" HN 121 0.496 -0.197 0.457 18093 37 1 7 "Average Difference" N 121 2.613 0.822 2.491 18093 38 1 7 "Average Difference" HA 130 0.230 0.089 0.212 18093 39 1 7 "Average Difference" C 120 0.863 0.142 0.855 18093 40 1 7 "Average Difference" CA 129 1.174 -0.551 1.040 18093 41 1 7 "Average Difference" CB 110 0.720 -0.025 0.723 18093 42 1 7 "Average Difference" HN 121 0.469 -0.166 0.440 18093 43 1 8 "Average Difference" N 121 2.527 0.580 2.470 18093 44 1 8 "Average Difference" HA 130 0.206 0.096 0.183 18093 45 1 8 "Average Difference" C 120 0.916 0.194 0.899 18093 46 1 8 "Average Difference" CA 129 1.215 -0.581 1.071 18093 47 1 8 "Average Difference" CB 110 0.830 -0.011 0.834 18093 48 1 8 "Average Difference" HN 121 0.487 -0.229 0.432 18093 49 1 9 "Average Difference" N 121 2.537 0.713 2.445 18093 50 1 9 "Average Difference" HA 130 0.200 0.080 0.184 18093 51 1 9 "Average Difference" C 120 0.825 0.173 0.810 18093 52 1 9 "Average Difference" CA 129 1.179 -0.554 1.045 18093 53 1 9 "Average Difference" CB 110 0.734 0.044 0.736 18093 54 1 9 "Average Difference" HN 121 0.463 -0.189 0.424 18093 55 1 10 "Average Difference" N 121 2.369 0.611 2.299 18093 56 1 10 "Average Difference" HA 130 0.215 0.088 0.197 18093 57 1 10 "Average Difference" C 120 0.885 0.260 0.850 18093 58 1 10 "Average Difference" CA 129 1.258 -0.518 1.151 18093 59 1 10 "Average Difference" CB 110 0.678 -0.088 0.675 18093 60 1 10 "Average Difference" HN 121 0.495 -0.222 0.444 18093 61 1 11 "Average Difference" N 121 2.342 0.568 2.282 18093 62 1 11 "Average Difference" HA 130 0.225 0.100 0.202 18093 63 1 11 "Average Difference" C 120 0.859 0.133 0.852 18093 64 1 11 "Average Difference" CA 129 1.240 -0.568 1.106 18093 65 1 11 "Average Difference" CB 110 0.773 -0.034 0.776 18093 66 1 11 "Average Difference" HN 121 0.480 -0.186 0.445 18093 67 1 12 "Average Difference" N 121 2.450 0.679 2.364 18093 68 1 12 "Average Difference" HA 130 0.216 0.081 0.201 18093 69 1 12 "Average Difference" C 120 0.908 0.183 0.893 18093 70 1 12 "Average Difference" CA 129 1.195 -0.484 1.097 18093 71 1 12 "Average Difference" CB 110 0.650 -0.024 0.653 18093 72 1 12 "Average Difference" HN 121 0.452 -0.186 0.414 18093 73 1 13 "Average Difference" N 121 2.485 0.600 2.422 18093 74 1 13 "Average Difference" HA 130 0.205 0.067 0.194 18093 75 1 13 "Average Difference" C 120 0.889 0.223 0.865 18093 76 1 13 "Average Difference" CA 129 1.159 -0.468 1.064 18093 77 1 13 "Average Difference" CB 110 0.770 -0.019 0.773 18093 78 1 13 "Average Difference" HN 121 0.481 -0.158 0.456 18093 79 1 14 "Average Difference" N 121 2.459 0.694 2.369 18093 80 1 14 "Average Difference" HA 130 0.213 0.087 0.196 18093 81 1 14 "Average Difference" C 120 0.914 0.185 0.898 18093 82 1 14 "Average Difference" CA 129 1.180 -0.540 1.054 18093 83 1 14 "Average Difference" CB 110 0.725 -0.074 0.724 18093 84 1 14 "Average Difference" HN 121 0.466 -0.187 0.429 18093 85 1 15 "Average Difference" N 121 2.308 0.576 2.245 18093 86 1 15 "Average Difference" HA 130 0.223 0.080 0.209 18093 87 1 15 "Average Difference" C 120 0.825 0.127 0.819 18093 88 1 15 "Average Difference" CA 129 1.210 -0.566 1.074 18093 89 1 15 "Average Difference" CB 110 0.671 -0.104 0.666 18093 90 1 15 "Average Difference" HN 121 0.497 -0.230 0.442 18093 91 1 16 "Average Difference" N 121 2.364 0.753 2.250 18093 92 1 16 "Average Difference" HA 130 0.206 0.070 0.195 18093 93 1 16 "Average Difference" C 120 0.864 0.137 0.856 18093 94 1 16 "Average Difference" CA 129 1.084 -0.473 0.980 18093 95 1 16 "Average Difference" CB 110 0.750 -0.040 0.752 18093 96 1 16 "Average Difference" HN 121 0.488 -0.179 0.456 18093 97 1 17 "Average Difference" N 121 2.387 0.683 2.297 18093 98 1 17 "Average Difference" HA 130 0.212 0.069 0.201 18093 99 1 17 "Average Difference" C 120 0.874 0.187 0.858 18093 100 1 17 "Average Difference" CA 129 1.184 -0.490 1.082 18093 101 1 17 "Average Difference" CB 110 0.770 -0.101 0.766 18093 102 1 17 "Average Difference" HN 121 0.475 -0.173 0.444 18093 103 1 18 "Average Difference" N 121 2.492 0.768 2.381 18093 104 1 18 "Average Difference" HA 130 0.211 0.084 0.194 18093 105 1 18 "Average Difference" C 120 0.842 0.232 0.813 18093 106 1 18 "Average Difference" CA 129 1.242 -0.490 1.146 18093 107 1 18 "Average Difference" CB 110 0.726 -0.080 0.725 18093 108 1 18 "Average Difference" HN 121 0.503 -0.189 0.468 18093 109 1 19 "Average Difference" N 121 2.605 0.931 2.443 18093 110 1 19 "Average Difference" HA 130 0.216 0.097 0.194 18093 111 1 19 "Average Difference" C 120 0.952 0.197 0.935 18093 112 1 19 "Average Difference" CA 129 1.217 -0.591 1.068 18093 113 1 19 "Average Difference" CB 110 0.795 -0.000 0.798 18093 114 1 19 "Average Difference" HN 121 0.499 -0.190 0.463 18093 115 1 20 "Average Difference" N 121 2.416 0.745 2.308 18093 116 1 20 "Average Difference" HA 130 0.201 0.069 0.189 18093 117 1 20 "Average Difference" C 120 0.914 0.215 0.892 18093 118 1 20 "Average Difference" CA 129 1.180 -0.500 1.073 18093 119 1 20 "Average Difference" CB 110 0.695 -0.115 0.689 18093 120 1 20 "Average Difference" HN 121 0.485 -0.188 0.448 18093 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 18093 _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 GLU N N 5 119.627 119.627 119.152 0.475 18093 2 1 . 1 1 5 5 GLU HA H 5 4.208 4.208 4.392 -0.184 18093 3 1 . 1 1 5 5 GLU C C 5 176.581 176.581 174.997 1.584 18093 4 1 . 1 1 5 5 GLU CA C 5 57.045 57.045 56.471 0.574 18093 5 1 . 1 1 5 5 GLU CB C 5 30.038 30.038 29.583 0.455 18093 6 1 . 1 1 5 5 GLU H H 5 8.003 8.003 8.306 -0.303 18093 7 1 . 1 1 6 6 LEU N N 6 121.267 121.267 122.195 -0.928 18093 8 1 . 1 1 6 6 LEU HA H 6 4.425 4.425 4.596 -0.171 18093 9 1 . 1 1 6 6 LEU CA C 6 55.635 55.635 53.289 2.346 18093 10 1 . 1 1 6 6 LEU CB C 6 41.296 41.296 41.725 -0.429 18093 11 1 . 1 1 6 6 LEU H H 6 8.104 8.104 7.880 0.224 18093 12 1 . 1 1 7 7 PRO HA H 7 4.399 4.399 4.569 -0.170 18093 13 1 . 1 1 7 7 PRO C C 7 178.408 178.408 177.899 0.509 18093 14 1 . 1 1 7 7 PRO CA C 7 64.712 64.712 62.085 2.627 18093 15 1 . 1 1 7 7 PRO CB C 7 31.917 31.917 32.782 -0.865 18093 16 1 . 1 1 8 8 LEU N N 8 121.835 121.835 120.581 1.254 18093 17 1 . 1 1 8 8 LEU HA H 8 4.089 4.089 4.169 -0.080 18093 18 1 . 1 1 8 8 LEU C C 8 177.902 177.902 178.345 -0.443 18093 19 1 . 1 1 8 8 LEU CA C 8 58.105 58.105 57.558 0.547 18093 20 1 . 1 1 8 8 LEU CB C 8 41.607 41.607 41.138 0.469 18093 21 1 . 1 1 8 8 LEU H H 8 8.162 8.162 8.513 -0.351 18093 22 1 . 1 1 9 9 PHE N N 9 118.342 118.342 118.862 -0.520 18093 23 1 . 1 1 9 9 PHE HA H 9 4.189 4.189 4.150 0.039 18093 24 1 . 1 1 9 9 PHE C C 9 177.596 177.596 177.157 0.439 18093 25 1 . 1 1 9 9 PHE CA C 9 61.114 61.114 61.281 -0.167 18093 26 1 . 1 1 9 9 PHE CB C 9 38.727 38.727 38.245 0.483 18093 27 1 . 1 1 9 9 PHE H H 9 8.318 8.318 8.211 0.107 18093 28 1 . 1 1 10 10 TYR N N 10 117.584 117.584 118.439 -0.855 18093 29 1 . 1 1 10 10 TYR HA H 10 4.154 4.154 3.958 0.196 18093 30 1 . 1 1 10 10 TYR C C 10 177.630 177.630 177.449 0.181 18093 31 1 . 1 1 10 10 TYR CA C 10 61.036 61.036 60.580 0.456 18093 32 1 . 1 1 10 10 TYR CB C 10 38.660 38.660 38.156 0.504 18093 33 1 . 1 1 10 10 TYR H H 10 8.105 8.105 8.214 -0.109 18093 34 1 . 1 1 11 11 THR N N 11 115.563 115.563 116.295 -0.732 18093 35 1 . 1 1 11 11 THR HA H 11 3.871 3.871 3.951 -0.080 18093 36 1 . 1 1 11 11 THR C C 11 175.955 175.955 176.507 -0.552 18093 37 1 . 1 1 11 11 THR CA C 11 67.290 67.290 66.660 0.630 18093 38 1 . 1 1 11 11 THR CB C 11 68.201 68.201 68.633 -0.432 18093 39 1 . 1 1 11 11 THR H H 11 7.915 7.915 7.697 0.218 18093 40 1 . 1 1 12 12 ILE N N 12 119.727 119.727 120.412 -0.685 18093 41 1 . 1 1 12 12 ILE HA H 12 3.699 3.699 3.868 -0.169 18093 42 1 . 1 1 12 12 ILE C C 12 175.773 175.773 177.382 -1.609 18093 43 1 . 1 1 12 12 ILE CA C 12 64.699 64.699 62.952 1.747 18093 44 1 . 1 1 12 12 ILE CB C 12 38.096 38.096 36.750 1.346 18093 45 1 . 1 1 12 12 ILE H H 12 8.186 8.186 7.869 0.317 18093 46 1 . 1 1 13 13 ASN N N 13 114.190 114.190 118.610 -4.420 18093 47 1 . 1 1 13 13 ASN HA H 13 4.422 4.422 4.490 -0.068 18093 48 1 . 1 1 13 13 ASN C C 13 174.786 174.786 176.661 -1.875 18093 49 1 . 1 1 13 13 ASN CA C 13 55.555 55.555 55.438 0.117 18093 50 1 . 1 1 13 13 ASN CB C 13 39.358 39.358 38.723 0.635 18093 51 1 . 1 1 13 13 ASN H H 13 7.601 7.601 7.423 0.178 18093 52 1 . 1 1 14 14 LEU N N 14 115.031 115.031 118.765 -3.734 18093 53 1 . 1 1 14 14 LEU HA H 14 4.196 4.196 4.048 0.148 18093 54 1 . 1 1 14 14 LEU C C 14 177.540 177.540 178.018 -0.478 18093 55 1 . 1 1 14 14 LEU CA C 14 56.407 56.407 56.442 -0.035 18093 56 1 . 1 1 14 14 LEU CB C 14 41.842 41.842 42.196 -0.354 18093 57 1 . 1 1 14 14 LEU H H 14 7.390 7.390 7.400 -0.010 18093 58 1 . 1 1 15 15 ILE N N 15 118.223 118.223 120.302 -2.079 18093 59 1 . 1 1 15 15 ILE HA H 15 3.613 3.613 3.694 -0.081 18093 60 1 . 1 1 15 15 ILE CA C 15 65.720 65.720 62.677 3.043 18093 61 1 . 1 1 15 15 ILE CB C 15 37.612 37.612 38.258 -0.646 18093 62 1 . 1 1 15 15 ILE H H 15 8.123 8.123 7.582 0.541 18093 63 1 . 1 1 17 17 PRO HA H 17 4.069 4.069 4.305 -0.236 18093 64 1 . 1 1 17 17 PRO C C 17 177.721 177.721 178.760 -1.039 18093 65 1 . 1 1 17 17 PRO CA C 17 66.761 66.761 65.476 1.285 18093 66 1 . 1 1 17 17 PRO CB C 17 30.742 30.742 30.732 0.010 18093 67 1 . 1 1 18 18 CYS N N 18 113.538 113.538 117.239 -3.701 18093 68 1 . 1 1 18 18 CYS HA H 18 4.008 4.008 4.051 -0.043 18093 69 1 . 1 1 18 18 CYS C C 18 177.683 177.683 176.963 0.720 18093 70 1 . 1 1 18 18 CYS CA C 18 64.500 64.500 63.336 1.164 18093 71 1 . 1 1 18 18 CYS CB C 18 26.873 26.873 27.042 -0.169 18093 72 1 . 1 1 18 18 CYS H H 18 7.410 7.410 7.396 0.014 18093 73 1 . 1 1 19 19 LEU N N 19 122.545 122.545 119.275 3.270 18093 74 1 . 1 1 19 19 LEU HA H 19 3.999 3.999 4.114 -0.115 18093 75 1 . 1 1 19 19 LEU C C 19 178.608 178.608 178.832 -0.224 18093 76 1 . 1 1 19 19 LEU CA C 19 58.421 58.421 57.336 1.085 18093 77 1 . 1 1 19 19 LEU CB C 19 41.844 41.844 41.386 0.458 18093 78 1 . 1 1 19 19 LEU H H 19 8.635 8.635 7.413 1.222 18093 79 1 . 1 1 20 20 LEU N N 20 119.404 119.404 120.715 -1.310 18093 80 1 . 1 1 20 20 LEU HA H 20 4.006 4.006 3.921 0.085 18093 81 1 . 1 1 20 20 LEU C C 20 178.540 178.540 179.275 -0.735 18093 82 1 . 1 1 20 20 LEU CA C 20 58.799 58.799 58.437 0.362 18093 83 1 . 1 1 20 20 LEU CB C 20 41.999 41.999 41.870 0.129 18093 84 1 . 1 1 20 20 LEU H H 20 8.392 8.392 7.504 0.888 18093 85 1 . 1 1 21 21 ILE N N 21 117.335 117.335 114.163 3.172 18093 86 1 . 1 1 21 21 ILE HA H 21 3.651 3.651 3.810 -0.159 18093 87 1 . 1 1 21 21 ILE C C 21 177.249 177.249 177.565 -0.316 18093 88 1 . 1 1 21 21 ILE CA C 21 65.261 65.261 64.649 0.612 18093 89 1 . 1 1 21 21 ILE CB C 21 37.960 37.960 37.272 0.688 18093 90 1 . 1 1 21 21 ILE H H 21 8.403 8.403 8.406 -0.003 18093 91 1 . 1 1 22 22 SER N N 22 116.385 116.385 118.091 -1.706 18093 92 1 . 1 1 22 22 SER HA H 22 4.056 4.056 4.246 -0.190 18093 93 1 . 1 1 22 22 SER C C 22 176.813 176.813 176.604 0.209 18093 94 1 . 1 1 22 22 SER CA C 22 63.866 63.866 62.032 1.834 18093 95 1 . 1 1 22 22 SER CB C 22 62.898 62.898 62.968 -0.070 18093 96 1 . 1 1 22 22 SER H H 22 8.271 8.271 7.597 0.674 18093 97 1 . 1 1 23 23 CYS N N 23 119.001 119.001 120.680 -1.679 18093 98 1 . 1 1 23 23 CYS HA H 23 3.990 3.990 4.116 -0.126 18093 99 1 . 1 1 23 23 CYS C C 23 177.594 177.594 176.543 1.051 18093 100 1 . 1 1 23 23 CYS CA C 23 64.429 64.429 63.240 1.189 18093 101 1 . 1 1 23 23 CYS CB C 23 26.940 26.940 27.058 -0.118 18093 102 1 . 1 1 23 23 CYS H H 23 8.161 8.161 8.627 -0.466 18093 103 1 . 1 1 24 24 LEU N N 24 117.814 117.814 121.275 -3.461 18093 104 1 . 1 1 24 24 LEU HA H 24 3.977 3.977 3.860 0.117 18093 105 1 . 1 1 24 24 LEU C C 24 177.944 177.944 178.391 -0.447 18093 106 1 . 1 1 24 24 LEU CA C 24 58.287 58.287 58.675 -0.388 18093 107 1 . 1 1 24 24 LEU CB C 24 41.903 41.903 41.822 0.081 18093 108 1 . 1 1 24 24 LEU H H 24 8.106 8.106 7.649 0.457 18093 109 1 . 1 1 25 25 THR N N 25 115.670 115.670 114.583 1.087 18093 110 1 . 1 1 25 25 THR HA H 25 3.687 3.687 3.981 -0.294 18093 111 1 . 1 1 25 25 THR C C 25 175.845 175.845 176.824 -0.979 18093 112 1 . 1 1 25 25 THR CA C 25 68.306 68.306 66.766 1.540 18093 113 1 . 1 1 25 25 THR H H 25 7.924 7.924 7.550 0.374 18093 114 1 . 1 1 26 26 VAL N N 26 118.809 118.809 121.382 -2.573 18093 115 1 . 1 1 26 26 VAL HA H 26 3.515 3.515 3.710 -0.195 18093 116 1 . 1 1 26 26 VAL C C 26 177.530 177.530 177.753 -0.223 18093 117 1 . 1 1 26 26 VAL CA C 26 67.281 67.281 66.086 1.195 18093 118 1 . 1 1 26 26 VAL CB C 26 31.724 31.724 31.133 0.591 18093 119 1 . 1 1 26 26 VAL H H 26 7.764 7.764 7.329 0.435 18093 120 1 . 1 1 27 27 LEU N N 27 117.958 117.958 121.151 -3.193 18093 121 1 . 1 1 27 27 LEU HA H 27 4.036 4.036 4.059 -0.023 18093 122 1 . 1 1 27 27 LEU C C 27 178.163 178.163 179.137 -0.974 18093 123 1 . 1 1 27 27 LEU CA C 27 58.509 58.509 58.139 0.370 18093 124 1 . 1 1 27 27 LEU CB C 27 41.919 41.919 40.888 1.031 18093 125 1 . 1 1 27 27 LEU H H 27 7.912 7.912 8.138 -0.226 18093 126 1 . 1 1 28 28 VAL N N 28 114.472 114.472 117.333 -2.861 18093 127 1 . 1 1 28 28 VAL HA H 28 3.535 3.535 3.704 -0.169 18093 128 1 . 1 1 28 28 VAL C C 28 176.871 176.871 178.081 -1.210 18093 129 1 . 1 1 28 28 VAL CA C 28 65.977 65.977 66.128 -0.151 18093 130 1 . 1 1 28 28 VAL CB C 28 31.934 31.934 31.317 0.617 18093 131 1 . 1 1 28 28 VAL H H 28 7.892 7.892 7.590 0.302 18093 132 1 . 1 1 29 29 PHE N N 29 115.206 115.206 117.335 -2.129 18093 133 1 . 1 1 29 29 PHE HA H 29 4.203 4.203 4.211 -0.008 18093 134 1 . 1 1 29 29 PHE C C 29 176.614 176.614 176.833 -0.219 18093 135 1 . 1 1 29 29 PHE CA C 29 60.964 60.964 60.741 0.224 18093 136 1 . 1 1 29 29 PHE CB C 29 39.752 39.752 38.967 0.785 18093 137 1 . 1 1 29 29 PHE H H 29 7.748 7.748 7.712 0.036 18093 138 1 . 1 1 30 30 TYR N N 30 115.975 115.975 119.057 -3.082 18093 139 1 . 1 1 30 30 TYR HA H 30 4.322 4.322 4.413 -0.091 18093 140 1 . 1 1 30 30 TYR C C 30 175.553 175.553 175.740 -0.187 18093 141 1 . 1 1 30 30 TYR CA C 30 59.598 59.598 59.752 -0.154 18093 142 1 . 1 1 30 30 TYR CB C 30 39.763 39.763 40.125 -0.362 18093 143 1 . 1 1 30 30 TYR H H 30 7.985 7.985 7.692 0.293 18093 144 1 . 1 1 31 31 LEU N N 31 120.780 120.780 120.579 0.201 18093 145 1 . 1 1 31 31 LEU HA H 31 4.427 4.427 4.695 -0.268 18093 146 1 . 1 1 31 31 LEU CA C 31 54.665 54.665 52.021 2.644 18093 147 1 . 1 1 31 31 LEU CB C 31 42.388 42.388 43.586 -1.198 18093 148 1 . 1 1 31 31 LEU H H 31 7.643 7.643 7.748 -0.105 18093 149 1 . 1 1 34 34 GLU C C 34 176.271 176.271 176.091 0.180 18093 150 1 . 1 1 34 34 GLU CA C 34 57.590 57.590 55.998 1.592 18093 151 1 . 1 1 35 35 CYS N N 35 116.430 116.430 120.128 -3.698 18093 152 1 . 1 1 35 35 CYS HA H 35 4.367 4.367 4.499 -0.132 18093 153 1 . 1 1 35 35 CYS C C 35 175.198 175.198 176.028 -0.830 18093 154 1 . 1 1 35 35 CYS CA C 35 60.293 60.293 59.609 0.684 18093 155 1 . 1 1 35 35 CYS CB C 35 28.130 28.130 28.180 -0.050 18093 156 1 . 1 1 35 35 CYS H H 35 7.970 7.970 8.612 -0.642 18093 157 1 . 1 1 36 36 GLY N N 36 108.315 108.315 108.592 -0.277 18093 158 1 . 1 1 36 36 GLY C C 36 174.610 174.610 175.230 -0.620 18093 159 1 . 1 1 36 36 GLY CA C 36 46.004 46.004 45.798 0.206 18093 160 1 . 1 1 36 36 GLY H H 36 8.120 8.120 8.106 0.014 18093 161 1 . 1 1 37 37 GLU N N 37 121.347 121.347 120.956 0.391 18093 162 1 . 1 1 37 37 GLU HA H 37 4.047 4.047 4.043 0.004 18093 163 1 . 1 1 37 37 GLU C C 37 177.338 177.338 178.361 -1.023 18093 164 1 . 1 1 37 37 GLU CA C 37 58.507 58.507 59.379 -0.872 18093 165 1 . 1 1 37 37 GLU CB C 37 29.570 29.570 29.521 0.049 18093 166 1 . 1 1 37 37 GLU H H 37 8.423 8.423 8.398 0.025 18093 167 1 . 1 1 38 38 LYS N N 38 123.788 123.788 119.502 4.286 18093 168 1 . 1 1 38 38 LYS HA H 38 4.196 4.196 4.061 0.135 18093 169 1 . 1 1 38 38 LYS C C 38 177.976 177.976 178.821 -0.845 18093 170 1 . 1 1 38 38 LYS CA C 38 58.273 58.273 59.264 -0.991 18093 171 1 . 1 1 38 38 LYS CB C 38 31.649 31.649 31.895 -0.247 18093 172 1 . 1 1 38 38 LYS H H 38 8.211 8.211 7.968 0.243 18093 173 1 . 1 1 39 39 ILE N N 39 115.675 115.675 118.895 -3.220 18093 174 1 . 1 1 39 39 ILE HA H 39 3.608 3.608 3.759 -0.151 18093 175 1 . 1 1 39 39 ILE C C 39 177.204 177.204 178.063 -0.859 18093 176 1 . 1 1 39 39 ILE CA C 39 65.501 65.501 64.836 0.665 18093 177 1 . 1 1 39 39 ILE H H 39 7.933 7.933 7.706 0.227 18093 178 1 . 1 1 40 40 THR N N 40 117.411 117.411 115.916 1.495 18093 179 1 . 1 1 40 40 THR HA H 40 3.844 3.844 3.964 -0.120 18093 180 1 . 1 1 40 40 THR C C 40 175.983 175.983 176.672 -0.689 18093 181 1 . 1 1 40 40 THR CA C 40 67.360 67.360 66.496 0.864 18093 182 1 . 1 1 40 40 THR H H 40 8.362 8.362 7.706 0.656 18093 183 1 . 1 1 41 41 LEU N N 41 123.059 123.059 122.653 0.406 18093 184 1 . 1 1 41 41 LEU HA H 41 4.016 4.016 4.135 -0.119 18093 185 1 . 1 1 41 41 LEU C C 41 178.914 178.914 178.215 0.699 18093 186 1 . 1 1 41 41 LEU CA C 41 58.366 58.366 58.030 0.336 18093 187 1 . 1 1 41 41 LEU CB C 41 42.050 42.050 41.752 0.298 18093 188 1 . 1 1 41 41 LEU H H 41 8.282 8.282 7.805 0.477 18093 189 1 . 1 1 42 42 CYS N N 42 118.762 118.762 118.418 0.344 18093 190 1 . 1 1 42 42 CYS HA H 42 3.936 3.936 4.035 -0.099 18093 191 1 . 1 1 42 42 CYS C C 42 176.607 176.607 176.968 -0.361 18093 192 1 . 1 1 42 42 CYS CA C 42 64.317 64.317 63.506 0.811 18093 193 1 . 1 1 42 42 CYS CB C 42 26.919 26.919 27.224 -0.305 18093 194 1 . 1 1 42 42 CYS H H 42 8.195 8.195 7.956 0.239 18093 195 1 . 1 1 43 43 ILE N N 43 117.589 117.589 120.031 -2.442 18093 196 1 . 1 1 43 43 ILE HA H 43 3.607 3.607 3.702 -0.095 18093 197 1 . 1 1 43 43 ILE C C 43 177.323 177.323 177.837 -0.514 18093 198 1 . 1 1 43 43 ILE CA C 43 65.249 65.249 64.956 0.293 18093 199 1 . 1 1 43 43 ILE CB C 43 38.038 38.038 37.667 0.371 18093 200 1 . 1 1 43 43 ILE H H 43 8.428 8.428 7.649 0.779 18093 201 1 . 1 1 44 44 SER N N 44 115.950 115.950 116.544 -0.594 18093 202 1 . 1 1 44 44 SER HA H 44 4.012 4.012 4.168 -0.156 18093 203 1 . 1 1 44 44 SER C C 44 176.965 176.965 176.755 0.210 18093 204 1 . 1 1 44 44 SER CA C 44 63.575 63.575 62.261 1.314 18093 205 1 . 1 1 44 44 SER H H 44 7.984 7.984 7.693 0.291 18093 206 1 . 1 1 45 45 VAL N N 45 123.544 123.544 120.875 2.669 18093 207 1 . 1 1 45 45 VAL HA H 45 3.548 3.548 3.751 -0.203 18093 208 1 . 1 1 45 45 VAL C C 45 177.139 177.139 177.936 -0.797 18093 209 1 . 1 1 45 45 VAL CA C 45 67.233 67.233 66.225 1.008 18093 210 1 . 1 1 45 45 VAL CB C 45 31.642 31.642 31.432 0.210 18093 211 1 . 1 1 45 45 VAL H H 45 8.280 8.280 8.069 0.211 18093 212 1 . 1 1 46 46 LEU N N 46 119.883 119.883 120.513 -0.630 18093 213 1 . 1 1 46 46 LEU HA H 46 3.943 3.943 4.040 -0.097 18093 214 1 . 1 1 46 46 LEU C C 46 180.125 180.125 178.714 1.411 18093 215 1 . 1 1 46 46 LEU CA C 46 58.600 58.600 57.878 0.722 18093 216 1 . 1 1 46 46 LEU CB C 46 42.012 42.012 41.662 0.350 18093 217 1 . 1 1 46 46 LEU H H 46 8.117 8.117 7.503 0.614 18093 218 1 . 1 1 47 47 LEU N N 47 120.193 120.193 119.782 0.411 18093 219 1 . 1 1 47 47 LEU HA H 47 4.004 4.004 3.864 0.140 18093 220 1 . 1 1 47 47 LEU C C 47 178.370 178.370 178.958 -0.588 18093 221 1 . 1 1 47 47 LEU CA C 47 58.426 58.426 58.539 -0.113 18093 222 1 . 1 1 47 47 LEU CB C 47 42.055 42.055 41.619 0.436 18093 223 1 . 1 1 47 47 LEU H H 47 8.933 8.933 8.028 0.905 18093 224 1 . 1 1 48 48 SER N N 48 115.861 115.861 114.692 1.169 18093 225 1 . 1 1 48 48 SER HA H 48 4.013 4.013 4.189 -0.176 18093 226 1 . 1 1 48 48 SER C C 48 175.642 175.642 176.887 -1.245 18093 227 1 . 1 1 48 48 SER CA C 48 63.571 63.571 61.822 1.749 18093 228 1 . 1 1 48 48 SER CB C 48 62.879 62.879 63.019 -0.140 18093 229 1 . 1 1 48 48 SER H H 48 7.996 7.996 7.706 0.290 18093 230 1 . 1 1 49 49 LEU N N 49 120.673 120.673 122.614 -1.940 18093 231 1 . 1 1 49 49 LEU HA H 49 4.035 4.035 4.197 -0.162 18093 232 1 . 1 1 49 49 LEU C C 49 178.229 178.229 178.656 -0.427 18093 233 1 . 1 1 49 49 LEU CA C 49 58.283 58.283 58.114 0.169 18093 234 1 . 1 1 49 49 LEU CB C 49 41.946 41.946 42.016 -0.070 18093 235 1 . 1 1 49 49 LEU H H 49 8.352 8.352 7.961 0.391 18093 236 1 . 1 1 50 50 THR N N 50 115.582 115.582 114.888 0.694 18093 237 1 . 1 1 50 50 THR HA H 50 3.672 3.672 4.062 -0.390 18093 238 1 . 1 1 50 50 THR C C 50 175.877 175.877 176.650 -0.773 18093 239 1 . 1 1 50 50 THR CA C 50 68.628 68.628 66.505 2.123 18093 240 1 . 1 1 50 50 THR H H 50 7.937 7.937 8.062 -0.125 18093 241 1 . 1 1 51 51 VAL N N 51 119.774 119.774 122.200 -2.426 18093 242 1 . 1 1 51 51 VAL HA H 51 3.498 3.498 3.793 -0.295 18093 243 1 . 1 1 51 51 VAL C C 51 177.162 177.162 177.338 -0.176 18093 244 1 . 1 1 51 51 VAL CA C 51 67.585 67.585 66.452 1.133 18093 245 1 . 1 1 51 51 VAL CB C 51 31.521 31.521 31.601 -0.079 18093 246 1 . 1 1 51 51 VAL H H 51 8.115 8.115 7.836 0.279 18093 247 1 . 1 1 52 52 PHE N N 52 118.808 118.808 120.456 -1.648 18093 248 1 . 1 1 52 52 PHE HA H 52 4.122 4.122 4.308 -0.186 18093 249 1 . 1 1 52 52 PHE C C 52 176.697 176.697 176.827 -0.130 18093 250 1 . 1 1 52 52 PHE CA C 52 61.771 61.771 60.704 1.067 18093 251 1 . 1 1 52 52 PHE CB C 52 39.262 39.262 39.256 0.006 18093 252 1 . 1 1 52 52 PHE H H 52 8.256 8.256 8.397 -0.141 18093 253 1 . 1 1 53 53 LEU N N 53 117.267 117.267 121.330 -4.063 18093 254 1 . 1 1 53 53 LEU HA H 53 3.893 3.893 3.672 0.221 18093 255 1 . 1 1 53 53 LEU C C 53 179.319 179.319 177.895 1.424 18093 256 1 . 1 1 53 53 LEU CA C 53 57.985 57.985 57.890 0.095 18093 257 1 . 1 1 53 53 LEU CB C 53 41.827 41.827 41.390 0.437 18093 258 1 . 1 1 53 53 LEU H H 53 8.443 8.443 7.759 0.684 18093 259 1 . 1 1 54 54 LEU N N 54 119.762 119.762 119.059 0.703 18093 260 1 . 1 1 54 54 LEU HA H 54 4.054 4.054 3.970 0.084 18093 261 1 . 1 1 54 54 LEU C C 54 178.827 178.827 179.021 -0.194 18093 262 1 . 1 1 54 54 LEU CA C 54 58.105 58.105 57.937 0.168 18093 263 1 . 1 1 54 54 LEU CB C 54 41.947 41.947 41.734 0.213 18093 264 1 . 1 1 54 54 LEU H H 54 8.205 8.205 7.471 0.734 18093 265 1 . 1 1 55 55 LEU N N 55 118.585 118.585 118.470 0.115 18093 266 1 . 1 1 55 55 LEU HA H 55 4.077 4.077 3.981 0.096 18093 267 1 . 1 1 55 55 LEU C C 55 178.909 178.909 178.772 0.137 18093 268 1 . 1 1 55 55 LEU CA C 55 58.108 58.108 57.799 0.309 18093 269 1 . 1 1 55 55 LEU CB C 55 41.979 41.979 41.603 0.376 18093 270 1 . 1 1 55 55 LEU H H 55 8.179 8.179 7.419 0.760 18093 271 1 . 1 1 56 56 ILE N N 56 116.079 116.079 115.594 0.485 18093 272 1 . 1 1 56 56 ILE HA H 56 3.729 3.729 3.979 -0.250 18093 273 1 . 1 1 56 56 ILE C C 56 176.988 176.988 177.713 -0.725 18093 274 1 . 1 1 56 56 ILE CA C 56 64.257 64.257 63.324 0.934 18093 275 1 . 1 1 56 56 ILE CB C 56 37.417 37.417 36.773 0.644 18093 276 1 . 1 1 56 56 ILE H H 56 8.040 8.040 7.429 0.611 18093 277 1 . 1 1 57 57 THR N N 57 110.105 110.105 110.580 -0.475 18093 278 1 . 1 1 57 57 THR HA H 57 4.015 4.015 4.206 -0.191 18093 279 1 . 1 1 57 57 THR C C 57 175.435 175.435 175.910 -0.475 18093 280 1 . 1 1 57 57 THR CA C 57 65.067 65.067 64.683 0.384 18093 281 1 . 1 1 57 57 THR CB C 57 69.179 69.179 68.929 0.250 18093 282 1 . 1 1 57 57 THR H H 57 7.655 7.655 7.721 -0.066 18093 283 1 . 1 1 58 58 GLU N N 58 117.313 117.313 121.236 -3.923 18093 284 1 . 1 1 58 58 GLU HA H 58 4.333 4.333 4.285 0.048 18093 285 1 . 1 1 58 58 GLU C C 58 176.940 176.940 178.115 -1.175 18093 286 1 . 1 1 58 58 GLU CA C 58 57.068 57.068 57.935 -0.867 18093 287 1 . 1 1 58 58 GLU CB C 58 29.396 29.396 29.880 -0.484 18093 288 1 . 1 1 58 58 GLU H H 58 7.521 7.521 7.969 -0.448 18093 289 1 . 1 1 59 59 ILE N N 59 114.870 114.870 114.035 0.835 18093 290 1 . 1 1 59 59 ILE HA H 59 4.089 4.089 4.082 0.007 18093 291 1 . 1 1 59 59 ILE C C 59 175.456 175.456 176.167 -0.711 18093 292 1 . 1 1 59 59 ILE CA C 59 62.434 62.434 62.156 0.278 18093 293 1 . 1 1 59 59 ILE CB C 59 38.657 38.657 38.827 -0.170 18093 294 1 . 1 1 59 59 ILE H H 59 7.579 7.579 7.319 0.260 18093 295 1 . 1 1 60 60 ILE N N 60 119.354 119.354 118.039 1.315 18093 296 1 . 1 1 60 60 ILE HA H 60 4.304 4.304 3.877 0.427 18093 297 1 . 1 1 60 60 ILE CA C 60 59.617 59.617 61.480 -1.864 18093 298 1 . 1 1 60 60 ILE CB C 60 38.862 38.862 36.581 2.281 18093 299 1 . 1 1 60 60 ILE H H 60 7.629 7.629 7.603 0.026 18093 300 1 . 1 1 61 61 PRO HA H 61 4.400 4.400 4.396 0.004 18093 301 1 . 1 1 61 61 PRO C C 61 177.144 177.144 176.768 0.376 18093 302 1 . 1 1 61 61 PRO CA C 61 63.808 63.808 63.963 -0.155 18093 303 1 . 1 1 61 61 PRO CB C 61 31.882 31.882 32.370 -0.488 18093 304 1 . 1 1 62 62 SER N N 62 114.474 114.474 112.525 1.949 18093 305 1 . 1 1 62 62 SER HA H 62 4.434 4.434 4.442 -0.008 18093 306 1 . 1 1 62 62 SER C C 62 175.161 175.161 173.723 1.438 18093 307 1 . 1 1 62 62 SER CA C 62 59.047 59.047 58.436 0.611 18093 308 1 . 1 1 62 62 SER CB C 62 63.704 63.704 63.284 0.420 18093 309 1 . 1 1 62 62 SER H H 62 8.186 8.186 7.968 0.218 18093 310 1 . 1 1 63 63 THR N N 63 113.573 113.573 117.411 -3.838 18093 311 1 . 1 1 63 63 THR HA H 63 4.319 4.319 4.442 -0.123 18093 312 1 . 1 1 63 63 THR C C 63 174.834 174.834 174.081 0.753 18093 313 1 . 1 1 63 63 THR CA C 63 62.377 62.377 62.103 0.274 18093 314 1 . 1 1 63 63 THR CB C 63 69.422 69.422 69.011 0.411 18093 315 1 . 1 1 63 63 THR H H 63 7.963 7.963 8.249 -0.286 18093 316 1 . 1 1 64 64 SER N N 64 116.598 116.598 117.601 -1.003 18093 317 1 . 1 1 64 64 SER HA H 64 4.428 4.428 4.697 -0.269 18093 318 1 . 1 1 64 64 SER C C 64 174.618 174.618 174.130 0.488 18093 319 1 . 1 1 64 64 SER CA C 64 59.045 59.045 57.555 1.490 18093 320 1 . 1 1 64 64 SER CB C 64 63.700 63.700 64.740 -1.040 18093 321 1 . 1 1 64 64 SER H H 64 8.052 8.052 8.017 0.035 18093 322 1 . 1 1 65 65 SER N N 65 116.673 116.673 116.957 -0.284 18093 323 1 . 1 1 65 65 SER HA H 65 4.432 4.432 4.524 -0.092 18093 324 1 . 1 1 65 65 SER C C 65 174.335 174.335 175.027 -0.692 18093 325 1 . 1 1 65 65 SER CA C 65 58.927 58.927 59.218 -0.291 18093 326 1 . 1 1 65 65 SER CB C 65 63.621 63.621 63.317 0.304 18093 327 1 . 1 1 65 65 SER H H 65 8.114 8.114 8.531 -0.417 18093 328 1 . 1 1 66 66 VAL N N 66 119.054 119.054 116.894 2.160 18093 329 1 . 1 1 66 66 VAL HA H 66 4.170 4.170 4.239 -0.069 18093 330 1 . 1 1 66 66 VAL C C 66 175.278 175.278 175.587 -0.309 18093 331 1 . 1 1 66 66 VAL CA C 66 62.062 62.062 62.466 -0.404 18093 332 1 . 1 1 66 66 VAL CB C 66 32.629 32.629 32.364 0.265 18093 333 1 . 1 1 66 66 VAL H H 66 7.740 7.740 7.694 0.046 18093 334 1 . 1 1 67 67 SER N N 67 118.882 118.882 115.796 3.086 18093 335 1 . 1 1 67 67 SER HA H 67 4.704 4.704 4.680 0.024 18093 336 1 . 1 1 67 67 SER CA C 67 56.715 56.715 56.630 0.085 18093 337 1 . 1 1 67 67 SER CB C 67 63.624 63.624 64.049 -0.425 18093 338 1 . 1 1 67 67 SER H H 67 8.060 8.060 7.874 0.187 18093 339 1 . 1 1 68 68 PRO HA H 68 4.400 4.400 4.547 -0.147 18093 340 1 . 1 1 68 68 PRO C C 68 176.925 176.925 176.279 0.646 18093 341 1 . 1 1 68 68 PRO CA C 68 63.748 63.748 62.848 0.900 18093 342 1 . 1 1 68 68 PRO CB C 68 32.005 32.005 31.876 0.129 18093 343 1 . 1 1 69 69 SER N N 69 114.930 114.930 116.480 -1.550 18093 344 1 . 1 1 69 69 SER HA H 69 4.422 4.422 4.569 -0.147 18093 345 1 . 1 1 69 69 SER C C 69 175.617 175.617 175.559 0.058 18093 346 1 . 1 1 69 69 SER CA C 69 58.697 58.697 57.572 1.125 18093 347 1 . 1 1 69 69 SER CB C 69 63.804 63.804 65.181 -1.378 18093 348 1 . 1 1 69 69 SER H H 69 8.205 8.205 8.091 0.114 18093 349 1 . 1 1 70 70 ILE N N 70 120.840 120.840 123.857 -3.017 18093 350 1 . 1 1 70 70 ILE HA H 70 3.992 3.992 4.083 -0.091 18093 351 1 . 1 1 70 70 ILE C C 70 177.524 177.524 176.751 0.773 18093 352 1 . 1 1 70 70 ILE CA C 70 64.335 64.335 62.146 2.189 18093 353 1 . 1 1 70 70 ILE CB C 70 37.460 37.460 38.088 -0.628 18093 354 1 . 1 1 70 70 ILE H H 70 8.283 8.283 8.739 -0.456 18093 355 1 . 1 1 71 71 GLY N N 71 107.823 107.823 107.900 -0.077 18093 356 1 . 1 1 71 71 GLY C C 71 175.296 175.296 176.088 -0.792 18093 357 1 . 1 1 71 71 GLY CA C 71 47.455 47.455 47.157 0.298 18093 358 1 . 1 1 71 71 GLY H H 71 8.557 8.557 8.664 -0.107 18093 359 1 . 1 1 72 72 GLU N N 72 120.835 120.835 120.758 0.077 18093 360 1 . 1 1 72 72 GLU HA H 72 3.847 3.847 4.200 -0.353 18093 361 1 . 1 1 72 72 GLU C C 72 178.198 178.198 178.241 -0.043 18093 362 1 . 1 1 72 72 GLU CA C 72 60.117 60.117 58.287 1.830 18093 363 1 . 1 1 72 72 GLU CB C 72 29.393 29.393 29.649 -0.257 18093 364 1 . 1 1 72 72 GLU H H 72 7.922 7.922 7.752 0.170 18093 365 1 . 1 1 73 73 TYR N N 73 117.375 117.375 122.165 -4.790 18093 366 1 . 1 1 73 73 TYR HA H 73 4.162 4.162 4.291 -0.129 18093 367 1 . 1 1 73 73 TYR C C 73 179.912 179.912 177.386 2.526 18093 368 1 . 1 1 73 73 TYR CA C 73 62.155 62.155 61.141 1.014 18093 369 1 . 1 1 73 73 TYR CB C 73 38.766 38.766 38.630 0.136 18093 370 1 . 1 1 73 73 TYR H H 73 8.062 8.062 7.842 0.220 18093 371 1 . 1 1 74 74 LEU N N 74 121.493 121.493 119.203 2.291 18093 372 1 . 1 1 74 74 LEU HA H 74 4.049 4.049 3.782 0.267 18093 373 1 . 1 1 74 74 LEU C C 74 178.063 178.063 178.811 -0.748 18093 374 1 . 1 1 74 74 LEU CA C 74 58.495 58.495 57.584 0.911 18093 375 1 . 1 1 74 74 LEU CB C 74 41.847 41.847 41.869 -0.022 18093 376 1 . 1 1 74 74 LEU H H 74 8.552 8.552 8.768 -0.216 18093 377 1 . 1 1 75 75 LEU N N 75 120.375 120.375 120.312 0.063 18093 378 1 . 1 1 75 75 LEU HA H 75 4.040 4.040 4.062 -0.022 18093 379 1 . 1 1 75 75 LEU C C 75 178.515 178.515 178.488 0.027 18093 380 1 . 1 1 75 75 LEU CA C 75 58.638 58.638 58.113 0.525 18093 381 1 . 1 1 75 75 LEU CB C 75 42.039 42.039 41.794 0.245 18093 382 1 . 1 1 75 75 LEU H H 75 8.276 8.276 7.502 0.774 18093 383 1 . 1 1 76 76 PHE N N 76 116.626 116.626 118.264 -1.638 18093 384 1 . 1 1 76 76 PHE HA H 76 4.079 4.079 4.151 -0.072 18093 385 1 . 1 1 76 76 PHE C C 76 177.399 177.399 178.021 -0.622 18093 386 1 . 1 1 76 76 PHE CA C 76 61.734 61.734 61.623 0.111 18093 387 1 . 1 1 76 76 PHE CB C 76 38.741 38.741 38.433 0.308 18093 388 1 . 1 1 76 76 PHE H H 76 8.454 8.454 8.155 0.299 18093 389 1 . 1 1 77 77 THR N N 77 116.080 116.080 115.617 0.463 18093 390 1 . 1 1 77 77 THR HA H 77 3.687 3.687 3.841 -0.154 18093 391 1 . 1 1 77 77 THR C C 77 176.018 176.018 176.575 -0.557 18093 392 1 . 1 1 77 77 THR CA C 77 68.640 68.640 66.796 1.844 18093 393 1 . 1 1 77 77 THR H H 77 8.224 8.224 8.338 -0.114 18093 394 1 . 1 1 78 78 MET N N 78 119.394 119.394 120.617 -1.223 18093 395 1 . 1 1 78 78 MET HA H 78 4.129 4.129 4.058 0.071 18093 396 1 . 1 1 78 78 MET C C 78 179.608 179.608 178.509 1.099 18093 397 1 . 1 1 78 78 MET CA C 78 58.831 58.831 59.576 -0.745 18093 398 1 . 1 1 78 78 MET CB C 78 31.590 31.590 32.429 -0.839 18093 399 1 . 1 1 78 78 MET H H 78 8.372 8.372 7.561 0.811 18093 400 1 . 1 1 79 79 ILE N N 79 121.819 121.819 118.634 3.185 18093 401 1 . 1 1 79 79 ILE HA H 79 3.550 3.550 3.736 -0.186 18093 402 1 . 1 1 79 79 ILE C C 79 176.426 176.426 177.857 -1.431 18093 403 1 . 1 1 79 79 ILE CA C 79 65.876 65.876 64.097 1.779 18093 404 1 . 1 1 79 79 ILE CB C 79 37.673 37.673 37.103 0.570 18093 405 1 . 1 1 79 79 ILE H H 79 8.391 8.391 7.846 0.545 18093 406 1 . 1 1 80 80 PHE N N 80 119.916 119.916 121.417 -1.501 18093 407 1 . 1 1 80 80 PHE HA H 80 4.053 4.053 4.110 -0.057 18093 408 1 . 1 1 80 80 PHE C C 80 178.568 178.568 177.286 1.282 18093 409 1 . 1 1 80 80 PHE CA C 80 62.307 62.307 62.380 -0.073 18093 410 1 . 1 1 80 80 PHE CB C 80 38.774 38.774 39.485 -0.711 18093 411 1 . 1 1 80 80 PHE H H 80 8.479 8.479 7.909 0.570 18093 412 1 . 1 1 81 81 VAL N N 81 120.191 120.191 115.751 4.440 18093 413 1 . 1 1 81 81 VAL HA H 81 3.453 3.453 3.637 -0.184 18093 414 1 . 1 1 81 81 VAL C C 81 178.225 178.225 177.670 0.555 18093 415 1 . 1 1 81 81 VAL CA C 81 67.408 67.408 66.321 1.087 18093 416 1 . 1 1 81 81 VAL CB C 81 31.556 31.556 31.069 0.487 18093 417 1 . 1 1 81 81 VAL H H 81 8.928 8.928 8.667 0.261 18093 418 1 . 1 1 82 82 THR N N 82 115.930 115.930 117.587 -1.657 18093 419 1 . 1 1 82 82 THR HA H 82 3.636 3.636 3.956 -0.320 18093 420 1 . 1 1 82 82 THR C C 82 176.420 176.420 176.526 -0.106 18093 421 1 . 1 1 82 82 THR CA C 82 68.570 68.570 67.106 1.464 18093 422 1 . 1 1 82 82 THR CB C 82 68.202 68.202 68.715 -0.513 18093 423 1 . 1 1 82 82 THR H H 82 7.969 7.969 7.466 0.503 18093 424 1 . 1 1 83 83 LEU N N 83 119.780 119.780 120.286 -0.506 18093 425 1 . 1 1 83 83 LEU HA H 83 3.847 3.847 3.961 -0.114 18093 426 1 . 1 1 83 83 LEU C C 83 178.214 178.214 178.566 -0.352 18093 427 1 . 1 1 83 83 LEU CA C 83 58.237 58.237 57.621 0.616 18093 428 1 . 1 1 83 83 LEU CB C 83 41.791 41.791 41.227 0.565 18093 429 1 . 1 1 83 83 LEU H H 83 8.483 8.483 7.464 1.019 18093 430 1 . 1 1 84 84 SER N N 84 114.559 114.559 115.953 -1.394 18093 431 1 . 1 1 84 84 SER HA H 84 4.099 4.099 4.082 0.017 18093 432 1 . 1 1 84 84 SER C C 84 176.799 176.799 176.613 0.186 18093 433 1 . 1 1 84 84 SER CA C 84 63.609 63.609 62.189 1.420 18093 434 1 . 1 1 84 84 SER CB C 84 63.110 63.110 62.925 0.185 18093 435 1 . 1 1 84 84 SER H H 84 8.023 8.023 7.711 0.312 18093 436 1 . 1 1 85 85 ILE N N 85 123.962 123.962 121.552 2.410 18093 437 1 . 1 1 85 85 ILE HA H 85 3.604 3.604 3.870 -0.266 18093 438 1 . 1 1 85 85 ILE C C 85 177.487 177.487 177.928 -0.441 18093 439 1 . 1 1 85 85 ILE CA C 85 65.759 65.759 65.005 0.755 18093 440 1 . 1 1 85 85 ILE CB C 85 37.887 37.887 37.922 -0.035 18093 441 1 . 1 1 85 85 ILE H H 85 8.054 8.054 7.882 0.172 18093 442 1 . 1 1 86 86 VAL N N 86 118.744 118.744 120.366 -1.622 18093 443 1 . 1 1 86 86 VAL HA H 86 3.519 3.519 3.724 -0.205 18093 444 1 . 1 1 86 86 VAL C C 86 177.557 177.557 177.847 -0.290 18093 445 1 . 1 1 86 86 VAL CA C 86 67.535 67.535 66.524 1.011 18093 446 1 . 1 1 86 86 VAL CB C 86 31.466 31.466 31.767 -0.301 18093 447 1 . 1 1 86 86 VAL H H 86 8.158 8.158 7.348 0.810 18093 448 1 . 1 1 87 87 ILE N N 87 117.206 117.206 119.648 -2.442 18093 449 1 . 1 1 87 87 ILE HA H 87 3.604 3.604 3.855 -0.251 18093 450 1 . 1 1 87 87 ILE C C 87 177.283 177.283 178.387 -1.104 18093 451 1 . 1 1 87 87 ILE CA C 87 65.676 65.676 63.724 1.952 18093 452 1 . 1 1 87 87 ILE CB C 87 37.589 37.589 36.538 1.051 18093 453 1 . 1 1 87 87 ILE H H 87 8.459 8.459 8.370 0.089 18093 454 1 . 1 1 88 88 THR N N 88 116.158 116.158 116.979 -0.821 18093 455 1 . 1 1 88 88 THR HA H 88 3.672 3.672 4.196 -0.524 18093 456 1 . 1 1 88 88 THR C C 88 175.485 175.485 176.908 -1.423 18093 457 1 . 1 1 88 88 THR CA C 88 68.549 68.549 67.278 1.271 18093 458 1 . 1 1 88 88 THR CB C 88 68.127 68.127 68.725 -0.598 18093 459 1 . 1 1 88 88 THR H H 88 7.776 7.776 8.342 -0.566 18093 460 1 . 1 1 89 89 VAL N N 89 117.985 117.985 121.022 -3.038 18093 461 1 . 1 1 89 89 VAL HA H 89 3.543 3.543 3.833 -0.290 18093 462 1 . 1 1 89 89 VAL C C 89 177.393 177.393 177.501 -0.108 18093 463 1 . 1 1 89 89 VAL CA C 89 66.590 66.590 65.549 1.041 18093 464 1 . 1 1 89 89 VAL CB C 89 31.778 31.778 31.646 0.132 18093 465 1 . 1 1 89 89 VAL H H 89 8.206 8.206 7.659 0.547 18093 466 1 . 1 1 90 90 PHE N N 90 116.709 116.709 119.879 -3.170 18093 467 1 . 1 1 90 90 PHE HA H 90 4.378 4.378 4.233 0.145 18093 468 1 . 1 1 90 90 PHE C C 90 177.305 177.305 177.681 -0.376 18093 469 1 . 1 1 90 90 PHE CA C 90 61.119 61.119 61.630 -0.511 18093 470 1 . 1 1 90 90 PHE CB C 90 39.385 39.385 38.452 0.933 18093 471 1 . 1 1 90 90 PHE H H 90 7.956 7.956 7.682 0.274 18093 472 1 . 1 1 91 91 VAL N N 91 116.565 116.565 119.444 -2.879 18093 473 1 . 1 1 91 91 VAL HA H 91 3.835 3.835 3.728 0.107 18093 474 1 . 1 1 91 91 VAL C C 91 176.927 176.927 177.118 -0.191 18093 475 1 . 1 1 91 91 VAL CA C 91 65.347 65.347 65.937 -0.590 18093 476 1 . 1 1 91 91 VAL CB C 91 31.867 31.867 31.906 -0.039 18093 477 1 . 1 1 91 91 VAL H H 91 8.239 8.239 7.906 0.333 18093 478 1 . 1 1 92 92 LEU N N 92 117.443 117.443 117.294 0.149 18093 479 1 . 1 1 92 92 LEU HA H 92 4.194 4.194 4.246 -0.052 18093 480 1 . 1 1 92 92 LEU C C 92 177.180 177.180 177.850 -0.670 18093 481 1 . 1 1 92 92 LEU CA C 92 56.184 56.184 56.297 -0.113 18093 482 1 . 1 1 92 92 LEU CB C 92 41.944 41.944 42.214 -0.270 18093 483 1 . 1 1 92 92 LEU H H 92 7.967 7.967 7.621 0.346 18093 484 1 . 1 1 93 93 ASN N N 93 116.705 116.705 117.128 -0.423 18093 485 1 . 1 1 93 93 ASN HA H 93 4.647 4.647 4.545 0.102 18093 486 1 . 1 1 93 93 ASN C C 93 175.129 175.129 175.950 -0.821 18093 487 1 . 1 1 93 93 ASN CA C 93 53.854 53.854 55.216 -1.362 18093 488 1 . 1 1 93 93 ASN CB C 93 39.395 39.395 39.257 0.138 18093 489 1 . 1 1 93 93 ASN H H 93 7.683 7.683 7.701 -0.018 18093 490 1 . 1 1 94 94 VAL N N 94 118.224 118.224 117.819 0.405 18093 491 1 . 1 1 94 94 VAL HA H 94 3.961 3.961 3.971 -0.010 18093 492 1 . 1 1 94 94 VAL C C 94 175.600 175.600 174.415 1.185 18093 493 1 . 1 1 94 94 VAL CA C 94 62.825 62.825 62.443 0.382 18093 494 1 . 1 1 94 94 VAL CB C 94 32.214 32.214 33.116 -0.902 18093 495 1 . 1 1 94 94 VAL H H 94 7.627 7.627 7.753 -0.126 18093 496 1 . 1 1 95 95 HIS N N 95 120.999 120.999 121.329 -0.330 18093 497 1 . 1 1 95 95 HIS HA H 95 4.593 4.593 4.663 -0.070 18093 498 1 . 1 1 95 95 HIS C C 95 174.146 174.146 174.147 -0.001 18093 499 1 . 1 1 95 95 HIS CA C 95 55.666 55.666 55.854 -0.188 18093 500 1 . 1 1 95 95 HIS CB C 95 29.736 29.736 30.327 -0.591 18093 501 1 . 1 1 95 95 HIS H H 95 8.263 8.263 8.137 0.126 18093 502 1 . 1 1 96 96 HIS N N 96 122.740 122.740 119.596 3.144 18093 503 1 . 1 1 96 96 HIS HA H 96 4.633 4.633 4.656 -0.023 18093 504 1 . 1 1 96 96 HIS CA C 96 55.895 55.895 56.116 -0.221 18093 505 1 . 1 1 96 96 HIS CB C 96 29.750 29.750 30.665 -0.915 18093 506 1 . 1 1 96 96 HIS H H 96 8.298 8.298 8.323 -0.025 18093 507 1 . 1 1 97 97 ARG N N 97 118.503 118.503 121.475 -2.972 18093 508 1 . 1 1 97 97 ARG HA H 97 4.312 4.312 4.544 -0.232 18093 509 1 . 1 1 97 97 ARG C C 97 175.776 175.776 175.395 0.381 18093 510 1 . 1 1 97 97 ARG CA C 97 56.225 56.225 55.779 0.446 18093 511 1 . 1 1 97 97 ARG CB C 97 30.912 30.912 30.598 0.314 18093 512 1 . 1 1 97 97 ARG H H 97 8.250 8.250 8.298 -0.049 18093 513 1 . 1 1 98 98 SER N N 98 118.482 118.482 117.671 0.811 18093 514 1 . 1 1 98 98 SER HA H 98 4.722 4.722 4.798 -0.076 18093 515 1 . 1 1 98 98 SER CA C 98 56.547 56.547 56.550 -0.003 18093 516 1 . 1 1 98 98 SER CB C 98 63.624 63.624 64.264 -0.640 18093 517 1 . 1 1 98 98 SER H H 98 8.254 8.254 8.199 0.055 18093 518 1 . 1 1 99 99 PRO HA H 99 4.403 4.403 4.417 -0.014 18093 519 1 . 1 1 99 99 PRO C C 99 176.899 176.899 176.680 0.219 18093 520 1 . 1 1 99 99 PRO CA C 99 63.701 63.701 64.261 -0.560 18093 521 1 . 1 1 99 99 PRO CB C 99 31.949 31.949 32.269 -0.320 18093 522 1 . 1 1 100 100 GLU N N 100 120.187 120.187 115.977 4.210 18093 523 1 . 1 1 100 100 GLU HA H 100 4.288 4.288 4.232 0.056 18093 524 1 . 1 1 100 100 GLU C C 100 176.593 176.593 175.446 1.147 18093 525 1 . 1 1 100 100 GLU CA C 100 56.722 56.722 56.744 -0.022 18093 526 1 . 1 1 100 100 GLU CB C 100 29.999 29.999 29.702 0.297 18093 527 1 . 1 1 100 100 GLU H H 100 8.401 8.401 8.356 0.045 18093 528 1 . 1 1 101 101 THR N N 101 113.968 113.968 112.896 1.072 18093 529 1 . 1 1 101 101 THR HA H 101 4.286 4.286 4.387 -0.101 18093 530 1 . 1 1 101 101 THR C C 101 174.525 174.525 174.488 0.037 18093 531 1 . 1 1 101 101 THR CA C 101 61.956 61.956 62.367 -0.411 18093 532 1 . 1 1 101 101 THR CB C 101 69.697 69.697 69.441 0.256 18093 533 1 . 1 1 101 101 THR H H 101 7.945 7.945 7.913 0.032 18093 534 1 . 1 1 102 102 HIS N N 102 120.322 120.322 121.486 -1.164 18093 535 1 . 1 1 102 102 HIS HA H 102 4.741 4.741 4.687 0.054 18093 536 1 . 1 1 102 102 HIS C C 102 174.783 174.783 174.798 -0.015 18093 537 1 . 1 1 102 102 HIS CA C 102 55.701 55.701 56.042 -0.341 18093 538 1 . 1 1 102 102 HIS CB C 102 29.093 29.093 30.609 -1.516 18093 539 1 . 1 1 102 102 HIS H H 102 8.455 8.455 8.357 0.098 18093 540 1 . 1 1 103 103 THR N N 103 114.282 114.282 114.888 -0.606 18093 541 1 . 1 1 103 103 THR HA H 103 4.352 4.352 4.430 -0.078 18093 542 1 . 1 1 103 103 THR C C 103 175.104 175.104 174.830 0.274 18093 543 1 . 1 1 103 103 THR CA C 103 62.057 62.057 61.713 0.344 18093 544 1 . 1 1 103 103 THR CB C 103 69.966 69.966 69.455 0.511 18093 545 1 . 1 1 103 103 THR H H 103 8.069 8.069 8.063 0.006 18093 546 1 . 1 1 104 104 GLY N N 104 111.159 111.159 111.692 -0.533 18093 547 1 . 1 1 104 104 GLY C C 104 174.776 174.776 174.189 0.587 18093 548 1 . 1 1 104 104 GLY CA C 104 45.588 45.588 45.058 0.530 18093 549 1 . 1 1 104 104 GLY H H 104 8.393 8.393 8.377 0.016 18093 550 1 . 1 1 105 105 GLY N N 105 108.657 108.657 109.043 -0.386 18093 551 1 . 1 1 105 105 GLY C C 105 174.957 174.957 174.450 0.507 18093 552 1 . 1 1 105 105 GLY CA C 105 45.612 45.612 44.875 0.737 18093 553 1 . 1 1 105 105 GLY H H 105 8.275 8.275 8.302 -0.027 18093 554 1 . 1 1 106 106 GLY N N 106 108.870 108.870 109.062 -0.192 18093 555 1 . 1 1 106 106 GLY C C 106 174.877 174.877 173.763 1.114 18093 556 1 . 1 1 106 106 GLY CA C 106 45.665 45.665 45.019 0.646 18093 557 1 . 1 1 106 106 GLY H H 106 8.357 8.357 8.229 0.128 18093 558 1 . 1 1 107 107 GLY N N 107 108.476 108.476 108.895 -0.419 18093 559 1 . 1 1 107 107 GLY C C 107 174.877 174.877 174.748 0.129 18093 560 1 . 1 1 107 107 GLY CA C 107 45.696 45.696 45.396 0.300 18093 561 1 . 1 1 107 107 GLY H H 107 8.330 8.330 8.217 0.113 18093 562 1 . 1 1 108 108 GLY N N 108 108.486 108.486 109.837 -1.351 18093 563 1 . 1 1 108 108 GLY C C 108 175.345 175.345 175.369 -0.024 18093 564 1 . 1 1 108 108 GLY CA C 108 45.763 45.763 44.932 0.831 18093 565 1 . 1 1 108 108 GLY H H 108 8.328 8.328 8.458 -0.130 18093 566 1 . 1 1 109 109 ILE N N 109 120.433 120.433 119.868 0.565 18093 567 1 . 1 1 109 109 ILE HA H 109 3.968 3.968 3.953 0.015 18093 568 1 . 1 1 109 109 ILE C C 109 176.127 176.127 177.088 -0.961 18093 569 1 . 1 1 109 109 ILE CA C 109 62.735 62.735 63.386 -0.651 18093 570 1 . 1 1 109 109 ILE CB C 109 38.125 38.125 38.006 0.119 18093 571 1 . 1 1 109 109 ILE H H 109 8.192 8.192 7.995 0.197 18093 572 1 . 1 1 110 110 ASP N N 110 121.148 121.148 120.008 1.140 18093 573 1 . 1 1 110 110 ASP HA H 110 4.306 4.306 4.580 -0.274 18093 574 1 . 1 1 110 110 ASP C C 110 177.651 177.651 178.256 -0.605 18093 575 1 . 1 1 110 110 ASP CA C 110 56.776 56.776 58.031 -1.255 18093 576 1 . 1 1 110 110 ASP CB C 110 41.097 41.097 40.551 0.546 18093 577 1 . 1 1 110 110 ASP H H 110 8.427 8.427 8.594 -0.167 18093 578 1 . 1 1 111 111 ARG N N 111 119.228 119.228 119.298 -0.070 18093 579 1 . 1 1 111 111 ARG HA H 111 3.996 3.996 4.261 -0.265 18093 580 1 . 1 1 111 111 ARG C C 111 177.786 177.786 178.932 -1.146 18093 581 1 . 1 1 111 111 ARG CA C 111 58.942 58.942 59.039 -0.097 18093 582 1 . 1 1 111 111 ARG CB C 111 30.196 30.196 29.912 0.284 18093 583 1 . 1 1 111 111 ARG H H 111 7.850 7.850 8.438 -0.588 18093 584 1 . 1 1 112 112 ILE N N 112 118.000 118.000 119.632 -1.632 18093 585 1 . 1 1 112 112 ILE HA H 112 3.813 3.813 4.114 -0.301 18093 586 1 . 1 1 112 112 ILE C C 112 177.496 177.496 177.940 -0.444 18093 587 1 . 1 1 112 112 ILE CA C 112 64.812 64.812 62.226 2.586 18093 588 1 . 1 1 112 112 ILE CB C 112 37.727 37.727 36.917 0.810 18093 589 1 . 1 1 112 112 ILE H H 112 7.764 7.764 7.750 0.014 18093 590 1 . 1 1 113 113 PHE N N 113 118.367 118.367 122.116 -3.749 18093 591 1 . 1 1 113 113 PHE HA H 113 4.255 4.255 4.271 -0.016 18093 592 1 . 1 1 113 113 PHE C C 113 177.218 177.218 177.374 -0.157 18093 593 1 . 1 1 113 113 PHE CA C 113 61.433 61.433 62.375 -0.942 18093 594 1 . 1 1 113 113 PHE CB C 113 38.807 38.807 39.189 -0.382 18093 595 1 . 1 1 113 113 PHE H H 113 7.963 7.963 7.968 -0.005 18093 596 1 . 1 1 114 114 LEU N N 114 118.921 118.921 117.518 1.403 18093 597 1 . 1 1 114 114 LEU HA H 114 3.997 3.997 3.950 0.047 18093 598 1 . 1 1 114 114 LEU C C 114 178.297 178.297 178.413 -0.116 18093 599 1 . 1 1 114 114 LEU CA C 114 58.611 58.611 58.232 0.379 18093 600 1 . 1 1 114 114 LEU CB C 114 41.952 41.952 41.262 0.690 18093 601 1 . 1 1 114 114 LEU H H 114 7.939 7.939 8.071 -0.132 18093 602 1 . 1 1 115 115 TRP N N 115 117.464 117.464 119.470 -2.006 18093 603 1 . 1 1 115 115 TRP HA H 115 4.374 4.374 4.379 -0.005 18093 604 1 . 1 1 115 115 TRP C C 115 178.572 178.572 178.255 0.317 18093 605 1 . 1 1 115 115 TRP CA C 115 60.922 60.922 59.789 1.133 18093 606 1 . 1 1 115 115 TRP CB C 115 28.507 28.507 29.773 -1.266 18093 607 1 . 1 1 115 115 TRP H H 115 7.969 7.969 7.621 0.348 18093 608 1 . 1 1 116 116 MET N N 116 117.069 117.069 118.922 -1.853 18093 609 1 . 1 1 116 116 MET HA H 116 4.065 4.065 4.223 -0.158 18093 610 1 . 1 1 116 116 MET C C 116 177.425 177.425 178.191 -0.766 18093 611 1 . 1 1 116 116 MET CA C 116 59.289 59.289 59.106 0.183 18093 612 1 . 1 1 116 116 MET CB C 116 31.692 31.692 32.526 -0.834 18093 613 1 . 1 1 116 116 MET H H 116 8.465 8.465 7.721 0.744 18093 614 1 . 1 1 117 117 PHE N N 117 118.755 118.755 117.785 0.970 18093 615 1 . 1 1 117 117 PHE HA H 117 4.099 4.099 4.088 0.011 18093 616 1 . 1 1 117 117 PHE C C 117 177.965 177.965 178.252 -0.287 18093 617 1 . 1 1 117 117 PHE CA C 117 61.708 61.708 62.229 -0.521 18093 618 1 . 1 1 117 117 PHE CB C 117 39.185 39.185 38.261 0.924 18093 619 1 . 1 1 117 117 PHE H H 117 8.418 8.418 7.848 0.570 18093 620 1 . 1 1 118 118 ILE N N 118 119.133 119.133 115.266 3.867 18093 621 1 . 1 1 118 118 ILE HA H 118 3.344 3.344 3.899 -0.555 18093 622 1 . 1 1 118 118 ILE C C 118 177.244 177.244 177.504 -0.260 18093 623 1 . 1 1 118 118 ILE CA C 118 65.825 65.825 64.132 1.693 18093 624 1 . 1 1 118 118 ILE CB C 118 37.548 37.548 37.803 -0.255 18093 625 1 . 1 1 118 118 ILE H H 118 8.266 8.266 7.694 0.572 18093 626 1 . 1 1 119 119 ILE N N 119 118.846 118.846 121.495 -2.649 18093 627 1 . 1 1 119 119 ILE HA H 119 3.572 3.572 3.931 -0.359 18093 628 1 . 1 1 119 119 ILE C C 119 177.523 177.523 177.556 -0.033 18093 629 1 . 1 1 119 119 ILE CA C 119 65.889 65.889 65.174 0.715 18093 630 1 . 1 1 119 119 ILE CB C 119 37.564 37.564 38.275 -0.711 18093 631 1 . 1 1 119 119 ILE H H 119 8.308 8.308 7.310 0.998 18093 632 1 . 1 1 120 120 VAL N N 120 119.228 119.228 117.664 1.564 18093 633 1 . 1 1 120 120 VAL HA H 120 3.508 3.508 3.826 -0.318 18093 634 1 . 1 1 120 120 VAL C C 120 177.651 177.651 177.372 0.279 18093 635 1 . 1 1 120 120 VAL CA C 120 67.601 67.601 65.542 2.059 18093 636 1 . 1 1 120 120 VAL CB C 120 31.406 31.406 30.832 0.575 18093 637 1 . 1 1 120 120 VAL H H 120 8.399 8.399 7.966 0.433 18093 638 1 . 1 1 121 121 CYS N N 121 117.151 117.151 119.505 -2.354 18093 639 1 . 1 1 121 121 CYS HA H 121 3.903 3.903 4.092 -0.190 18093 640 1 . 1 1 121 121 CYS C C 121 177.719 177.719 176.936 0.783 18093 641 1 . 1 1 121 121 CYS CA C 121 64.298 64.298 63.896 0.402 18093 642 1 . 1 1 121 121 CYS CB C 121 26.677 26.677 26.977 -0.300 18093 643 1 . 1 1 121 121 CYS H H 121 8.008 8.008 7.504 0.504 18093 644 1 . 1 1 122 122 LEU N N 122 121.402 121.402 120.005 1.397 18093 645 1 . 1 1 122 122 LEU HA H 122 3.983 3.983 4.169 -0.186 18093 646 1 . 1 1 122 122 LEU C C 122 178.282 178.282 178.938 -0.656 18093 647 1 . 1 1 122 122 LEU CA C 122 58.545 58.545 57.793 0.752 18093 648 1 . 1 1 122 122 LEU CB C 122 41.966 41.966 41.295 0.671 18093 649 1 . 1 1 122 122 LEU H H 122 8.417 8.417 7.664 0.753 18093 650 1 . 1 1 123 123 LEU N N 123 118.543 118.543 120.280 -1.737 18093 651 1 . 1 1 123 123 LEU HA H 123 3.920 3.920 4.033 -0.113 18093 652 1 . 1 1 123 123 LEU C C 123 179.028 179.028 178.740 0.288 18093 653 1 . 1 1 123 123 LEU CA C 123 58.117 58.117 58.472 -0.355 18093 654 1 . 1 1 123 123 LEU CB C 123 42.056 42.056 40.983 1.073 18093 655 1 . 1 1 123 123 LEU H H 123 8.590 8.590 7.712 0.878 18093 656 1 . 1 1 124 124 GLY N N 124 104.896 104.896 105.454 -0.558 18093 657 1 . 1 1 124 124 GLY C C 124 173.932 173.932 176.066 -2.134 18093 658 1 . 1 1 124 124 GLY CA C 124 47.227 47.227 47.517 -0.290 18093 659 1 . 1 1 124 124 GLY H H 124 8.601 8.601 8.382 0.219 18093 660 1 . 1 1 125 125 THR N N 125 115.403 115.403 119.138 -3.735 18093 661 1 . 1 1 125 125 THR HA H 125 3.686 3.686 3.857 -0.171 18093 662 1 . 1 1 125 125 THR C C 125 176.407 176.407 176.645 -0.238 18093 663 1 . 1 1 125 125 THR CA C 125 67.565 67.565 66.945 0.620 18093 664 1 . 1 1 125 125 THR CB C 125 68.143 68.143 68.598 -0.455 18093 665 1 . 1 1 125 125 THR H H 125 7.734 7.734 7.463 0.271 18093 666 1 . 1 1 126 126 VAL N N 126 119.056 119.056 121.167 -2.111 18093 667 1 . 1 1 126 126 VAL HA H 126 3.539 3.539 3.696 -0.157 18093 668 1 . 1 1 126 126 VAL C C 126 177.628 177.628 178.098 -0.470 18093 669 1 . 1 1 126 126 VAL CA C 126 66.601 66.601 66.732 -0.131 18093 670 1 . 1 1 126 126 VAL CB C 126 31.494 31.494 31.508 -0.014 18093 671 1 . 1 1 126 126 VAL H H 126 8.015 8.015 8.077 -0.062 18093 672 1 . 1 1 127 127 GLY N N 127 104.644 104.644 107.336 -2.692 18093 673 1 . 1 1 127 127 GLY C C 127 173.933 173.933 175.753 -1.820 18093 674 1 . 1 1 127 127 GLY CA C 127 47.281 47.281 47.089 0.192 18093 675 1 . 1 1 127 127 GLY H H 127 8.248 8.248 8.417 -0.169 18093 676 1 . 1 1 128 128 LEU N N 128 117.354 117.354 121.050 -3.696 18093 677 1 . 1 1 128 128 LEU HA H 128 4.012 4.012 4.123 -0.111 18093 678 1 . 1 1 128 128 LEU C C 128 177.443 177.443 177.832 -0.389 18093 679 1 . 1 1 128 128 LEU CA C 128 56.626 56.626 56.932 -0.306 18093 680 1 . 1 1 128 128 LEU CB C 128 42.260 42.260 41.817 0.443 18093 681 1 . 1 1 128 128 LEU H H 128 7.568 7.568 7.725 -0.157 18093 682 1 . 1 1 129 129 PHE N N 129 113.971 113.971 116.584 -2.613 18093 683 1 . 1 1 129 129 PHE HA H 129 4.458 4.458 4.328 0.130 18093 684 1 . 1 1 129 129 PHE C C 129 176.216 176.216 176.318 -0.102 18093 685 1 . 1 1 129 129 PHE CA C 129 58.385 58.385 60.383 -1.998 18093 686 1 . 1 1 129 129 PHE CB C 129 39.719 39.719 39.837 -0.118 18093 687 1 . 1 1 129 129 PHE H H 129 7.639 7.639 7.599 0.040 18093 688 1 . 1 1 130 130 LEU N N 130 117.752 117.752 119.300 -1.548 18093 689 1 . 1 1 130 130 LEU HA H 130 4.433 4.433 4.555 -0.122 18093 690 1 . 1 1 130 130 LEU CA C 130 54.156 54.156 53.111 1.045 18093 691 1 . 1 1 130 130 LEU H H 130 8.099 8.099 7.691 0.408 18093 692 1 . 1 1 131 131 PRO HA H 131 4.450 4.450 4.873 -0.423 18093 693 1 . 1 1 131 131 PRO CA C 131 63.899 63.899 61.618 2.281 18093 694 1 . 1 1 132 132 PRO HA H 132 4.262 4.262 4.406 -0.143 18093 695 1 . 1 1 132 132 PRO C C 132 177.616 177.616 178.102 -0.486 18093 696 1 . 1 1 132 132 PRO CA C 132 64.980 64.980 64.616 0.364 18093 697 1 . 1 1 132 132 PRO CB C 132 31.625 31.625 32.212 -0.587 18093 698 1 . 1 1 133 133 TRP N N 133 115.508 115.508 119.749 -4.240 18093 699 1 . 1 1 133 133 TRP HA H 133 4.592 4.592 4.444 0.148 18093 700 1 . 1 1 133 133 TRP C C 133 176.842 176.842 176.315 0.527 18093 701 1 . 1 1 133 133 TRP CA C 133 57.283 57.283 59.173 -1.890 18093 702 1 . 1 1 133 133 TRP CB C 133 28.596 28.596 29.078 -0.482 18093 703 1 . 1 1 133 133 TRP H H 133 7.311 7.311 8.284 -0.973 18093 704 1 . 1 1 134 134 LEU N N 134 119.570 119.570 116.999 2.571 18093 705 1 . 1 1 134 134 LEU HA H 134 4.177 4.177 4.379 -0.202 18093 706 1 . 1 1 134 134 LEU C C 134 175.768 175.768 176.693 -0.925 18093 707 1 . 1 1 134 134 LEU CA C 134 55.621 55.621 54.391 1.230 18093 708 1 . 1 1 134 134 LEU CB C 134 42.648 42.648 41.544 1.104 18093 709 1 . 1 1 134 134 LEU H H 134 7.453 7.453 7.723 -0.270 18093 710 1 . 1 1 135 135 ALA N N 135 119.004 119.004 122.111 -3.107 18093 711 1 . 1 1 135 135 ALA HA H 135 4.223 4.223 4.316 -0.093 18093 712 1 . 1 1 135 135 ALA C C 135 177.170 177.170 178.101 -0.931 18093 713 1 . 1 1 135 135 ALA CA C 135 52.456 52.456 53.725 -1.268 18093 714 1 . 1 1 135 135 ALA CB C 135 19.736 19.736 19.676 0.060 18093 715 1 . 1 1 135 135 ALA H H 135 7.541 7.541 7.729 -0.188 18093 716 1 . 1 1 136 136 GLY N N 136 105.879 105.879 106.739 -0.860 18093 717 1 . 1 1 136 136 GLY C C 136 173.042 173.042 174.437 -1.395 18093 718 1 . 1 1 136 136 GLY CA C 136 45.693 45.693 45.183 0.510 18093 719 1 . 1 1 136 136 GLY H H 136 7.846 7.846 8.171 -0.325 18093 stop_ save_