data_25061 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25061 _Entry.PDB_ID 2MR5 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 25061 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 GLY CA C 2 45.319 45.319 45.504 -0.185 25061 2 1 1 . 1 1 3 3 THR HA H 3 4.820 4.820 4.258 0.562 25061 3 1 1 . 1 1 3 3 THR C C 3 172.374 172.374 173.683 -1.309 25061 4 1 1 . 1 1 3 3 THR CA C 3 62.760 62.760 61.033 1.727 25061 5 1 1 . 1 1 3 3 THR CB C 3 71.441 71.441 70.107 1.334 25061 6 1 1 . 1 1 4 4 VAL N N 4 126.881 126.881 124.735 2.146 25061 7 1 1 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.674 -0.106 25061 8 1 1 . 1 1 4 4 VAL C C 4 173.116 173.116 174.760 -1.644 25061 9 1 1 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.748 -1.293 25061 10 1 1 . 1 1 4 4 VAL CB C 4 33.800 33.800 32.688 1.112 25061 11 1 1 . 1 1 4 4 VAL H H 4 9.097 9.097 8.685 0.412 25061 12 1 1 . 1 1 5 5 VAL N N 5 127.172 127.172 123.100 4.072 25061 13 1 1 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.473 -0.586 25061 14 1 1 . 1 1 5 5 VAL C C 5 174.091 174.091 175.087 -0.996 25061 15 1 1 . 1 1 5 5 VAL CA C 5 60.118 60.118 58.964 1.154 25061 16 1 1 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.531 -0.596 25061 17 1 1 . 1 1 5 5 VAL H H 5 8.811 8.811 8.842 -0.031 25061 18 1 1 . 1 1 6 6 ILE N N 6 127.577 127.577 128.809 -1.232 25061 19 1 1 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.561 0.059 25061 20 1 1 . 1 1 6 6 ILE C C 6 173.328 173.328 175.578 -2.250 25061 21 1 1 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.552 0.280 25061 22 1 1 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.392 1.538 25061 23 1 1 . 1 1 6 6 ILE H H 6 9.210 9.210 8.548 0.662 25061 24 1 1 . 1 1 7 7 VAL N N 7 129.024 129.024 130.060 -1.036 25061 25 1 1 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.630 0.175 25061 26 1 1 . 1 1 7 7 VAL C C 7 173.561 173.561 175.269 -1.708 25061 27 1 1 . 1 1 7 7 VAL CA C 7 60.849 60.849 62.029 -1.180 25061 28 1 1 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.498 0.862 25061 29 1 1 . 1 1 7 7 VAL H H 7 9.294 9.294 8.246 1.048 25061 30 1 1 . 1 1 8 8 VAL N N 8 125.318 125.318 130.248 -4.930 25061 31 1 1 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.473 -0.077 25061 32 1 1 . 1 1 8 8 VAL C C 8 175.723 175.723 175.190 0.533 25061 33 1 1 . 1 1 8 8 VAL CA C 8 59.617 59.617 60.473 -0.856 25061 34 1 1 . 1 1 8 8 VAL CB C 8 34.915 34.915 34.696 0.219 25061 35 1 1 . 1 1 8 8 VAL H H 8 8.898 8.898 8.825 0.073 25061 36 1 1 . 1 1 9 9 SER N N 9 116.544 116.544 120.465 -3.921 25061 37 1 1 . 1 1 9 9 SER HA H 9 4.724 4.724 4.892 -0.168 25061 38 1 1 . 1 1 9 9 SER C C 9 174.552 174.552 174.519 0.033 25061 39 1 1 . 1 1 9 9 SER CA C 9 57.419 57.419 56.598 0.821 25061 40 1 1 . 1 1 9 9 SER CB C 9 64.998 64.998 66.043 -1.046 25061 41 1 1 . 1 1 9 9 SER H H 9 7.833 7.833 8.045 -0.212 25061 42 1 1 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.590 0.322 25061 43 1 1 . 1 1 10 10 ASN C C 10 176.170 176.170 175.137 1.033 25061 44 1 1 . 1 1 10 10 ASN CA C 10 54.141 54.141 56.142 -2.001 25061 45 1 1 . 1 1 10 10 ASN CB C 10 38.626 38.626 38.654 -0.028 25061 46 1 1 . 1 1 11 11 ASP N N 11 120.164 120.164 117.402 2.762 25061 47 1 1 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.717 0.126 25061 48 1 1 . 1 1 11 11 ASP C C 11 176.148 176.148 177.095 -0.947 25061 49 1 1 . 1 1 11 11 ASP CA C 11 52.620 52.620 53.346 -0.726 25061 50 1 1 . 1 1 11 11 ASP CB C 11 42.631 42.631 42.572 0.059 25061 51 1 1 . 1 1 11 11 ASP H H 11 8.142 8.142 8.112 0.030 25061 52 1 1 . 1 1 12 12 GLU N N 12 127.184 127.184 124.104 3.080 25061 53 1 1 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.042 -0.189 25061 54 1 1 . 1 1 12 12 GLU C C 12 177.853 177.853 178.624 -0.771 25061 55 1 1 . 1 1 12 12 GLU CA C 12 59.547 59.547 59.604 -0.057 25061 56 1 1 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.949 -0.130 25061 57 1 1 . 1 1 12 12 GLU H H 12 9.152 9.152 8.809 0.343 25061 58 1 1 . 1 1 13 13 ARG N N 13 119.026 119.026 119.337 -0.311 25061 59 1 1 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.075 0.028 25061 60 1 1 . 1 1 13 13 ARG C C 13 179.151 179.151 178.997 0.154 25061 61 1 1 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.951 -0.008 25061 62 1 1 . 1 1 13 13 ARG CB C 13 28.757 28.757 29.770 -1.013 25061 63 1 1 . 1 1 13 13 ARG H H 13 8.389 8.389 7.828 0.561 25061 64 1 1 . 1 1 14 14 ILE N N 14 119.238 119.238 120.438 -1.200 25061 65 1 1 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.843 -0.242 25061 66 1 1 . 1 1 14 14 ILE C C 14 177.905 177.905 177.801 0.104 25061 67 1 1 . 1 1 14 14 ILE CA C 14 64.666 64.666 63.609 1.057 25061 68 1 1 . 1 1 14 14 ILE CB C 14 36.780 36.780 36.739 0.042 25061 69 1 1 . 1 1 14 14 ILE H H 14 7.254 7.254 7.741 -0.487 25061 70 1 1 . 1 1 15 15 LEU N N 15 117.008 117.008 119.870 -2.862 25061 71 1 1 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.123 -0.202 25061 72 1 1 . 1 1 15 15 LEU C C 15 178.062 178.062 179.557 -1.495 25061 73 1 1 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.035 0.376 25061 74 1 1 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.448 -0.279 25061 75 1 1 . 1 1 15 15 LEU H H 15 7.412 7.412 7.631 -0.219 25061 76 1 1 . 1 1 16 16 GLU N N 16 117.637 117.637 118.947 -1.310 25061 77 1 1 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.927 -0.226 25061 78 1 1 . 1 1 16 16 GLU C C 16 179.182 179.182 178.739 0.443 25061 79 1 1 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.412 0.005 25061 80 1 1 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.022 0.437 25061 81 1 1 . 1 1 16 16 GLU H H 16 7.981 7.981 8.072 -0.090 25061 82 1 1 . 1 1 17 17 GLU N N 17 119.759 119.759 121.599 -1.840 25061 83 1 1 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.290 -0.274 25061 84 1 1 . 1 1 17 17 GLU C C 17 179.949 179.949 179.178 0.771 25061 85 1 1 . 1 1 17 17 GLU CA C 17 59.195 59.195 59.088 0.107 25061 86 1 1 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.699 -0.159 25061 87 1 1 . 1 1 17 17 GLU H H 17 8.248 8.248 7.986 0.262 25061 88 1 1 . 1 1 18 18 LEU N N 18 119.764 119.764 119.133 0.631 25061 89 1 1 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.161 -0.080 25061 90 1 1 . 1 1 18 18 LEU C C 18 177.620 177.620 178.988 -1.368 25061 91 1 1 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.787 -0.109 25061 92 1 1 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.505 -0.395 25061 93 1 1 . 1 1 18 18 LEU H H 18 8.486 8.486 8.435 0.051 25061 94 1 1 . 1 1 19 19 LEU N N 19 123.102 123.102 120.745 2.357 25061 95 1 1 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.394 0.268 25061 96 1 1 . 1 1 19 19 LEU C C 19 178.343 178.343 178.140 0.203 25061 97 1 1 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.195 1.041 25061 98 1 1 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.218 -0.567 25061 99 1 1 . 1 1 19 19 LEU H H 19 7.870 7.870 7.528 0.342 25061 100 1 1 . 1 1 20 20 GLU N N 20 117.884 117.884 118.629 -0.745 25061 101 1 1 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.902 0.002 25061 102 1 1 . 1 1 20 20 GLU C C 20 177.707 177.707 179.225 -1.518 25061 103 1 1 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.487 -0.095 25061 104 1 1 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.439 -0.462 25061 105 1 1 . 1 1 20 20 GLU H H 20 7.497 7.497 7.652 -0.155 25061 106 1 1 . 1 1 21 21 VAL N N 21 117.709 117.709 120.173 -2.464 25061 107 1 1 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.654 -0.030 25061 108 1 1 . 1 1 21 21 VAL C C 21 178.523 178.523 178.011 0.512 25061 109 1 1 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.538 -0.341 25061 110 1 1 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.815 -0.668 25061 111 1 1 . 1 1 21 21 VAL H H 21 7.514 7.514 7.682 -0.168 25061 112 1 1 . 1 1 22 22 VAL N N 22 121.233 121.233 118.781 2.452 25061 113 1 1 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.646 -0.200 25061 114 1 1 . 1 1 22 22 VAL C C 22 176.868 176.868 178.003 -1.135 25061 115 1 1 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.245 0.768 25061 116 1 1 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.756 -0.442 25061 117 1 1 . 1 1 22 22 VAL H H 22 7.863 7.863 7.471 0.392 25061 118 1 1 . 1 1 23 23 LEU N N 23 118.101 118.101 119.930 -1.829 25061 119 1 1 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.017 0.048 25061 120 1 1 . 1 1 23 23 LEU C C 23 179.701 179.701 178.544 1.157 25061 121 1 1 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.764 -0.467 25061 122 1 1 . 1 1 23 23 LEU CB C 23 41.704 41.704 42.150 -0.446 25061 123 1 1 . 1 1 23 23 LEU H H 23 8.151 8.151 8.482 -0.331 25061 124 1 1 . 1 1 24 24 LYS N N 24 114.622 114.622 116.783 -2.161 25061 125 1 1 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.115 0.022 25061 126 1 1 . 1 1 24 24 LYS C C 24 178.062 178.062 178.900 -0.838 25061 127 1 1 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.500 -1.132 25061 128 1 1 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.012 0.582 25061 129 1 1 . 1 1 24 24 LYS H H 24 7.823 7.823 7.671 0.152 25061 130 1 1 . 1 1 25 25 SER N N 25 115.474 115.474 115.992 -0.518 25061 131 1 1 . 1 1 25 25 SER HA H 25 4.377 4.377 4.317 0.060 25061 132 1 1 . 1 1 25 25 SER C C 25 174.520 174.520 174.322 0.198 25061 133 1 1 . 1 1 25 25 SER CA C 25 61.049 61.049 60.540 0.509 25061 134 1 1 . 1 1 25 25 SER CB C 25 63.777 63.777 64.040 -0.263 25061 135 1 1 . 1 1 25 25 SER H H 25 7.798 7.798 7.658 0.140 25061 136 1 1 . 1 1 26 26 ASP N N 26 117.424 117.424 117.939 -0.515 25061 137 1 1 . 1 1 26 26 ASP HA H 26 4.886 4.886 4.923 -0.037 25061 138 1 1 . 1 1 26 26 ASP C C 26 173.521 173.521 174.037 -0.516 25061 139 1 1 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.957 -0.909 25061 140 1 1 . 1 1 26 26 ASP CB C 26 42.202 42.202 43.107 -0.905 25061 141 1 1 . 1 1 26 26 ASP H H 26 7.990 7.990 7.975 0.015 25061 142 1 1 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.670 -0.025 25061 143 1 1 . 1 1 27 27 PRO C C 27 177.016 177.016 176.723 0.293 25061 144 1 1 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.694 -0.093 25061 145 1 1 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.611 -0.438 25061 146 1 1 . 1 1 28 28 ASN N N 28 115.839 115.839 116.696 -0.857 25061 147 1 1 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.741 -0.049 25061 148 1 1 . 1 1 28 28 ASN C C 28 175.701 175.701 175.370 0.331 25061 149 1 1 . 1 1 28 28 ASN CA C 28 53.472 53.472 54.202 -0.730 25061 150 1 1 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.825 -0.612 25061 151 1 1 . 1 1 28 28 ASN H H 28 8.608 8.608 8.150 0.458 25061 152 1 1 . 1 1 29 29 VAL N N 29 120.770 120.770 122.338 -1.568 25061 153 1 1 . 1 1 29 29 VAL HA H 29 3.815 3.815 4.053 -0.238 25061 154 1 1 . 1 1 29 29 VAL C C 29 175.023 175.023 175.782 -0.759 25061 155 1 1 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.233 -0.681 25061 156 1 1 . 1 1 29 29 VAL CB C 29 32.147 32.147 31.221 0.926 25061 157 1 1 . 1 1 29 29 VAL H H 29 7.428 7.428 7.772 -0.344 25061 158 1 1 . 1 1 30 30 LYS N N 30 127.345 127.345 129.555 -2.210 25061 159 1 1 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.340 0.139 25061 160 1 1 . 1 1 30 30 LYS C C 30 174.777 174.777 176.424 -1.647 25061 161 1 1 . 1 1 30 30 LYS CA C 30 55.204 55.204 54.866 0.338 25061 162 1 1 . 1 1 30 30 LYS CB C 30 31.949 31.949 30.732 1.217 25061 163 1 1 . 1 1 30 30 LYS H H 30 8.457 8.457 8.270 0.187 25061 164 1 1 . 1 1 31 31 THR N N 31 113.552 113.552 117.372 -3.820 25061 165 1 1 . 1 1 31 31 THR HA H 31 5.723 5.723 5.122 0.601 25061 166 1 1 . 1 1 31 31 THR C C 31 174.593 174.593 174.828 -0.235 25061 167 1 1 . 1 1 31 31 THR CA C 31 59.030 59.030 61.218 -2.188 25061 168 1 1 . 1 1 31 31 THR CB C 31 72.206 72.206 68.924 3.282 25061 169 1 1 . 1 1 31 31 THR H H 31 8.164 8.164 8.254 -0.090 25061 170 1 1 . 1 1 32 32 VAL N N 32 119.206 119.206 127.768 -8.562 25061 171 1 1 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.313 0.092 25061 172 1 1 . 1 1 32 32 VAL C C 32 172.663 172.663 175.191 -2.528 25061 173 1 1 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.101 -0.029 25061 174 1 1 . 1 1 32 32 VAL CB C 32 35.051 35.051 33.244 1.807 25061 175 1 1 . 1 1 32 32 VAL H H 32 8.615 8.615 8.910 -0.295 25061 176 1 1 . 1 1 33 33 ARG N N 33 130.278 130.278 128.194 2.084 25061 177 1 1 . 1 1 33 33 ARG HA H 33 5.331 5.331 4.725 0.606 25061 178 1 1 . 1 1 33 33 ARG C C 33 173.836 173.836 175.928 -2.092 25061 179 1 1 . 1 1 33 33 ARG CA C 33 54.150 54.150 56.549 -2.399 25061 180 1 1 . 1 1 33 33 ARG CB C 33 30.028 30.028 30.340 -0.312 25061 181 1 1 . 1 1 33 33 ARG H H 33 8.996 8.996 8.896 0.100 25061 182 1 1 . 1 1 34 34 THR N N 34 121.695 121.695 117.751 3.944 25061 183 1 1 . 1 1 34 34 THR HA H 34 4.483 4.483 4.352 0.131 25061 184 1 1 . 1 1 34 34 THR C C 34 169.769 169.769 173.774 -4.005 25061 185 1 1 . 1 1 34 34 THR CA C 34 60.814 60.814 62.333 -1.519 25061 186 1 1 . 1 1 34 34 THR CB C 34 67.402 67.402 70.132 -2.730 25061 187 1 1 . 1 1 34 34 THR H H 34 8.126 8.126 8.500 -0.374 25061 188 1 1 . 1 1 35 35 ASP N N 35 122.198 122.198 119.527 2.671 25061 189 1 1 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.214 0.610 25061 190 1 1 . 1 1 35 35 ASP C C 35 174.790 174.790 174.410 0.380 25061 191 1 1 . 1 1 35 35 ASP CA C 35 53.386 53.386 55.554 -2.168 25061 192 1 1 . 1 1 35 35 ASP CB C 35 41.848 41.848 39.796 2.052 25061 193 1 1 . 1 1 35 35 ASP H H 35 7.983 7.983 8.380 -0.397 25061 194 1 1 . 1 1 36 36 ASP N N 36 121.091 121.091 117.342 3.749 25061 195 1 1 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.601 -0.008 25061 196 1 1 . 1 1 36 36 ASP C C 36 176.189 176.189 176.396 -0.207 25061 197 1 1 . 1 1 36 36 ASP CA C 36 53.055 53.055 53.193 -0.138 25061 198 1 1 . 1 1 36 36 ASP CB C 36 42.159 42.159 42.449 -0.290 25061 199 1 1 . 1 1 36 36 ASP H H 36 8.157 8.157 7.814 0.343 25061 200 1 1 . 1 1 37 37 LYS N N 37 125.839 125.839 118.615 7.224 25061 201 1 1 . 1 1 37 37 LYS HA H 37 3.722 3.722 4.265 -0.543 25061 202 1 1 . 1 1 37 37 LYS C C 37 176.870 176.870 177.914 -1.044 25061 203 1 1 . 1 1 37 37 LYS CA C 37 59.404 59.404 57.910 1.494 25061 204 1 1 . 1 1 37 37 LYS CB C 37 32.394 32.394 32.880 -0.486 25061 205 1 1 . 1 1 37 37 LYS H H 37 8.843 8.843 8.383 0.460 25061 206 1 1 . 1 1 38 38 GLU N N 38 118.369 118.369 120.334 -1.965 25061 207 1 1 . 1 1 38 38 GLU HA H 38 4.007 4.007 4.022 -0.015 25061 208 1 1 . 1 1 38 38 GLU C C 38 179.502 179.502 178.358 1.144 25061 209 1 1 . 1 1 38 38 GLU CA C 38 58.670 58.670 59.008 -0.338 25061 210 1 1 . 1 1 38 38 GLU CB C 38 28.474 28.474 29.125 -0.650 25061 211 1 1 . 1 1 38 38 GLU H H 38 8.182 8.182 7.996 0.186 25061 212 1 1 . 1 1 39 39 LYS N N 39 121.722 121.722 120.514 1.208 25061 213 1 1 . 1 1 39 39 LYS HA H 39 4.165 4.165 3.977 0.188 25061 214 1 1 . 1 1 39 39 LYS C C 39 178.500 178.500 178.198 0.302 25061 215 1 1 . 1 1 39 39 LYS CA C 39 57.736 57.736 59.705 -1.969 25061 216 1 1 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.444 -1.306 25061 217 1 1 . 1 1 39 39 LYS H H 39 7.524 7.524 8.169 -0.645 25061 218 1 1 . 1 1 40 40 VAL N N 40 117.199 117.199 118.252 -1.053 25061 219 1 1 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.625 -0.397 25061 220 1 1 . 1 1 40 40 VAL C C 40 177.362 177.362 178.020 -0.658 25061 221 1 1 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.577 1.065 25061 222 1 1 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.526 -0.622 25061 223 1 1 . 1 1 40 40 VAL H H 40 7.883 7.883 8.061 -0.178 25061 224 1 1 . 1 1 41 41 LYS N N 41 117.677 117.677 118.903 -1.226 25061 225 1 1 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.734 -0.292 25061 226 1 1 . 1 1 41 41 LYS C C 41 177.686 177.686 178.910 -1.224 25061 227 1 1 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.846 0.963 25061 228 1 1 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.424 0.191 25061 229 1 1 . 1 1 41 41 LYS H H 41 7.567 7.567 7.386 0.181 25061 230 1 1 . 1 1 42 42 GLU N N 42 118.369 118.369 118.264 0.105 25061 231 1 1 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.059 -0.052 25061 232 1 1 . 1 1 42 42 GLU C C 42 179.725 179.725 179.175 0.550 25061 233 1 1 . 1 1 42 42 GLU CA C 42 59.069 59.069 58.839 0.230 25061 234 1 1 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.067 0.472 25061 235 1 1 . 1 1 42 42 GLU H H 42 7.634 7.634 7.678 -0.044 25061 236 1 1 . 1 1 43 43 GLU N N 43 117.906 117.906 119.258 -1.352 25061 237 1 1 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.184 -0.001 25061 238 1 1 . 1 1 43 43 GLU C C 43 179.757 179.757 179.238 0.519 25061 239 1 1 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.118 0.248 25061 240 1 1 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.169 -0.328 25061 241 1 1 . 1 1 43 43 GLU H H 43 8.162 8.162 8.143 0.019 25061 242 1 1 . 1 1 44 44 ILE N N 44 122.291 122.291 120.981 1.310 25061 243 1 1 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.660 -0.048 25061 244 1 1 . 1 1 44 44 ILE C C 44 177.101 177.101 177.726 -0.625 25061 245 1 1 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.966 0.389 25061 246 1 1 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.841 -0.381 25061 247 1 1 . 1 1 44 44 ILE H H 44 8.742 8.742 8.252 0.490 25061 248 1 1 . 1 1 45 45 GLU N N 45 119.892 119.892 120.834 -0.942 25061 249 1 1 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.098 -0.040 25061 250 1 1 . 1 1 45 45 GLU C C 45 178.991 178.991 178.935 0.056 25061 251 1 1 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.453 0.212 25061 252 1 1 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.361 -0.200 25061 253 1 1 . 1 1 45 45 GLU H H 45 8.171 8.171 7.918 0.253 25061 254 1 1 . 1 1 46 46 LYS N N 46 118.064 118.064 118.578 -0.514 25061 255 1 1 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.054 -0.072 25061 256 1 1 . 1 1 46 46 LYS C C 46 178.837 178.837 178.977 -0.140 25061 257 1 1 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.441 0.300 25061 258 1 1 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.218 0.225 25061 259 1 1 . 1 1 46 46 LYS H H 46 7.785 7.785 7.532 0.253 25061 260 1 1 . 1 1 47 47 ALA N N 47 121.817 121.817 122.526 -0.709 25061 261 1 1 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.059 -0.028 25061 262 1 1 . 1 1 47 47 ALA C C 47 179.859 179.859 179.064 0.795 25061 263 1 1 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.332 -0.037 25061 264 1 1 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.540 -0.884 25061 265 1 1 . 1 1 47 47 ALA H H 47 8.123 8.123 8.003 0.120 25061 266 1 1 . 1 1 48 48 ARG N N 48 119.080 119.080 117.088 1.992 25061 267 1 1 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.060 0.029 25061 268 1 1 . 1 1 48 48 ARG C C 48 180.155 180.155 178.534 1.621 25061 269 1 1 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.749 0.448 25061 270 1 1 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.781 -0.271 25061 271 1 1 . 1 1 48 48 ARG H H 48 8.768 8.768 8.137 0.631 25061 272 1 1 . 1 1 49 49 LYS N N 49 119.951 119.951 119.638 0.313 25061 273 1 1 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.121 -0.082 25061 274 1 1 . 1 1 49 49 LYS C C 49 178.288 178.288 178.643 -0.355 25061 275 1 1 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.715 0.122 25061 276 1 1 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.416 -0.273 25061 277 1 1 . 1 1 49 49 LYS H H 49 8.037 8.037 7.527 0.510 25061 278 1 1 . 1 1 50 50 GLN N N 50 115.284 115.284 115.135 0.149 25061 279 1 1 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.250 0.092 25061 280 1 1 . 1 1 50 50 GLN C C 50 176.180 176.180 177.279 -1.099 25061 281 1 1 . 1 1 50 50 GLN CA C 50 55.741 55.741 56.254 -0.513 25061 282 1 1 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.434 0.131 25061 283 1 1 . 1 1 50 50 GLN H H 50 7.740 7.740 7.819 -0.079 25061 284 1 1 . 1 1 51 51 GLY N N 51 109.725 109.725 108.016 1.709 25061 285 1 1 . 1 1 51 51 GLY C C 51 174.552 174.552 173.779 0.773 25061 286 1 1 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.425 0.938 25061 287 1 1 . 1 1 51 51 GLY H H 51 8.027 8.027 7.949 0.078 25061 288 1 1 . 1 1 52 52 ARG N N 52 119.064 119.064 119.625 -0.561 25061 289 1 1 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.797 0.100 25061 290 1 1 . 1 1 52 52 ARG C C 52 173.123 173.123 174.076 -0.953 25061 291 1 1 . 1 1 52 52 ARG CA C 52 52.247 52.247 52.540 -0.293 25061 292 1 1 . 1 1 52 52 ARG CB C 52 32.366 32.366 31.546 0.820 25061 293 1 1 . 1 1 52 52 ARG H H 52 7.969 7.969 8.014 -0.045 25061 294 1 1 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.708 0.147 25061 295 1 1 . 1 1 53 53 PRO C C 53 174.069 174.069 175.715 -1.646 25061 296 1 1 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.898 -1.080 25061 297 1 1 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.596 -0.536 25061 298 1 1 . 1 1 54 54 ILE N N 54 116.301 116.301 121.355 -5.054 25061 299 1 1 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.436 0.802 25061 300 1 1 . 1 1 54 54 ILE C C 54 171.709 171.709 173.384 -1.675 25061 301 1 1 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.516 -1.742 25061 302 1 1 . 1 1 54 54 ILE CB C 54 41.558 41.558 41.889 -0.331 25061 303 1 1 . 1 1 54 54 ILE H H 54 7.920 7.920 8.477 -0.557 25061 304 1 1 . 1 1 55 55 VAL N N 55 126.302 126.302 129.294 -2.992 25061 305 1 1 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.003 -0.079 25061 306 1 1 . 1 1 55 55 VAL C C 55 173.624 173.624 174.748 -1.124 25061 307 1 1 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.763 -0.968 25061 308 1 1 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.764 0.063 25061 309 1 1 . 1 1 55 55 VAL H H 55 8.652 8.652 8.469 0.183 25061 310 1 1 . 1 1 56 56 ILE N N 56 127.503 127.503 127.965 -0.462 25061 311 1 1 . 1 1 56 56 ILE HA H 56 4.664 4.664 4.717 -0.053 25061 312 1 1 . 1 1 56 56 ILE C C 56 173.479 173.479 175.164 -1.685 25061 313 1 1 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.768 0.239 25061 314 1 1 . 1 1 56 56 ILE CB C 56 40.285 40.285 37.988 2.297 25061 315 1 1 . 1 1 56 56 ILE H H 56 9.124 9.124 8.227 0.897 25061 316 1 1 . 1 1 57 57 PHE N N 57 125.302 125.302 128.200 -2.898 25061 317 1 1 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.107 0.109 25061 318 1 1 . 1 1 57 57 PHE C C 57 174.536 174.536 175.644 -1.108 25061 319 1 1 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.177 -0.216 25061 320 1 1 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.258 1.171 25061 321 1 1 . 1 1 57 57 PHE H H 57 8.971 8.971 8.677 0.294 25061 322 1 1 . 1 1 58 58 ILE N N 58 126.472 126.472 123.952 2.520 25061 323 1 1 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.859 -0.344 25061 324 1 1 . 1 1 58 58 ILE C C 58 173.391 173.391 174.918 -1.527 25061 325 1 1 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.085 0.005 25061 326 1 1 . 1 1 58 58 ILE CB C 58 41.742 41.742 40.704 1.038 25061 327 1 1 . 1 1 58 58 ILE H H 58 9.248 9.248 8.799 0.449 25061 328 1 1 . 1 1 59 59 ARG N N 59 124.681 124.681 124.068 0.613 25061 329 1 1 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.066 -0.137 25061 330 1 1 . 1 1 59 59 ARG C C 59 178.521 178.521 177.904 0.617 25061 331 1 1 . 1 1 59 59 ARG CA C 59 55.742 55.742 54.877 0.865 25061 332 1 1 . 1 1 59 59 ARG CB C 59 30.918 30.918 32.871 -1.953 25061 333 1 1 . 1 1 59 59 ARG H H 59 8.587 8.587 8.482 0.105 25061 334 1 1 . 1 1 60 60 GLY N N 60 108.848 108.848 109.140 -0.292 25061 335 1 1 . 1 1 60 60 GLY C C 60 174.775 174.775 174.766 0.009 25061 336 1 1 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.280 -0.313 25061 337 1 1 . 1 1 60 60 GLY H H 60 7.732 7.732 8.373 -0.641 25061 338 1 1 . 1 1 61 61 ALA N N 61 120.877 120.877 122.748 -1.871 25061 339 1 1 . 1 1 61 61 ALA HA H 61 4.144 4.144 4.104 0.040 25061 340 1 1 . 1 1 61 61 ALA C C 61 177.769 177.769 179.540 -1.771 25061 341 1 1 . 1 1 61 61 ALA CA C 61 53.449 53.449 54.093 -0.644 25061 342 1 1 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.424 -0.052 25061 343 1 1 . 1 1 61 61 ALA H H 61 7.852 7.852 8.249 -0.397 25061 344 1 1 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.189 0.611 25061 345 1 1 . 1 1 62 62 TYR CA C 62 63.039 63.039 60.875 2.164 25061 346 1 1 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.831 -0.391 25061 347 1 1 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.749 -0.064 25061 348 1 1 . 1 1 63 63 GLU C C 63 176.251 176.251 178.312 -2.061 25061 349 1 1 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.254 0.004 25061 350 1 1 . 1 1 63 63 GLU CB C 63 29.412 29.412 28.938 0.474 25061 351 1 1 . 1 1 64 64 GLU N N 64 119.209 119.209 119.671 -0.462 25061 352 1 1 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.539 0.362 25061 353 1 1 . 1 1 64 64 GLU C C 64 178.251 178.251 178.645 -0.394 25061 354 1 1 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.692 0.520 25061 355 1 1 . 1 1 64 64 GLU CB C 64 28.645 28.645 29.012 -0.367 25061 356 1 1 . 1 1 64 64 GLU H H 64 8.878 8.878 7.559 1.319 25061 357 1 1 . 1 1 65 65 VAL N N 65 116.728 116.728 119.015 -2.287 25061 358 1 1 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.806 0.176 25061 359 1 1 . 1 1 65 65 VAL C C 65 176.915 176.915 178.013 -1.098 25061 360 1 1 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.625 -1.016 25061 361 1 1 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.380 0.515 25061 362 1 1 . 1 1 65 65 VAL H H 65 7.652 7.652 7.848 -0.196 25061 363 1 1 . 1 1 66 66 VAL N N 66 119.462 119.462 119.253 0.209 25061 364 1 1 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.620 -0.306 25061 365 1 1 . 1 1 66 66 VAL C C 66 177.142 177.142 177.718 -0.576 25061 366 1 1 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.255 1.080 25061 367 1 1 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.329 0.101 25061 368 1 1 . 1 1 66 66 VAL H H 66 7.896 7.896 7.662 0.234 25061 369 1 1 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.095 -0.467 25061 370 1 1 . 1 1 67 67 ARG C C 67 177.841 177.841 178.070 -0.229 25061 371 1 1 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.658 0.394 25061 372 1 1 . 1 1 67 67 ARG CB C 67 29.393 29.393 30.037 -0.644 25061 373 1 1 . 1 1 68 68 ASP N N 68 118.316 118.316 119.319 -1.003 25061 374 1 1 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.476 -0.115 25061 375 1 1 . 1 1 68 68 ASP C C 68 178.945 178.945 178.621 0.324 25061 376 1 1 . 1 1 68 68 ASP CA C 68 57.311 57.311 57.334 -0.023 25061 377 1 1 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.801 0.713 25061 378 1 1 . 1 1 68 68 ASP H H 68 7.625 7.625 8.006 -0.381 25061 379 1 1 . 1 1 69 69 ILE N N 69 119.231 119.231 118.839 0.392 25061 380 1 1 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.886 -0.256 25061 381 1 1 . 1 1 69 69 ILE C C 69 177.138 177.138 177.972 -0.834 25061 382 1 1 . 1 1 69 69 ILE CA C 69 64.540 64.540 64.000 0.540 25061 383 1 1 . 1 1 69 69 ILE CB C 69 37.050 37.050 38.155 -1.105 25061 384 1 1 . 1 1 69 69 ILE H H 69 8.113 8.113 7.157 0.956 25061 385 1 1 . 1 1 70 70 VAL N N 70 120.164 120.164 120.713 -0.549 25061 386 1 1 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.570 -0.153 25061 387 1 1 . 1 1 70 70 VAL C C 70 177.079 177.079 177.929 -0.850 25061 388 1 1 . 1 1 70 70 VAL CA C 70 67.274 67.274 66.931 0.342 25061 389 1 1 . 1 1 70 70 VAL CB C 70 31.258 31.258 30.741 0.517 25061 390 1 1 . 1 1 70 70 VAL H H 70 8.478 8.478 8.163 0.315 25061 391 1 1 . 1 1 71 71 GLU N N 71 118.293 118.293 119.696 -1.403 25061 392 1 1 . 1 1 71 71 GLU HA H 71 4.054 4.054 4.127 -0.073 25061 393 1 1 . 1 1 71 71 GLU C C 71 179.009 179.009 178.937 0.072 25061 394 1 1 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.791 -0.375 25061 395 1 1 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.518 -0.696 25061 396 1 1 . 1 1 71 71 GLU H H 71 8.152 8.152 7.889 0.263 25061 397 1 1 . 1 1 72 72 TYR N N 72 120.091 120.091 119.878 0.213 25061 398 1 1 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.156 0.006 25061 399 1 1 . 1 1 72 72 TYR C C 72 176.404 176.404 177.170 -0.766 25061 400 1 1 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.223 -0.091 25061 401 1 1 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.226 -0.089 25061 402 1 1 . 1 1 72 72 TYR H H 72 7.959 7.959 7.613 0.346 25061 403 1 1 . 1 1 73 73 ALA N N 73 120.133 120.133 119.973 0.160 25061 404 1 1 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.839 -0.209 25061 405 1 1 . 1 1 73 73 ALA C C 73 179.182 179.182 179.636 -0.454 25061 406 1 1 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.060 0.052 25061 407 1 1 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.036 0.155 25061 408 1 1 . 1 1 73 73 ALA H H 73 8.604 8.604 8.052 0.552 25061 409 1 1 . 1 1 74 74 GLN N N 74 115.553 115.553 117.048 -1.495 25061 410 1 1 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.969 0.169 25061 411 1 1 . 1 1 74 74 GLN C C 74 180.595 180.595 178.618 1.977 25061 412 1 1 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.367 0.728 25061 413 1 1 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.840 -0.265 25061 414 1 1 . 1 1 74 74 GLN H H 74 8.619 8.619 7.921 0.698 25061 415 1 1 . 1 1 75 75 LYS N N 75 122.396 122.396 118.438 3.958 25061 416 1 1 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.032 -0.004 25061 417 1 1 . 1 1 75 75 LYS C C 75 178.521 178.521 178.617 -0.096 25061 418 1 1 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.049 1.009 25061 419 1 1 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.824 -0.225 25061 420 1 1 . 1 1 75 75 LYS H H 75 8.123 8.123 7.590 0.533 25061 421 1 1 . 1 1 76 76 GLU N N 76 116.294 116.294 118.467 -2.173 25061 422 1 1 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.059 0.040 25061 423 1 1 . 1 1 76 76 GLU C C 76 175.957 175.957 177.457 -1.500 25061 424 1 1 . 1 1 76 76 GLU CA C 76 55.605 55.605 57.365 -1.760 25061 425 1 1 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.726 0.098 25061 426 1 1 . 1 1 76 76 GLU H H 76 7.450 7.450 7.854 -0.404 25061 427 1 1 . 1 1 77 77 GLY N N 77 107.446 107.446 106.731 0.715 25061 428 1 1 . 1 1 77 77 GLY C C 77 174.520 174.520 174.247 0.273 25061 429 1 1 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.149 0.658 25061 430 1 1 . 1 1 77 77 GLY H H 77 7.763 7.763 7.648 0.115 25061 431 1 1 . 1 1 78 78 LEU N N 78 120.179 120.179 119.535 0.644 25061 432 1 1 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.535 -0.147 25061 433 1 1 . 1 1 78 78 LEU C C 78 175.914 175.914 176.739 -0.825 25061 434 1 1 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.259 0.213 25061 435 1 1 . 1 1 78 78 LEU CB C 78 41.889 41.889 43.008 -1.119 25061 436 1 1 . 1 1 78 78 LEU H H 78 7.930 7.930 7.416 0.514 25061 437 1 1 . 1 1 79 79 ARG N N 79 122.207 122.207 123.076 -0.869 25061 438 1 1 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.327 0.070 25061 439 1 1 . 1 1 79 79 ARG C C 79 174.960 174.960 174.843 0.117 25061 440 1 1 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.775 -0.127 25061 441 1 1 . 1 1 79 79 ARG CB C 79 30.476 30.476 29.675 0.801 25061 442 1 1 . 1 1 79 79 ARG H H 79 8.241 8.241 8.506 -0.265 25061 443 1 1 . 1 1 80 80 VAL N N 80 123.333 123.333 126.728 -3.395 25061 444 1 1 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.577 0.718 25061 445 1 1 . 1 1 80 80 VAL C C 80 174.048 174.048 174.035 0.013 25061 446 1 1 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.190 -1.149 25061 447 1 1 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.528 1.777 25061 448 1 1 . 1 1 80 80 VAL H H 80 8.359 8.359 8.640 -0.281 25061 449 1 1 . 1 1 81 81 LEU N N 81 128.719 128.719 130.452 -1.733 25061 450 1 1 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.112 -0.008 25061 451 1 1 . 1 1 81 81 LEU C C 81 174.484 174.484 174.480 0.004 25061 452 1 1 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.901 0.219 25061 453 1 1 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.593 -0.637 25061 454 1 1 . 1 1 81 81 LEU H H 81 8.650 8.650 8.931 -0.281 25061 455 1 1 . 1 1 82 82 VAL N N 82 122.487 122.487 128.277 -5.790 25061 456 1 1 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.373 0.724 25061 457 1 1 . 1 1 82 82 VAL C C 82 174.525 174.525 175.022 -0.497 25061 458 1 1 . 1 1 82 82 VAL CA C 82 60.285 60.285 62.023 -1.738 25061 459 1 1 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.278 2.511 25061 460 1 1 . 1 1 82 82 VAL H H 82 8.781 8.781 8.865 -0.084 25061 461 1 1 . 1 1 83 83 ILE N N 83 128.082 128.082 129.556 -1.474 25061 462 1 1 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.545 0.385 25061 463 1 1 . 1 1 83 83 ILE C C 83 172.925 172.925 174.641 -1.716 25061 464 1 1 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.663 -0.722 25061 465 1 1 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.083 2.103 25061 466 1 1 . 1 1 83 83 ILE H H 83 9.527 9.527 8.537 0.990 25061 467 1 1 . 1 1 84 84 LYS N N 84 128.493 128.493 128.729 -0.236 25061 468 1 1 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.123 -0.075 25061 469 1 1 . 1 1 84 84 LYS C C 84 174.027 174.027 175.081 -1.054 25061 470 1 1 . 1 1 84 84 LYS CA C 84 53.253 53.253 54.493 -1.240 25061 471 1 1 . 1 1 84 84 LYS CB C 84 34.652 34.652 36.833 -2.181 25061 472 1 1 . 1 1 84 84 LYS H H 84 8.721 8.721 9.029 -0.308 25061 473 1 1 . 1 1 85 85 VAL N N 85 126.729 126.729 127.037 -0.308 25061 474 1 1 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.099 0.637 25061 475 1 1 . 1 1 85 85 VAL C C 85 175.935 175.935 174.740 1.195 25061 476 1 1 . 1 1 85 85 VAL CA C 85 60.200 60.200 62.244 -2.044 25061 477 1 1 . 1 1 85 85 VAL CB C 85 30.847 30.847 31.381 -0.534 25061 478 1 1 . 1 1 85 85 VAL H H 85 8.643 8.643 8.298 0.345 25061 479 1 1 . 1 1 86 86 ALA N N 86 132.930 132.930 130.173 2.757 25061 480 1 1 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.487 -0.057 25061 481 1 1 . 1 1 86 86 ALA C C 86 175.635 175.635 176.832 -1.197 25061 482 1 1 . 1 1 86 86 ALA CA C 86 51.504 51.504 51.961 -0.457 25061 483 1 1 . 1 1 86 86 ALA CB C 86 20.821 20.821 20.069 0.752 25061 484 1 1 . 1 1 86 86 ALA H H 86 8.835 8.835 8.015 0.820 25061 485 1 1 . 1 1 87 87 GLN N N 87 118.719 118.719 119.208 -0.489 25061 486 1 1 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.258 0.211 25061 487 1 1 . 1 1 87 87 GLN C C 87 175.949 175.949 175.032 0.917 25061 488 1 1 . 1 1 87 87 GLN CA C 87 55.260 55.260 55.059 0.201 25061 489 1 1 . 1 1 87 87 GLN CB C 87 30.432 30.432 28.248 2.184 25061 490 1 1 . 1 1 87 87 GLN H H 87 8.570 8.570 8.447 0.122 25061 491 1 1 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.216 0.264 25061 492 1 1 . 1 1 88 88 ASP CA C 88 55.454 55.454 55.390 0.064 25061 493 1 1 . 1 1 88 88 ASP CB C 88 41.204 41.204 40.461 0.743 25061 494 1 1 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.567 -0.520 25061 495 1 1 . 1 1 89 89 GLN CA C 89 56.687 56.687 54.699 1.988 25061 496 1 1 . 1 1 89 89 GLN CB C 89 27.850 27.850 32.181 -4.331 25061 497 1 1 . 1 1 92 92 LEU N N 92 125.291 125.291 119.610 5.681 25061 498 1 1 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.100 0.101 25061 499 1 1 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.480 -2.422 25061 500 1 1 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.812 0.234 25061 501 1 1 . 1 1 92 92 LEU H H 92 8.277 8.277 7.959 0.318 25061 502 1 1 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.490 0.266 25061 503 1 1 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.068 -0.019 25061 504 1 1 . 1 1 94 94 ARG C C 94 178.544 178.544 178.921 -0.377 25061 505 1 1 . 1 1 94 94 ARG CA C 94 58.607 58.607 59.463 -0.856 25061 506 1 1 . 1 1 94 94 ARG CB C 94 29.614 29.614 30.185 -0.571 25061 507 1 1 . 1 1 95 95 PHE N N 95 117.407 117.407 118.655 -1.248 25061 508 1 1 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.613 -0.238 25061 509 1 1 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.443 -0.212 25061 510 1 1 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.363 -1.421 25061 511 1 1 . 1 1 95 95 PHE H H 95 8.419 8.419 7.797 0.622 25061 512 1 1 . 1 1 96 96 TYR HA H 96 3.808 3.808 4.053 -0.245 25061 513 1 1 . 1 1 96 96 TYR C C 96 177.728 177.728 176.962 0.766 25061 514 1 1 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.261 1.895 25061 515 1 1 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.136 -0.436 25061 516 1 1 . 1 1 97 97 GLU N N 97 119.054 119.054 118.099 0.955 25061 517 1 1 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.681 0.382 25061 518 1 1 . 1 1 97 97 GLU C C 97 179.071 179.071 178.743 0.328 25061 519 1 1 . 1 1 97 97 GLU CA C 97 58.760 58.760 58.653 0.107 25061 520 1 1 . 1 1 97 97 GLU CB C 97 29.172 29.172 28.974 0.198 25061 521 1 1 . 1 1 97 97 GLU H H 97 7.858 7.858 7.969 -0.111 25061 522 1 1 . 1 1 98 98 GLN N N 98 119.385 119.385 117.992 1.393 25061 523 1 1 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.936 -0.035 25061 524 1 1 . 1 1 98 98 GLN C C 98 177.599 177.599 178.562 -0.963 25061 525 1 1 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.601 -0.290 25061 526 1 1 . 1 1 98 98 GLN CB C 98 27.766 27.766 27.941 -0.175 25061 527 1 1 . 1 1 98 98 GLN H H 98 7.747 7.747 7.546 0.201 25061 528 1 1 . 1 1 99 99 LEU N N 99 118.348 118.348 119.677 -1.329 25061 529 1 1 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.882 0.137 25061 530 1 1 . 1 1 99 99 LEU C C 99 178.669 178.669 178.592 0.077 25061 531 1 1 . 1 1 99 99 LEU CA C 99 57.430 57.430 58.125 -0.695 25061 532 1 1 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.463 0.040 25061 533 1 1 . 1 1 99 99 LEU H H 99 7.891 7.891 7.283 0.608 25061 534 1 1 . 1 1 100 100 LYS N N 100 118.332 118.332 118.583 -0.251 25061 535 1 1 . 1 1 100 100 LYS HA H 100 4.509 4.509 3.977 0.532 25061 536 1 1 . 1 1 100 100 LYS C C 100 180.846 180.846 179.055 1.791 25061 537 1 1 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.902 0.186 25061 538 1 1 . 1 1 100 100 LYS CB C 100 32.269 32.269 32.256 0.013 25061 539 1 1 . 1 1 100 100 LYS H H 100 7.560 7.560 7.242 0.318 25061 540 1 1 . 1 1 101 101 LYS N N 101 121.944 121.944 119.295 2.649 25061 541 1 1 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.009 0.063 25061 542 1 1 . 1 1 101 101 LYS C C 101 177.707 177.707 177.784 -0.077 25061 543 1 1 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.635 0.236 25061 544 1 1 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.416 -0.321 25061 545 1 1 . 1 1 101 101 LYS H H 101 7.959 7.959 7.626 0.333 25061 546 1 1 . 1 1 102 102 ASP N N 102 118.788 118.788 116.695 2.093 25061 547 1 1 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.453 0.241 25061 548 1 1 . 1 1 102 102 ASP C C 102 176.359 176.359 177.569 -1.210 25061 549 1 1 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.387 -0.808 25061 550 1 1 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.888 -1.314 25061 551 1 1 . 1 1 102 102 ASP H H 102 7.893 7.893 7.734 0.159 25061 552 1 1 . 1 1 103 103 GLY N N 103 107.024 107.024 105.187 1.837 25061 553 1 1 . 1 1 103 103 GLY C C 103 174.328 174.328 174.438 -0.110 25061 554 1 1 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.751 0.595 25061 555 1 1 . 1 1 103 103 GLY H H 103 7.866 7.866 7.974 -0.108 25061 556 1 1 . 1 1 104 104 VAL N N 104 123.060 123.060 122.095 0.965 25061 557 1 1 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.831 0.142 25061 558 1 1 . 1 1 104 104 VAL C C 104 175.023 175.023 175.080 -0.057 25061 559 1 1 . 1 1 104 104 VAL CA C 104 61.878 61.878 63.505 -1.627 25061 560 1 1 . 1 1 104 104 VAL CB C 104 32.088 32.088 31.970 0.118 25061 561 1 1 . 1 1 104 104 VAL H H 104 7.955 7.955 7.742 0.213 25061 562 1 1 . 1 1 105 105 ASP N N 105 127.987 127.987 128.424 -0.437 25061 563 1 1 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.633 -0.058 25061 564 1 1 . 1 1 105 105 ASP C C 105 173.624 173.624 174.556 -0.932 25061 565 1 1 . 1 1 105 105 ASP CA C 105 54.087 54.087 54.727 -0.640 25061 566 1 1 . 1 1 105 105 ASP CB C 105 40.660 40.660 43.121 -2.461 25061 567 1 1 . 1 1 105 105 ASP H H 105 8.399 8.399 8.094 0.305 25061 568 1 1 . 1 1 106 106 VAL N N 106 125.798 125.798 123.458 2.340 25061 569 1 1 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.632 0.183 25061 570 1 1 . 1 1 106 106 VAL C C 106 174.902 174.902 174.496 0.406 25061 571 1 1 . 1 1 106 106 VAL CA C 106 60.194 60.194 60.265 -0.071 25061 572 1 1 . 1 1 106 106 VAL CB C 106 34.179 34.179 34.686 -0.507 25061 573 1 1 . 1 1 106 106 VAL H H 106 7.550 7.550 8.312 -0.762 25061 574 1 1 . 1 1 107 107 ARG N N 107 128.099 128.099 130.220 -2.121 25061 575 1 1 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.596 0.280 25061 576 1 1 . 1 1 107 107 ARG C C 107 173.815 173.815 175.325 -1.510 25061 577 1 1 . 1 1 107 107 ARG CA C 107 53.386 53.386 53.543 -0.157 25061 578 1 1 . 1 1 107 107 ARG CB C 107 31.195 31.195 29.499 1.696 25061 579 1 1 . 1 1 107 107 ARG H H 107 9.132 9.132 8.591 0.541 25061 580 1 1 . 1 1 108 108 VAL N N 108 123.979 123.979 123.462 0.517 25061 581 1 1 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.074 -0.132 25061 582 1 1 . 1 1 108 108 VAL C C 108 175.854 175.854 176.628 -0.774 25061 583 1 1 . 1 1 108 108 VAL CA C 108 60.017 60.017 61.276 -1.259 25061 584 1 1 . 1 1 108 108 VAL CB C 108 32.844 32.844 31.539 1.305 25061 585 1 1 . 1 1 108 108 VAL H H 108 8.561 8.561 8.373 0.188 25061 586 1 1 . 1 1 109 109 THR N N 109 120.144 120.144 122.223 -2.079 25061 587 1 1 . 1 1 109 109 THR HA H 109 4.815 4.815 4.352 0.463 25061 588 1 1 . 1 1 109 109 THR C C 109 171.867 171.867 175.212 -3.345 25061 589 1 1 . 1 1 109 109 THR CA C 109 59.613 59.613 65.148 -5.535 25061 590 1 1 . 1 1 109 109 THR CB C 109 69.720 69.720 69.497 0.223 25061 591 1 1 . 1 1 109 109 THR H H 109 8.803 8.803 8.714 0.089 25061 592 1 1 . 1 1 110 110 ASP N N 110 123.212 123.212 117.781 5.431 25061 593 1 1 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.411 0.558 25061 594 1 1 . 1 1 110 110 ASP C C 110 175.739 175.739 173.810 1.929 25061 595 1 1 . 1 1 110 110 ASP CA C 110 53.243 53.243 55.568 -2.325 25061 596 1 1 . 1 1 110 110 ASP CB C 110 41.351 41.351 40.305 1.046 25061 597 1 1 . 1 1 110 110 ASP H H 110 8.363 8.363 8.246 0.117 25061 598 1 1 . 1 1 111 111 ASN N N 111 116.298 116.298 113.473 2.825 25061 599 1 1 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.884 -0.008 25061 600 1 1 . 1 1 111 111 ASN C C 111 174.756 174.756 174.214 0.542 25061 601 1 1 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.717 -0.585 25061 602 1 1 . 1 1 111 111 ASN CB C 111 40.765 40.765 41.332 -0.567 25061 603 1 1 . 1 1 111 111 ASN H H 111 8.085 8.085 7.705 0.380 25061 604 1 1 . 1 1 112 112 GLU HA H 112 3.848 3.848 4.282 -0.434 25061 605 1 1 . 1 1 112 112 GLU C C 112 177.016 177.016 177.685 -0.669 25061 606 1 1 . 1 1 112 112 GLU CA C 112 59.480 59.480 58.885 0.596 25061 607 1 1 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.926 -0.252 25061 608 1 1 . 1 1 113 113 ASP N N 113 121.033 121.033 119.442 1.591 25061 609 1 1 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.370 0.043 25061 610 1 1 . 1 1 113 113 ASP C C 113 178.988 178.988 178.825 0.163 25061 611 1 1 . 1 1 113 113 ASP CA C 113 57.855 57.855 58.051 -0.196 25061 612 1 1 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.373 0.129 25061 613 1 1 . 1 1 113 113 ASP H H 113 8.219 8.219 8.782 -0.563 25061 614 1 1 . 1 1 114 114 GLU N N 114 121.280 121.280 119.249 2.031 25061 615 1 1 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.058 0.007 25061 616 1 1 . 1 1 114 114 GLU C C 114 178.776 178.776 178.492 0.284 25061 617 1 1 . 1 1 114 114 GLU CA C 114 58.714 58.714 58.749 -0.035 25061 618 1 1 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.581 -0.368 25061 619 1 1 . 1 1 114 114 GLU H H 114 8.296 8.296 8.639 -0.343 25061 620 1 1 . 1 1 115 115 ALA N N 115 120.924 120.924 122.516 -1.592 25061 621 1 1 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.050 -0.212 25061 622 1 1 . 1 1 115 115 ALA C C 115 178.502 178.502 179.593 -1.091 25061 623 1 1 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.141 0.497 25061 624 1 1 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.314 0.183 25061 625 1 1 . 1 1 115 115 ALA H H 115 7.853 7.853 7.867 -0.014 25061 626 1 1 . 1 1 116 116 LYS N N 116 116.616 116.616 116.779 -0.163 25061 627 1 1 . 1 1 116 116 LYS HA H 116 3.719 3.719 4.041 -0.322 25061 628 1 1 . 1 1 116 116 LYS C C 116 178.097 178.097 178.759 -0.662 25061 629 1 1 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.277 1.475 25061 630 1 1 . 1 1 116 116 LYS CB C 116 32.555 32.555 31.913 0.642 25061 631 1 1 . 1 1 116 116 LYS H H 116 8.091 8.091 7.665 0.426 25061 632 1 1 . 1 1 117 117 LYS N N 117 118.990 118.990 120.059 -1.069 25061 633 1 1 . 1 1 117 117 LYS HA H 117 3.911 3.911 3.997 -0.086 25061 634 1 1 . 1 1 117 117 LYS C C 117 179.186 179.186 179.135 0.051 25061 635 1 1 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.358 0.213 25061 636 1 1 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.273 0.247 25061 637 1 1 . 1 1 117 117 LYS H H 117 7.742 7.742 7.502 0.240 25061 638 1 1 . 1 1 118 118 ARG N N 118 117.441 117.441 120.182 -2.741 25061 639 1 1 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.058 0.082 25061 640 1 1 . 1 1 118 118 ARG C C 118 178.921 178.921 178.646 0.275 25061 641 1 1 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.846 -1.175 25061 642 1 1 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.668 -0.007 25061 643 1 1 . 1 1 118 118 ARG H H 118 8.468 8.468 8.077 0.391 25061 644 1 1 . 1 1 119 119 LEU N N 119 120.100 120.100 119.692 0.408 25061 645 1 1 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.872 0.088 25061 646 1 1 . 1 1 119 119 LEU C C 119 177.554 177.554 179.066 -1.512 25061 647 1 1 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.148 -0.267 25061 648 1 1 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.443 0.446 25061 649 1 1 . 1 1 119 119 LEU H H 119 8.322 8.322 7.994 0.328 25061 650 1 1 . 1 1 120 120 LYS N N 120 118.238 118.238 119.186 -0.948 25061 651 1 1 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.984 -0.162 25061 652 1 1 . 1 1 120 120 LYS C C 120 178.703 178.703 179.202 -0.499 25061 653 1 1 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.292 1.054 25061 654 1 1 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.332 -0.096 25061 655 1 1 . 1 1 120 120 LYS H H 120 7.990 7.990 7.599 0.391 25061 656 1 1 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.019 0.003 25061 657 1 1 . 1 1 121 121 GLU C C 121 177.769 177.769 178.668 -0.899 25061 658 1 1 . 1 1 121 121 GLU CA C 121 58.922 58.922 58.846 0.076 25061 659 1 1 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.418 0.036 25061 660 1 1 . 1 1 122 122 LEU N N 122 119.454 119.454 118.401 1.053 25061 661 1 1 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.065 0.068 25061 662 1 1 . 1 1 122 122 LEU C C 122 178.991 178.991 178.233 0.758 25061 663 1 1 . 1 1 122 122 LEU CA C 122 57.326 57.326 56.986 0.340 25061 664 1 1 . 1 1 122 122 LEU CB C 122 41.679 41.679 42.202 -0.523 25061 665 1 1 . 1 1 122 122 LEU H H 122 7.930 7.930 7.831 0.099 25061 666 1 1 . 1 1 123 123 LEU N N 123 117.862 117.862 117.593 0.269 25061 667 1 1 . 1 1 123 123 LEU HA H 123 4.067 4.067 4.080 -0.013 25061 668 1 1 . 1 1 123 123 LEU C C 123 179.178 179.178 178.527 0.651 25061 669 1 1 . 1 1 123 123 LEU CA C 123 56.920 56.920 57.203 -0.283 25061 670 1 1 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.345 -0.135 25061 671 1 1 . 1 1 123 123 LEU H H 123 8.095 8.095 7.681 0.414 25061 672 1 1 . 1 1 124 124 GLU N N 124 118.975 118.975 116.973 2.002 25061 673 1 1 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.097 0.032 25061 674 1 1 . 1 1 124 124 GLU C C 124 177.777 177.777 177.050 0.727 25061 675 1 1 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.587 -0.500 25061 676 1 1 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.670 -0.130 25061 677 1 1 . 1 1 124 124 GLU H H 124 7.930 7.930 7.835 0.095 25061 678 1 1 . 1 1 125 125 LYS N N 125 118.933 118.933 116.337 2.596 25061 679 1 1 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.421 -0.084 25061 680 1 1 . 1 1 125 125 LYS C C 125 178.188 178.188 176.875 1.313 25061 681 1 1 . 1 1 125 125 LYS CA C 125 56.980 56.980 56.907 0.073 25061 682 1 1 . 1 1 125 125 LYS CB C 125 32.608 32.608 35.513 -2.905 25061 683 1 1 . 1 1 125 125 LYS H H 125 7.729 7.729 7.495 0.234 25061 684 1 1 . 1 1 126 126 VAL N N 126 117.933 117.933 116.201 1.732 25061 685 1 1 . 1 1 126 126 VAL HA H 126 4.022 4.022 4.163 -0.141 25061 686 1 1 . 1 1 126 126 VAL C C 126 176.947 176.947 174.053 2.894 25061 687 1 1 . 1 1 126 126 VAL CA C 126 63.641 63.641 62.861 0.780 25061 688 1 1 . 1 1 126 126 VAL CB C 126 31.859 31.859 34.664 -2.805 25061 689 1 1 . 1 1 126 126 VAL H H 126 8.044 8.044 8.197 -0.153 25061 690 1 1 . 1 1 127 127 GLY N N 127 109.813 109.813 109.637 0.176 25061 691 1 1 . 1 1 127 127 GLY C C 127 174.264 174.264 173.375 0.889 25061 692 1 1 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.453 -0.174 25061 693 1 1 . 1 1 127 127 GLY H H 127 8.279 8.279 7.826 0.453 25061 694 1 1 . 1 1 128 128 SER N N 128 115.185 115.185 115.144 0.041 25061 695 1 1 . 1 1 128 128 SER HA H 128 4.462 4.462 4.566 -0.104 25061 696 1 1 . 1 1 128 128 SER C C 128 174.775 174.775 173.023 1.752 25061 697 1 1 . 1 1 128 128 SER CA C 128 58.739 58.739 58.446 0.293 25061 698 1 1 . 1 1 128 128 SER CB C 128 63.850 63.850 63.744 0.106 25061 699 1 1 . 1 1 128 128 SER H H 128 8.048 8.048 8.229 -0.181 25061 700 1 1 . 1 1 129 129 LEU N N 129 123.060 123.060 120.811 2.249 25061 701 1 1 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.513 -0.215 25061 702 1 1 . 1 1 129 129 LEU C C 129 177.313 177.313 174.906 2.407 25061 703 1 1 . 1 1 129 129 LEU CA C 129 55.158 55.158 55.089 0.069 25061 704 1 1 . 1 1 129 129 LEU CB C 129 41.837 41.837 44.367 -2.530 25061 705 1 1 . 1 1 129 129 LEU H H 129 8.147 8.147 7.601 0.546 25061 706 1 1 . 1 1 130 130 GLU N N 130 120.088 120.088 121.977 -1.889 25061 707 1 1 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.079 0.102 25061 708 1 1 . 1 1 130 130 GLU C C 130 176.148 176.148 176.269 -0.121 25061 709 1 1 . 1 1 130 130 GLU CA C 130 56.726 56.726 57.560 -0.834 25061 710 1 1 . 1 1 130 130 GLU CB C 130 30.026 30.026 30.042 -0.016 25061 711 1 1 . 1 1 130 130 GLU H H 130 8.242 8.242 8.615 -0.373 25061 712 1 2 . 1 1 2 2 GLY CA C 2 45.319 45.319 44.986 0.333 25061 713 1 2 . 1 1 3 3 THR HA H 3 4.820 4.820 4.793 0.027 25061 714 1 2 . 1 1 3 3 THR C C 3 172.374 172.374 173.657 -1.283 25061 715 1 2 . 1 1 3 3 THR CA C 3 62.760 62.760 60.605 2.155 25061 716 1 2 . 1 1 3 3 THR CB C 3 71.441 71.441 69.944 1.497 25061 717 1 2 . 1 1 4 4 VAL N N 4 126.881 126.881 127.989 -1.108 25061 718 1 2 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.713 -0.145 25061 719 1 2 . 1 1 4 4 VAL C C 4 173.116 173.116 174.519 -1.403 25061 720 1 2 . 1 1 4 4 VAL CA C 4 60.455 60.455 60.791 -0.336 25061 721 1 2 . 1 1 4 4 VAL CB C 4 33.800 33.800 32.610 1.190 25061 722 1 2 . 1 1 4 4 VAL H H 4 9.097 9.097 8.630 0.467 25061 723 1 2 . 1 1 5 5 VAL N N 5 127.172 127.172 124.885 2.287 25061 724 1 2 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.408 -0.521 25061 725 1 2 . 1 1 5 5 VAL C C 5 174.091 174.091 174.640 -0.549 25061 726 1 2 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.435 0.683 25061 727 1 2 . 1 1 5 5 VAL CB C 5 32.935 32.935 34.199 -1.264 25061 728 1 2 . 1 1 5 5 VAL H H 5 8.811 8.811 8.414 0.397 25061 729 1 2 . 1 1 6 6 ILE N N 6 127.577 127.577 126.489 1.088 25061 730 1 2 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.514 0.106 25061 731 1 2 . 1 1 6 6 ILE C C 6 173.328 173.328 175.239 -1.911 25061 732 1 2 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.605 0.227 25061 733 1 2 . 1 1 6 6 ILE CB C 6 39.930 39.930 39.946 -0.016 25061 734 1 2 . 1 1 6 6 ILE H H 6 9.210 9.210 8.790 0.420 25061 735 1 2 . 1 1 7 7 VAL N N 7 129.024 129.024 128.953 0.071 25061 736 1 2 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.454 0.351 25061 737 1 2 . 1 1 7 7 VAL C C 7 173.561 173.561 174.840 -1.279 25061 738 1 2 . 1 1 7 7 VAL CA C 7 60.849 60.849 61.902 -1.053 25061 739 1 2 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.563 0.797 25061 740 1 2 . 1 1 7 7 VAL H H 7 9.294 9.294 8.507 0.787 25061 741 1 2 . 1 1 8 8 VAL N N 8 125.318 125.318 127.227 -1.909 25061 742 1 2 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.559 -0.163 25061 743 1 2 . 1 1 8 8 VAL C C 8 175.723 175.723 175.224 0.499 25061 744 1 2 . 1 1 8 8 VAL CA C 8 59.617 59.617 59.476 0.141 25061 745 1 2 . 1 1 8 8 VAL CB C 8 34.915 34.915 34.975 -0.060 25061 746 1 2 . 1 1 8 8 VAL H H 8 8.898 8.898 8.390 0.508 25061 747 1 2 . 1 1 9 9 SER N N 9 116.544 116.544 118.157 -1.613 25061 748 1 2 . 1 1 9 9 SER HA H 9 4.724 4.724 4.748 -0.024 25061 749 1 2 . 1 1 9 9 SER C C 9 174.552 174.552 173.690 0.862 25061 750 1 2 . 1 1 9 9 SER CA C 9 57.419 57.419 57.703 -0.284 25061 751 1 2 . 1 1 9 9 SER CB C 9 64.998 64.998 64.882 0.116 25061 752 1 2 . 1 1 9 9 SER H H 9 7.833 7.833 8.655 -0.822 25061 753 1 2 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.419 0.493 25061 754 1 2 . 1 1 10 10 ASN C C 10 176.170 176.170 175.034 1.136 25061 755 1 2 . 1 1 10 10 ASN CA C 10 54.141 54.141 55.393 -1.252 25061 756 1 2 . 1 1 10 10 ASN CB C 10 38.626 38.626 39.091 -0.465 25061 757 1 2 . 1 1 11 11 ASP N N 11 120.164 120.164 118.917 1.247 25061 758 1 2 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.873 -0.030 25061 759 1 2 . 1 1 11 11 ASP C C 11 176.148 176.148 176.366 -0.218 25061 760 1 2 . 1 1 11 11 ASP CA C 11 52.620 52.620 53.832 -1.212 25061 761 1 2 . 1 1 11 11 ASP CB C 11 42.631 42.631 42.636 -0.005 25061 762 1 2 . 1 1 11 11 ASP H H 11 8.142 8.142 7.499 0.643 25061 763 1 2 . 1 1 12 12 GLU N N 12 127.184 127.184 125.147 2.037 25061 764 1 2 . 1 1 12 12 GLU HA H 12 3.853 3.853 3.942 -0.089 25061 765 1 2 . 1 1 12 12 GLU C C 12 177.853 177.853 178.044 -0.191 25061 766 1 2 . 1 1 12 12 GLU CA C 12 59.547 59.547 59.340 0.207 25061 767 1 2 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.467 0.352 25061 768 1 2 . 1 1 12 12 GLU H H 12 9.152 9.152 8.968 0.184 25061 769 1 2 . 1 1 13 13 ARG N N 13 119.026 119.026 118.229 0.797 25061 770 1 2 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.128 -0.025 25061 771 1 2 . 1 1 13 13 ARG C C 13 179.151 179.151 178.417 0.734 25061 772 1 2 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.974 -0.031 25061 773 1 2 . 1 1 13 13 ARG CB C 13 28.757 28.757 30.027 -1.270 25061 774 1 2 . 1 1 13 13 ARG H H 13 8.389 8.389 8.472 -0.083 25061 775 1 2 . 1 1 14 14 ILE N N 14 119.238 119.238 120.154 -0.916 25061 776 1 2 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.938 -0.337 25061 777 1 2 . 1 1 14 14 ILE C C 14 177.905 177.905 177.814 0.091 25061 778 1 2 . 1 1 14 14 ILE CA C 14 64.666 64.666 62.906 1.760 25061 779 1 2 . 1 1 14 14 ILE CB C 14 36.780 36.780 37.183 -0.403 25061 780 1 2 . 1 1 14 14 ILE H H 14 7.254 7.254 7.503 -0.249 25061 781 1 2 . 1 1 15 15 LEU N N 15 117.008 117.008 120.192 -3.184 25061 782 1 2 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.175 -0.254 25061 783 1 2 . 1 1 15 15 LEU C C 15 178.062 178.062 179.190 -1.128 25061 784 1 2 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.098 0.313 25061 785 1 2 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.515 -0.346 25061 786 1 2 . 1 1 15 15 LEU H H 15 7.412 7.412 7.567 -0.155 25061 787 1 2 . 1 1 16 16 GLU N N 16 117.637 117.637 119.281 -1.644 25061 788 1 2 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.848 -0.147 25061 789 1 2 . 1 1 16 16 GLU C C 16 179.182 179.182 178.665 0.517 25061 790 1 2 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.541 -0.124 25061 791 1 2 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.709 -0.250 25061 792 1 2 . 1 1 16 16 GLU H H 16 7.981 7.981 8.062 -0.081 25061 793 1 2 . 1 1 17 17 GLU N N 17 119.759 119.759 120.295 -0.536 25061 794 1 2 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.090 -0.074 25061 795 1 2 . 1 1 17 17 GLU C C 17 179.949 179.949 179.275 0.674 25061 796 1 2 . 1 1 17 17 GLU CA C 17 59.195 59.195 59.021 0.174 25061 797 1 2 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.387 0.153 25061 798 1 2 . 1 1 17 17 GLU H H 17 8.248 8.248 8.047 0.201 25061 799 1 2 . 1 1 18 18 LEU N N 18 119.764 119.764 119.282 0.482 25061 800 1 2 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.218 -0.137 25061 801 1 2 . 1 1 18 18 LEU C C 18 177.620 177.620 179.303 -1.683 25061 802 1 2 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.599 0.079 25061 803 1 2 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.684 -0.574 25061 804 1 2 . 1 1 18 18 LEU H H 18 8.486 8.486 8.092 0.394 25061 805 1 2 . 1 1 19 19 LEU N N 19 123.102 123.102 121.142 1.960 25061 806 1 2 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.928 -0.266 25061 807 1 2 . 1 1 19 19 LEU C C 19 178.343 178.343 178.371 -0.028 25061 808 1 2 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.430 0.806 25061 809 1 2 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.266 -0.615 25061 810 1 2 . 1 1 19 19 LEU H H 19 7.870 7.870 7.538 0.332 25061 811 1 2 . 1 1 20 20 GLU N N 20 117.884 117.884 118.053 -0.169 25061 812 1 2 . 1 1 20 20 GLU HA H 20 3.904 3.904 4.025 -0.121 25061 813 1 2 . 1 1 20 20 GLU C C 20 177.707 177.707 179.437 -1.730 25061 814 1 2 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.237 0.155 25061 815 1 2 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.018 -0.041 25061 816 1 2 . 1 1 20 20 GLU H H 20 7.497 7.497 7.757 -0.260 25061 817 1 2 . 1 1 21 21 VAL N N 21 117.709 117.709 120.234 -2.525 25061 818 1 2 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.738 -0.114 25061 819 1 2 . 1 1 21 21 VAL C C 21 178.523 178.523 178.274 0.249 25061 820 1 2 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.495 -0.298 25061 821 1 2 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.496 -0.349 25061 822 1 2 . 1 1 21 21 VAL H H 21 7.514 7.514 7.695 -0.181 25061 823 1 2 . 1 1 22 22 VAL N N 22 121.233 121.233 119.606 1.627 25061 824 1 2 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.532 -0.086 25061 825 1 2 . 1 1 22 22 VAL C C 22 176.868 176.868 177.874 -1.006 25061 826 1 2 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.748 0.266 25061 827 1 2 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.820 -0.506 25061 828 1 2 . 1 1 22 22 VAL H H 22 7.863 7.863 7.496 0.367 25061 829 1 2 . 1 1 23 23 LEU N N 23 118.101 118.101 118.722 -0.621 25061 830 1 2 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.000 0.065 25061 831 1 2 . 1 1 23 23 LEU C C 23 179.701 179.701 179.174 0.527 25061 832 1 2 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.728 -0.432 25061 833 1 2 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.674 0.030 25061 834 1 2 . 1 1 23 23 LEU H H 23 8.151 8.151 8.227 -0.076 25061 835 1 2 . 1 1 24 24 LYS N N 24 114.622 114.622 115.927 -1.305 25061 836 1 2 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.133 0.004 25061 837 1 2 . 1 1 24 24 LYS C C 24 178.062 178.062 177.814 0.248 25061 838 1 2 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.272 -0.904 25061 839 1 2 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.043 0.551 25061 840 1 2 . 1 1 24 24 LYS H H 24 7.823 7.823 8.026 -0.203 25061 841 1 2 . 1 1 25 25 SER N N 25 115.474 115.474 115.527 -0.053 25061 842 1 2 . 1 1 25 25 SER HA H 25 4.377 4.377 4.404 -0.027 25061 843 1 2 . 1 1 25 25 SER C C 25 174.520 174.520 174.105 0.415 25061 844 1 2 . 1 1 25 25 SER CA C 25 61.049 61.049 60.372 0.677 25061 845 1 2 . 1 1 25 25 SER CB C 25 63.777 63.777 64.660 -0.883 25061 846 1 2 . 1 1 25 25 SER H H 25 7.798 7.798 7.626 0.172 25061 847 1 2 . 1 1 26 26 ASP N N 26 117.424 117.424 118.967 -1.543 25061 848 1 2 . 1 1 26 26 ASP HA H 26 4.886 4.886 5.064 -0.178 25061 849 1 2 . 1 1 26 26 ASP C C 26 173.521 173.521 174.469 -0.948 25061 850 1 2 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.092 -0.044 25061 851 1 2 . 1 1 26 26 ASP CB C 26 42.202 42.202 43.111 -0.909 25061 852 1 2 . 1 1 26 26 ASP H H 26 7.990 7.990 7.974 0.016 25061 853 1 2 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.710 -0.065 25061 854 1 2 . 1 1 27 27 PRO C C 27 177.016 177.016 176.722 0.294 25061 855 1 2 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.547 0.054 25061 856 1 2 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.374 -0.202 25061 857 1 2 . 1 1 28 28 ASN N N 28 115.839 115.839 117.269 -1.430 25061 858 1 2 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.663 0.029 25061 859 1 2 . 1 1 28 28 ASN C C 28 175.701 175.701 175.576 0.125 25061 860 1 2 . 1 1 28 28 ASN CA C 28 53.472 53.472 54.672 -1.200 25061 861 1 2 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.099 0.114 25061 862 1 2 . 1 1 28 28 ASN H H 28 8.608 8.608 7.862 0.746 25061 863 1 2 . 1 1 29 29 VAL N N 29 120.770 120.770 122.126 -1.356 25061 864 1 2 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.986 -0.171 25061 865 1 2 . 1 1 29 29 VAL C C 29 175.023 175.023 176.895 -1.872 25061 866 1 2 . 1 1 29 29 VAL CA C 29 62.552 62.552 64.256 -1.704 25061 867 1 2 . 1 1 29 29 VAL CB C 29 32.147 32.147 31.087 1.060 25061 868 1 2 . 1 1 29 29 VAL H H 29 7.428 7.428 7.803 -0.375 25061 869 1 2 . 1 1 30 30 LYS N N 30 127.345 127.345 128.797 -1.452 25061 870 1 2 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.096 0.383 25061 871 1 2 . 1 1 30 30 LYS C C 30 174.777 174.777 176.647 -1.870 25061 872 1 2 . 1 1 30 30 LYS CA C 30 55.204 55.204 57.323 -2.119 25061 873 1 2 . 1 1 30 30 LYS CB C 30 31.949 31.949 32.703 -0.754 25061 874 1 2 . 1 1 30 30 LYS H H 30 8.457 8.457 9.028 -0.571 25061 875 1 2 . 1 1 31 31 THR N N 31 113.552 113.552 109.464 4.088 25061 876 1 2 . 1 1 31 31 THR HA H 31 5.723 5.723 4.167 1.556 25061 877 1 2 . 1 1 31 31 THR C C 31 174.593 174.593 173.607 0.986 25061 878 1 2 . 1 1 31 31 THR CA C 31 59.030 59.030 62.507 -3.477 25061 879 1 2 . 1 1 31 31 THR CB C 31 72.206 72.206 68.709 3.497 25061 880 1 2 . 1 1 31 31 THR H H 31 8.164 8.164 7.975 0.189 25061 881 1 2 . 1 1 32 32 VAL N N 32 119.206 119.206 123.506 -4.300 25061 882 1 2 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.404 0.001 25061 883 1 2 . 1 1 32 32 VAL C C 32 172.663 172.663 174.591 -1.928 25061 884 1 2 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.709 -0.637 25061 885 1 2 . 1 1 32 32 VAL CB C 32 35.051 35.051 35.045 0.005 25061 886 1 2 . 1 1 32 32 VAL H H 32 8.615 8.615 8.711 -0.096 25061 887 1 2 . 1 1 33 33 ARG N N 33 130.278 130.278 128.882 1.396 25061 888 1 2 . 1 1 33 33 ARG HA H 33 5.331 5.331 5.028 0.303 25061 889 1 2 . 1 1 33 33 ARG C C 33 173.836 173.836 175.326 -1.490 25061 890 1 2 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.523 -1.373 25061 891 1 2 . 1 1 33 33 ARG CB C 33 30.028 30.028 30.870 -0.842 25061 892 1 2 . 1 1 33 33 ARG H H 33 8.996 8.996 8.738 0.258 25061 893 1 2 . 1 1 34 34 THR N N 34 121.695 121.695 120.166 1.529 25061 894 1 2 . 1 1 34 34 THR HA H 34 4.483 4.483 4.337 0.146 25061 895 1 2 . 1 1 34 34 THR C C 34 169.769 169.769 172.934 -3.165 25061 896 1 2 . 1 1 34 34 THR CA C 34 60.814 60.814 61.398 -0.584 25061 897 1 2 . 1 1 34 34 THR CB C 34 67.402 67.402 70.171 -2.769 25061 898 1 2 . 1 1 34 34 THR H H 34 8.126 8.126 8.303 -0.177 25061 899 1 2 . 1 1 35 35 ASP N N 35 122.198 122.198 120.235 1.963 25061 900 1 2 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.556 0.268 25061 901 1 2 . 1 1 35 35 ASP C C 35 174.790 174.790 175.546 -0.756 25061 902 1 2 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.101 -0.715 25061 903 1 2 . 1 1 35 35 ASP CB C 35 41.848 41.848 41.141 0.707 25061 904 1 2 . 1 1 35 35 ASP H H 35 7.983 7.983 8.386 -0.403 25061 905 1 2 . 1 1 36 36 ASP N N 36 121.091 121.091 123.642 -2.551 25061 906 1 2 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.449 0.144 25061 907 1 2 . 1 1 36 36 ASP C C 36 176.189 176.189 177.269 -1.080 25061 908 1 2 . 1 1 36 36 ASP CA C 36 53.055 53.055 54.868 -1.813 25061 909 1 2 . 1 1 36 36 ASP CB C 36 42.159 42.159 41.166 0.993 25061 910 1 2 . 1 1 36 36 ASP H H 36 8.157 8.157 7.643 0.514 25061 911 1 2 . 1 1 37 37 LYS N N 37 125.839 125.839 126.200 -0.361 25061 912 1 2 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.912 -0.190 25061 913 1 2 . 1 1 37 37 LYS C C 37 176.870 176.870 178.305 -1.435 25061 914 1 2 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.338 0.066 25061 915 1 2 . 1 1 37 37 LYS CB C 37 32.394 32.394 32.045 0.349 25061 916 1 2 . 1 1 37 37 LYS H H 37 8.843 8.843 8.357 0.486 25061 917 1 2 . 1 1 38 38 GLU N N 38 118.369 118.369 118.831 -0.462 25061 918 1 2 . 1 1 38 38 GLU HA H 38 4.007 4.007 4.112 -0.105 25061 919 1 2 . 1 1 38 38 GLU C C 38 179.502 179.502 178.643 0.859 25061 920 1 2 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.395 0.275 25061 921 1 2 . 1 1 38 38 GLU CB C 38 28.474 28.474 28.898 -0.424 25061 922 1 2 . 1 1 38 38 GLU H H 38 8.182 8.182 8.264 -0.082 25061 923 1 2 . 1 1 39 39 LYS N N 39 121.722 121.722 121.480 0.242 25061 924 1 2 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.040 0.126 25061 925 1 2 . 1 1 39 39 LYS C C 39 178.500 178.500 178.838 -0.338 25061 926 1 2 . 1 1 39 39 LYS CA C 39 57.736 57.736 59.208 -1.472 25061 927 1 2 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.574 -1.436 25061 928 1 2 . 1 1 39 39 LYS H H 39 7.524 7.524 7.612 -0.088 25061 929 1 2 . 1 1 40 40 VAL N N 40 117.199 117.199 119.110 -1.911 25061 930 1 2 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.525 -0.297 25061 931 1 2 . 1 1 40 40 VAL C C 40 177.362 177.362 177.995 -0.633 25061 932 1 2 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.242 1.400 25061 933 1 2 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.502 -0.599 25061 934 1 2 . 1 1 40 40 VAL H H 40 7.883 7.883 8.055 -0.172 25061 935 1 2 . 1 1 41 41 LYS N N 41 117.677 117.677 119.231 -1.554 25061 936 1 2 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.547 -0.105 25061 937 1 2 . 1 1 41 41 LYS C C 41 177.686 177.686 178.350 -0.664 25061 938 1 2 . 1 1 41 41 LYS CA C 41 60.809 60.809 60.003 0.806 25061 939 1 2 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.489 0.126 25061 940 1 2 . 1 1 41 41 LYS H H 41 7.567 7.567 7.314 0.253 25061 941 1 2 . 1 1 42 42 GLU N N 42 118.369 118.369 118.321 0.048 25061 942 1 2 . 1 1 42 42 GLU HA H 42 4.007 4.007 3.989 0.018 25061 943 1 2 . 1 1 42 42 GLU C C 42 179.725 179.725 178.814 0.911 25061 944 1 2 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.175 -0.106 25061 945 1 2 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.082 0.457 25061 946 1 2 . 1 1 42 42 GLU H H 42 7.634 7.634 7.588 0.046 25061 947 1 2 . 1 1 43 43 GLU N N 43 117.906 117.906 119.303 -1.397 25061 948 1 2 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.156 0.027 25061 949 1 2 . 1 1 43 43 GLU C C 43 179.757 179.757 179.222 0.535 25061 950 1 2 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.714 -0.348 25061 951 1 2 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.501 -0.660 25061 952 1 2 . 1 1 43 43 GLU H H 43 8.162 8.162 7.978 0.184 25061 953 1 2 . 1 1 44 44 ILE N N 44 122.291 122.291 120.948 1.343 25061 954 1 2 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.640 -0.028 25061 955 1 2 . 1 1 44 44 ILE C C 44 177.101 177.101 177.658 -0.557 25061 956 1 2 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.891 0.465 25061 957 1 2 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.739 -0.279 25061 958 1 2 . 1 1 44 44 ILE H H 44 8.742 8.742 8.165 0.577 25061 959 1 2 . 1 1 45 45 GLU N N 45 119.892 119.892 119.917 -0.025 25061 960 1 2 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.098 -0.040 25061 961 1 2 . 1 1 45 45 GLU C C 45 178.991 178.991 178.989 0.002 25061 962 1 2 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.663 0.002 25061 963 1 2 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.262 -0.101 25061 964 1 2 . 1 1 45 45 GLU H H 45 8.171 8.171 8.025 0.146 25061 965 1 2 . 1 1 46 46 LYS N N 46 118.064 118.064 118.644 -0.580 25061 966 1 2 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.132 -0.150 25061 967 1 2 . 1 1 46 46 LYS C C 46 178.837 178.837 178.810 0.027 25061 968 1 2 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.031 0.710 25061 969 1 2 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.404 0.039 25061 970 1 2 . 1 1 46 46 LYS H H 46 7.785 7.785 7.397 0.388 25061 971 1 2 . 1 1 47 47 ALA N N 47 121.817 121.817 121.806 0.011 25061 972 1 2 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.075 -0.044 25061 973 1 2 . 1 1 47 47 ALA C C 47 179.859 179.859 179.545 0.314 25061 974 1 2 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.094 0.201 25061 975 1 2 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.557 -0.901 25061 976 1 2 . 1 1 47 47 ALA H H 47 8.123 8.123 7.742 0.381 25061 977 1 2 . 1 1 48 48 ARG N N 48 119.080 119.080 116.820 2.260 25061 978 1 2 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.098 -0.009 25061 979 1 2 . 1 1 48 48 ARG C C 48 180.155 180.155 177.951 2.204 25061 980 1 2 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.475 0.722 25061 981 1 2 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.930 -0.420 25061 982 1 2 . 1 1 48 48 ARG H H 48 8.768 8.768 8.153 0.615 25061 983 1 2 . 1 1 49 49 LYS N N 49 119.951 119.951 118.733 1.218 25061 984 1 2 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.136 -0.097 25061 985 1 2 . 1 1 49 49 LYS C C 49 178.288 178.288 178.159 0.129 25061 986 1 2 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.664 0.173 25061 987 1 2 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.334 -0.191 25061 988 1 2 . 1 1 49 49 LYS H H 49 8.037 8.037 7.436 0.601 25061 989 1 2 . 1 1 50 50 GLN N N 50 115.284 115.284 116.964 -1.680 25061 990 1 2 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.290 0.052 25061 991 1 2 . 1 1 50 50 GLN C C 50 176.180 176.180 177.206 -1.026 25061 992 1 2 . 1 1 50 50 GLN CA C 50 55.741 55.741 56.484 -0.743 25061 993 1 2 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.954 -0.390 25061 994 1 2 . 1 1 50 50 GLN H H 50 7.740 7.740 7.854 -0.114 25061 995 1 2 . 1 1 51 51 GLY N N 51 109.725 109.725 107.986 1.739 25061 996 1 2 . 1 1 51 51 GLY C C 51 174.552 174.552 173.711 0.841 25061 997 1 2 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.013 1.350 25061 998 1 2 . 1 1 51 51 GLY H H 51 8.027 8.027 8.289 -0.262 25061 999 1 2 . 1 1 52 52 ARG N N 52 119.064 119.064 120.908 -1.844 25061 1000 1 2 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.512 0.385 25061 1001 1 2 . 1 1 52 52 ARG C C 52 173.123 173.123 173.902 -0.779 25061 1002 1 2 . 1 1 52 52 ARG CA C 52 52.247 52.247 54.405 -2.158 25061 1003 1 2 . 1 1 52 52 ARG CB C 52 32.366 32.366 30.006 2.360 25061 1004 1 2 . 1 1 52 52 ARG H H 52 7.969 7.969 7.751 0.218 25061 1005 1 2 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.472 0.383 25061 1006 1 2 . 1 1 53 53 PRO C C 53 174.069 174.069 175.545 -1.476 25061 1007 1 2 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.280 -0.462 25061 1008 1 2 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.640 -0.580 25061 1009 1 2 . 1 1 54 54 ILE N N 54 116.301 116.301 120.694 -4.393 25061 1010 1 2 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.552 0.686 25061 1011 1 2 . 1 1 54 54 ILE C C 54 171.709 171.709 173.547 -1.838 25061 1012 1 2 . 1 1 54 54 ILE CA C 54 57.774 57.774 60.330 -2.556 25061 1013 1 2 . 1 1 54 54 ILE CB C 54 41.558 41.558 41.159 0.399 25061 1014 1 2 . 1 1 54 54 ILE H H 54 7.920 7.920 7.776 0.144 25061 1015 1 2 . 1 1 55 55 VAL N N 55 126.302 126.302 128.589 -2.287 25061 1016 1 2 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.288 -0.364 25061 1017 1 2 . 1 1 55 55 VAL C C 55 173.624 173.624 175.161 -1.537 25061 1018 1 2 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.537 -0.742 25061 1019 1 2 . 1 1 55 55 VAL CB C 55 32.828 32.828 33.484 -0.656 25061 1020 1 2 . 1 1 55 55 VAL H H 55 8.652 8.652 8.534 0.118 25061 1021 1 2 . 1 1 56 56 ILE N N 56 127.503 127.503 127.168 0.335 25061 1022 1 2 . 1 1 56 56 ILE HA H 56 4.664 4.664 5.191 -0.527 25061 1023 1 2 . 1 1 56 56 ILE C C 56 173.479 173.479 174.898 -1.419 25061 1024 1 2 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.240 0.767 25061 1025 1 2 . 1 1 56 56 ILE CB C 56 40.285 40.285 38.704 1.581 25061 1026 1 2 . 1 1 56 56 ILE H H 56 9.124 9.124 8.278 0.846 25061 1027 1 2 . 1 1 57 57 PHE N N 57 125.302 125.302 125.670 -0.368 25061 1028 1 2 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.486 -0.270 25061 1029 1 2 . 1 1 57 57 PHE C C 57 174.536 174.536 175.593 -1.057 25061 1030 1 2 . 1 1 57 57 PHE CA C 57 56.961 56.961 56.578 0.383 25061 1031 1 2 . 1 1 57 57 PHE CB C 57 40.429 40.429 40.972 -0.543 25061 1032 1 2 . 1 1 57 57 PHE H H 57 8.971 8.971 8.693 0.278 25061 1033 1 2 . 1 1 58 58 ILE N N 58 126.472 126.472 117.138 9.334 25061 1034 1 2 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.635 -0.120 25061 1035 1 2 . 1 1 58 58 ILE C C 58 173.391 173.391 174.836 -1.445 25061 1036 1 2 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.543 -0.453 25061 1037 1 2 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.086 -0.344 25061 1038 1 2 . 1 1 58 58 ILE H H 58 9.248 9.248 8.558 0.690 25061 1039 1 2 . 1 1 59 59 ARG N N 59 124.681 124.681 123.742 0.939 25061 1040 1 2 . 1 1 59 59 ARG HA H 59 4.929 4.929 4.525 0.404 25061 1041 1 2 . 1 1 59 59 ARG C C 59 178.521 178.521 177.342 1.179 25061 1042 1 2 . 1 1 59 59 ARG CA C 59 55.742 55.742 59.217 -3.475 25061 1043 1 2 . 1 1 59 59 ARG CB C 59 30.918 30.918 31.134 -0.216 25061 1044 1 2 . 1 1 59 59 ARG H H 59 8.587 8.587 8.800 -0.213 25061 1045 1 2 . 1 1 60 60 GLY N N 60 108.848 108.848 104.425 4.423 25061 1046 1 2 . 1 1 60 60 GLY C C 60 174.775 174.775 175.846 -1.071 25061 1047 1 2 . 1 1 60 60 GLY CA C 60 46.967 46.967 45.206 1.761 25061 1048 1 2 . 1 1 60 60 GLY H H 60 7.732 7.732 8.273 -0.540 25061 1049 1 2 . 1 1 61 61 ALA N N 61 120.877 120.877 124.509 -3.632 25061 1050 1 2 . 1 1 61 61 ALA HA H 61 4.144 4.144 4.086 0.058 25061 1051 1 2 . 1 1 61 61 ALA C C 61 177.769 177.769 179.031 -1.262 25061 1052 1 2 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.887 -0.438 25061 1053 1 2 . 1 1 61 61 ALA CB C 61 18.371 18.371 17.967 0.404 25061 1054 1 2 . 1 1 61 61 ALA H H 61 7.852 7.852 8.387 -0.535 25061 1055 1 2 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.202 0.598 25061 1056 1 2 . 1 1 62 62 TYR CA C 62 63.039 63.039 59.262 3.777 25061 1057 1 2 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.480 -0.040 25061 1058 1 2 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.888 -0.203 25061 1059 1 2 . 1 1 63 63 GLU C C 63 176.251 176.251 178.358 -2.107 25061 1060 1 2 . 1 1 63 63 GLU CA C 63 59.258 59.258 58.885 0.373 25061 1061 1 2 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.147 0.265 25061 1062 1 2 . 1 1 64 64 GLU N N 64 119.209 119.209 119.225 -0.016 25061 1063 1 2 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.191 0.710 25061 1064 1 2 . 1 1 64 64 GLU C C 64 178.251 178.251 178.675 -0.424 25061 1065 1 2 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.455 0.757 25061 1066 1 2 . 1 1 64 64 GLU CB C 64 28.645 28.645 28.985 -0.340 25061 1067 1 2 . 1 1 64 64 GLU H H 64 8.878 8.878 7.499 1.379 25061 1068 1 2 . 1 1 65 65 VAL N N 65 116.728 116.728 117.952 -1.224 25061 1069 1 2 . 1 1 65 65 VAL HA H 65 3.982 3.982 4.008 -0.026 25061 1070 1 2 . 1 1 65 65 VAL C C 65 176.915 176.915 178.005 -1.090 25061 1071 1 2 . 1 1 65 65 VAL CA C 65 64.609 64.609 64.675 -0.066 25061 1072 1 2 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.410 0.485 25061 1073 1 2 . 1 1 65 65 VAL H H 65 7.652 7.652 7.440 0.212 25061 1074 1 2 . 1 1 66 66 VAL N N 66 119.462 119.462 120.625 -1.163 25061 1075 1 2 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.624 -0.310 25061 1076 1 2 . 1 1 66 66 VAL C C 66 177.142 177.142 177.049 0.093 25061 1077 1 2 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.384 0.951 25061 1078 1 2 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.247 0.183 25061 1079 1 2 . 1 1 66 66 VAL H H 66 7.896 7.896 7.803 0.093 25061 1080 1 2 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.034 -0.406 25061 1081 1 2 . 1 1 67 67 ARG C C 67 177.841 177.841 178.264 -0.423 25061 1082 1 2 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.793 0.259 25061 1083 1 2 . 1 1 67 67 ARG CB C 67 29.393 29.393 30.079 -0.686 25061 1084 1 2 . 1 1 68 68 ASP N N 68 118.316 118.316 119.493 -1.177 25061 1085 1 2 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.506 -0.145 25061 1086 1 2 . 1 1 68 68 ASP C C 68 178.945 178.945 178.808 0.137 25061 1087 1 2 . 1 1 68 68 ASP CA C 68 57.311 57.311 57.675 -0.364 25061 1088 1 2 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.684 0.830 25061 1089 1 2 . 1 1 68 68 ASP H H 68 7.625 7.625 7.936 -0.311 25061 1090 1 2 . 1 1 69 69 ILE N N 69 119.231 119.231 120.646 -1.415 25061 1091 1 2 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.789 -0.159 25061 1092 1 2 . 1 1 69 69 ILE C C 69 177.138 177.138 178.444 -1.306 25061 1093 1 2 . 1 1 69 69 ILE CA C 69 64.540 64.540 64.747 -0.207 25061 1094 1 2 . 1 1 69 69 ILE CB C 69 37.050 37.050 38.081 -1.031 25061 1095 1 2 . 1 1 69 69 ILE H H 69 8.113 8.113 7.315 0.798 25061 1096 1 2 . 1 1 70 70 VAL N N 70 120.164 120.164 119.937 0.227 25061 1097 1 2 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.701 -0.284 25061 1098 1 2 . 1 1 70 70 VAL C C 70 177.079 177.079 176.759 0.320 25061 1099 1 2 . 1 1 70 70 VAL CA C 70 67.274 67.274 66.430 0.844 25061 1100 1 2 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.713 -0.455 25061 1101 1 2 . 1 1 70 70 VAL H H 70 8.478 8.478 8.461 0.017 25061 1102 1 2 . 1 1 71 71 GLU N N 71 118.293 118.293 119.443 -1.150 25061 1103 1 2 . 1 1 71 71 GLU HA H 71 4.054 4.054 4.263 -0.209 25061 1104 1 2 . 1 1 71 71 GLU C C 71 179.009 179.009 178.597 0.412 25061 1105 1 2 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.277 0.139 25061 1106 1 2 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.239 -0.417 25061 1107 1 2 . 1 1 71 71 GLU H H 71 8.152 8.152 8.221 -0.069 25061 1108 1 2 . 1 1 72 72 TYR N N 72 120.091 120.091 120.426 -0.335 25061 1109 1 2 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.195 -0.033 25061 1110 1 2 . 1 1 72 72 TYR C C 72 176.404 176.404 177.006 -0.602 25061 1111 1 2 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.572 -0.440 25061 1112 1 2 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.520 -0.383 25061 1113 1 2 . 1 1 72 72 TYR H H 72 7.959 7.959 7.731 0.228 25061 1114 1 2 . 1 1 73 73 ALA N N 73 120.133 120.133 120.695 -0.562 25061 1115 1 2 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.925 -0.295 25061 1116 1 2 . 1 1 73 73 ALA C C 73 179.182 179.182 179.205 -0.023 25061 1117 1 2 . 1 1 73 73 ALA CA C 73 55.112 55.112 54.994 0.118 25061 1118 1 2 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.307 -0.116 25061 1119 1 2 . 1 1 73 73 ALA H H 73 8.604 8.604 7.947 0.657 25061 1120 1 2 . 1 1 74 74 GLN N N 74 115.553 115.553 117.127 -1.574 25061 1121 1 2 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.994 0.144 25061 1122 1 2 . 1 1 74 74 GLN C C 74 180.595 180.595 178.809 1.786 25061 1123 1 2 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.323 0.772 25061 1124 1 2 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.734 -0.159 25061 1125 1 2 . 1 1 74 74 GLN H H 74 8.619 8.619 8.207 0.412 25061 1126 1 2 . 1 1 75 75 LYS N N 75 122.396 122.396 119.368 3.028 25061 1127 1 2 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.021 0.007 25061 1128 1 2 . 1 1 75 75 LYS C C 75 178.521 178.521 178.605 -0.084 25061 1129 1 2 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.368 0.690 25061 1130 1 2 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.952 -0.353 25061 1131 1 2 . 1 1 75 75 LYS H H 75 8.123 8.123 7.562 0.561 25061 1132 1 2 . 1 1 76 76 GLU N N 76 116.294 116.294 115.394 0.900 25061 1133 1 2 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.246 -0.147 25061 1134 1 2 . 1 1 76 76 GLU C C 76 175.957 175.957 177.421 -1.464 25061 1135 1 2 . 1 1 76 76 GLU CA C 76 55.605 55.605 56.085 -0.480 25061 1136 1 2 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.583 0.241 25061 1137 1 2 . 1 1 76 76 GLU H H 76 7.450 7.450 7.687 -0.237 25061 1138 1 2 . 1 1 77 77 GLY N N 77 107.446 107.446 107.325 0.121 25061 1139 1 2 . 1 1 77 77 GLY C C 77 174.520 174.520 174.856 -0.336 25061 1140 1 2 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.770 0.037 25061 1141 1 2 . 1 1 77 77 GLY H H 77 7.763 7.763 7.431 0.332 25061 1142 1 2 . 1 1 78 78 LEU N N 78 120.179 120.179 120.265 -0.086 25061 1143 1 2 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.215 0.173 25061 1144 1 2 . 1 1 78 78 LEU C C 78 175.914 175.914 176.522 -0.608 25061 1145 1 2 . 1 1 78 78 LEU CA C 78 53.472 53.472 54.836 -1.364 25061 1146 1 2 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.042 -0.153 25061 1147 1 2 . 1 1 78 78 LEU H H 78 7.930 7.930 7.807 0.123 25061 1148 1 2 . 1 1 79 79 ARG N N 79 122.207 122.207 124.342 -2.135 25061 1149 1 2 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.344 0.053 25061 1150 1 2 . 1 1 79 79 ARG C C 79 174.960 174.960 174.771 0.189 25061 1151 1 2 . 1 1 79 79 ARG CA C 79 55.648 55.648 56.347 -0.699 25061 1152 1 2 . 1 1 79 79 ARG CB C 79 30.476 30.476 30.945 -0.469 25061 1153 1 2 . 1 1 79 79 ARG H H 79 8.241 8.241 8.401 -0.160 25061 1154 1 2 . 1 1 80 80 VAL N N 80 123.333 123.333 123.293 0.040 25061 1155 1 2 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.947 0.348 25061 1156 1 2 . 1 1 80 80 VAL C C 80 174.048 174.048 174.285 -0.237 25061 1157 1 2 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.593 -1.552 25061 1158 1 2 . 1 1 80 80 VAL CB C 80 34.305 34.305 34.631 -0.326 25061 1159 1 2 . 1 1 80 80 VAL H H 80 8.359 8.359 8.434 -0.075 25061 1160 1 2 . 1 1 81 81 LEU N N 81 128.719 128.719 129.096 -0.377 25061 1161 1 2 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.452 -0.348 25061 1162 1 2 . 1 1 81 81 LEU C C 81 174.484 174.484 174.560 -0.076 25061 1163 1 2 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.716 0.404 25061 1164 1 2 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.623 -0.668 25061 1165 1 2 . 1 1 81 81 LEU H H 81 8.650 8.650 9.021 -0.371 25061 1166 1 2 . 1 1 82 82 VAL N N 82 122.487 122.487 128.161 -5.674 25061 1167 1 2 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.444 0.653 25061 1168 1 2 . 1 1 82 82 VAL C C 82 174.525 174.525 174.752 -0.227 25061 1169 1 2 . 1 1 82 82 VAL CA C 82 60.285 60.285 61.431 -1.146 25061 1170 1 2 . 1 1 82 82 VAL CB C 82 34.789 34.789 31.901 2.888 25061 1171 1 2 . 1 1 82 82 VAL H H 82 8.781 8.781 8.445 0.336 25061 1172 1 2 . 1 1 83 83 ILE N N 83 128.082 128.082 129.782 -1.700 25061 1173 1 2 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.305 0.625 25061 1174 1 2 . 1 1 83 83 ILE C C 83 172.925 172.925 174.502 -1.577 25061 1175 1 2 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.786 -0.845 25061 1176 1 2 . 1 1 83 83 ILE CB C 83 40.186 40.186 37.908 2.278 25061 1177 1 2 . 1 1 83 83 ILE H H 83 9.527 9.527 8.916 0.611 25061 1178 1 2 . 1 1 84 84 LYS N N 84 128.493 128.493 126.611 1.882 25061 1179 1 2 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.512 -0.464 25061 1180 1 2 . 1 1 84 84 LYS C C 84 174.027 174.027 175.487 -1.460 25061 1181 1 2 . 1 1 84 84 LYS CA C 84 53.253 53.253 53.525 -0.272 25061 1182 1 2 . 1 1 84 84 LYS CB C 84 34.652 34.652 36.096 -1.444 25061 1183 1 2 . 1 1 84 84 LYS H H 84 8.721 8.721 8.834 -0.113 25061 1184 1 2 . 1 1 85 85 VAL N N 85 126.729 126.729 124.243 2.486 25061 1185 1 2 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.277 0.459 25061 1186 1 2 . 1 1 85 85 VAL C C 85 175.935 175.935 176.652 -0.717 25061 1187 1 2 . 1 1 85 85 VAL CA C 85 60.200 60.200 62.228 -2.029 25061 1188 1 2 . 1 1 85 85 VAL CB C 85 30.847 30.847 32.673 -1.827 25061 1189 1 2 . 1 1 85 85 VAL H H 85 8.643 8.643 7.864 0.779 25061 1190 1 2 . 1 1 86 86 ALA N N 86 132.930 132.930 130.898 2.032 25061 1191 1 2 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.018 0.412 25061 1192 1 2 . 1 1 86 86 ALA C C 86 175.635 175.635 178.527 -2.892 25061 1193 1 2 . 1 1 86 86 ALA CA C 86 51.504 51.504 54.193 -2.689 25061 1194 1 2 . 1 1 86 86 ALA CB C 86 20.821 20.821 18.928 1.893 25061 1195 1 2 . 1 1 86 86 ALA H H 86 8.835 8.835 8.671 0.164 25061 1196 1 2 . 1 1 87 87 GLN N N 87 118.719 118.719 115.303 3.416 25061 1197 1 2 . 1 1 87 87 GLN HA H 87 4.469 4.469 3.864 0.605 25061 1198 1 2 . 1 1 87 87 GLN C C 87 175.949 175.949 177.057 -1.108 25061 1199 1 2 . 1 1 87 87 GLN CA C 87 55.260 55.260 58.385 -3.124 25061 1200 1 2 . 1 1 87 87 GLN CB C 87 30.432 30.432 26.252 4.180 25061 1201 1 2 . 1 1 87 87 GLN H H 87 8.570 8.570 8.547 0.023 25061 1202 1 2 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.391 0.089 25061 1203 1 2 . 1 1 88 88 ASP CA C 88 55.454 55.454 56.118 -0.664 25061 1204 1 2 . 1 1 88 88 ASP CB C 88 41.204 41.204 41.296 -0.092 25061 1205 1 2 . 1 1 89 89 GLN HA H 89 4.047 4.047 3.774 0.273 25061 1206 1 2 . 1 1 89 89 GLN CA C 89 56.687 56.687 58.472 -1.786 25061 1207 1 2 . 1 1 89 89 GLN CB C 89 27.850 27.850 27.034 0.816 25061 1208 1 2 . 1 1 92 92 LEU N N 92 125.291 125.291 120.353 4.938 25061 1209 1 2 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.038 0.163 25061 1210 1 2 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.840 -2.783 25061 1211 1 2 . 1 1 92 92 LEU CB C 92 42.046 42.046 42.112 -0.066 25061 1212 1 2 . 1 1 92 92 LEU H H 92 8.277 8.277 8.482 -0.205 25061 1213 1 2 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.428 0.328 25061 1214 1 2 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.088 -0.039 25061 1215 1 2 . 1 1 94 94 ARG C C 94 178.544 178.544 178.569 -0.025 25061 1216 1 2 . 1 1 94 94 ARG CA C 94 58.607 58.607 58.916 -0.309 25061 1217 1 2 . 1 1 94 94 ARG CB C 94 29.614 29.614 29.694 -0.080 25061 1218 1 2 . 1 1 95 95 PHE N N 95 117.407 117.407 118.454 -1.047 25061 1219 1 2 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.337 0.038 25061 1220 1 2 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.191 0.040 25061 1221 1 2 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.344 -1.403 25061 1222 1 2 . 1 1 95 95 PHE H H 95 8.419 8.419 7.703 0.716 25061 1223 1 2 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.982 -0.174 25061 1224 1 2 . 1 1 96 96 TYR C C 96 177.728 177.728 177.405 0.323 25061 1225 1 2 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.398 1.758 25061 1226 1 2 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.629 -0.929 25061 1227 1 2 . 1 1 97 97 GLU N N 97 119.054 119.054 117.799 1.255 25061 1228 1 2 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.747 0.316 25061 1229 1 2 . 1 1 97 97 GLU C C 97 179.071 179.071 178.774 0.297 25061 1230 1 2 . 1 1 97 97 GLU CA C 97 58.760 58.760 59.318 -0.558 25061 1231 1 2 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.280 -0.108 25061 1232 1 2 . 1 1 97 97 GLU H H 97 7.858 7.858 8.076 -0.218 25061 1233 1 2 . 1 1 98 98 GLN N N 98 119.385 119.385 118.618 0.767 25061 1234 1 2 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.987 -0.086 25061 1235 1 2 . 1 1 98 98 GLN C C 98 177.599 177.599 178.393 -0.794 25061 1236 1 2 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.682 -0.371 25061 1237 1 2 . 1 1 98 98 GLN CB C 98 27.766 27.766 27.859 -0.093 25061 1238 1 2 . 1 1 98 98 GLN H H 98 7.747 7.747 7.488 0.259 25061 1239 1 2 . 1 1 99 99 LEU N N 99 118.348 118.348 119.129 -0.781 25061 1240 1 2 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.931 0.088 25061 1241 1 2 . 1 1 99 99 LEU C C 99 178.669 178.669 178.922 -0.253 25061 1242 1 2 . 1 1 99 99 LEU CA C 99 57.430 57.430 57.602 -0.172 25061 1243 1 2 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.336 0.167 25061 1244 1 2 . 1 1 99 99 LEU H H 99 7.891 7.891 7.308 0.583 25061 1245 1 2 . 1 1 100 100 LYS N N 100 118.332 118.332 119.209 -0.877 25061 1246 1 2 . 1 1 100 100 LYS HA H 100 4.509 4.509 3.973 0.536 25061 1247 1 2 . 1 1 100 100 LYS C C 100 180.846 180.846 178.841 2.005 25061 1248 1 2 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.247 0.841 25061 1249 1 2 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.911 0.358 25061 1250 1 2 . 1 1 100 100 LYS H H 100 7.560 7.560 7.258 0.302 25061 1251 1 2 . 1 1 101 101 LYS N N 101 121.944 121.944 118.480 3.464 25061 1252 1 2 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.094 -0.022 25061 1253 1 2 . 1 1 101 101 LYS C C 101 177.707 177.707 177.520 0.187 25061 1254 1 2 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.262 0.609 25061 1255 1 2 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.566 -0.471 25061 1256 1 2 . 1 1 101 101 LYS H H 101 7.959 7.959 7.639 0.320 25061 1257 1 2 . 1 1 102 102 ASP N N 102 118.788 118.788 117.133 1.655 25061 1258 1 2 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.452 0.242 25061 1259 1 2 . 1 1 102 102 ASP C C 102 176.359 176.359 177.552 -1.193 25061 1260 1 2 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.658 -1.079 25061 1261 1 2 . 1 1 102 102 ASP CB C 102 40.574 40.574 42.598 -2.024 25061 1262 1 2 . 1 1 102 102 ASP H H 102 7.893 7.893 7.770 0.123 25061 1263 1 2 . 1 1 103 103 GLY N N 103 107.024 107.024 107.115 -0.091 25061 1264 1 2 . 1 1 103 103 GLY C C 103 174.328 174.328 174.410 -0.082 25061 1265 1 2 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.767 0.578 25061 1266 1 2 . 1 1 103 103 GLY H H 103 7.866 7.866 8.195 -0.329 25061 1267 1 2 . 1 1 104 104 VAL N N 104 123.060 123.060 122.121 0.939 25061 1268 1 2 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.836 0.137 25061 1269 1 2 . 1 1 104 104 VAL C C 104 175.023 175.023 175.216 -0.193 25061 1270 1 2 . 1 1 104 104 VAL CA C 104 61.878 61.878 63.430 -1.552 25061 1271 1 2 . 1 1 104 104 VAL CB C 104 32.088 32.088 31.839 0.249 25061 1272 1 2 . 1 1 104 104 VAL H H 104 7.955 7.955 7.552 0.403 25061 1273 1 2 . 1 1 105 105 ASP N N 105 127.987 127.987 129.017 -1.030 25061 1274 1 2 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.676 -0.101 25061 1275 1 2 . 1 1 105 105 ASP C C 105 173.624 173.624 174.577 -0.953 25061 1276 1 2 . 1 1 105 105 ASP CA C 105 54.087 54.087 53.232 0.855 25061 1277 1 2 . 1 1 105 105 ASP CB C 105 40.660 40.660 40.772 -0.112 25061 1278 1 2 . 1 1 105 105 ASP H H 105 8.399 8.399 8.243 0.156 25061 1279 1 2 . 1 1 106 106 VAL N N 106 125.798 125.798 123.439 2.359 25061 1280 1 2 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.681 0.134 25061 1281 1 2 . 1 1 106 106 VAL C C 106 174.902 174.902 174.479 0.423 25061 1282 1 2 . 1 1 106 106 VAL CA C 106 60.194 60.194 61.133 -0.939 25061 1283 1 2 . 1 1 106 106 VAL CB C 106 34.179 34.179 33.878 0.301 25061 1284 1 2 . 1 1 106 106 VAL H H 106 7.550 7.550 7.675 -0.125 25061 1285 1 2 . 1 1 107 107 ARG N N 107 128.099 128.099 127.501 0.598 25061 1286 1 2 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.897 -0.021 25061 1287 1 2 . 1 1 107 107 ARG C C 107 173.815 173.815 174.595 -0.780 25061 1288 1 2 . 1 1 107 107 ARG CA C 107 53.386 53.386 53.387 -0.001 25061 1289 1 2 . 1 1 107 107 ARG CB C 107 31.195 31.195 33.345 -2.150 25061 1290 1 2 . 1 1 107 107 ARG H H 107 9.132 9.132 9.080 0.052 25061 1291 1 2 . 1 1 108 108 VAL N N 108 123.979 123.979 122.024 1.955 25061 1292 1 2 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.164 -0.222 25061 1293 1 2 . 1 1 108 108 VAL C C 108 175.854 175.854 176.783 -0.929 25061 1294 1 2 . 1 1 108 108 VAL CA C 108 60.017 60.017 60.731 -0.714 25061 1295 1 2 . 1 1 108 108 VAL CB C 108 32.844 32.844 31.818 1.026 25061 1296 1 2 . 1 1 108 108 VAL H H 108 8.561 8.561 8.907 -0.346 25061 1297 1 2 . 1 1 109 109 THR N N 109 120.144 120.144 119.299 0.845 25061 1298 1 2 . 1 1 109 109 THR HA H 109 4.815 4.815 4.226 0.589 25061 1299 1 2 . 1 1 109 109 THR C C 109 171.867 171.867 176.007 -4.140 25061 1300 1 2 . 1 1 109 109 THR CA C 109 59.613 59.613 62.577 -2.964 25061 1301 1 2 . 1 1 109 109 THR CB C 109 69.720 69.720 69.576 0.144 25061 1302 1 2 . 1 1 109 109 THR H H 109 8.803 8.803 8.716 0.087 25061 1303 1 2 . 1 1 110 110 ASP N N 110 123.212 123.212 120.045 3.167 25061 1304 1 2 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.271 0.698 25061 1305 1 2 . 1 1 110 110 ASP C C 110 175.739 175.739 175.666 0.073 25061 1306 1 2 . 1 1 110 110 ASP CA C 110 53.243 53.243 56.742 -3.499 25061 1307 1 2 . 1 1 110 110 ASP CB C 110 41.351 41.351 39.735 1.616 25061 1308 1 2 . 1 1 110 110 ASP H H 110 8.363 8.363 8.608 -0.245 25061 1309 1 2 . 1 1 111 111 ASN N N 111 116.298 116.298 119.314 -3.016 25061 1310 1 2 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.686 0.190 25061 1311 1 2 . 1 1 111 111 ASN C C 111 174.756 174.756 176.729 -1.973 25061 1312 1 2 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.969 -0.837 25061 1313 1 2 . 1 1 111 111 ASN CB C 111 40.765 40.765 39.604 1.161 25061 1314 1 2 . 1 1 111 111 ASN H H 111 8.085 8.085 8.088 -0.003 25061 1315 1 2 . 1 1 112 112 GLU HA H 112 3.848 3.848 4.057 -0.209 25061 1316 1 2 . 1 1 112 112 GLU C C 112 177.016 177.016 177.982 -0.966 25061 1317 1 2 . 1 1 112 112 GLU CA C 112 59.480 59.480 59.784 -0.304 25061 1318 1 2 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.579 0.095 25061 1319 1 2 . 1 1 113 113 ASP N N 113 121.033 121.033 119.192 1.841 25061 1320 1 2 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.519 -0.106 25061 1321 1 2 . 1 1 113 113 ASP C C 113 178.988 178.988 178.468 0.520 25061 1322 1 2 . 1 1 113 113 ASP CA C 113 57.855 57.855 56.588 1.267 25061 1323 1 2 . 1 1 113 113 ASP CB C 113 40.502 40.502 41.272 -0.770 25061 1324 1 2 . 1 1 113 113 ASP H H 113 8.219 8.219 7.953 0.266 25061 1325 1 2 . 1 1 114 114 GLU N N 114 121.280 121.280 118.847 2.433 25061 1326 1 2 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.104 -0.039 25061 1327 1 2 . 1 1 114 114 GLU C C 114 178.776 178.776 178.553 0.223 25061 1328 1 2 . 1 1 114 114 GLU CA C 114 58.714 58.714 58.889 -0.175 25061 1329 1 2 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.097 0.116 25061 1330 1 2 . 1 1 114 114 GLU H H 114 8.296 8.296 8.325 -0.029 25061 1331 1 2 . 1 1 115 115 ALA N N 115 120.924 120.924 121.389 -0.465 25061 1332 1 2 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.088 -0.250 25061 1333 1 2 . 1 1 115 115 ALA C C 115 178.502 178.502 179.282 -0.780 25061 1334 1 2 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.151 0.487 25061 1335 1 2 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.404 0.093 25061 1336 1 2 . 1 1 115 115 ALA H H 115 7.853 7.853 7.557 0.296 25061 1337 1 2 . 1 1 116 116 LYS N N 116 116.616 116.616 117.123 -0.507 25061 1338 1 2 . 1 1 116 116 LYS HA H 116 3.719 3.719 4.048 -0.329 25061 1339 1 2 . 1 1 116 116 LYS C C 116 178.097 178.097 178.712 -0.615 25061 1340 1 2 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.058 1.694 25061 1341 1 2 . 1 1 116 116 LYS CB C 116 32.555 32.555 31.982 0.573 25061 1342 1 2 . 1 1 116 116 LYS H H 116 8.091 8.091 7.585 0.506 25061 1343 1 2 . 1 1 117 117 LYS N N 117 118.990 118.990 120.250 -1.260 25061 1344 1 2 . 1 1 117 117 LYS HA H 117 3.911 3.911 3.958 -0.047 25061 1345 1 2 . 1 1 117 117 LYS C C 117 179.186 179.186 179.291 -0.105 25061 1346 1 2 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.504 0.067 25061 1347 1 2 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.236 0.284 25061 1348 1 2 . 1 1 117 117 LYS H H 117 7.742 7.742 7.847 -0.105 25061 1349 1 2 . 1 1 118 118 ARG N N 118 117.441 117.441 119.027 -1.586 25061 1350 1 2 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.091 0.049 25061 1351 1 2 . 1 1 118 118 ARG C C 118 178.921 178.921 178.840 0.081 25061 1352 1 2 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.972 -1.301 25061 1353 1 2 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.695 -0.035 25061 1354 1 2 . 1 1 118 118 ARG H H 118 8.468 8.468 7.570 0.898 25061 1355 1 2 . 1 1 119 119 LEU N N 119 120.100 120.100 119.708 0.392 25061 1356 1 2 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.863 0.097 25061 1357 1 2 . 1 1 119 119 LEU C C 119 177.554 177.554 178.685 -1.131 25061 1358 1 2 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.497 -0.616 25061 1359 1 2 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.460 0.429 25061 1360 1 2 . 1 1 119 119 LEU H H 119 8.322 8.322 7.619 0.703 25061 1361 1 2 . 1 1 120 120 LYS N N 120 118.238 118.238 119.481 -1.243 25061 1362 1 2 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.943 -0.121 25061 1363 1 2 . 1 1 120 120 LYS C C 120 178.703 178.703 179.102 -0.399 25061 1364 1 2 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.519 0.827 25061 1365 1 2 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.379 -0.143 25061 1366 1 2 . 1 1 120 120 LYS H H 120 7.990 7.990 7.599 0.391 25061 1367 1 2 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.056 -0.034 25061 1368 1 2 . 1 1 121 121 GLU C C 121 177.769 177.769 179.271 -1.502 25061 1369 1 2 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.176 -0.254 25061 1370 1 2 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.589 -0.135 25061 1371 1 2 . 1 1 122 122 LEU N N 122 119.454 119.454 120.819 -1.365 25061 1372 1 2 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.454 -0.321 25061 1373 1 2 . 1 1 122 122 LEU C C 122 178.991 178.991 179.308 -0.317 25061 1374 1 2 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.811 -0.485 25061 1375 1 2 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.997 -0.318 25061 1376 1 2 . 1 1 122 122 LEU H H 122 7.930 7.930 8.176 -0.246 25061 1377 1 2 . 1 1 123 123 LEU N N 123 117.862 117.862 117.978 -0.116 25061 1378 1 2 . 1 1 123 123 LEU HA H 123 4.067 4.067 4.202 -0.135 25061 1379 1 2 . 1 1 123 123 LEU C C 123 179.178 179.178 179.440 -0.262 25061 1380 1 2 . 1 1 123 123 LEU CA C 123 56.920 56.920 56.960 -0.040 25061 1381 1 2 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.074 0.136 25061 1382 1 2 . 1 1 123 123 LEU H H 123 8.095 8.095 8.068 0.027 25061 1383 1 2 . 1 1 124 124 GLU N N 124 118.975 118.975 117.992 0.983 25061 1384 1 2 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.084 0.045 25061 1385 1 2 . 1 1 124 124 GLU C C 124 177.777 177.777 177.658 0.119 25061 1386 1 2 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.719 -0.632 25061 1387 1 2 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.288 0.252 25061 1388 1 2 . 1 1 124 124 GLU H H 124 7.930 7.930 7.867 0.063 25061 1389 1 2 . 1 1 125 125 LYS N N 125 118.933 118.933 116.428 2.505 25061 1390 1 2 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.412 -0.075 25061 1391 1 2 . 1 1 125 125 LYS C C 125 178.188 178.188 177.300 0.888 25061 1392 1 2 . 1 1 125 125 LYS CA C 125 56.980 56.980 57.646 -0.666 25061 1393 1 2 . 1 1 125 125 LYS CB C 125 32.608 32.608 34.905 -2.297 25061 1394 1 2 . 1 1 125 125 LYS H H 125 7.729 7.729 7.692 0.037 25061 1395 1 2 . 1 1 126 126 VAL N N 126 117.933 117.933 112.916 5.017 25061 1396 1 2 . 1 1 126 126 VAL HA H 126 4.022 4.022 4.236 -0.214 25061 1397 1 2 . 1 1 126 126 VAL C C 126 176.947 176.947 174.446 2.501 25061 1398 1 2 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.234 0.407 25061 1399 1 2 . 1 1 126 126 VAL CB C 126 31.859 31.859 33.973 -2.114 25061 1400 1 2 . 1 1 126 126 VAL H H 126 8.044 8.044 8.343 -0.299 25061 1401 1 2 . 1 1 127 127 GLY N N 127 109.813 109.813 107.973 1.840 25061 1402 1 2 . 1 1 127 127 GLY C C 127 174.264 174.264 172.551 1.713 25061 1403 1 2 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.814 -0.535 25061 1404 1 2 . 1 1 127 127 GLY H H 127 8.279 8.279 7.983 0.296 25061 1405 1 2 . 1 1 128 128 SER N N 128 115.185 115.185 116.240 -1.055 25061 1406 1 2 . 1 1 128 128 SER HA H 128 4.462 4.462 4.782 -0.320 25061 1407 1 2 . 1 1 128 128 SER C C 128 174.775 174.775 173.004 1.771 25061 1408 1 2 . 1 1 128 128 SER CA C 128 58.739 58.739 58.150 0.589 25061 1409 1 2 . 1 1 128 128 SER CB C 128 63.850 63.850 64.625 -0.775 25061 1410 1 2 . 1 1 128 128 SER H H 128 8.048 8.048 7.473 0.575 25061 1411 1 2 . 1 1 129 129 LEU N N 129 123.060 123.060 123.751 -0.691 25061 1412 1 2 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.056 0.242 25061 1413 1 2 . 1 1 129 129 LEU C C 129 177.313 177.313 174.096 3.217 25061 1414 1 2 . 1 1 129 129 LEU CA C 129 55.158 55.158 56.206 -1.048 25061 1415 1 2 . 1 1 129 129 LEU CB C 129 41.837 41.837 42.555 -0.718 25061 1416 1 2 . 1 1 129 129 LEU H H 129 8.147 8.147 8.592 -0.445 25061 1417 1 2 . 1 1 130 130 GLU N N 130 120.088 120.088 122.993 -2.905 25061 1418 1 2 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.385 -0.204 25061 1419 1 2 . 1 1 130 130 GLU C C 130 176.148 176.148 174.361 1.787 25061 1420 1 2 . 1 1 130 130 GLU CA C 130 56.726 56.726 54.717 2.009 25061 1421 1 2 . 1 1 130 130 GLU CB C 130 30.026 30.026 31.403 -1.377 25061 1422 1 2 . 1 1 130 130 GLU H H 130 8.242 8.242 7.800 0.442 25061 1423 1 3 . 1 1 2 2 GLY CA C 2 45.319 45.319 44.905 0.414 25061 1424 1 3 . 1 1 3 3 THR HA H 3 4.820 4.820 4.399 0.421 25061 1425 1 3 . 1 1 3 3 THR C C 3 172.374 172.374 174.109 -1.735 25061 1426 1 3 . 1 1 3 3 THR CA C 3 62.760 62.760 63.260 -0.500 25061 1427 1 3 . 1 1 3 3 THR CB C 3 71.441 71.441 69.599 1.843 25061 1428 1 3 . 1 1 4 4 VAL N N 4 126.881 126.881 127.973 -1.092 25061 1429 1 3 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.157 0.411 25061 1430 1 3 . 1 1 4 4 VAL C C 4 173.116 173.116 174.692 -1.576 25061 1431 1 3 . 1 1 4 4 VAL CA C 4 60.455 60.455 62.095 -1.640 25061 1432 1 3 . 1 1 4 4 VAL CB C 4 33.800 33.800 31.638 2.162 25061 1433 1 3 . 1 1 4 4 VAL H H 4 9.097 9.097 8.896 0.201 25061 1434 1 3 . 1 1 5 5 VAL N N 5 127.172 127.172 123.619 3.553 25061 1435 1 3 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.472 -0.585 25061 1436 1 3 . 1 1 5 5 VAL C C 5 174.091 174.091 175.131 -1.040 25061 1437 1 3 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.188 0.930 25061 1438 1 3 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.250 -0.315 25061 1439 1 3 . 1 1 5 5 VAL H H 5 8.811 8.811 8.926 -0.115 25061 1440 1 3 . 1 1 6 6 ILE N N 6 127.577 127.577 128.879 -1.302 25061 1441 1 3 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.378 0.242 25061 1442 1 3 . 1 1 6 6 ILE C C 6 173.328 173.328 175.250 -1.922 25061 1443 1 3 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.684 0.148 25061 1444 1 3 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.434 1.496 25061 1445 1 3 . 1 1 6 6 ILE H H 6 9.210 9.210 8.691 0.519 25061 1446 1 3 . 1 1 7 7 VAL N N 7 129.024 129.024 129.966 -0.942 25061 1447 1 3 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.791 0.014 25061 1448 1 3 . 1 1 7 7 VAL C C 7 173.561 173.561 175.109 -1.548 25061 1449 1 3 . 1 1 7 7 VAL CA C 7 60.849 60.849 61.628 -0.779 25061 1450 1 3 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.858 0.502 25061 1451 1 3 . 1 1 7 7 VAL H H 7 9.294 9.294 8.124 1.170 25061 1452 1 3 . 1 1 8 8 VAL N N 8 125.318 125.318 128.930 -3.612 25061 1453 1 3 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.378 0.018 25061 1454 1 3 . 1 1 8 8 VAL C C 8 175.723 175.723 175.454 0.269 25061 1455 1 3 . 1 1 8 8 VAL CA C 8 59.617 59.617 60.462 -0.845 25061 1456 1 3 . 1 1 8 8 VAL CB C 8 34.915 34.915 35.743 -0.828 25061 1457 1 3 . 1 1 8 8 VAL H H 8 8.898 8.898 7.846 1.052 25061 1458 1 3 . 1 1 9 9 SER N N 9 116.544 116.544 118.134 -1.590 25061 1459 1 3 . 1 1 9 9 SER HA H 9 4.724 4.724 4.987 -0.263 25061 1460 1 3 . 1 1 9 9 SER C C 9 174.552 174.552 173.727 0.825 25061 1461 1 3 . 1 1 9 9 SER CA C 9 57.419 57.419 56.998 0.421 25061 1462 1 3 . 1 1 9 9 SER CB C 9 64.998 64.998 66.911 -1.913 25061 1463 1 3 . 1 1 9 9 SER H H 9 7.833 7.833 7.956 -0.123 25061 1464 1 3 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.494 0.418 25061 1465 1 3 . 1 1 10 10 ASN C C 10 176.170 176.170 174.872 1.298 25061 1466 1 3 . 1 1 10 10 ASN CA C 10 54.141 54.141 55.008 -0.867 25061 1467 1 3 . 1 1 10 10 ASN CB C 10 38.626 38.626 39.397 -0.771 25061 1468 1 3 . 1 1 11 11 ASP N N 11 120.164 120.164 119.431 0.733 25061 1469 1 3 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.782 0.061 25061 1470 1 3 . 1 1 11 11 ASP C C 11 176.148 176.148 176.273 -0.125 25061 1471 1 3 . 1 1 11 11 ASP CA C 11 52.620 52.620 54.882 -2.262 25061 1472 1 3 . 1 1 11 11 ASP CB C 11 42.631 42.631 42.390 0.241 25061 1473 1 3 . 1 1 11 11 ASP H H 11 8.142 8.142 7.538 0.604 25061 1474 1 3 . 1 1 12 12 GLU N N 12 127.184 127.184 124.926 2.258 25061 1475 1 3 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.088 -0.235 25061 1476 1 3 . 1 1 12 12 GLU C C 12 177.853 177.853 177.913 -0.060 25061 1477 1 3 . 1 1 12 12 GLU CA C 12 59.547 59.547 59.473 0.074 25061 1478 1 3 . 1 1 12 12 GLU CB C 12 29.819 29.819 30.009 -0.190 25061 1479 1 3 . 1 1 12 12 GLU H H 12 9.152 9.152 8.907 0.245 25061 1480 1 3 . 1 1 13 13 ARG N N 13 119.026 119.026 118.727 0.299 25061 1481 1 3 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.327 -0.224 25061 1482 1 3 . 1 1 13 13 ARG C C 13 179.151 179.151 178.585 0.566 25061 1483 1 3 . 1 1 13 13 ARG CA C 13 58.943 58.943 59.159 -0.216 25061 1484 1 3 . 1 1 13 13 ARG CB C 13 28.757 28.757 29.447 -0.690 25061 1485 1 3 . 1 1 13 13 ARG H H 13 8.389 8.389 8.505 -0.116 25061 1486 1 3 . 1 1 14 14 ILE N N 14 119.238 119.238 119.686 -0.448 25061 1487 1 3 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.883 -0.282 25061 1488 1 3 . 1 1 14 14 ILE C C 14 177.905 177.905 178.152 -0.247 25061 1489 1 3 . 1 1 14 14 ILE CA C 14 64.666 64.666 63.707 0.959 25061 1490 1 3 . 1 1 14 14 ILE CB C 14 36.780 36.780 36.992 -0.212 25061 1491 1 3 . 1 1 14 14 ILE H H 14 7.254 7.254 8.173 -0.919 25061 1492 1 3 . 1 1 15 15 LEU N N 15 117.008 117.008 119.905 -2.897 25061 1493 1 3 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.192 -0.271 25061 1494 1 3 . 1 1 15 15 LEU C C 15 178.062 178.062 179.558 -1.496 25061 1495 1 3 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.427 -0.016 25061 1496 1 3 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.409 -0.240 25061 1497 1 3 . 1 1 15 15 LEU H H 15 7.412 7.412 7.583 -0.171 25061 1498 1 3 . 1 1 16 16 GLU N N 16 117.637 117.637 118.486 -0.849 25061 1499 1 3 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.842 -0.141 25061 1500 1 3 . 1 1 16 16 GLU C C 16 179.182 179.182 178.933 0.249 25061 1501 1 3 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.437 -0.020 25061 1502 1 3 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.280 0.179 25061 1503 1 3 . 1 1 16 16 GLU H H 16 7.981 7.981 7.885 0.096 25061 1504 1 3 . 1 1 17 17 GLU N N 17 119.759 119.759 120.937 -1.178 25061 1505 1 3 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.066 -0.050 25061 1506 1 3 . 1 1 17 17 GLU C C 17 179.949 179.949 179.182 0.767 25061 1507 1 3 . 1 1 17 17 GLU CA C 17 59.195 59.195 58.990 0.205 25061 1508 1 3 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.788 -0.247 25061 1509 1 3 . 1 1 17 17 GLU H H 17 8.248 8.248 8.073 0.175 25061 1510 1 3 . 1 1 18 18 LEU N N 18 119.764 119.764 119.860 -0.096 25061 1511 1 3 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.162 -0.081 25061 1512 1 3 . 1 1 18 18 LEU C C 18 177.620 177.620 179.087 -1.467 25061 1513 1 3 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.484 0.194 25061 1514 1 3 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.679 -0.569 25061 1515 1 3 . 1 1 18 18 LEU H H 18 8.486 8.486 8.254 0.232 25061 1516 1 3 . 1 1 19 19 LEU N N 19 123.102 123.102 120.826 2.276 25061 1517 1 3 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.193 0.469 25061 1518 1 3 . 1 1 19 19 LEU C C 19 178.343 178.343 178.129 0.214 25061 1519 1 3 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.300 0.936 25061 1520 1 3 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.199 -0.548 25061 1521 1 3 . 1 1 19 19 LEU H H 19 7.870 7.870 7.728 0.142 25061 1522 1 3 . 1 1 20 20 GLU N N 20 117.884 117.884 118.043 -0.159 25061 1523 1 3 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.893 0.011 25061 1524 1 3 . 1 1 20 20 GLU C C 20 177.707 177.707 179.038 -1.331 25061 1525 1 3 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.408 -0.016 25061 1526 1 3 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.381 -0.404 25061 1527 1 3 . 1 1 20 20 GLU H H 20 7.497 7.497 7.553 -0.056 25061 1528 1 3 . 1 1 21 21 VAL N N 21 117.709 117.709 119.952 -2.243 25061 1529 1 3 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.672 -0.048 25061 1530 1 3 . 1 1 21 21 VAL C C 21 178.523 178.523 178.070 0.453 25061 1531 1 3 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.309 -0.112 25061 1532 1 3 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.599 -0.452 25061 1533 1 3 . 1 1 21 21 VAL H H 21 7.514 7.514 7.367 0.147 25061 1534 1 3 . 1 1 22 22 VAL N N 22 121.233 121.233 119.876 1.357 25061 1535 1 3 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.658 -0.211 25061 1536 1 3 . 1 1 22 22 VAL C C 22 176.868 176.868 177.928 -1.060 25061 1537 1 3 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.489 0.524 25061 1538 1 3 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.773 -0.460 25061 1539 1 3 . 1 1 22 22 VAL H H 22 7.863 7.863 7.369 0.494 25061 1540 1 3 . 1 1 23 23 LEU N N 23 118.101 118.101 118.498 -0.397 25061 1541 1 3 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.032 0.033 25061 1542 1 3 . 1 1 23 23 LEU C C 23 179.701 179.701 178.183 1.518 25061 1543 1 3 . 1 1 23 23 LEU CA C 23 57.296 57.296 58.160 -0.864 25061 1544 1 3 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.783 -0.079 25061 1545 1 3 . 1 1 23 23 LEU H H 23 8.151 8.151 8.086 0.065 25061 1546 1 3 . 1 1 24 24 LYS N N 24 114.622 114.622 115.389 -0.767 25061 1547 1 3 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.140 -0.003 25061 1548 1 3 . 1 1 24 24 LYS C C 24 178.062 178.062 178.701 -0.639 25061 1549 1 3 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.129 -0.761 25061 1550 1 3 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.296 0.298 25061 1551 1 3 . 1 1 24 24 LYS H H 24 7.823 7.823 7.925 -0.102 25061 1552 1 3 . 1 1 25 25 SER N N 25 115.474 115.474 116.474 -1.000 25061 1553 1 3 . 1 1 25 25 SER HA H 25 4.377 4.377 4.348 0.029 25061 1554 1 3 . 1 1 25 25 SER C C 25 174.520 174.520 174.526 -0.006 25061 1555 1 3 . 1 1 25 25 SER CA C 25 61.049 61.049 60.732 0.317 25061 1556 1 3 . 1 1 25 25 SER CB C 25 63.777 63.777 64.350 -0.573 25061 1557 1 3 . 1 1 25 25 SER H H 25 7.798 7.798 7.682 0.116 25061 1558 1 3 . 1 1 26 26 ASP N N 26 117.424 117.424 118.383 -0.959 25061 1559 1 3 . 1 1 26 26 ASP HA H 26 4.886 4.886 5.056 -0.170 25061 1560 1 3 . 1 1 26 26 ASP C C 26 173.521 173.521 174.246 -0.725 25061 1561 1 3 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.648 -0.600 25061 1562 1 3 . 1 1 26 26 ASP CB C 26 42.202 42.202 42.844 -0.642 25061 1563 1 3 . 1 1 26 26 ASP H H 26 7.990 7.990 8.005 -0.015 25061 1564 1 3 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.438 0.207 25061 1565 1 3 . 1 1 27 27 PRO C C 27 177.016 177.016 176.876 0.140 25061 1566 1 3 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.762 -0.161 25061 1567 1 3 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.455 -0.282 25061 1568 1 3 . 1 1 28 28 ASN N N 28 115.839 115.839 115.870 -0.031 25061 1569 1 3 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.492 0.200 25061 1570 1 3 . 1 1 28 28 ASN C C 28 175.701 175.701 175.820 -0.119 25061 1571 1 3 . 1 1 28 28 ASN CA C 28 53.472 53.472 54.790 -1.318 25061 1572 1 3 . 1 1 28 28 ASN CB C 28 39.213 39.213 38.415 0.798 25061 1573 1 3 . 1 1 28 28 ASN H H 28 8.608 8.608 8.322 0.286 25061 1574 1 3 . 1 1 29 29 VAL N N 29 120.770 120.770 122.046 -1.276 25061 1575 1 3 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.906 -0.091 25061 1576 1 3 . 1 1 29 29 VAL C C 29 175.023 175.023 175.463 -0.440 25061 1577 1 3 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.665 -1.113 25061 1578 1 3 . 1 1 29 29 VAL CB C 29 32.147 32.147 31.155 0.992 25061 1579 1 3 . 1 1 29 29 VAL H H 29 7.428 7.428 7.491 -0.063 25061 1580 1 3 . 1 1 30 30 LYS N N 30 127.345 127.345 126.511 0.834 25061 1581 1 3 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.366 0.113 25061 1582 1 3 . 1 1 30 30 LYS C C 30 174.777 174.777 175.966 -1.189 25061 1583 1 3 . 1 1 30 30 LYS CA C 30 55.204 55.204 57.089 -1.885 25061 1584 1 3 . 1 1 30 30 LYS CB C 30 31.949 31.949 33.666 -1.717 25061 1585 1 3 . 1 1 30 30 LYS H H 30 8.457 8.457 7.771 0.686 25061 1586 1 3 . 1 1 31 31 THR N N 31 113.552 113.552 113.833 -0.281 25061 1587 1 3 . 1 1 31 31 THR HA H 31 5.723 5.723 5.382 0.341 25061 1588 1 3 . 1 1 31 31 THR C C 31 174.593 174.593 173.961 0.632 25061 1589 1 3 . 1 1 31 31 THR CA C 31 59.030 59.030 60.381 -1.351 25061 1590 1 3 . 1 1 31 31 THR CB C 31 72.206 72.206 71.130 1.076 25061 1591 1 3 . 1 1 31 31 THR H H 31 8.164 8.164 8.342 -0.178 25061 1592 1 3 . 1 1 32 32 VAL N N 32 119.206 119.206 126.689 -7.483 25061 1593 1 3 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.341 0.064 25061 1594 1 3 . 1 1 32 32 VAL C C 32 172.663 172.663 174.480 -1.817 25061 1595 1 3 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.619 -0.547 25061 1596 1 3 . 1 1 32 32 VAL CB C 32 35.051 35.051 34.192 0.859 25061 1597 1 3 . 1 1 32 32 VAL H H 32 8.615 8.615 8.850 -0.235 25061 1598 1 3 . 1 1 33 33 ARG N N 33 130.278 130.278 129.380 0.898 25061 1599 1 3 . 1 1 33 33 ARG HA H 33 5.331 5.331 5.131 0.200 25061 1600 1 3 . 1 1 33 33 ARG C C 33 173.836 173.836 175.569 -1.733 25061 1601 1 3 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.549 -1.399 25061 1602 1 3 . 1 1 33 33 ARG CB C 33 30.028 30.028 30.691 -0.662 25061 1603 1 3 . 1 1 33 33 ARG H H 33 8.996 8.996 8.805 0.191 25061 1604 1 3 . 1 1 34 34 THR N N 34 121.695 121.695 119.980 1.715 25061 1605 1 3 . 1 1 34 34 THR HA H 34 4.483 4.483 4.357 0.126 25061 1606 1 3 . 1 1 34 34 THR C C 34 169.769 169.769 173.169 -3.400 25061 1607 1 3 . 1 1 34 34 THR CA C 34 60.814 60.814 61.046 -0.232 25061 1608 1 3 . 1 1 34 34 THR CB C 34 67.402 67.402 70.318 -2.916 25061 1609 1 3 . 1 1 34 34 THR H H 34 8.126 8.126 8.359 -0.233 25061 1610 1 3 . 1 1 35 35 ASP N N 35 122.198 122.198 122.155 0.043 25061 1611 1 3 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.307 0.517 25061 1612 1 3 . 1 1 35 35 ASP C C 35 174.790 174.790 175.798 -1.008 25061 1613 1 3 . 1 1 35 35 ASP CA C 35 53.386 53.386 55.060 -1.674 25061 1614 1 3 . 1 1 35 35 ASP CB C 35 41.848 41.848 41.219 0.629 25061 1615 1 3 . 1 1 35 35 ASP H H 35 7.983 7.983 8.376 -0.393 25061 1616 1 3 . 1 1 36 36 ASP N N 36 121.091 121.091 120.159 0.932 25061 1617 1 3 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.490 0.103 25061 1618 1 3 . 1 1 36 36 ASP C C 36 176.189 176.189 177.386 -1.197 25061 1619 1 3 . 1 1 36 36 ASP CA C 36 53.055 53.055 54.369 -1.314 25061 1620 1 3 . 1 1 36 36 ASP CB C 36 42.159 42.159 41.760 0.399 25061 1621 1 3 . 1 1 36 36 ASP H H 36 8.157 8.157 7.491 0.666 25061 1622 1 3 . 1 1 37 37 LYS N N 37 125.839 125.839 127.269 -1.430 25061 1623 1 3 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.974 -0.252 25061 1624 1 3 . 1 1 37 37 LYS C C 37 176.870 176.870 177.803 -0.933 25061 1625 1 3 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.316 0.088 25061 1626 1 3 . 1 1 37 37 LYS CB C 37 32.394 32.394 32.418 -0.024 25061 1627 1 3 . 1 1 37 37 LYS H H 37 8.843 8.843 8.739 0.104 25061 1628 1 3 . 1 1 38 38 GLU N N 38 118.369 118.369 118.217 0.152 25061 1629 1 3 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.945 0.062 25061 1630 1 3 . 1 1 38 38 GLU C C 38 179.502 179.502 178.164 1.338 25061 1631 1 3 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.792 -0.122 25061 1632 1 3 . 1 1 38 38 GLU CB C 38 28.474 28.474 28.751 -0.277 25061 1633 1 3 . 1 1 38 38 GLU H H 38 8.182 8.182 8.158 0.024 25061 1634 1 3 . 1 1 39 39 LYS N N 39 121.722 121.722 121.090 0.632 25061 1635 1 3 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.264 -0.099 25061 1636 1 3 . 1 1 39 39 LYS C C 39 178.500 178.500 178.398 0.102 25061 1637 1 3 . 1 1 39 39 LYS CA C 39 57.736 57.736 59.027 -1.291 25061 1638 1 3 . 1 1 39 39 LYS CB C 39 31.138 31.138 31.882 -0.744 25061 1639 1 3 . 1 1 39 39 LYS H H 39 7.524 7.524 7.895 -0.371 25061 1640 1 3 . 1 1 40 40 VAL N N 40 117.199 117.199 119.152 -1.953 25061 1641 1 3 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.531 -0.303 25061 1642 1 3 . 1 1 40 40 VAL C C 40 177.362 177.362 178.006 -0.644 25061 1643 1 3 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.761 0.881 25061 1644 1 3 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.475 -0.572 25061 1645 1 3 . 1 1 40 40 VAL H H 40 7.883 7.883 7.663 0.220 25061 1646 1 3 . 1 1 41 41 LYS N N 41 117.677 117.677 119.095 -1.418 25061 1647 1 3 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.544 -0.102 25061 1648 1 3 . 1 1 41 41 LYS C C 41 177.686 177.686 178.913 -1.227 25061 1649 1 3 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.649 1.160 25061 1650 1 3 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.562 0.052 25061 1651 1 3 . 1 1 41 41 LYS H H 41 7.567 7.567 7.789 -0.222 25061 1652 1 3 . 1 1 42 42 GLU N N 42 118.369 118.369 119.345 -0.976 25061 1653 1 3 . 1 1 42 42 GLU HA H 42 4.007 4.007 3.980 0.027 25061 1654 1 3 . 1 1 42 42 GLU C C 42 179.725 179.725 179.278 0.447 25061 1655 1 3 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.408 -0.339 25061 1656 1 3 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.601 -0.062 25061 1657 1 3 . 1 1 42 42 GLU H H 42 7.634 7.634 7.863 -0.229 25061 1658 1 3 . 1 1 43 43 GLU N N 43 117.906 117.906 118.707 -0.801 25061 1659 1 3 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.148 0.035 25061 1660 1 3 . 1 1 43 43 GLU C C 43 179.757 179.757 179.116 0.641 25061 1661 1 3 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.123 0.243 25061 1662 1 3 . 1 1 43 43 GLU CB C 43 28.841 28.841 28.960 -0.119 25061 1663 1 3 . 1 1 43 43 GLU H H 43 8.162 8.162 7.893 0.269 25061 1664 1 3 . 1 1 44 44 ILE N N 44 122.291 122.291 120.267 2.024 25061 1665 1 3 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.622 -0.010 25061 1666 1 3 . 1 1 44 44 ILE C C 44 177.101 177.101 177.661 -0.560 25061 1667 1 3 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.814 0.541 25061 1668 1 3 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.721 -0.261 25061 1669 1 3 . 1 1 44 44 ILE H H 44 8.742 8.742 8.340 0.402 25061 1670 1 3 . 1 1 45 45 GLU N N 45 119.892 119.892 120.931 -1.039 25061 1671 1 3 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.026 0.032 25061 1672 1 3 . 1 1 45 45 GLU C C 45 178.991 178.991 178.631 0.360 25061 1673 1 3 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.694 -0.029 25061 1674 1 3 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.539 -0.378 25061 1675 1 3 . 1 1 45 45 GLU H H 45 8.171 8.171 7.951 0.220 25061 1676 1 3 . 1 1 46 46 LYS N N 46 118.064 118.064 118.957 -0.893 25061 1677 1 3 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.070 -0.088 25061 1678 1 3 . 1 1 46 46 LYS C C 46 178.837 178.837 179.105 -0.268 25061 1679 1 3 . 1 1 46 46 LYS CA C 46 59.741 59.741 58.824 0.917 25061 1680 1 3 . 1 1 46 46 LYS CB C 46 32.443 32.443 31.834 0.609 25061 1681 1 3 . 1 1 46 46 LYS H H 46 7.785 7.785 7.455 0.330 25061 1682 1 3 . 1 1 47 47 ALA N N 47 121.817 121.817 123.086 -1.269 25061 1683 1 3 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.054 -0.023 25061 1684 1 3 . 1 1 47 47 ALA C C 47 179.859 179.859 178.835 1.024 25061 1685 1 3 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.384 -0.089 25061 1686 1 3 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.525 -0.869 25061 1687 1 3 . 1 1 47 47 ALA H H 47 8.123 8.123 8.164 -0.041 25061 1688 1 3 . 1 1 48 48 ARG N N 48 119.080 119.080 117.169 1.911 25061 1689 1 3 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.159 -0.070 25061 1690 1 3 . 1 1 48 48 ARG C C 48 180.155 180.155 178.398 1.757 25061 1691 1 3 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.025 1.172 25061 1692 1 3 . 1 1 48 48 ARG CB C 48 29.510 29.510 30.004 -0.494 25061 1693 1 3 . 1 1 48 48 ARG H H 48 8.768 8.768 7.634 1.134 25061 1694 1 3 . 1 1 49 49 LYS N N 49 119.951 119.951 119.432 0.519 25061 1695 1 3 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.144 -0.105 25061 1696 1 3 . 1 1 49 49 LYS C C 49 178.288 178.288 178.295 -0.007 25061 1697 1 3 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.680 0.157 25061 1698 1 3 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.601 -0.458 25061 1699 1 3 . 1 1 49 49 LYS H H 49 8.037 8.037 8.069 -0.032 25061 1700 1 3 . 1 1 50 50 GLN N N 50 115.284 115.284 114.579 0.705 25061 1701 1 3 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.422 -0.080 25061 1702 1 3 . 1 1 50 50 GLN C C 50 176.180 176.180 176.853 -0.673 25061 1703 1 3 . 1 1 50 50 GLN CA C 50 55.741 55.741 55.140 0.601 25061 1704 1 3 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.538 0.027 25061 1705 1 3 . 1 1 50 50 GLN H H 50 7.740 7.740 7.680 0.060 25061 1706 1 3 . 1 1 51 51 GLY N N 51 109.725 109.725 108.656 1.069 25061 1707 1 3 . 1 1 51 51 GLY C C 51 174.552 174.552 173.784 0.768 25061 1708 1 3 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.946 0.417 25061 1709 1 3 . 1 1 51 51 GLY H H 51 8.027 8.027 7.967 0.060 25061 1710 1 3 . 1 1 52 52 ARG N N 52 119.064 119.064 119.813 -0.749 25061 1711 1 3 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.711 0.186 25061 1712 1 3 . 1 1 52 52 ARG C C 52 173.123 173.123 174.185 -1.062 25061 1713 1 3 . 1 1 52 52 ARG CA C 52 52.247 52.247 52.938 -0.691 25061 1714 1 3 . 1 1 52 52 ARG CB C 52 32.366 32.366 30.537 1.829 25061 1715 1 3 . 1 1 52 52 ARG H H 52 7.969 7.969 7.892 0.077 25061 1716 1 3 . 1 1 53 53 PRO HA H 53 4.855 4.855 5.003 -0.148 25061 1717 1 3 . 1 1 53 53 PRO C C 53 174.069 174.069 175.890 -1.821 25061 1718 1 3 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.948 -1.130 25061 1719 1 3 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.485 -0.425 25061 1720 1 3 . 1 1 54 54 ILE N N 54 116.301 116.301 120.812 -4.511 25061 1721 1 3 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.824 0.414 25061 1722 1 3 . 1 1 54 54 ILE C C 54 171.709 171.709 173.657 -1.948 25061 1723 1 3 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.243 -1.469 25061 1724 1 3 . 1 1 54 54 ILE CB C 54 41.558 41.558 42.164 -0.606 25061 1725 1 3 . 1 1 54 54 ILE H H 54 7.920 7.920 8.051 -0.131 25061 1726 1 3 . 1 1 55 55 VAL N N 55 126.302 126.302 129.181 -2.879 25061 1727 1 3 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.215 -0.291 25061 1728 1 3 . 1 1 55 55 VAL C C 55 173.624 173.624 175.087 -1.463 25061 1729 1 3 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.462 -0.667 25061 1730 1 3 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.736 0.092 25061 1731 1 3 . 1 1 55 55 VAL H H 55 8.652 8.652 8.742 -0.089 25061 1732 1 3 . 1 1 56 56 ILE N N 56 127.503 127.503 128.117 -0.614 25061 1733 1 3 . 1 1 56 56 ILE HA H 56 4.664 4.664 4.773 -0.109 25061 1734 1 3 . 1 1 56 56 ILE C C 56 173.479 173.479 175.222 -1.743 25061 1735 1 3 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.550 0.457 25061 1736 1 3 . 1 1 56 56 ILE CB C 56 40.285 40.285 37.385 2.900 25061 1737 1 3 . 1 1 56 56 ILE H H 56 9.124 9.124 8.105 1.019 25061 1738 1 3 . 1 1 57 57 PHE N N 57 125.302 125.302 128.644 -3.342 25061 1739 1 3 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.304 -0.088 25061 1740 1 3 . 1 1 57 57 PHE C C 57 174.536 174.536 175.939 -1.403 25061 1741 1 3 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.287 -0.326 25061 1742 1 3 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.496 0.933 25061 1743 1 3 . 1 1 57 57 PHE H H 57 8.971 8.971 8.510 0.461 25061 1744 1 3 . 1 1 58 58 ILE N N 58 126.472 126.472 118.310 8.162 25061 1745 1 3 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.779 -0.264 25061 1746 1 3 . 1 1 58 58 ILE C C 58 173.391 173.391 173.958 -0.567 25061 1747 1 3 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.009 0.081 25061 1748 1 3 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.251 -0.509 25061 1749 1 3 . 1 1 58 58 ILE H H 58 9.248 9.248 8.765 0.483 25061 1750 1 3 . 1 1 59 59 ARG N N 59 124.681 124.681 121.449 3.232 25061 1751 1 3 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.185 -0.256 25061 1752 1 3 . 1 1 59 59 ARG C C 59 178.521 178.521 178.011 0.510 25061 1753 1 3 . 1 1 59 59 ARG CA C 59 55.742 55.742 55.416 0.326 25061 1754 1 3 . 1 1 59 59 ARG CB C 59 30.918 30.918 32.999 -2.081 25061 1755 1 3 . 1 1 59 59 ARG H H 59 8.587 8.587 8.923 -0.336 25061 1756 1 3 . 1 1 60 60 GLY N N 60 108.848 108.848 109.159 -0.311 25061 1757 1 3 . 1 1 60 60 GLY C C 60 174.775 174.775 174.538 0.237 25061 1758 1 3 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.279 -0.312 25061 1759 1 3 . 1 1 60 60 GLY H H 60 7.732 7.732 8.388 -0.656 25061 1760 1 3 . 1 1 61 61 ALA N N 61 120.877 120.877 123.514 -2.637 25061 1761 1 3 . 1 1 61 61 ALA HA H 61 4.144 4.144 4.125 0.019 25061 1762 1 3 . 1 1 61 61 ALA C C 61 177.769 177.769 179.671 -1.902 25061 1763 1 3 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.951 -0.502 25061 1764 1 3 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.393 -0.022 25061 1765 1 3 . 1 1 61 61 ALA H H 61 7.852 7.852 7.776 0.076 25061 1766 1 3 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.275 0.525 25061 1767 1 3 . 1 1 62 62 TYR CA C 62 63.039 63.039 59.463 3.576 25061 1768 1 3 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.349 0.091 25061 1769 1 3 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.658 0.027 25061 1770 1 3 . 1 1 63 63 GLU C C 63 176.251 176.251 178.306 -2.055 25061 1771 1 3 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.462 -0.204 25061 1772 1 3 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.095 0.317 25061 1773 1 3 . 1 1 64 64 GLU N N 64 119.209 119.209 119.024 0.185 25061 1774 1 3 . 1 1 64 64 GLU HA H 64 3.901 3.901 4.265 -0.364 25061 1775 1 3 . 1 1 64 64 GLU C C 64 178.251 178.251 179.219 -0.968 25061 1776 1 3 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.901 0.311 25061 1777 1 3 . 1 1 64 64 GLU CB C 64 28.645 28.645 28.793 -0.147 25061 1778 1 3 . 1 1 64 64 GLU H H 64 8.878 8.878 7.665 1.213 25061 1779 1 3 . 1 1 65 65 VAL N N 65 116.728 116.728 120.471 -3.743 25061 1780 1 3 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.768 0.214 25061 1781 1 3 . 1 1 65 65 VAL C C 65 176.915 176.915 177.960 -1.045 25061 1782 1 3 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.703 -1.094 25061 1783 1 3 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.756 0.139 25061 1784 1 3 . 1 1 65 65 VAL H H 65 7.652 7.652 7.693 -0.041 25061 1785 1 3 . 1 1 66 66 VAL N N 66 119.462 119.462 118.958 0.504 25061 1786 1 3 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.704 -0.390 25061 1787 1 3 . 1 1 66 66 VAL C C 66 177.142 177.142 177.215 -0.073 25061 1788 1 3 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.501 0.834 25061 1789 1 3 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.348 0.082 25061 1790 1 3 . 1 1 66 66 VAL H H 66 7.896 7.896 7.914 -0.018 25061 1791 1 3 . 1 1 67 67 ARG HA H 67 3.628 3.628 3.887 -0.259 25061 1792 1 3 . 1 1 67 67 ARG C C 67 177.841 177.841 177.942 -0.101 25061 1793 1 3 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.843 0.208 25061 1794 1 3 . 1 1 67 67 ARG CB C 67 29.393 29.393 29.908 -0.515 25061 1795 1 3 . 1 1 68 68 ASP N N 68 118.316 118.316 118.459 -0.143 25061 1796 1 3 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.591 -0.230 25061 1797 1 3 . 1 1 68 68 ASP C C 68 178.945 178.945 178.649 0.296 25061 1798 1 3 . 1 1 68 68 ASP CA C 68 57.311 57.311 56.895 0.416 25061 1799 1 3 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.904 0.611 25061 1800 1 3 . 1 1 68 68 ASP H H 68 7.625 7.625 7.861 -0.236 25061 1801 1 3 . 1 1 69 69 ILE N N 69 119.231 119.231 120.816 -1.585 25061 1802 1 3 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.762 -0.132 25061 1803 1 3 . 1 1 69 69 ILE C C 69 177.138 177.138 177.988 -0.850 25061 1804 1 3 . 1 1 69 69 ILE CA C 69 64.540 64.540 64.691 -0.151 25061 1805 1 3 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.828 -0.778 25061 1806 1 3 . 1 1 69 69 ILE H H 69 8.113 8.113 7.457 0.656 25061 1807 1 3 . 1 1 70 70 VAL N N 70 120.164 120.164 119.918 0.246 25061 1808 1 3 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.511 -0.094 25061 1809 1 3 . 1 1 70 70 VAL C C 70 177.079 177.079 177.426 -0.347 25061 1810 1 3 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.293 -0.019 25061 1811 1 3 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.337 -0.079 25061 1812 1 3 . 1 1 70 70 VAL H H 70 8.478 8.478 8.582 -0.104 25061 1813 1 3 . 1 1 71 71 GLU N N 71 118.293 118.293 119.658 -1.365 25061 1814 1 3 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.954 0.100 25061 1815 1 3 . 1 1 71 71 GLU C C 71 179.009 179.009 178.695 0.314 25061 1816 1 3 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.364 0.052 25061 1817 1 3 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.325 -0.503 25061 1818 1 3 . 1 1 71 71 GLU H H 71 8.152 8.152 7.829 0.323 25061 1819 1 3 . 1 1 72 72 TYR N N 72 120.091 120.091 120.183 -0.092 25061 1820 1 3 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.105 0.057 25061 1821 1 3 . 1 1 72 72 TYR C C 72 176.404 176.404 177.345 -0.941 25061 1822 1 3 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.693 -0.561 25061 1823 1 3 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.385 -0.248 25061 1824 1 3 . 1 1 72 72 TYR H H 72 7.959 7.959 7.533 0.426 25061 1825 1 3 . 1 1 73 73 ALA N N 73 120.133 120.133 120.043 0.090 25061 1826 1 3 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.908 -0.278 25061 1827 1 3 . 1 1 73 73 ALA C C 73 179.182 179.182 179.309 -0.127 25061 1828 1 3 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.146 -0.034 25061 1829 1 3 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.367 -0.176 25061 1830 1 3 . 1 1 73 73 ALA H H 73 8.604 8.604 8.097 0.507 25061 1831 1 3 . 1 1 74 74 GLN N N 74 115.553 115.553 116.779 -1.226 25061 1832 1 3 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.068 0.070 25061 1833 1 3 . 1 1 74 74 GLN C C 74 180.595 180.595 178.599 1.996 25061 1834 1 3 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.106 0.989 25061 1835 1 3 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.820 -0.245 25061 1836 1 3 . 1 1 74 74 GLN H H 74 8.619 8.619 8.133 0.486 25061 1837 1 3 . 1 1 75 75 LYS N N 75 122.396 122.396 119.209 3.187 25061 1838 1 3 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.074 -0.046 25061 1839 1 3 . 1 1 75 75 LYS C C 75 178.521 178.521 178.960 -0.439 25061 1840 1 3 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.010 1.048 25061 1841 1 3 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.744 -0.145 25061 1842 1 3 . 1 1 75 75 LYS H H 75 8.123 8.123 7.695 0.428 25061 1843 1 3 . 1 1 76 76 GLU N N 76 116.294 116.294 116.637 -0.343 25061 1844 1 3 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.163 -0.064 25061 1845 1 3 . 1 1 76 76 GLU C C 76 175.957 175.957 177.208 -1.251 25061 1846 1 3 . 1 1 76 76 GLU CA C 76 55.605 55.605 56.657 -1.052 25061 1847 1 3 . 1 1 76 76 GLU CB C 76 29.824 29.824 30.042 -0.218 25061 1848 1 3 . 1 1 76 76 GLU H H 76 7.450 7.450 7.714 -0.264 25061 1849 1 3 . 1 1 77 77 GLY N N 77 107.446 107.446 107.098 0.348 25061 1850 1 3 . 1 1 77 77 GLY C C 77 174.520 174.520 174.599 -0.079 25061 1851 1 3 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.759 0.048 25061 1852 1 3 . 1 1 77 77 GLY H H 77 7.763 7.763 7.406 0.357 25061 1853 1 3 . 1 1 78 78 LEU N N 78 120.179 120.179 118.741 1.438 25061 1854 1 3 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.609 -0.221 25061 1855 1 3 . 1 1 78 78 LEU C C 78 175.914 175.914 176.543 -0.629 25061 1856 1 3 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.725 -0.253 25061 1857 1 3 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.882 -0.993 25061 1858 1 3 . 1 1 78 78 LEU H H 78 7.930 7.930 7.875 0.055 25061 1859 1 3 . 1 1 79 79 ARG N N 79 122.207 122.207 121.913 0.294 25061 1860 1 3 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.376 0.021 25061 1861 1 3 . 1 1 79 79 ARG C C 79 174.960 174.960 174.780 0.180 25061 1862 1 3 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.292 0.356 25061 1863 1 3 . 1 1 79 79 ARG CB C 79 30.476 30.476 30.192 0.284 25061 1864 1 3 . 1 1 79 79 ARG H H 79 8.241 8.241 8.395 -0.154 25061 1865 1 3 . 1 1 80 80 VAL N N 80 123.333 123.333 125.946 -2.613 25061 1866 1 3 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.267 1.028 25061 1867 1 3 . 1 1 80 80 VAL C C 80 174.048 174.048 174.261 -0.213 25061 1868 1 3 . 1 1 80 80 VAL CA C 80 60.041 60.041 62.060 -2.019 25061 1869 1 3 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.736 1.569 25061 1870 1 3 . 1 1 80 80 VAL H H 80 8.359 8.359 8.678 -0.319 25061 1871 1 3 . 1 1 81 81 LEU N N 81 128.719 128.719 129.988 -1.269 25061 1872 1 3 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.349 -0.245 25061 1873 1 3 . 1 1 81 81 LEU C C 81 174.484 174.484 174.519 -0.035 25061 1874 1 3 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.853 0.267 25061 1875 1 3 . 1 1 81 81 LEU CB C 81 44.955 44.955 46.374 -1.419 25061 1876 1 3 . 1 1 81 81 LEU H H 81 8.650 8.650 8.958 -0.308 25061 1877 1 3 . 1 1 82 82 VAL N N 82 122.487 122.487 128.220 -5.733 25061 1878 1 3 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.525 0.572 25061 1879 1 3 . 1 1 82 82 VAL C C 82 174.525 174.525 174.888 -0.363 25061 1880 1 3 . 1 1 82 82 VAL CA C 82 60.285 60.285 61.781 -1.496 25061 1881 1 3 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.529 2.260 25061 1882 1 3 . 1 1 82 82 VAL H H 82 8.781 8.781 8.540 0.241 25061 1883 1 3 . 1 1 83 83 ILE N N 83 128.082 128.082 130.072 -1.990 25061 1884 1 3 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.656 0.274 25061 1885 1 3 . 1 1 83 83 ILE C C 83 172.925 172.925 174.708 -1.783 25061 1886 1 3 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.605 -0.664 25061 1887 1 3 . 1 1 83 83 ILE CB C 83 40.186 40.186 37.806 2.380 25061 1888 1 3 . 1 1 83 83 ILE H H 83 9.527 9.527 8.404 1.123 25061 1889 1 3 . 1 1 84 84 LYS N N 84 128.493 128.493 126.934 1.559 25061 1890 1 3 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.227 -0.179 25061 1891 1 3 . 1 1 84 84 LYS C C 84 174.027 174.027 175.618 -1.591 25061 1892 1 3 . 1 1 84 84 LYS CA C 84 53.253 53.253 53.868 -0.615 25061 1893 1 3 . 1 1 84 84 LYS CB C 84 34.652 34.652 35.673 -1.021 25061 1894 1 3 . 1 1 84 84 LYS H H 84 8.721 8.721 9.099 -0.378 25061 1895 1 3 . 1 1 85 85 VAL N N 85 126.729 126.729 123.967 2.762 25061 1896 1 3 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.260 0.476 25061 1897 1 3 . 1 1 85 85 VAL C C 85 175.935 175.935 176.904 -0.969 25061 1898 1 3 . 1 1 85 85 VAL CA C 85 60.200 60.200 62.154 -1.954 25061 1899 1 3 . 1 1 85 85 VAL CB C 85 30.847 30.847 31.299 -0.452 25061 1900 1 3 . 1 1 85 85 VAL H H 85 8.643 8.643 8.287 0.356 25061 1901 1 3 . 1 1 86 86 ALA N N 86 132.930 132.930 131.841 1.089 25061 1902 1 3 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.021 0.409 25061 1903 1 3 . 1 1 86 86 ALA C C 86 175.635 175.635 177.654 -2.019 25061 1904 1 3 . 1 1 86 86 ALA CA C 86 51.504 51.504 54.468 -2.963 25061 1905 1 3 . 1 1 86 86 ALA CB C 86 20.821 20.821 18.918 1.903 25061 1906 1 3 . 1 1 86 86 ALA H H 86 8.835 8.835 8.817 0.018 25061 1907 1 3 . 1 1 87 87 GLN N N 87 118.719 118.719 115.960 2.759 25061 1908 1 3 . 1 1 87 87 GLN HA H 87 4.469 4.469 3.947 0.522 25061 1909 1 3 . 1 1 87 87 GLN C C 87 175.949 175.949 174.707 1.242 25061 1910 1 3 . 1 1 87 87 GLN CA C 87 55.260 55.260 56.341 -1.081 25061 1911 1 3 . 1 1 87 87 GLN CB C 87 30.432 30.432 27.232 3.200 25061 1912 1 3 . 1 1 87 87 GLN H H 87 8.570 8.570 7.874 0.696 25061 1913 1 3 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.229 0.251 25061 1914 1 3 . 1 1 88 88 ASP CA C 88 55.454 55.454 55.531 -0.076 25061 1915 1 3 . 1 1 88 88 ASP CB C 88 41.204 41.204 40.684 0.520 25061 1916 1 3 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.561 -0.514 25061 1917 1 3 . 1 1 89 89 GLN CA C 89 56.687 56.687 54.520 2.167 25061 1918 1 3 . 1 1 89 89 GLN CB C 89 27.850 27.850 31.310 -3.460 25061 1919 1 3 . 1 1 92 92 LEU N N 92 125.291 125.291 120.993 4.298 25061 1920 1 3 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.564 -0.363 25061 1921 1 3 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.546 -2.489 25061 1922 1 3 . 1 1 92 92 LEU CB C 92 42.046 42.046 42.017 0.029 25061 1923 1 3 . 1 1 92 92 LEU H H 92 8.277 8.277 7.913 0.364 25061 1924 1 3 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.371 0.385 25061 1925 1 3 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.183 -0.134 25061 1926 1 3 . 1 1 94 94 ARG C C 94 178.544 178.544 178.237 0.307 25061 1927 1 3 . 1 1 94 94 ARG CA C 94 58.607 58.607 58.398 0.209 25061 1928 1 3 . 1 1 94 94 ARG CB C 94 29.614 29.614 29.764 -0.150 25061 1929 1 3 . 1 1 95 95 PHE N N 95 117.407 117.407 120.354 -2.947 25061 1930 1 3 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.170 0.205 25061 1931 1 3 . 1 1 95 95 PHE CA C 95 60.231 60.231 61.535 -1.304 25061 1932 1 3 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.151 -1.209 25061 1933 1 3 . 1 1 95 95 PHE H H 95 8.419 8.419 7.819 0.600 25061 1934 1 3 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.965 -0.157 25061 1935 1 3 . 1 1 96 96 TYR C C 96 177.728 177.728 177.238 0.490 25061 1936 1 3 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.766 1.390 25061 1937 1 3 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.289 -0.589 25061 1938 1 3 . 1 1 97 97 GLU N N 97 119.054 119.054 117.632 1.422 25061 1939 1 3 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.655 0.408 25061 1940 1 3 . 1 1 97 97 GLU C C 97 179.071 179.071 178.646 0.425 25061 1941 1 3 . 1 1 97 97 GLU CA C 97 58.760 58.760 58.798 -0.038 25061 1942 1 3 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.425 -0.253 25061 1943 1 3 . 1 1 97 97 GLU H H 97 7.858 7.858 7.865 -0.007 25061 1944 1 3 . 1 1 98 98 GLN N N 98 119.385 119.385 119.887 -0.502 25061 1945 1 3 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.980 -0.079 25061 1946 1 3 . 1 1 98 98 GLN C C 98 177.599 177.599 178.389 -0.790 25061 1947 1 3 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.486 -0.175 25061 1948 1 3 . 1 1 98 98 GLN CB C 98 27.766 27.766 28.125 -0.359 25061 1949 1 3 . 1 1 98 98 GLN H H 98 7.747 7.747 7.601 0.146 25061 1950 1 3 . 1 1 99 99 LEU N N 99 118.348 118.348 118.727 -0.379 25061 1951 1 3 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.971 0.048 25061 1952 1 3 . 1 1 99 99 LEU C C 99 178.669 178.669 179.184 -0.515 25061 1953 1 3 . 1 1 99 99 LEU CA C 99 57.430 57.430 57.709 -0.279 25061 1954 1 3 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.234 0.268 25061 1955 1 3 . 1 1 99 99 LEU H H 99 7.891 7.891 7.479 0.412 25061 1956 1 3 . 1 1 100 100 LYS N N 100 118.332 118.332 118.878 -0.546 25061 1957 1 3 . 1 1 100 100 LYS HA H 100 4.509 4.509 3.962 0.547 25061 1958 1 3 . 1 1 100 100 LYS C C 100 180.846 180.846 178.987 1.859 25061 1959 1 3 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.054 1.034 25061 1960 1 3 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.686 0.583 25061 1961 1 3 . 1 1 100 100 LYS H H 100 7.560 7.560 7.278 0.282 25061 1962 1 3 . 1 1 101 101 LYS N N 101 121.944 121.944 119.702 2.242 25061 1963 1 3 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.050 0.022 25061 1964 1 3 . 1 1 101 101 LYS C C 101 177.707 177.707 177.952 -0.245 25061 1965 1 3 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.642 0.229 25061 1966 1 3 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.294 -0.199 25061 1967 1 3 . 1 1 101 101 LYS H H 101 7.959 7.959 7.415 0.544 25061 1968 1 3 . 1 1 102 102 ASP N N 102 118.788 118.788 116.868 1.920 25061 1969 1 3 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.460 0.234 25061 1970 1 3 . 1 1 102 102 ASP C C 102 176.359 176.359 177.105 -0.746 25061 1971 1 3 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.462 -0.883 25061 1972 1 3 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.611 -1.037 25061 1973 1 3 . 1 1 102 102 ASP H H 102 7.893 7.893 7.582 0.311 25061 1974 1 3 . 1 1 103 103 GLY N N 103 107.024 107.024 108.449 -1.425 25061 1975 1 3 . 1 1 103 103 GLY C C 103 174.328 174.328 173.284 1.044 25061 1976 1 3 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.840 0.505 25061 1977 1 3 . 1 1 103 103 GLY H H 103 7.866 7.866 8.177 -0.311 25061 1978 1 3 . 1 1 104 104 VAL N N 104 123.060 123.060 118.494 4.566 25061 1979 1 3 . 1 1 104 104 VAL HA H 104 3.973 3.973 4.309 -0.336 25061 1980 1 3 . 1 1 104 104 VAL C C 104 175.023 175.023 173.650 1.373 25061 1981 1 3 . 1 1 104 104 VAL CA C 104 61.878 61.878 60.411 1.467 25061 1982 1 3 . 1 1 104 104 VAL CB C 104 32.088 32.088 34.903 -2.815 25061 1983 1 3 . 1 1 104 104 VAL H H 104 7.955 7.955 7.765 0.190 25061 1984 1 3 . 1 1 105 105 ASP N N 105 127.987 127.987 125.730 2.257 25061 1985 1 3 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.861 -0.286 25061 1986 1 3 . 1 1 105 105 ASP C C 105 173.624 173.624 174.915 -1.291 25061 1987 1 3 . 1 1 105 105 ASP CA C 105 54.087 54.087 54.412 -0.325 25061 1988 1 3 . 1 1 105 105 ASP CB C 105 40.660 40.660 41.965 -1.304 25061 1989 1 3 . 1 1 105 105 ASP H H 105 8.399 8.399 8.406 -0.007 25061 1990 1 3 . 1 1 106 106 VAL N N 106 125.798 125.798 119.725 6.073 25061 1991 1 3 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.806 0.009 25061 1992 1 3 . 1 1 106 106 VAL C C 106 174.902 174.902 175.642 -0.740 25061 1993 1 3 . 1 1 106 106 VAL CA C 106 60.194 60.194 60.658 -0.464 25061 1994 1 3 . 1 1 106 106 VAL CB C 106 34.179 34.179 33.160 1.020 25061 1995 1 3 . 1 1 106 106 VAL H H 106 7.550 7.550 8.348 -0.798 25061 1996 1 3 . 1 1 107 107 ARG N N 107 128.099 128.099 128.672 -0.573 25061 1997 1 3 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.656 0.220 25061 1998 1 3 . 1 1 107 107 ARG C C 107 173.815 173.815 175.356 -1.541 25061 1999 1 3 . 1 1 107 107 ARG CA C 107 53.386 53.386 53.329 0.057 25061 2000 1 3 . 1 1 107 107 ARG CB C 107 31.195 31.195 29.941 1.254 25061 2001 1 3 . 1 1 107 107 ARG H H 107 9.132 9.132 8.640 0.492 25061 2002 1 3 . 1 1 108 108 VAL N N 108 123.979 123.979 123.183 0.796 25061 2003 1 3 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.086 -0.144 25061 2004 1 3 . 1 1 108 108 VAL C C 108 175.854 175.854 177.070 -1.216 25061 2005 1 3 . 1 1 108 108 VAL CA C 108 60.017 60.017 60.689 -0.672 25061 2006 1 3 . 1 1 108 108 VAL CB C 108 32.844 32.844 31.027 1.817 25061 2007 1 3 . 1 1 108 108 VAL H H 108 8.561 8.561 8.466 0.095 25061 2008 1 3 . 1 1 109 109 THR N N 109 120.144 120.144 116.142 4.002 25061 2009 1 3 . 1 1 109 109 THR HA H 109 4.815 4.815 4.627 0.188 25061 2010 1 3 . 1 1 109 109 THR C C 109 171.867 171.867 175.451 -3.584 25061 2011 1 3 . 1 1 109 109 THR CA C 109 59.613 59.613 63.005 -3.392 25061 2012 1 3 . 1 1 109 109 THR CB C 109 69.720 69.720 70.686 -0.966 25061 2013 1 3 . 1 1 109 109 THR H H 109 8.803 8.803 8.505 0.298 25061 2014 1 3 . 1 1 110 110 ASP N N 110 123.212 123.212 118.568 4.644 25061 2015 1 3 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.216 0.753 25061 2016 1 3 . 1 1 110 110 ASP C C 110 175.739 175.739 175.923 -0.184 25061 2017 1 3 . 1 1 110 110 ASP CA C 110 53.243 53.243 57.370 -4.127 25061 2018 1 3 . 1 1 110 110 ASP CB C 110 41.351 41.351 39.177 2.174 25061 2019 1 3 . 1 1 110 110 ASP H H 110 8.363 8.363 8.210 0.153 25061 2020 1 3 . 1 1 111 111 ASN N N 111 116.298 116.298 119.508 -3.210 25061 2021 1 3 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.779 0.097 25061 2022 1 3 . 1 1 111 111 ASN C C 111 174.756 174.756 175.713 -0.957 25061 2023 1 3 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.698 -0.566 25061 2024 1 3 . 1 1 111 111 ASN CB C 111 40.765 40.765 40.483 0.282 25061 2025 1 3 . 1 1 111 111 ASN H H 111 8.085 8.085 8.043 0.042 25061 2026 1 3 . 1 1 112 112 GLU HA H 112 3.848 3.848 4.162 -0.314 25061 2027 1 3 . 1 1 112 112 GLU C C 112 177.016 177.016 178.219 -1.203 25061 2028 1 3 . 1 1 112 112 GLU CA C 112 59.480 59.480 60.017 -0.537 25061 2029 1 3 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.858 -0.184 25061 2030 1 3 . 1 1 113 113 ASP N N 113 121.033 121.033 120.015 1.018 25061 2031 1 3 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.447 -0.034 25061 2032 1 3 . 1 1 113 113 ASP C C 113 178.988 178.988 178.451 0.537 25061 2033 1 3 . 1 1 113 113 ASP CA C 113 57.855 57.855 57.398 0.457 25061 2034 1 3 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.665 -0.163 25061 2035 1 3 . 1 1 113 113 ASP H H 113 8.219 8.219 8.125 0.094 25061 2036 1 3 . 1 1 114 114 GLU N N 114 121.280 121.280 119.424 1.856 25061 2037 1 3 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.035 0.030 25061 2038 1 3 . 1 1 114 114 GLU C C 114 178.776 178.776 178.633 0.143 25061 2039 1 3 . 1 1 114 114 GLU CA C 114 58.714 58.714 58.893 -0.179 25061 2040 1 3 . 1 1 114 114 GLU CB C 114 29.213 29.213 28.967 0.246 25061 2041 1 3 . 1 1 114 114 GLU H H 114 8.296 8.296 8.075 0.221 25061 2042 1 3 . 1 1 115 115 ALA N N 115 120.924 120.924 121.943 -1.019 25061 2043 1 3 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.142 -0.304 25061 2044 1 3 . 1 1 115 115 ALA C C 115 178.502 178.502 179.193 -0.691 25061 2045 1 3 . 1 1 115 115 ALA CA C 115 55.638 55.638 54.861 0.777 25061 2046 1 3 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.424 0.073 25061 2047 1 3 . 1 1 115 115 ALA H H 115 7.853 7.853 7.522 0.331 25061 2048 1 3 . 1 1 116 116 LYS N N 116 116.616 116.616 119.153 -2.537 25061 2049 1 3 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.935 -0.216 25061 2050 1 3 . 1 1 116 116 LYS C C 116 178.097 178.097 178.788 -0.691 25061 2051 1 3 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.786 0.966 25061 2052 1 3 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.396 0.159 25061 2053 1 3 . 1 1 116 116 LYS H H 116 8.091 8.091 7.846 0.245 25061 2054 1 3 . 1 1 117 117 LYS N N 117 118.990 118.990 116.641 2.349 25061 2055 1 3 . 1 1 117 117 LYS HA H 117 3.911 3.911 4.079 -0.168 25061 2056 1 3 . 1 1 117 117 LYS C C 117 179.186 179.186 179.222 -0.036 25061 2057 1 3 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.071 0.500 25061 2058 1 3 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.084 0.436 25061 2059 1 3 . 1 1 117 117 LYS H H 117 7.742 7.742 8.073 -0.331 25061 2060 1 3 . 1 1 118 118 ARG N N 118 117.441 117.441 120.013 -2.572 25061 2061 1 3 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.239 -0.099 25061 2062 1 3 . 1 1 118 118 ARG C C 118 178.921 178.921 178.931 -0.010 25061 2063 1 3 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.196 -0.525 25061 2064 1 3 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.577 0.084 25061 2065 1 3 . 1 1 118 118 ARG H H 118 8.468 8.468 7.513 0.955 25061 2066 1 3 . 1 1 119 119 LEU N N 119 120.100 120.100 120.284 -0.184 25061 2067 1 3 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.932 0.028 25061 2068 1 3 . 1 1 119 119 LEU C C 119 177.554 177.554 178.629 -1.075 25061 2069 1 3 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.358 -0.477 25061 2070 1 3 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.381 0.508 25061 2071 1 3 . 1 1 119 119 LEU H H 119 8.322 8.322 8.300 0.022 25061 2072 1 3 . 1 1 120 120 LYS N N 120 118.238 118.238 119.629 -1.391 25061 2073 1 3 . 1 1 120 120 LYS HA H 120 3.822 3.822 4.007 -0.185 25061 2074 1 3 . 1 1 120 120 LYS C C 120 178.703 178.703 178.576 0.127 25061 2075 1 3 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.371 0.975 25061 2076 1 3 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.451 -0.215 25061 2077 1 3 . 1 1 120 120 LYS H H 120 7.990 7.990 7.538 0.452 25061 2078 1 3 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.332 -0.310 25061 2079 1 3 . 1 1 121 121 GLU C C 121 177.769 177.769 179.092 -1.323 25061 2080 1 3 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.402 -0.480 25061 2081 1 3 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.637 -0.183 25061 2082 1 3 . 1 1 122 122 LEU N N 122 119.454 119.454 118.238 1.216 25061 2083 1 3 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.178 -0.045 25061 2084 1 3 . 1 1 122 122 LEU C C 122 178.991 178.991 179.462 -0.471 25061 2085 1 3 . 1 1 122 122 LEU CA C 122 57.326 57.326 56.869 0.457 25061 2086 1 3 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.792 -0.113 25061 2087 1 3 . 1 1 122 122 LEU H H 122 7.930 7.930 8.127 -0.197 25061 2088 1 3 . 1 1 123 123 LEU N N 123 117.862 117.862 121.119 -3.257 25061 2089 1 3 . 1 1 123 123 LEU HA H 123 4.067 4.067 3.960 0.107 25061 2090 1 3 . 1 1 123 123 LEU C C 123 179.178 179.178 179.320 -0.142 25061 2091 1 3 . 1 1 123 123 LEU CA C 123 56.920 56.920 58.320 -1.400 25061 2092 1 3 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.664 -0.454 25061 2093 1 3 . 1 1 123 123 LEU H H 123 8.095 8.095 7.670 0.425 25061 2094 1 3 . 1 1 124 124 GLU N N 124 118.975 118.975 119.603 -0.628 25061 2095 1 3 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.087 0.042 25061 2096 1 3 . 1 1 124 124 GLU C C 124 177.777 177.777 177.537 0.240 25061 2097 1 3 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.964 -0.877 25061 2098 1 3 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.431 0.109 25061 2099 1 3 . 1 1 124 124 GLU H H 124 7.930 7.930 7.929 0.001 25061 2100 1 3 . 1 1 125 125 LYS N N 125 118.933 118.933 116.678 2.255 25061 2101 1 3 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.337 0.000 25061 2102 1 3 . 1 1 125 125 LYS C C 125 178.188 178.188 175.608 2.580 25061 2103 1 3 . 1 1 125 125 LYS CA C 125 56.980 56.980 55.871 1.109 25061 2104 1 3 . 1 1 125 125 LYS CB C 125 32.608 32.608 32.198 0.410 25061 2105 1 3 . 1 1 125 125 LYS H H 125 7.729 7.729 7.460 0.269 25061 2106 1 3 . 1 1 126 126 VAL N N 126 117.933 117.933 116.862 1.071 25061 2107 1 3 . 1 1 126 126 VAL HA H 126 4.022 4.022 3.714 0.308 25061 2108 1 3 . 1 1 126 126 VAL C C 126 176.947 176.947 175.593 1.354 25061 2109 1 3 . 1 1 126 126 VAL CA C 126 63.641 63.641 62.870 0.771 25061 2110 1 3 . 1 1 126 126 VAL CB C 126 31.859 31.859 29.195 2.664 25061 2111 1 3 . 1 1 126 126 VAL H H 126 8.044 8.044 7.662 0.382 25061 2112 1 3 . 1 1 127 127 GLY N N 127 109.813 109.813 105.947 3.866 25061 2113 1 3 . 1 1 127 127 GLY C C 127 174.264 174.264 174.310 -0.046 25061 2114 1 3 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.201 0.078 25061 2115 1 3 . 1 1 127 127 GLY H H 127 8.279 8.279 8.279 0.000 25061 2116 1 3 . 1 1 128 128 SER N N 128 115.185 115.185 115.654 -0.469 25061 2117 1 3 . 1 1 128 128 SER HA H 128 4.462 4.462 4.505 -0.043 25061 2118 1 3 . 1 1 128 128 SER C C 128 174.775 174.775 173.852 0.923 25061 2119 1 3 . 1 1 128 128 SER CA C 128 58.739 58.739 58.029 0.710 25061 2120 1 3 . 1 1 128 128 SER CB C 128 63.850 63.850 64.600 -0.750 25061 2121 1 3 . 1 1 128 128 SER H H 128 8.048 8.048 7.733 0.315 25061 2122 1 3 . 1 1 129 129 LEU N N 129 123.060 123.060 121.436 1.624 25061 2123 1 3 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.614 -0.316 25061 2124 1 3 . 1 1 129 129 LEU C C 129 177.313 177.313 176.781 0.532 25061 2125 1 3 . 1 1 129 129 LEU CA C 129 55.158 55.158 53.987 1.171 25061 2126 1 3 . 1 1 129 129 LEU CB C 129 41.837 41.837 43.359 -1.522 25061 2127 1 3 . 1 1 129 129 LEU H H 129 8.147 8.147 8.315 -0.168 25061 2128 1 3 . 1 1 130 130 GLU N N 130 120.088 120.088 119.956 0.132 25061 2129 1 3 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.282 -0.101 25061 2130 1 3 . 1 1 130 130 GLU C C 130 176.148 176.148 175.999 0.149 25061 2131 1 3 . 1 1 130 130 GLU CA C 130 56.726 56.726 56.731 -0.005 25061 2132 1 3 . 1 1 130 130 GLU CB C 130 30.026 30.026 28.661 1.365 25061 2133 1 3 . 1 1 130 130 GLU H H 130 8.242 8.242 8.766 -0.524 25061 2134 1 4 . 1 1 2 2 GLY CA C 2 45.319 45.319 44.944 0.375 25061 2135 1 4 . 1 1 3 3 THR HA H 3 4.820 4.820 4.920 -0.100 25061 2136 1 4 . 1 1 3 3 THR C C 3 172.374 172.374 173.705 -1.331 25061 2137 1 4 . 1 1 3 3 THR CA C 3 62.760 62.760 61.582 1.178 25061 2138 1 4 . 1 1 3 3 THR CB C 3 71.441 71.441 70.233 1.208 25061 2139 1 4 . 1 1 4 4 VAL N N 4 126.881 126.881 128.607 -1.726 25061 2140 1 4 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.145 0.423 25061 2141 1 4 . 1 1 4 4 VAL C C 4 173.116 173.116 174.334 -1.218 25061 2142 1 4 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.947 -1.492 25061 2143 1 4 . 1 1 4 4 VAL CB C 4 33.800 33.800 31.977 1.823 25061 2144 1 4 . 1 1 4 4 VAL H H 4 9.097 9.097 8.928 0.169 25061 2145 1 4 . 1 1 5 5 VAL N N 5 127.172 127.172 124.907 2.265 25061 2146 1 4 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.207 -0.320 25061 2147 1 4 . 1 1 5 5 VAL C C 5 174.091 174.091 174.853 -0.762 25061 2148 1 4 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.710 0.408 25061 2149 1 4 . 1 1 5 5 VAL CB C 5 32.935 32.935 32.946 -0.011 25061 2150 1 4 . 1 1 5 5 VAL H H 5 8.811 8.811 8.683 0.128 25061 2151 1 4 . 1 1 6 6 ILE N N 6 127.577 127.577 128.950 -1.373 25061 2152 1 4 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.482 0.138 25061 2153 1 4 . 1 1 6 6 ILE C C 6 173.328 173.328 175.178 -1.850 25061 2154 1 4 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.692 0.140 25061 2155 1 4 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.807 1.123 25061 2156 1 4 . 1 1 6 6 ILE H H 6 9.210 9.210 8.813 0.397 25061 2157 1 4 . 1 1 7 7 VAL N N 7 129.024 129.024 130.066 -1.042 25061 2158 1 4 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.308 0.497 25061 2159 1 4 . 1 1 7 7 VAL C C 7 173.561 173.561 175.110 -1.549 25061 2160 1 4 . 1 1 7 7 VAL CA C 7 60.849 60.849 62.319 -1.470 25061 2161 1 4 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.130 1.230 25061 2162 1 4 . 1 1 7 7 VAL H H 7 9.294 9.294 8.228 1.066 25061 2163 1 4 . 1 1 8 8 VAL N N 8 125.318 125.318 129.806 -4.488 25061 2164 1 4 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.499 -0.103 25061 2165 1 4 . 1 1 8 8 VAL C C 8 175.723 175.723 175.866 -0.143 25061 2166 1 4 . 1 1 8 8 VAL CA C 8 59.617 59.617 59.992 -0.375 25061 2167 1 4 . 1 1 8 8 VAL CB C 8 34.915 34.915 33.502 1.413 25061 2168 1 4 . 1 1 8 8 VAL H H 8 8.898 8.898 8.994 -0.096 25061 2169 1 4 . 1 1 9 9 SER N N 9 116.544 116.544 119.955 -3.411 25061 2170 1 4 . 1 1 9 9 SER HA H 9 4.724 4.724 4.828 -0.104 25061 2171 1 4 . 1 1 9 9 SER C C 9 174.552 174.552 172.975 1.577 25061 2172 1 4 . 1 1 9 9 SER CA C 9 57.419 57.419 56.997 0.422 25061 2173 1 4 . 1 1 9 9 SER CB C 9 64.998 64.998 65.850 -0.852 25061 2174 1 4 . 1 1 9 9 SER H H 9 7.833 7.833 8.252 -0.419 25061 2175 1 4 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.820 0.092 25061 2176 1 4 . 1 1 10 10 ASN C C 10 176.170 176.170 174.520 1.650 25061 2177 1 4 . 1 1 10 10 ASN CA C 10 54.141 54.141 53.036 1.105 25061 2178 1 4 . 1 1 10 10 ASN CB C 10 38.626 38.626 38.713 -0.087 25061 2179 1 4 . 1 1 11 11 ASP N N 11 120.164 120.164 118.329 1.835 25061 2180 1 4 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.819 0.024 25061 2181 1 4 . 1 1 11 11 ASP C C 11 176.148 176.148 175.582 0.566 25061 2182 1 4 . 1 1 11 11 ASP CA C 11 52.620 52.620 52.614 0.006 25061 2183 1 4 . 1 1 11 11 ASP CB C 11 42.631 42.631 43.975 -1.345 25061 2184 1 4 . 1 1 11 11 ASP H H 11 8.142 8.142 7.509 0.633 25061 2185 1 4 . 1 1 12 12 GLU N N 12 127.184 127.184 121.470 5.714 25061 2186 1 4 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.207 -0.354 25061 2187 1 4 . 1 1 12 12 GLU C C 12 177.853 177.853 178.327 -0.474 25061 2188 1 4 . 1 1 12 12 GLU CA C 12 59.547 59.547 58.943 0.604 25061 2189 1 4 . 1 1 12 12 GLU CB C 12 29.819 29.819 30.213 -0.394 25061 2190 1 4 . 1 1 12 12 GLU H H 12 9.152 9.152 8.685 0.467 25061 2191 1 4 . 1 1 13 13 ARG N N 13 119.026 119.026 119.241 -0.215 25061 2192 1 4 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.140 -0.037 25061 2193 1 4 . 1 1 13 13 ARG C C 13 179.151 179.151 179.058 0.093 25061 2194 1 4 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.641 0.302 25061 2195 1 4 . 1 1 13 13 ARG CB C 13 28.757 28.757 30.227 -1.470 25061 2196 1 4 . 1 1 13 13 ARG H H 13 8.389 8.389 7.911 0.478 25061 2197 1 4 . 1 1 14 14 ILE N N 14 119.238 119.238 120.913 -1.675 25061 2198 1 4 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.738 -0.137 25061 2199 1 4 . 1 1 14 14 ILE C C 14 177.905 177.905 177.591 0.314 25061 2200 1 4 . 1 1 14 14 ILE CA C 14 64.666 64.666 65.648 -0.982 25061 2201 1 4 . 1 1 14 14 ILE CB C 14 36.780 36.780 37.735 -0.955 25061 2202 1 4 . 1 1 14 14 ILE H H 14 7.254 7.254 8.367 -1.113 25061 2203 1 4 . 1 1 15 15 LEU N N 15 117.008 117.008 119.080 -2.072 25061 2204 1 4 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.119 -0.198 25061 2205 1 4 . 1 1 15 15 LEU C C 15 178.062 178.062 179.261 -1.199 25061 2206 1 4 . 1 1 15 15 LEU CA C 15 58.411 58.411 57.896 0.515 25061 2207 1 4 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.403 -0.234 25061 2208 1 4 . 1 1 15 15 LEU H H 15 7.412 7.412 7.591 -0.179 25061 2209 1 4 . 1 1 16 16 GLU N N 16 117.637 117.637 118.163 -0.526 25061 2210 1 4 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.900 -0.199 25061 2211 1 4 . 1 1 16 16 GLU C C 16 179.182 179.182 178.983 0.199 25061 2212 1 4 . 1 1 16 16 GLU CA C 16 59.417 59.417 58.807 0.610 25061 2213 1 4 . 1 1 16 16 GLU CB C 16 29.459 29.459 28.831 0.628 25061 2214 1 4 . 1 1 16 16 GLU H H 16 7.981 7.981 7.591 0.390 25061 2215 1 4 . 1 1 17 17 GLU N N 17 119.759 119.759 121.330 -1.571 25061 2216 1 4 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.034 -0.018 25061 2217 1 4 . 1 1 17 17 GLU C C 17 179.949 179.949 179.130 0.819 25061 2218 1 4 . 1 1 17 17 GLU CA C 17 59.195 59.195 59.144 0.051 25061 2219 1 4 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.686 -0.146 25061 2220 1 4 . 1 1 17 17 GLU H H 17 8.248 8.248 8.118 0.130 25061 2221 1 4 . 1 1 18 18 LEU N N 18 119.764 119.764 119.768 -0.004 25061 2222 1 4 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.132 -0.051 25061 2223 1 4 . 1 1 18 18 LEU C C 18 177.620 177.620 179.241 -1.621 25061 2224 1 4 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.687 -0.009 25061 2225 1 4 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.612 -0.502 25061 2226 1 4 . 1 1 18 18 LEU H H 18 8.486 8.486 8.180 0.306 25061 2227 1 4 . 1 1 19 19 LEU N N 19 123.102 123.102 120.113 2.989 25061 2228 1 4 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.221 0.441 25061 2229 1 4 . 1 1 19 19 LEU C C 19 178.343 178.343 178.357 -0.014 25061 2230 1 4 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.166 1.070 25061 2231 1 4 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.334 -0.683 25061 2232 1 4 . 1 1 19 19 LEU H H 19 7.870 7.870 7.555 0.315 25061 2233 1 4 . 1 1 20 20 GLU N N 20 117.884 117.884 118.311 -0.427 25061 2234 1 4 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.938 -0.034 25061 2235 1 4 . 1 1 20 20 GLU C C 20 177.707 177.707 179.026 -1.319 25061 2236 1 4 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.446 -0.054 25061 2237 1 4 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.537 -0.560 25061 2238 1 4 . 1 1 20 20 GLU H H 20 7.497 7.497 7.561 -0.064 25061 2239 1 4 . 1 1 21 21 VAL N N 21 117.709 117.709 119.871 -2.162 25061 2240 1 4 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.693 -0.069 25061 2241 1 4 . 1 1 21 21 VAL C C 21 178.523 178.523 178.182 0.341 25061 2242 1 4 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.302 -0.105 25061 2243 1 4 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.641 -0.494 25061 2244 1 4 . 1 1 21 21 VAL H H 21 7.514 7.514 7.612 -0.098 25061 2245 1 4 . 1 1 22 22 VAL N N 22 121.233 121.233 119.410 1.823 25061 2246 1 4 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.714 -0.268 25061 2247 1 4 . 1 1 22 22 VAL C C 22 176.868 176.868 177.782 -0.914 25061 2248 1 4 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.850 0.163 25061 2249 1 4 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.631 -0.317 25061 2250 1 4 . 1 1 22 22 VAL H H 22 7.863 7.863 7.592 0.271 25061 2251 1 4 . 1 1 23 23 LEU N N 23 118.101 118.101 119.099 -0.998 25061 2252 1 4 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.159 -0.094 25061 2253 1 4 . 1 1 23 23 LEU C C 23 179.701 179.701 178.780 0.921 25061 2254 1 4 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.672 -0.376 25061 2255 1 4 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.702 0.002 25061 2256 1 4 . 1 1 23 23 LEU H H 23 8.151 8.151 8.015 0.136 25061 2257 1 4 . 1 1 24 24 LYS N N 24 114.622 114.622 116.448 -1.826 25061 2258 1 4 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.138 -0.001 25061 2259 1 4 . 1 1 24 24 LYS C C 24 178.062 178.062 178.526 -0.464 25061 2260 1 4 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.178 -0.810 25061 2261 1 4 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.029 0.565 25061 2262 1 4 . 1 1 24 24 LYS H H 24 7.823 7.823 7.994 -0.171 25061 2263 1 4 . 1 1 25 25 SER N N 25 115.474 115.474 115.000 0.474 25061 2264 1 4 . 1 1 25 25 SER HA H 25 4.377 4.377 4.302 0.075 25061 2265 1 4 . 1 1 25 25 SER C C 25 174.520 174.520 174.623 -0.103 25061 2266 1 4 . 1 1 25 25 SER CA C 25 61.049 61.049 60.213 0.836 25061 2267 1 4 . 1 1 25 25 SER CB C 25 63.777 63.777 64.177 -0.400 25061 2268 1 4 . 1 1 25 25 SER H H 25 7.798 7.798 7.660 0.138 25061 2269 1 4 . 1 1 26 26 ASP N N 26 117.424 117.424 117.142 0.282 25061 2270 1 4 . 1 1 26 26 ASP HA H 26 4.886 4.886 4.944 -0.058 25061 2271 1 4 . 1 1 26 26 ASP C C 26 173.521 173.521 173.889 -0.368 25061 2272 1 4 . 1 1 26 26 ASP CA C 26 52.048 52.048 53.031 -0.983 25061 2273 1 4 . 1 1 26 26 ASP CB C 26 42.202 42.202 42.646 -0.444 25061 2274 1 4 . 1 1 26 26 ASP H H 26 7.990 7.990 8.070 -0.080 25061 2275 1 4 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.607 0.038 25061 2276 1 4 . 1 1 27 27 PRO C C 27 177.016 177.016 176.648 0.368 25061 2277 1 4 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.695 -0.094 25061 2278 1 4 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.185 -0.012 25061 2279 1 4 . 1 1 28 28 ASN N N 28 115.839 115.839 117.080 -1.241 25061 2280 1 4 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.759 -0.067 25061 2281 1 4 . 1 1 28 28 ASN C C 28 175.701 175.701 175.772 -0.071 25061 2282 1 4 . 1 1 28 28 ASN CA C 28 53.472 53.472 53.257 0.215 25061 2283 1 4 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.889 -0.676 25061 2284 1 4 . 1 1 28 28 ASN H H 28 8.608 8.608 8.111 0.497 25061 2285 1 4 . 1 1 29 29 VAL N N 29 120.770 120.770 117.547 3.223 25061 2286 1 4 . 1 1 29 29 VAL HA H 29 3.815 3.815 4.078 -0.263 25061 2287 1 4 . 1 1 29 29 VAL C C 29 175.023 175.023 175.874 -0.851 25061 2288 1 4 . 1 1 29 29 VAL CA C 29 62.552 62.552 62.190 0.362 25061 2289 1 4 . 1 1 29 29 VAL CB C 29 32.147 32.147 31.661 0.486 25061 2290 1 4 . 1 1 29 29 VAL H H 29 7.428 7.428 7.916 -0.488 25061 2291 1 4 . 1 1 30 30 LYS N N 30 127.345 127.345 124.873 2.472 25061 2292 1 4 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.508 -0.029 25061 2293 1 4 . 1 1 30 30 LYS C C 30 174.777 174.777 176.137 -1.360 25061 2294 1 4 . 1 1 30 30 LYS CA C 30 55.204 55.204 54.280 0.924 25061 2295 1 4 . 1 1 30 30 LYS CB C 30 31.949 31.949 30.759 1.190 25061 2296 1 4 . 1 1 30 30 LYS H H 30 8.457 8.457 8.334 0.123 25061 2297 1 4 . 1 1 31 31 THR N N 31 113.552 113.552 117.193 -3.641 25061 2298 1 4 . 1 1 31 31 THR HA H 31 5.723 5.723 5.285 0.438 25061 2299 1 4 . 1 1 31 31 THR C C 31 174.593 174.593 174.787 -0.194 25061 2300 1 4 . 1 1 31 31 THR CA C 31 59.030 59.030 60.863 -1.833 25061 2301 1 4 . 1 1 31 31 THR CB C 31 72.206 72.206 69.084 3.122 25061 2302 1 4 . 1 1 31 31 THR H H 31 8.164 8.164 8.164 0.000 25061 2303 1 4 . 1 1 32 32 VAL N N 32 119.206 119.206 127.851 -8.645 25061 2304 1 4 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.384 0.021 25061 2305 1 4 . 1 1 32 32 VAL C C 32 172.663 172.663 174.325 -1.662 25061 2306 1 4 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.574 -0.502 25061 2307 1 4 . 1 1 32 32 VAL CB C 32 35.051 35.051 34.350 0.701 25061 2308 1 4 . 1 1 32 32 VAL H H 32 8.615 8.615 8.796 -0.181 25061 2309 1 4 . 1 1 33 33 ARG N N 33 130.278 130.278 127.916 2.362 25061 2310 1 4 . 1 1 33 33 ARG HA H 33 5.331 5.331 5.539 -0.208 25061 2311 1 4 . 1 1 33 33 ARG C C 33 173.836 173.836 176.137 -2.301 25061 2312 1 4 . 1 1 33 33 ARG CA C 33 54.150 54.150 54.406 -0.256 25061 2313 1 4 . 1 1 33 33 ARG CB C 33 30.028 30.028 30.882 -0.854 25061 2314 1 4 . 1 1 33 33 ARG H H 33 8.996 8.996 8.696 0.300 25061 2315 1 4 . 1 1 34 34 THR N N 34 121.695 121.695 117.002 4.693 25061 2316 1 4 . 1 1 34 34 THR HA H 34 4.483 4.483 4.231 0.252 25061 2317 1 4 . 1 1 34 34 THR C C 34 169.769 169.769 172.772 -3.003 25061 2318 1 4 . 1 1 34 34 THR CA C 34 60.814 60.814 61.958 -1.144 25061 2319 1 4 . 1 1 34 34 THR CB C 34 67.402 67.402 71.263 -3.861 25061 2320 1 4 . 1 1 34 34 THR H H 34 8.126 8.126 8.263 -0.137 25061 2321 1 4 . 1 1 35 35 ASP N N 35 122.198 122.198 121.792 0.406 25061 2322 1 4 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.794 0.030 25061 2323 1 4 . 1 1 35 35 ASP C C 35 174.790 174.790 175.156 -0.366 25061 2324 1 4 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.094 -0.708 25061 2325 1 4 . 1 1 35 35 ASP CB C 35 41.848 41.848 40.742 1.106 25061 2326 1 4 . 1 1 35 35 ASP H H 35 7.983 7.983 8.549 -0.566 25061 2327 1 4 . 1 1 36 36 ASP N N 36 121.091 121.091 124.382 -3.291 25061 2328 1 4 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.602 -0.009 25061 2329 1 4 . 1 1 36 36 ASP C C 36 176.189 176.189 176.294 -0.105 25061 2330 1 4 . 1 1 36 36 ASP CA C 36 53.055 53.055 54.608 -1.553 25061 2331 1 4 . 1 1 36 36 ASP CB C 36 42.159 42.159 42.675 -0.516 25061 2332 1 4 . 1 1 36 36 ASP H H 36 8.157 8.157 8.503 -0.346 25061 2333 1 4 . 1 1 37 37 LYS N N 37 125.839 125.839 118.589 7.250 25061 2334 1 4 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.717 0.005 25061 2335 1 4 . 1 1 37 37 LYS C C 37 176.870 176.870 176.783 0.087 25061 2336 1 4 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.367 0.037 25061 2337 1 4 . 1 1 37 37 LYS CB C 37 32.394 32.394 31.259 1.135 25061 2338 1 4 . 1 1 37 37 LYS H H 37 8.843 8.843 8.481 0.362 25061 2339 1 4 . 1 1 38 38 GLU N N 38 118.369 118.369 118.858 -0.489 25061 2340 1 4 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.784 0.223 25061 2341 1 4 . 1 1 38 38 GLU C C 38 179.502 179.502 178.196 1.306 25061 2342 1 4 . 1 1 38 38 GLU CA C 38 58.670 58.670 59.191 -0.522 25061 2343 1 4 . 1 1 38 38 GLU CB C 38 28.474 28.474 29.294 -0.820 25061 2344 1 4 . 1 1 38 38 GLU H H 38 8.182 8.182 8.194 -0.012 25061 2345 1 4 . 1 1 39 39 LYS N N 39 121.722 121.722 120.364 1.358 25061 2346 1 4 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.335 -0.170 25061 2347 1 4 . 1 1 39 39 LYS C C 39 178.500 178.500 178.768 -0.268 25061 2348 1 4 . 1 1 39 39 LYS CA C 39 57.736 57.736 59.160 -1.424 25061 2349 1 4 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.039 -0.901 25061 2350 1 4 . 1 1 39 39 LYS H H 39 7.524 7.524 8.320 -0.796 25061 2351 1 4 . 1 1 40 40 VAL N N 40 117.199 117.199 118.490 -1.291 25061 2352 1 4 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.569 -0.341 25061 2353 1 4 . 1 1 40 40 VAL C C 40 177.362 177.362 177.884 -0.522 25061 2354 1 4 . 1 1 40 40 VAL CA C 40 67.642 67.642 65.884 1.758 25061 2355 1 4 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.472 -0.569 25061 2356 1 4 . 1 1 40 40 VAL H H 40 7.883 7.883 8.044 -0.161 25061 2357 1 4 . 1 1 41 41 LYS N N 41 117.677 117.677 118.963 -1.286 25061 2358 1 4 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.825 -0.383 25061 2359 1 4 . 1 1 41 41 LYS C C 41 177.686 177.686 178.927 -1.241 25061 2360 1 4 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.815 0.994 25061 2361 1 4 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.613 0.002 25061 2362 1 4 . 1 1 41 41 LYS H H 41 7.567 7.567 7.356 0.211 25061 2363 1 4 . 1 1 42 42 GLU N N 42 118.369 118.369 119.683 -1.314 25061 2364 1 4 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.283 -0.276 25061 2365 1 4 . 1 1 42 42 GLU C C 42 179.725 179.725 179.296 0.429 25061 2366 1 4 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.210 -0.141 25061 2367 1 4 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.582 -0.043 25061 2368 1 4 . 1 1 42 42 GLU H H 42 7.634 7.634 7.729 -0.095 25061 2369 1 4 . 1 1 43 43 GLU N N 43 117.906 117.906 118.829 -0.923 25061 2370 1 4 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.141 0.042 25061 2371 1 4 . 1 1 43 43 GLU C C 43 179.757 179.757 179.260 0.497 25061 2372 1 4 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.538 -0.172 25061 2373 1 4 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.215 -0.374 25061 2374 1 4 . 1 1 43 43 GLU H H 43 8.162 8.162 8.068 0.094 25061 2375 1 4 . 1 1 44 44 ILE N N 44 122.291 122.291 121.214 1.077 25061 2376 1 4 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.591 0.021 25061 2377 1 4 . 1 1 44 44 ILE C C 44 177.101 177.101 177.693 -0.592 25061 2378 1 4 . 1 1 44 44 ILE CA C 44 66.355 66.355 66.027 0.328 25061 2379 1 4 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.892 -0.431 25061 2380 1 4 . 1 1 44 44 ILE H H 44 8.742 8.742 8.295 0.447 25061 2381 1 4 . 1 1 45 45 GLU N N 45 119.892 119.892 119.888 0.004 25061 2382 1 4 . 1 1 45 45 GLU HA H 45 4.058 4.058 3.992 0.066 25061 2383 1 4 . 1 1 45 45 GLU C C 45 178.991 178.991 179.321 -0.330 25061 2384 1 4 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.804 -0.139 25061 2385 1 4 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.392 -0.232 25061 2386 1 4 . 1 1 45 45 GLU H H 45 8.171 8.171 7.951 0.220 25061 2387 1 4 . 1 1 46 46 LYS N N 46 118.064 118.064 118.636 -0.572 25061 2388 1 4 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.025 -0.043 25061 2389 1 4 . 1 1 46 46 LYS C C 46 178.837 178.837 179.411 -0.574 25061 2390 1 4 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.442 0.299 25061 2391 1 4 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.199 0.244 25061 2392 1 4 . 1 1 46 46 LYS H H 46 7.785 7.785 7.744 0.041 25061 2393 1 4 . 1 1 47 47 ALA N N 47 121.817 121.817 123.278 -1.461 25061 2394 1 4 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.104 -0.073 25061 2395 1 4 . 1 1 47 47 ALA C C 47 179.859 179.859 179.491 0.368 25061 2396 1 4 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.133 0.162 25061 2397 1 4 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.657 -1.000 25061 2398 1 4 . 1 1 47 47 ALA H H 47 8.123 8.123 7.931 0.192 25061 2399 1 4 . 1 1 48 48 ARG N N 48 119.080 119.080 118.119 0.961 25061 2400 1 4 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.130 -0.041 25061 2401 1 4 . 1 1 48 48 ARG C C 48 180.155 180.155 178.679 1.476 25061 2402 1 4 . 1 1 48 48 ARG CA C 48 59.197 59.197 57.765 1.432 25061 2403 1 4 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.222 0.288 25061 2404 1 4 . 1 1 48 48 ARG H H 48 8.768 8.768 8.266 0.502 25061 2405 1 4 . 1 1 49 49 LYS N N 49 119.951 119.951 120.531 -0.580 25061 2406 1 4 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.103 -0.064 25061 2407 1 4 . 1 1 49 49 LYS C C 49 178.288 178.288 177.910 0.378 25061 2408 1 4 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.678 0.159 25061 2409 1 4 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.318 -0.175 25061 2410 1 4 . 1 1 49 49 LYS H H 49 8.037 8.037 7.928 0.109 25061 2411 1 4 . 1 1 50 50 GLN N N 50 115.284 115.284 116.836 -1.552 25061 2412 1 4 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.394 -0.052 25061 2413 1 4 . 1 1 50 50 GLN C C 50 176.180 176.180 175.474 0.706 25061 2414 1 4 . 1 1 50 50 GLN CA C 50 55.741 55.741 54.558 1.183 25061 2415 1 4 . 1 1 50 50 GLN CB C 50 29.565 29.565 28.479 1.086 25061 2416 1 4 . 1 1 50 50 GLN H H 50 7.740 7.740 7.402 0.338 25061 2417 1 4 . 1 1 51 51 GLY N N 51 109.725 109.725 108.986 0.739 25061 2418 1 4 . 1 1 51 51 GLY C C 51 174.552 174.552 174.340 0.212 25061 2419 1 4 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.776 0.587 25061 2420 1 4 . 1 1 51 51 GLY H H 51 8.027 8.027 7.421 0.606 25061 2421 1 4 . 1 1 52 52 ARG N N 52 119.064 119.064 119.756 -0.692 25061 2422 1 4 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.746 0.151 25061 2423 1 4 . 1 1 52 52 ARG C C 52 173.123 173.123 173.589 -0.466 25061 2424 1 4 . 1 1 52 52 ARG CA C 52 52.247 52.247 52.343 -0.096 25061 2425 1 4 . 1 1 52 52 ARG CB C 52 32.366 32.366 32.472 -0.106 25061 2426 1 4 . 1 1 52 52 ARG H H 52 7.969 7.969 7.847 0.122 25061 2427 1 4 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.745 0.110 25061 2428 1 4 . 1 1 53 53 PRO C C 53 174.069 174.069 175.798 -1.729 25061 2429 1 4 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.408 -0.590 25061 2430 1 4 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.777 -0.717 25061 2431 1 4 . 1 1 54 54 ILE N N 54 116.301 116.301 121.534 -5.233 25061 2432 1 4 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.516 0.722 25061 2433 1 4 . 1 1 54 54 ILE C C 54 171.709 171.709 173.687 -1.978 25061 2434 1 4 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.482 -1.708 25061 2435 1 4 . 1 1 54 54 ILE CB C 54 41.558 41.558 40.786 0.772 25061 2436 1 4 . 1 1 54 54 ILE H H 54 7.920 7.920 7.714 0.206 25061 2437 1 4 . 1 1 55 55 VAL N N 55 126.302 126.302 129.690 -3.388 25061 2438 1 4 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.105 -0.181 25061 2439 1 4 . 1 1 55 55 VAL C C 55 173.624 173.624 174.961 -1.337 25061 2440 1 4 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.089 -0.294 25061 2441 1 4 . 1 1 55 55 VAL CB C 55 32.828 32.828 31.863 0.965 25061 2442 1 4 . 1 1 55 55 VAL H H 55 8.652 8.652 8.431 0.221 25061 2443 1 4 . 1 1 56 56 ILE N N 56 127.503 127.503 128.895 -1.392 25061 2444 1 4 . 1 1 56 56 ILE HA H 56 4.664 4.664 4.775 -0.111 25061 2445 1 4 . 1 1 56 56 ILE C C 56 173.479 173.479 175.203 -1.724 25061 2446 1 4 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.451 0.556 25061 2447 1 4 . 1 1 56 56 ILE CB C 56 40.285 40.285 37.750 2.535 25061 2448 1 4 . 1 1 56 56 ILE H H 56 9.124 9.124 8.266 0.858 25061 2449 1 4 . 1 1 57 57 PHE N N 57 125.302 125.302 128.468 -3.166 25061 2450 1 4 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.375 -0.159 25061 2451 1 4 . 1 1 57 57 PHE C C 57 174.536 174.536 175.849 -1.313 25061 2452 1 4 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.143 -0.182 25061 2453 1 4 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.687 0.742 25061 2454 1 4 . 1 1 57 57 PHE H H 57 8.971 8.971 8.422 0.549 25061 2455 1 4 . 1 1 58 58 ILE N N 58 126.472 126.472 117.611 8.861 25061 2456 1 4 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.776 -0.261 25061 2457 1 4 . 1 1 58 58 ILE C C 58 173.391 173.391 174.179 -0.788 25061 2458 1 4 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.185 -0.095 25061 2459 1 4 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.184 -0.442 25061 2460 1 4 . 1 1 58 58 ILE H H 58 9.248 9.248 9.075 0.173 25061 2461 1 4 . 1 1 59 59 ARG N N 59 124.681 124.681 121.163 3.518 25061 2462 1 4 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.180 -0.251 25061 2463 1 4 . 1 1 59 59 ARG C C 59 178.521 178.521 177.885 0.636 25061 2464 1 4 . 1 1 59 59 ARG CA C 59 55.742 55.742 55.685 0.056 25061 2465 1 4 . 1 1 59 59 ARG CB C 59 30.918 30.918 33.060 -2.142 25061 2466 1 4 . 1 1 59 59 ARG H H 59 8.587 8.587 8.933 -0.346 25061 2467 1 4 . 1 1 60 60 GLY N N 60 108.848 108.848 108.314 0.534 25061 2468 1 4 . 1 1 60 60 GLY C C 60 174.775 174.775 174.675 0.100 25061 2469 1 4 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.301 -0.334 25061 2470 1 4 . 1 1 60 60 GLY H H 60 7.732 7.732 8.389 -0.657 25061 2471 1 4 . 1 1 61 61 ALA N N 61 120.877 120.877 122.554 -1.677 25061 2472 1 4 . 1 1 61 61 ALA HA H 61 4.144 4.144 3.876 0.268 25061 2473 1 4 . 1 1 61 61 ALA C C 61 177.769 177.769 178.980 -1.211 25061 2474 1 4 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.940 -0.490 25061 2475 1 4 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.344 0.027 25061 2476 1 4 . 1 1 61 61 ALA H H 61 7.852 7.852 7.935 -0.083 25061 2477 1 4 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.274 0.526 25061 2478 1 4 . 1 1 62 62 TYR CA C 62 63.039 63.039 59.365 3.674 25061 2479 1 4 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.290 0.150 25061 2480 1 4 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.937 -0.252 25061 2481 1 4 . 1 1 63 63 GLU C C 63 176.251 176.251 178.878 -2.627 25061 2482 1 4 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.245 0.013 25061 2483 1 4 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.134 0.278 25061 2484 1 4 . 1 1 64 64 GLU N N 64 119.209 119.209 119.646 -0.437 25061 2485 1 4 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.925 -0.024 25061 2486 1 4 . 1 1 64 64 GLU C C 64 178.251 178.251 179.055 -0.804 25061 2487 1 4 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.767 0.445 25061 2488 1 4 . 1 1 64 64 GLU CB C 64 28.645 28.645 29.069 -0.423 25061 2489 1 4 . 1 1 64 64 GLU H H 64 8.878 8.878 7.576 1.302 25061 2490 1 4 . 1 1 65 65 VAL N N 65 116.728 116.728 119.958 -3.230 25061 2491 1 4 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.767 0.215 25061 2492 1 4 . 1 1 65 65 VAL C C 65 176.915 176.915 177.509 -0.594 25061 2493 1 4 . 1 1 65 65 VAL CA C 65 64.609 64.609 66.110 -1.501 25061 2494 1 4 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.775 0.120 25061 2495 1 4 . 1 1 65 65 VAL H H 65 7.652 7.652 7.659 -0.007 25061 2496 1 4 . 1 1 66 66 VAL N N 66 119.462 119.462 119.302 0.160 25061 2497 1 4 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.566 -0.252 25061 2498 1 4 . 1 1 66 66 VAL C C 66 177.142 177.142 177.399 -0.257 25061 2499 1 4 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.304 1.031 25061 2500 1 4 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.357 0.073 25061 2501 1 4 . 1 1 66 66 VAL H H 66 7.896 7.896 7.699 0.197 25061 2502 1 4 . 1 1 67 67 ARG HA H 67 3.628 3.628 3.938 -0.310 25061 2503 1 4 . 1 1 67 67 ARG C C 67 177.841 177.841 178.238 -0.397 25061 2504 1 4 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.724 0.328 25061 2505 1 4 . 1 1 67 67 ARG CB C 67 29.393 29.393 29.988 -0.595 25061 2506 1 4 . 1 1 68 68 ASP N N 68 118.316 118.316 118.194 0.122 25061 2507 1 4 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.800 -0.439 25061 2508 1 4 . 1 1 68 68 ASP C C 68 178.945 178.945 178.559 0.386 25061 2509 1 4 . 1 1 68 68 ASP CA C 68 57.311 57.311 56.991 0.320 25061 2510 1 4 . 1 1 68 68 ASP CB C 68 41.514 41.514 41.055 0.459 25061 2511 1 4 . 1 1 68 68 ASP H H 68 7.625 7.625 7.708 -0.083 25061 2512 1 4 . 1 1 69 69 ILE N N 69 119.231 119.231 120.663 -1.432 25061 2513 1 4 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.654 -0.024 25061 2514 1 4 . 1 1 69 69 ILE C C 69 177.138 177.138 177.843 -0.705 25061 2515 1 4 . 1 1 69 69 ILE CA C 69 64.540 64.540 65.201 -0.660 25061 2516 1 4 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.950 -0.901 25061 2517 1 4 . 1 1 69 69 ILE H H 69 8.113 8.113 7.483 0.630 25061 2518 1 4 . 1 1 70 70 VAL N N 70 120.164 120.164 119.738 0.426 25061 2519 1 4 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.493 -0.076 25061 2520 1 4 . 1 1 70 70 VAL C C 70 177.079 177.079 177.762 -0.683 25061 2521 1 4 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.409 -0.135 25061 2522 1 4 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.319 -0.061 25061 2523 1 4 . 1 1 70 70 VAL H H 70 8.478 8.478 8.361 0.117 25061 2524 1 4 . 1 1 71 71 GLU N N 71 118.293 118.293 118.563 -0.270 25061 2525 1 4 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.928 0.126 25061 2526 1 4 . 1 1 71 71 GLU C C 71 179.009 179.009 178.850 0.159 25061 2527 1 4 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.687 -0.271 25061 2528 1 4 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.262 -0.440 25061 2529 1 4 . 1 1 71 71 GLU H H 71 8.152 8.152 8.077 0.075 25061 2530 1 4 . 1 1 72 72 TYR N N 72 120.091 120.091 120.274 -0.183 25061 2531 1 4 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.195 -0.033 25061 2532 1 4 . 1 1 72 72 TYR C C 72 176.404 176.404 177.052 -0.648 25061 2533 1 4 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.153 -0.021 25061 2534 1 4 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.434 -0.297 25061 2535 1 4 . 1 1 72 72 TYR H H 72 7.959 7.959 7.386 0.573 25061 2536 1 4 . 1 1 73 73 ALA N N 73 120.133 120.133 120.722 -0.589 25061 2537 1 4 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.831 -0.201 25061 2538 1 4 . 1 1 73 73 ALA C C 73 179.182 179.182 179.208 -0.026 25061 2539 1 4 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.179 -0.067 25061 2540 1 4 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.258 -0.067 25061 2541 1 4 . 1 1 73 73 ALA H H 73 8.604 8.604 8.354 0.250 25061 2542 1 4 . 1 1 74 74 GLN N N 74 115.553 115.553 116.222 -0.669 25061 2543 1 4 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.016 0.122 25061 2544 1 4 . 1 1 74 74 GLN C C 74 180.595 180.595 178.245 2.350 25061 2545 1 4 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.200 0.895 25061 2546 1 4 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.800 -0.225 25061 2547 1 4 . 1 1 74 74 GLN H H 74 8.619 8.619 7.873 0.746 25061 2548 1 4 . 1 1 75 75 LYS N N 75 122.396 122.396 118.719 3.677 25061 2549 1 4 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.018 0.010 25061 2550 1 4 . 1 1 75 75 LYS C C 75 178.521 178.521 178.116 0.405 25061 2551 1 4 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.138 0.920 25061 2552 1 4 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.544 0.055 25061 2553 1 4 . 1 1 75 75 LYS H H 75 8.123 8.123 7.234 0.889 25061 2554 1 4 . 1 1 76 76 GLU N N 76 116.294 116.294 115.673 0.621 25061 2555 1 4 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.259 -0.160 25061 2556 1 4 . 1 1 76 76 GLU C C 76 175.957 175.957 176.985 -1.028 25061 2557 1 4 . 1 1 76 76 GLU CA C 76 55.605 55.605 55.675 -0.070 25061 2558 1 4 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.496 0.328 25061 2559 1 4 . 1 1 76 76 GLU H H 76 7.450 7.450 7.410 0.040 25061 2560 1 4 . 1 1 77 77 GLY N N 77 107.446 107.446 106.946 0.500 25061 2561 1 4 . 1 1 77 77 GLY C C 77 174.520 174.520 174.817 -0.297 25061 2562 1 4 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.413 0.394 25061 2563 1 4 . 1 1 77 77 GLY H H 77 7.763 7.763 7.220 0.543 25061 2564 1 4 . 1 1 78 78 LEU N N 78 120.179 120.179 120.147 0.032 25061 2565 1 4 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.404 -0.016 25061 2566 1 4 . 1 1 78 78 LEU C C 78 175.914 175.914 176.618 -0.704 25061 2567 1 4 . 1 1 78 78 LEU CA C 78 53.472 53.472 54.566 -1.094 25061 2568 1 4 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.376 -0.487 25061 2569 1 4 . 1 1 78 78 LEU H H 78 7.930 7.930 7.812 0.118 25061 2570 1 4 . 1 1 79 79 ARG N N 79 122.207 122.207 123.789 -1.582 25061 2571 1 4 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.320 0.077 25061 2572 1 4 . 1 1 79 79 ARG C C 79 174.960 174.960 174.598 0.362 25061 2573 1 4 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.511 0.137 25061 2574 1 4 . 1 1 79 79 ARG CB C 79 30.476 30.476 30.830 -0.354 25061 2575 1 4 . 1 1 79 79 ARG H H 79 8.241 8.241 8.017 0.224 25061 2576 1 4 . 1 1 80 80 VAL N N 80 123.333 123.333 124.845 -1.512 25061 2577 1 4 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.331 0.964 25061 2578 1 4 . 1 1 80 80 VAL C C 80 174.048 174.048 174.222 -0.174 25061 2579 1 4 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.310 -1.270 25061 2580 1 4 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.447 1.858 25061 2581 1 4 . 1 1 80 80 VAL H H 80 8.359 8.359 8.481 -0.122 25061 2582 1 4 . 1 1 81 81 LEU N N 81 128.719 128.719 129.942 -1.223 25061 2583 1 4 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.213 -0.109 25061 2584 1 4 . 1 1 81 81 LEU C C 81 174.484 174.484 174.462 0.022 25061 2585 1 4 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.529 0.591 25061 2586 1 4 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.374 -0.419 25061 2587 1 4 . 1 1 81 81 LEU H H 81 8.650 8.650 8.831 -0.181 25061 2588 1 4 . 1 1 82 82 VAL N N 82 122.487 122.487 128.278 -5.791 25061 2589 1 4 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.370 0.727 25061 2590 1 4 . 1 1 82 82 VAL C C 82 174.525 174.525 175.285 -0.760 25061 2591 1 4 . 1 1 82 82 VAL CA C 82 60.285 60.285 61.869 -1.584 25061 2592 1 4 . 1 1 82 82 VAL CB C 82 34.789 34.789 31.982 2.807 25061 2593 1 4 . 1 1 82 82 VAL H H 82 8.781 8.781 8.521 0.260 25061 2594 1 4 . 1 1 83 83 ILE N N 83 128.082 128.082 128.983 -0.901 25061 2595 1 4 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.764 0.166 25061 2596 1 4 . 1 1 83 83 ILE C C 83 172.925 172.925 174.670 -1.745 25061 2597 1 4 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.321 -0.380 25061 2598 1 4 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.668 1.518 25061 2599 1 4 . 1 1 83 83 ILE H H 83 9.527 9.527 8.889 0.638 25061 2600 1 4 . 1 1 84 84 LYS N N 84 128.493 128.493 127.888 0.605 25061 2601 1 4 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.039 0.009 25061 2602 1 4 . 1 1 84 84 LYS C C 84 174.027 174.027 175.024 -0.997 25061 2603 1 4 . 1 1 84 84 LYS CA C 84 53.253 53.253 54.727 -1.474 25061 2604 1 4 . 1 1 84 84 LYS CB C 84 34.652 34.652 36.871 -2.219 25061 2605 1 4 . 1 1 84 84 LYS H H 84 8.721 8.721 8.938 -0.217 25061 2606 1 4 . 1 1 85 85 VAL N N 85 126.729 126.729 126.247 0.482 25061 2607 1 4 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.025 0.711 25061 2608 1 4 . 1 1 85 85 VAL C C 85 175.935 175.935 174.363 1.572 25061 2609 1 4 . 1 1 85 85 VAL CA C 85 60.200 60.200 62.763 -2.563 25061 2610 1 4 . 1 1 85 85 VAL CB C 85 30.847 30.847 31.962 -1.115 25061 2611 1 4 . 1 1 85 85 VAL H H 85 8.643 8.643 8.082 0.561 25061 2612 1 4 . 1 1 86 86 ALA N N 86 132.930 132.930 129.328 3.602 25061 2613 1 4 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.627 -0.197 25061 2614 1 4 . 1 1 86 86 ALA C C 86 175.635 175.635 176.470 -0.835 25061 2615 1 4 . 1 1 86 86 ALA CA C 86 51.504 51.504 51.195 0.309 25061 2616 1 4 . 1 1 86 86 ALA CB C 86 20.821 20.821 22.086 -1.265 25061 2617 1 4 . 1 1 86 86 ALA H H 86 8.835 8.835 7.976 0.859 25061 2618 1 4 . 1 1 87 87 GLN N N 87 118.719 118.719 121.812 -3.093 25061 2619 1 4 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.576 -0.107 25061 2620 1 4 . 1 1 87 87 GLN C C 87 175.949 175.949 175.817 0.132 25061 2621 1 4 . 1 1 87 87 GLN CA C 87 55.260 55.260 55.977 -0.717 25061 2622 1 4 . 1 1 87 87 GLN CB C 87 30.432 30.432 29.801 0.631 25061 2623 1 4 . 1 1 87 87 GLN H H 87 8.570 8.570 8.694 -0.124 25061 2624 1 4 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.507 -0.027 25061 2625 1 4 . 1 1 88 88 ASP CA C 88 55.454 55.454 55.646 -0.192 25061 2626 1 4 . 1 1 88 88 ASP CB C 88 41.204 41.204 41.079 0.125 25061 2627 1 4 . 1 1 89 89 GLN HA H 89 4.047 4.047 3.721 0.326 25061 2628 1 4 . 1 1 89 89 GLN CA C 89 56.687 56.687 58.543 -1.856 25061 2629 1 4 . 1 1 89 89 GLN CB C 89 27.850 27.850 26.966 0.884 25061 2630 1 4 . 1 1 92 92 LEU N N 92 125.291 125.291 119.498 5.793 25061 2631 1 4 . 1 1 92 92 LEU HA H 92 4.201 4.201 3.939 0.262 25061 2632 1 4 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.743 -2.686 25061 2633 1 4 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.482 0.564 25061 2634 1 4 . 1 1 92 92 LEU H H 92 8.277 8.277 8.190 0.087 25061 2635 1 4 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.020 0.736 25061 2636 1 4 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.108 -0.059 25061 2637 1 4 . 1 1 94 94 ARG C C 94 178.544 178.544 178.320 0.224 25061 2638 1 4 . 1 1 94 94 ARG CA C 94 58.607 58.607 59.273 -0.666 25061 2639 1 4 . 1 1 94 94 ARG CB C 94 29.614 29.614 30.203 -0.589 25061 2640 1 4 . 1 1 95 95 PHE N N 95 117.407 117.407 118.815 -1.408 25061 2641 1 4 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.336 0.039 25061 2642 1 4 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.367 -0.136 25061 2643 1 4 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.549 -1.607 25061 2644 1 4 . 1 1 95 95 PHE H H 95 8.419 8.419 7.722 0.697 25061 2645 1 4 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.943 -0.135 25061 2646 1 4 . 1 1 96 96 TYR C C 96 177.728 177.728 177.342 0.386 25061 2647 1 4 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.679 1.477 25061 2648 1 4 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.736 -1.036 25061 2649 1 4 . 1 1 97 97 GLU N N 97 119.054 119.054 117.524 1.530 25061 2650 1 4 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.963 0.100 25061 2651 1 4 . 1 1 97 97 GLU C C 97 179.071 179.071 178.750 0.321 25061 2652 1 4 . 1 1 97 97 GLU CA C 97 58.760 58.760 58.925 -0.165 25061 2653 1 4 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.505 -0.333 25061 2654 1 4 . 1 1 97 97 GLU H H 97 7.858 7.858 7.942 -0.084 25061 2655 1 4 . 1 1 98 98 GLN N N 98 119.385 119.385 118.428 0.957 25061 2656 1 4 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.976 -0.075 25061 2657 1 4 . 1 1 98 98 GLN C C 98 177.599 177.599 178.806 -1.207 25061 2658 1 4 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.265 0.046 25061 2659 1 4 . 1 1 98 98 GLN CB C 98 27.766 27.766 27.920 -0.154 25061 2660 1 4 . 1 1 98 98 GLN H H 98 7.747 7.747 7.655 0.092 25061 2661 1 4 . 1 1 99 99 LEU N N 99 118.348 118.348 119.385 -1.037 25061 2662 1 4 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.915 0.104 25061 2663 1 4 . 1 1 99 99 LEU C C 99 178.669 178.669 178.599 0.070 25061 2664 1 4 . 1 1 99 99 LEU CA C 99 57.430 57.430 57.913 -0.483 25061 2665 1 4 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.272 0.231 25061 2666 1 4 . 1 1 99 99 LEU H H 99 7.891 7.891 7.421 0.470 25061 2667 1 4 . 1 1 100 100 LYS N N 100 118.332 118.332 119.108 -0.776 25061 2668 1 4 . 1 1 100 100 LYS HA H 100 4.509 4.509 4.114 0.395 25061 2669 1 4 . 1 1 100 100 LYS C C 100 180.846 180.846 178.911 1.935 25061 2670 1 4 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.850 0.238 25061 2671 1 4 . 1 1 100 100 LYS CB C 100 32.269 32.269 32.047 0.222 25061 2672 1 4 . 1 1 100 100 LYS H H 100 7.560 7.560 7.230 0.330 25061 2673 1 4 . 1 1 101 101 LYS N N 101 121.944 121.944 118.612 3.332 25061 2674 1 4 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.032 0.040 25061 2675 1 4 . 1 1 101 101 LYS C C 101 177.707 177.707 177.946 -0.239 25061 2676 1 4 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.754 0.117 25061 2677 1 4 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.248 -0.153 25061 2678 1 4 . 1 1 101 101 LYS H H 101 7.959 7.959 7.949 0.010 25061 2679 1 4 . 1 1 102 102 ASP N N 102 118.788 118.788 117.336 1.452 25061 2680 1 4 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.431 0.263 25061 2681 1 4 . 1 1 102 102 ASP C C 102 176.359 176.359 177.116 -0.757 25061 2682 1 4 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.760 -1.181 25061 2683 1 4 . 1 1 102 102 ASP CB C 102 40.574 40.574 42.414 -1.841 25061 2684 1 4 . 1 1 102 102 ASP H H 102 7.893 7.893 7.661 0.232 25061 2685 1 4 . 1 1 103 103 GLY N N 103 107.024 107.024 105.470 1.554 25061 2686 1 4 . 1 1 103 103 GLY C C 103 174.328 174.328 173.615 0.713 25061 2687 1 4 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.872 0.473 25061 2688 1 4 . 1 1 103 103 GLY H H 103 7.866 7.866 7.926 -0.060 25061 2689 1 4 . 1 1 104 104 VAL N N 104 123.060 123.060 123.277 -0.217 25061 2690 1 4 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.753 0.220 25061 2691 1 4 . 1 1 104 104 VAL C C 104 175.023 175.023 175.160 -0.137 25061 2692 1 4 . 1 1 104 104 VAL CA C 104 61.878 61.878 64.278 -2.400 25061 2693 1 4 . 1 1 104 104 VAL CB C 104 32.088 32.088 31.297 0.791 25061 2694 1 4 . 1 1 104 104 VAL H H 104 7.955 7.955 7.660 0.295 25061 2695 1 4 . 1 1 105 105 ASP N N 105 127.987 127.987 127.486 0.501 25061 2696 1 4 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.590 -0.015 25061 2697 1 4 . 1 1 105 105 ASP C C 105 173.624 173.624 174.954 -1.330 25061 2698 1 4 . 1 1 105 105 ASP CA C 105 54.087 54.087 54.617 -0.530 25061 2699 1 4 . 1 1 105 105 ASP CB C 105 40.660 40.660 42.834 -2.174 25061 2700 1 4 . 1 1 105 105 ASP H H 105 8.399 8.399 7.905 0.494 25061 2701 1 4 . 1 1 106 106 VAL N N 106 125.798 125.798 115.870 9.928 25061 2702 1 4 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.790 0.025 25061 2703 1 4 . 1 1 106 106 VAL C C 106 174.902 174.902 174.561 0.341 25061 2704 1 4 . 1 1 106 106 VAL CA C 106 60.194 60.194 59.240 0.954 25061 2705 1 4 . 1 1 106 106 VAL CB C 106 34.179 34.179 34.464 -0.285 25061 2706 1 4 . 1 1 106 106 VAL H H 106 7.550 7.550 7.995 -0.445 25061 2707 1 4 . 1 1 107 107 ARG N N 107 128.099 128.099 126.097 2.002 25061 2708 1 4 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.574 0.302 25061 2709 1 4 . 1 1 107 107 ARG C C 107 173.815 173.815 175.331 -1.516 25061 2710 1 4 . 1 1 107 107 ARG CA C 107 53.386 53.386 54.717 -1.331 25061 2711 1 4 . 1 1 107 107 ARG CB C 107 31.195 31.195 31.532 -0.337 25061 2712 1 4 . 1 1 107 107 ARG H H 107 9.132 9.132 8.149 0.983 25061 2713 1 4 . 1 1 108 108 VAL N N 108 123.979 123.979 122.810 1.169 25061 2714 1 4 . 1 1 108 108 VAL HA H 108 4.942 4.942 4.599 0.343 25061 2715 1 4 . 1 1 108 108 VAL C C 108 175.854 175.854 175.529 0.325 25061 2716 1 4 . 1 1 108 108 VAL CA C 108 60.017 60.017 61.517 -1.500 25061 2717 1 4 . 1 1 108 108 VAL CB C 108 32.844 32.844 31.296 1.548 25061 2718 1 4 . 1 1 108 108 VAL H H 108 8.561 8.561 8.747 -0.186 25061 2719 1 4 . 1 1 109 109 THR N N 109 120.144 120.144 120.448 -0.304 25061 2720 1 4 . 1 1 109 109 THR HA H 109 4.815 4.815 4.188 0.627 25061 2721 1 4 . 1 1 109 109 THR C C 109 171.867 171.867 175.272 -3.405 25061 2722 1 4 . 1 1 109 109 THR CA C 109 59.613 59.613 63.191 -3.578 25061 2723 1 4 . 1 1 109 109 THR CB C 109 69.720 69.720 69.402 0.318 25061 2724 1 4 . 1 1 109 109 THR H H 109 8.803 8.803 8.319 0.484 25061 2725 1 4 . 1 1 110 110 ASP N N 110 123.212 123.212 120.422 2.790 25061 2726 1 4 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.373 0.596 25061 2727 1 4 . 1 1 110 110 ASP C C 110 175.739 175.739 175.701 0.038 25061 2728 1 4 . 1 1 110 110 ASP CA C 110 53.243 53.243 57.340 -4.097 25061 2729 1 4 . 1 1 110 110 ASP CB C 110 41.351 41.351 39.218 2.132 25061 2730 1 4 . 1 1 110 110 ASP H H 110 8.363 8.363 7.934 0.429 25061 2731 1 4 . 1 1 111 111 ASN N N 111 116.298 116.298 119.866 -3.568 25061 2732 1 4 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.888 -0.012 25061 2733 1 4 . 1 1 111 111 ASN C C 111 174.756 174.756 176.157 -1.401 25061 2734 1 4 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.579 -0.447 25061 2735 1 4 . 1 1 111 111 ASN CB C 111 40.765 40.765 39.685 1.080 25061 2736 1 4 . 1 1 111 111 ASN H H 111 8.085 8.085 8.075 0.010 25061 2737 1 4 . 1 1 112 112 GLU HA H 112 3.848 3.848 4.015 -0.167 25061 2738 1 4 . 1 1 112 112 GLU C C 112 177.016 177.016 178.186 -1.170 25061 2739 1 4 . 1 1 112 112 GLU CA C 112 59.480 59.480 60.032 -0.552 25061 2740 1 4 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.751 -0.077 25061 2741 1 4 . 1 1 113 113 ASP N N 113 121.033 121.033 118.407 2.626 25061 2742 1 4 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.404 0.009 25061 2743 1 4 . 1 1 113 113 ASP C C 113 178.988 178.988 178.258 0.730 25061 2744 1 4 . 1 1 113 113 ASP CA C 113 57.855 57.855 56.972 0.883 25061 2745 1 4 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.661 -0.159 25061 2746 1 4 . 1 1 113 113 ASP H H 113 8.219 8.219 8.409 -0.190 25061 2747 1 4 . 1 1 114 114 GLU N N 114 121.280 121.280 119.604 1.676 25061 2748 1 4 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.127 -0.062 25061 2749 1 4 . 1 1 114 114 GLU C C 114 178.776 178.776 177.654 1.122 25061 2750 1 4 . 1 1 114 114 GLU CA C 114 58.714 58.714 59.110 -0.396 25061 2751 1 4 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.304 -0.091 25061 2752 1 4 . 1 1 114 114 GLU H H 114 8.296 8.296 8.452 -0.156 25061 2753 1 4 . 1 1 115 115 ALA N N 115 120.924 120.924 121.258 -0.334 25061 2754 1 4 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.114 -0.276 25061 2755 1 4 . 1 1 115 115 ALA C C 115 178.502 178.502 179.488 -0.986 25061 2756 1 4 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.042 0.596 25061 2757 1 4 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.495 0.002 25061 2758 1 4 . 1 1 115 115 ALA H H 115 7.853 7.853 7.464 0.389 25061 2759 1 4 . 1 1 116 116 LYS N N 116 116.616 116.616 116.314 0.302 25061 2760 1 4 . 1 1 116 116 LYS HA H 116 3.719 3.719 4.098 -0.379 25061 2761 1 4 . 1 1 116 116 LYS C C 116 178.097 178.097 178.305 -0.208 25061 2762 1 4 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.000 1.752 25061 2763 1 4 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.066 0.489 25061 2764 1 4 . 1 1 116 116 LYS H H 116 8.091 8.091 7.657 0.434 25061 2765 1 4 . 1 1 117 117 LYS N N 117 118.990 118.990 119.984 -0.994 25061 2766 1 4 . 1 1 117 117 LYS HA H 117 3.911 3.911 4.041 -0.130 25061 2767 1 4 . 1 1 117 117 LYS C C 117 179.186 179.186 179.159 0.027 25061 2768 1 4 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.498 0.073 25061 2769 1 4 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.217 0.303 25061 2770 1 4 . 1 1 117 117 LYS H H 117 7.742 7.742 7.435 0.307 25061 2771 1 4 . 1 1 118 118 ARG N N 118 117.441 117.441 118.387 -0.946 25061 2772 1 4 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.160 -0.020 25061 2773 1 4 . 1 1 118 118 ARG C C 118 178.921 178.921 178.589 0.332 25061 2774 1 4 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.502 -0.831 25061 2775 1 4 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.104 0.557 25061 2776 1 4 . 1 1 118 118 ARG H H 118 8.468 8.468 7.701 0.767 25061 2777 1 4 . 1 1 119 119 LEU N N 119 120.100 120.100 120.770 -0.670 25061 2778 1 4 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.965 -0.005 25061 2779 1 4 . 1 1 119 119 LEU C C 119 177.554 177.554 178.925 -1.371 25061 2780 1 4 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.383 -0.502 25061 2781 1 4 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.377 0.513 25061 2782 1 4 . 1 1 119 119 LEU H H 119 8.322 8.322 7.667 0.655 25061 2783 1 4 . 1 1 120 120 LYS N N 120 118.238 118.238 119.309 -1.071 25061 2784 1 4 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.943 -0.121 25061 2785 1 4 . 1 1 120 120 LYS C C 120 178.703 178.703 178.755 -0.052 25061 2786 1 4 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.331 1.016 25061 2787 1 4 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.057 0.179 25061 2788 1 4 . 1 1 120 120 LYS H H 120 7.990 7.990 7.864 0.126 25061 2789 1 4 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.273 -0.251 25061 2790 1 4 . 1 1 121 121 GLU C C 121 177.769 177.769 179.294 -1.525 25061 2791 1 4 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.296 -0.374 25061 2792 1 4 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.349 0.105 25061 2793 1 4 . 1 1 122 122 LEU N N 122 119.454 119.454 119.877 -0.423 25061 2794 1 4 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.001 0.132 25061 2795 1 4 . 1 1 122 122 LEU C C 122 178.991 178.991 179.590 -0.599 25061 2796 1 4 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.748 -0.422 25061 2797 1 4 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.886 -0.207 25061 2798 1 4 . 1 1 122 122 LEU H H 122 7.930 7.930 8.083 -0.153 25061 2799 1 4 . 1 1 123 123 LEU N N 123 117.862 117.862 118.771 -0.909 25061 2800 1 4 . 1 1 123 123 LEU HA H 123 4.067 4.067 3.956 0.111 25061 2801 1 4 . 1 1 123 123 LEU C C 123 179.178 179.178 179.315 -0.137 25061 2802 1 4 . 1 1 123 123 LEU CA C 123 56.920 56.920 57.786 -0.866 25061 2803 1 4 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.379 -0.169 25061 2804 1 4 . 1 1 123 123 LEU H H 123 8.095 8.095 7.722 0.373 25061 2805 1 4 . 1 1 124 124 GLU N N 124 118.975 118.975 117.398 1.577 25061 2806 1 4 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.099 0.030 25061 2807 1 4 . 1 1 124 124 GLU C C 124 177.777 177.777 177.848 -0.071 25061 2808 1 4 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.619 -0.532 25061 2809 1 4 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.782 -0.241 25061 2810 1 4 . 1 1 124 124 GLU H H 124 7.930 7.930 8.185 -0.255 25061 2811 1 4 . 1 1 125 125 LYS N N 125 118.933 118.933 116.573 2.360 25061 2812 1 4 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.438 -0.101 25061 2813 1 4 . 1 1 125 125 LYS C C 125 178.188 178.188 176.267 1.921 25061 2814 1 4 . 1 1 125 125 LYS CA C 125 56.980 56.980 55.950 1.030 25061 2815 1 4 . 1 1 125 125 LYS CB C 125 32.608 32.608 33.319 -0.711 25061 2816 1 4 . 1 1 125 125 LYS H H 125 7.729 7.729 7.518 0.211 25061 2817 1 4 . 1 1 126 126 VAL N N 126 117.933 117.933 114.877 3.056 25061 2818 1 4 . 1 1 126 126 VAL HA H 126 4.022 4.022 3.711 0.311 25061 2819 1 4 . 1 1 126 126 VAL C C 126 176.947 176.947 174.553 2.394 25061 2820 1 4 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.315 0.326 25061 2821 1 4 . 1 1 126 126 VAL CB C 126 31.859 31.859 30.205 1.654 25061 2822 1 4 . 1 1 126 126 VAL H H 126 8.044 8.044 7.444 0.600 25061 2823 1 4 . 1 1 127 127 GLY N N 127 109.813 109.813 106.004 3.809 25061 2824 1 4 . 1 1 127 127 GLY C C 127 174.264 174.264 172.557 1.707 25061 2825 1 4 . 1 1 127 127 GLY CA C 127 45.279 45.279 44.584 0.695 25061 2826 1 4 . 1 1 127 127 GLY H H 127 8.279 8.279 7.825 0.454 25061 2827 1 4 . 1 1 128 128 SER N N 128 115.185 115.185 117.492 -2.307 25061 2828 1 4 . 1 1 128 128 SER HA H 128 4.462 4.462 4.775 -0.313 25061 2829 1 4 . 1 1 128 128 SER C C 128 174.775 174.775 173.392 1.383 25061 2830 1 4 . 1 1 128 128 SER CA C 128 58.739 58.739 57.861 0.878 25061 2831 1 4 . 1 1 128 128 SER CB C 128 63.850 63.850 65.167 -1.317 25061 2832 1 4 . 1 1 128 128 SER H H 128 8.048 8.048 8.295 -0.247 25061 2833 1 4 . 1 1 129 129 LEU N N 129 123.060 123.060 123.756 -0.696 25061 2834 1 4 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.629 -0.331 25061 2835 1 4 . 1 1 129 129 LEU C C 129 177.313 177.313 175.915 1.398 25061 2836 1 4 . 1 1 129 129 LEU CA C 129 55.158 55.158 54.550 0.608 25061 2837 1 4 . 1 1 129 129 LEU CB C 129 41.837 41.837 41.926 -0.089 25061 2838 1 4 . 1 1 129 129 LEU H H 129 8.147 8.147 8.459 -0.312 25061 2839 1 4 . 1 1 130 130 GLU N N 130 120.088 120.088 124.672 -4.584 25061 2840 1 4 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.491 -0.310 25061 2841 1 4 . 1 1 130 130 GLU C C 130 176.148 176.148 174.441 1.707 25061 2842 1 4 . 1 1 130 130 GLU CA C 130 56.726 56.726 55.929 0.797 25061 2843 1 4 . 1 1 130 130 GLU CB C 130 30.026 30.026 33.375 -3.349 25061 2844 1 4 . 1 1 130 130 GLU H H 130 8.242 8.242 8.414 -0.172 25061 2845 1 5 . 1 1 2 2 GLY CA C 2 45.319 45.319 44.435 0.884 25061 2846 1 5 . 1 1 3 3 THR HA H 3 4.820 4.820 4.566 0.254 25061 2847 1 5 . 1 1 3 3 THR C C 3 172.374 172.374 173.621 -1.247 25061 2848 1 5 . 1 1 3 3 THR CA C 3 62.760 62.760 60.477 2.283 25061 2849 1 5 . 1 1 3 3 THR CB C 3 71.441 71.441 70.143 1.298 25061 2850 1 5 . 1 1 4 4 VAL N N 4 126.881 126.881 127.964 -1.083 25061 2851 1 5 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.774 -0.206 25061 2852 1 5 . 1 1 4 4 VAL C C 4 173.116 173.116 174.590 -1.474 25061 2853 1 5 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.659 -1.204 25061 2854 1 5 . 1 1 4 4 VAL CB C 4 33.800 33.800 32.763 1.038 25061 2855 1 5 . 1 1 4 4 VAL H H 4 9.097 9.097 8.913 0.184 25061 2856 1 5 . 1 1 5 5 VAL N N 5 127.172 127.172 124.560 2.612 25061 2857 1 5 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.245 -0.358 25061 2858 1 5 . 1 1 5 5 VAL C C 5 174.091 174.091 174.930 -0.839 25061 2859 1 5 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.674 0.444 25061 2860 1 5 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.270 -0.335 25061 2861 1 5 . 1 1 5 5 VAL H H 5 8.811 8.811 8.785 0.026 25061 2862 1 5 . 1 1 6 6 ILE N N 6 127.577 127.577 128.838 -1.261 25061 2863 1 5 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.344 0.276 25061 2864 1 5 . 1 1 6 6 ILE C C 6 173.328 173.328 175.130 -1.802 25061 2865 1 5 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.855 -0.023 25061 2866 1 5 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.206 1.724 25061 2867 1 5 . 1 1 6 6 ILE H H 6 9.210 9.210 8.940 0.270 25061 2868 1 5 . 1 1 7 7 VAL N N 7 129.024 129.024 129.491 -0.467 25061 2869 1 5 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.260 0.545 25061 2870 1 5 . 1 1 7 7 VAL C C 7 173.561 173.561 175.007 -1.446 25061 2871 1 5 . 1 1 7 7 VAL CA C 7 60.849 60.849 61.774 -0.925 25061 2872 1 5 . 1 1 7 7 VAL CB C 7 32.360 32.360 30.664 1.696 25061 2873 1 5 . 1 1 7 7 VAL H H 7 9.294 9.294 8.147 1.147 25061 2874 1 5 . 1 1 8 8 VAL N N 8 125.318 125.318 129.600 -4.282 25061 2875 1 5 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.481 -0.085 25061 2876 1 5 . 1 1 8 8 VAL C C 8 175.723 175.723 175.574 0.149 25061 2877 1 5 . 1 1 8 8 VAL CA C 8 59.617 59.617 60.312 -0.695 25061 2878 1 5 . 1 1 8 8 VAL CB C 8 34.915 34.915 34.844 0.071 25061 2879 1 5 . 1 1 8 8 VAL H H 8 8.898 8.898 9.003 -0.105 25061 2880 1 5 . 1 1 9 9 SER N N 9 116.544 116.544 119.595 -3.051 25061 2881 1 5 . 1 1 9 9 SER HA H 9 4.724 4.724 4.728 -0.004 25061 2882 1 5 . 1 1 9 9 SER C C 9 174.552 174.552 173.141 1.411 25061 2883 1 5 . 1 1 9 9 SER CA C 9 57.419 57.419 57.058 0.361 25061 2884 1 5 . 1 1 9 9 SER CB C 9 64.998 64.998 65.764 -0.766 25061 2885 1 5 . 1 1 9 9 SER H H 9 7.833 7.833 8.135 -0.302 25061 2886 1 5 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.807 0.105 25061 2887 1 5 . 1 1 10 10 ASN C C 10 176.170 176.170 173.859 2.311 25061 2888 1 5 . 1 1 10 10 ASN CA C 10 54.141 54.141 53.285 0.856 25061 2889 1 5 . 1 1 10 10 ASN CB C 10 38.626 38.626 38.177 0.449 25061 2890 1 5 . 1 1 11 11 ASP N N 11 120.164 120.164 117.503 2.661 25061 2891 1 5 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.793 0.050 25061 2892 1 5 . 1 1 11 11 ASP C C 11 176.148 176.148 174.937 1.211 25061 2893 1 5 . 1 1 11 11 ASP CA C 11 52.620 52.620 52.924 -0.304 25061 2894 1 5 . 1 1 11 11 ASP CB C 11 42.631 42.631 43.697 -1.066 25061 2895 1 5 . 1 1 11 11 ASP H H 11 8.142 8.142 7.294 0.848 25061 2896 1 5 . 1 1 12 12 GLU N N 12 127.184 127.184 120.172 7.012 25061 2897 1 5 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.117 -0.264 25061 2898 1 5 . 1 1 12 12 GLU C C 12 177.853 177.853 178.236 -0.383 25061 2899 1 5 . 1 1 12 12 GLU CA C 12 59.547 59.547 58.985 0.562 25061 2900 1 5 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.919 -0.100 25061 2901 1 5 . 1 1 12 12 GLU H H 12 9.152 9.152 8.665 0.487 25061 2902 1 5 . 1 1 13 13 ARG N N 13 119.026 119.026 118.915 0.111 25061 2903 1 5 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.299 -0.196 25061 2904 1 5 . 1 1 13 13 ARG C C 13 179.151 179.151 178.710 0.441 25061 2905 1 5 . 1 1 13 13 ARG CA C 13 58.943 58.943 57.670 1.272 25061 2906 1 5 . 1 1 13 13 ARG CB C 13 28.757 28.757 29.499 -0.742 25061 2907 1 5 . 1 1 13 13 ARG H H 13 8.389 8.389 7.974 0.415 25061 2908 1 5 . 1 1 14 14 ILE N N 14 119.238 119.238 120.204 -0.966 25061 2909 1 5 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.718 -0.117 25061 2910 1 5 . 1 1 14 14 ILE C C 14 177.905 177.905 177.690 0.215 25061 2911 1 5 . 1 1 14 14 ILE CA C 14 64.666 64.666 64.824 -0.158 25061 2912 1 5 . 1 1 14 14 ILE CB C 14 36.780 36.780 37.700 -0.920 25061 2913 1 5 . 1 1 14 14 ILE H H 14 7.254 7.254 7.700 -0.446 25061 2914 1 5 . 1 1 15 15 LEU N N 15 117.008 117.008 119.851 -2.843 25061 2915 1 5 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.179 -0.258 25061 2916 1 5 . 1 1 15 15 LEU C C 15 178.062 178.062 179.176 -1.114 25061 2917 1 5 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.230 0.181 25061 2918 1 5 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.442 -0.273 25061 2919 1 5 . 1 1 15 15 LEU H H 15 7.412 7.412 7.695 -0.283 25061 2920 1 5 . 1 1 16 16 GLU N N 16 117.637 117.637 118.381 -0.744 25061 2921 1 5 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.796 -0.095 25061 2922 1 5 . 1 1 16 16 GLU C C 16 179.182 179.182 178.960 0.222 25061 2923 1 5 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.433 -0.016 25061 2924 1 5 . 1 1 16 16 GLU CB C 16 29.459 29.459 28.920 0.539 25061 2925 1 5 . 1 1 16 16 GLU H H 16 7.981 7.981 7.707 0.274 25061 2926 1 5 . 1 1 17 17 GLU N N 17 119.759 119.759 120.800 -1.041 25061 2927 1 5 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.194 -0.178 25061 2928 1 5 . 1 1 17 17 GLU C C 17 179.949 179.949 179.060 0.889 25061 2929 1 5 . 1 1 17 17 GLU CA C 17 59.195 59.195 58.979 0.216 25061 2930 1 5 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.748 -0.208 25061 2931 1 5 . 1 1 17 17 GLU H H 17 8.248 8.248 8.054 0.194 25061 2932 1 5 . 1 1 18 18 LEU N N 18 119.764 119.764 119.510 0.254 25061 2933 1 5 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.207 -0.126 25061 2934 1 5 . 1 1 18 18 LEU C C 18 177.620 177.620 179.277 -1.657 25061 2935 1 5 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.130 0.548 25061 2936 1 5 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.852 -0.742 25061 2937 1 5 . 1 1 18 18 LEU H H 18 8.486 8.486 8.014 0.472 25061 2938 1 5 . 1 1 19 19 LEU N N 19 123.102 123.102 120.985 2.117 25061 2939 1 5 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.690 -0.028 25061 2940 1 5 . 1 1 19 19 LEU C C 19 178.343 178.343 178.216 0.127 25061 2941 1 5 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.245 0.991 25061 2942 1 5 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.218 -0.567 25061 2943 1 5 . 1 1 19 19 LEU H H 19 7.870 7.870 7.945 -0.075 25061 2944 1 5 . 1 1 20 20 GLU N N 20 117.884 117.884 118.500 -0.616 25061 2945 1 5 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.986 -0.082 25061 2946 1 5 . 1 1 20 20 GLU C C 20 177.707 177.707 179.284 -1.577 25061 2947 1 5 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.494 -0.102 25061 2948 1 5 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.284 -0.307 25061 2949 1 5 . 1 1 20 20 GLU H H 20 7.497 7.497 7.663 -0.166 25061 2950 1 5 . 1 1 21 21 VAL N N 21 117.709 117.709 118.980 -1.271 25061 2951 1 5 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.774 -0.150 25061 2952 1 5 . 1 1 21 21 VAL C C 21 178.523 178.523 177.938 0.585 25061 2953 1 5 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.025 0.172 25061 2954 1 5 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.671 -0.524 25061 2955 1 5 . 1 1 21 21 VAL H H 21 7.514 7.514 7.311 0.203 25061 2956 1 5 . 1 1 22 22 VAL N N 22 121.233 121.233 118.937 2.296 25061 2957 1 5 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.779 -0.333 25061 2958 1 5 . 1 1 22 22 VAL C C 22 176.868 176.868 177.590 -0.722 25061 2959 1 5 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.467 0.546 25061 2960 1 5 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.779 -0.465 25061 2961 1 5 . 1 1 22 22 VAL H H 22 7.863 7.863 7.169 0.694 25061 2962 1 5 . 1 1 23 23 LEU N N 23 118.101 118.101 117.669 0.432 25061 2963 1 5 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.219 -0.154 25061 2964 1 5 . 1 1 23 23 LEU C C 23 179.701 179.701 178.169 1.532 25061 2965 1 5 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.295 0.001 25061 2966 1 5 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.770 -0.066 25061 2967 1 5 . 1 1 23 23 LEU H H 23 8.151 8.151 8.150 0.001 25061 2968 1 5 . 1 1 24 24 LYS N N 24 114.622 114.622 115.676 -1.054 25061 2969 1 5 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.100 0.037 25061 2970 1 5 . 1 1 24 24 LYS C C 24 178.062 178.062 178.030 0.032 25061 2971 1 5 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.297 -0.929 25061 2972 1 5 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.415 0.179 25061 2973 1 5 . 1 1 24 24 LYS H H 24 7.823 7.823 7.873 -0.050 25061 2974 1 5 . 1 1 25 25 SER N N 25 115.474 115.474 115.496 -0.022 25061 2975 1 5 . 1 1 25 25 SER HA H 25 4.377 4.377 4.393 -0.016 25061 2976 1 5 . 1 1 25 25 SER C C 25 174.520 174.520 174.446 0.074 25061 2977 1 5 . 1 1 25 25 SER CA C 25 61.049 61.049 60.423 0.625 25061 2978 1 5 . 1 1 25 25 SER CB C 25 63.777 63.777 64.525 -0.748 25061 2979 1 5 . 1 1 25 25 SER H H 25 7.798 7.798 7.914 -0.116 25061 2980 1 5 . 1 1 26 26 ASP N N 26 117.424 117.424 120.644 -3.220 25061 2981 1 5 . 1 1 26 26 ASP HA H 26 4.886 4.886 5.078 -0.192 25061 2982 1 5 . 1 1 26 26 ASP C C 26 173.521 173.521 174.704 -1.183 25061 2983 1 5 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.354 -0.306 25061 2984 1 5 . 1 1 26 26 ASP CB C 26 42.202 42.202 43.802 -1.600 25061 2985 1 5 . 1 1 26 26 ASP H H 26 7.990 7.990 8.192 -0.202 25061 2986 1 5 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.454 0.191 25061 2987 1 5 . 1 1 27 27 PRO C C 27 177.016 177.016 176.918 0.098 25061 2988 1 5 . 1 1 27 27 PRO CA C 27 63.601 63.601 64.087 -0.486 25061 2989 1 5 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.251 -0.078 25061 2990 1 5 . 1 1 28 28 ASN N N 28 115.839 115.839 116.217 -0.378 25061 2991 1 5 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.580 0.112 25061 2992 1 5 . 1 1 28 28 ASN C C 28 175.701 175.701 175.515 0.186 25061 2993 1 5 . 1 1 28 28 ASN CA C 28 53.472 53.472 53.640 -0.168 25061 2994 1 5 . 1 1 28 28 ASN CB C 28 39.213 39.213 37.950 1.263 25061 2995 1 5 . 1 1 28 28 ASN H H 28 8.608 8.608 8.528 0.080 25061 2996 1 5 . 1 1 29 29 VAL N N 29 120.770 120.770 119.975 0.795 25061 2997 1 5 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.781 0.034 25061 2998 1 5 . 1 1 29 29 VAL C C 29 175.023 175.023 177.039 -2.016 25061 2999 1 5 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.650 -1.098 25061 3000 1 5 . 1 1 29 29 VAL CB C 29 32.147 32.147 32.527 -0.380 25061 3001 1 5 . 1 1 29 29 VAL H H 29 7.428 7.428 7.340 0.088 25061 3002 1 5 . 1 1 30 30 LYS N N 30 127.345 127.345 126.631 0.714 25061 3003 1 5 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.085 0.394 25061 3004 1 5 . 1 1 30 30 LYS C C 30 174.777 174.777 176.200 -1.423 25061 3005 1 5 . 1 1 30 30 LYS CA C 30 55.204 55.204 57.880 -2.676 25061 3006 1 5 . 1 1 30 30 LYS CB C 30 31.949 31.949 32.826 -0.877 25061 3007 1 5 . 1 1 30 30 LYS H H 30 8.457 8.457 8.549 -0.092 25061 3008 1 5 . 1 1 31 31 THR N N 31 113.552 113.552 109.347 4.205 25061 3009 1 5 . 1 1 31 31 THR HA H 31 5.723 5.723 4.177 1.546 25061 3010 1 5 . 1 1 31 31 THR C C 31 174.593 174.593 174.007 0.586 25061 3011 1 5 . 1 1 31 31 THR CA C 31 59.030 59.030 62.658 -3.628 25061 3012 1 5 . 1 1 31 31 THR CB C 31 72.206 72.206 67.249 4.957 25061 3013 1 5 . 1 1 31 31 THR H H 31 8.164 8.164 8.079 0.085 25061 3014 1 5 . 1 1 32 32 VAL N N 32 119.206 119.206 124.194 -4.988 25061 3015 1 5 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.327 0.078 25061 3016 1 5 . 1 1 32 32 VAL C C 32 172.663 172.663 174.548 -1.885 25061 3017 1 5 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.296 -0.224 25061 3018 1 5 . 1 1 32 32 VAL CB C 32 35.051 35.051 34.217 0.834 25061 3019 1 5 . 1 1 32 32 VAL H H 32 8.615 8.615 8.567 0.048 25061 3020 1 5 . 1 1 33 33 ARG N N 33 130.278 130.278 129.515 0.763 25061 3021 1 5 . 1 1 33 33 ARG HA H 33 5.331 5.331 4.753 0.578 25061 3022 1 5 . 1 1 33 33 ARG C C 33 173.836 173.836 175.301 -1.465 25061 3023 1 5 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.594 -1.444 25061 3024 1 5 . 1 1 33 33 ARG CB C 33 30.028 30.028 29.765 0.263 25061 3025 1 5 . 1 1 33 33 ARG H H 33 8.996 8.996 8.820 0.176 25061 3026 1 5 . 1 1 34 34 THR N N 34 121.695 121.695 119.366 2.329 25061 3027 1 5 . 1 1 34 34 THR HA H 34 4.483 4.483 4.575 -0.092 25061 3028 1 5 . 1 1 34 34 THR C C 34 169.769 169.769 173.273 -3.504 25061 3029 1 5 . 1 1 34 34 THR CA C 34 60.814 60.814 61.309 -0.495 25061 3030 1 5 . 1 1 34 34 THR CB C 34 67.402 67.402 71.286 -3.884 25061 3031 1 5 . 1 1 34 34 THR H H 34 8.126 8.126 7.894 0.232 25061 3032 1 5 . 1 1 35 35 ASP N N 35 122.198 122.198 120.866 1.332 25061 3033 1 5 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.602 0.222 25061 3034 1 5 . 1 1 35 35 ASP C C 35 174.790 174.790 175.350 -0.560 25061 3035 1 5 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.297 -0.911 25061 3036 1 5 . 1 1 35 35 ASP CB C 35 41.848 41.848 41.355 0.493 25061 3037 1 5 . 1 1 35 35 ASP H H 35 7.983 7.983 8.485 -0.502 25061 3038 1 5 . 1 1 36 36 ASP N N 36 121.091 121.091 123.475 -2.384 25061 3039 1 5 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.523 0.070 25061 3040 1 5 . 1 1 36 36 ASP C C 36 176.189 176.189 176.962 -0.773 25061 3041 1 5 . 1 1 36 36 ASP CA C 36 53.055 53.055 54.811 -1.756 25061 3042 1 5 . 1 1 36 36 ASP CB C 36 42.159 42.159 40.190 1.969 25061 3043 1 5 . 1 1 36 36 ASP H H 36 8.157 8.157 8.352 -0.195 25061 3044 1 5 . 1 1 37 37 LYS N N 37 125.839 125.839 126.930 -1.091 25061 3045 1 5 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.798 -0.076 25061 3046 1 5 . 1 1 37 37 LYS C C 37 176.870 176.870 177.832 -0.962 25061 3047 1 5 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.767 -0.363 25061 3048 1 5 . 1 1 37 37 LYS CB C 37 32.394 32.394 31.826 0.568 25061 3049 1 5 . 1 1 37 37 LYS H H 37 8.843 8.843 8.421 0.422 25061 3050 1 5 . 1 1 38 38 GLU N N 38 118.369 118.369 118.286 0.083 25061 3051 1 5 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.911 0.096 25061 3052 1 5 . 1 1 38 38 GLU C C 38 179.502 179.502 178.769 0.733 25061 3053 1 5 . 1 1 38 38 GLU CA C 38 58.670 58.670 59.056 -0.387 25061 3054 1 5 . 1 1 38 38 GLU CB C 38 28.474 28.474 28.746 -0.272 25061 3055 1 5 . 1 1 38 38 GLU H H 38 8.182 8.182 8.771 -0.589 25061 3056 1 5 . 1 1 39 39 LYS N N 39 121.722 121.722 121.245 0.477 25061 3057 1 5 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.257 -0.092 25061 3058 1 5 . 1 1 39 39 LYS C C 39 178.500 178.500 178.831 -0.331 25061 3059 1 5 . 1 1 39 39 LYS CA C 39 57.736 57.736 58.883 -1.147 25061 3060 1 5 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.650 -1.512 25061 3061 1 5 . 1 1 39 39 LYS H H 39 7.524 7.524 7.342 0.182 25061 3062 1 5 . 1 1 40 40 VAL N N 40 117.199 117.199 119.026 -1.827 25061 3063 1 5 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.601 -0.373 25061 3064 1 5 . 1 1 40 40 VAL C C 40 177.362 177.362 178.147 -0.785 25061 3065 1 5 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.352 1.290 25061 3066 1 5 . 1 1 40 40 VAL CB C 40 30.903 30.903 30.946 -0.043 25061 3067 1 5 . 1 1 40 40 VAL H H 40 7.883 7.883 8.323 -0.440 25061 3068 1 5 . 1 1 41 41 LYS N N 41 117.677 117.677 119.015 -1.338 25061 3069 1 5 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.560 -0.118 25061 3070 1 5 . 1 1 41 41 LYS C C 41 177.686 177.686 178.585 -0.899 25061 3071 1 5 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.945 0.864 25061 3072 1 5 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.510 0.105 25061 3073 1 5 . 1 1 41 41 LYS H H 41 7.567 7.567 7.371 0.196 25061 3074 1 5 . 1 1 42 42 GLU N N 42 118.369 118.369 119.128 -0.759 25061 3075 1 5 . 1 1 42 42 GLU HA H 42 4.007 4.007 3.965 0.042 25061 3076 1 5 . 1 1 42 42 GLU C C 42 179.725 179.725 178.806 0.919 25061 3077 1 5 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.785 -0.716 25061 3078 1 5 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.198 0.341 25061 3079 1 5 . 1 1 42 42 GLU H H 42 7.634 7.634 7.573 0.061 25061 3080 1 5 . 1 1 43 43 GLU N N 43 117.906 117.906 119.023 -1.117 25061 3081 1 5 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.118 0.065 25061 3082 1 5 . 1 1 43 43 GLU C C 43 179.757 179.757 179.267 0.490 25061 3083 1 5 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.588 -0.222 25061 3084 1 5 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.087 -0.246 25061 3085 1 5 . 1 1 43 43 GLU H H 43 8.162 8.162 8.177 -0.015 25061 3086 1 5 . 1 1 44 44 ILE N N 44 122.291 122.291 120.876 1.415 25061 3087 1 5 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.642 -0.030 25061 3088 1 5 . 1 1 44 44 ILE C C 44 177.101 177.101 177.765 -0.664 25061 3089 1 5 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.890 0.465 25061 3090 1 5 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.876 -0.416 25061 3091 1 5 . 1 1 44 44 ILE H H 44 8.742 8.742 8.293 0.449 25061 3092 1 5 . 1 1 45 45 GLU N N 45 119.892 119.892 121.312 -1.420 25061 3093 1 5 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.138 -0.080 25061 3094 1 5 . 1 1 45 45 GLU C C 45 178.991 178.991 179.174 -0.183 25061 3095 1 5 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.668 -0.003 25061 3096 1 5 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.387 -0.226 25061 3097 1 5 . 1 1 45 45 GLU H H 45 8.171 8.171 8.130 0.041 25061 3098 1 5 . 1 1 46 46 LYS N N 46 118.064 118.064 118.400 -0.336 25061 3099 1 5 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.113 -0.131 25061 3100 1 5 . 1 1 46 46 LYS C C 46 178.837 178.837 178.990 -0.153 25061 3101 1 5 . 1 1 46 46 LYS CA C 46 59.741 59.741 58.965 0.776 25061 3102 1 5 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.315 0.128 25061 3103 1 5 . 1 1 46 46 LYS H H 46 7.785 7.785 8.041 -0.256 25061 3104 1 5 . 1 1 47 47 ALA N N 47 121.817 121.817 122.829 -1.012 25061 3105 1 5 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.071 -0.040 25061 3106 1 5 . 1 1 47 47 ALA C C 47 179.859 179.859 179.529 0.330 25061 3107 1 5 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.337 -0.042 25061 3108 1 5 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.558 -0.902 25061 3109 1 5 . 1 1 47 47 ALA H H 47 8.123 8.123 8.067 0.056 25061 3110 1 5 . 1 1 48 48 ARG N N 48 119.080 119.080 117.902 1.178 25061 3111 1 5 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.151 -0.062 25061 3112 1 5 . 1 1 48 48 ARG C C 48 180.155 180.155 178.555 1.600 25061 3113 1 5 . 1 1 48 48 ARG CA C 48 59.197 59.197 57.976 1.221 25061 3114 1 5 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.540 -0.030 25061 3115 1 5 . 1 1 48 48 ARG H H 48 8.768 8.768 8.246 0.522 25061 3116 1 5 . 1 1 49 49 LYS N N 49 119.951 119.951 119.649 0.302 25061 3117 1 5 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.090 -0.051 25061 3118 1 5 . 1 1 49 49 LYS C C 49 178.288 178.288 178.373 -0.085 25061 3119 1 5 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.655 0.182 25061 3120 1 5 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.316 -0.173 25061 3121 1 5 . 1 1 49 49 LYS H H 49 8.037 8.037 7.972 0.065 25061 3122 1 5 . 1 1 50 50 GLN N N 50 115.284 115.284 114.844 0.440 25061 3123 1 5 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.294 0.048 25061 3124 1 5 . 1 1 50 50 GLN C C 50 176.180 176.180 176.969 -0.789 25061 3125 1 5 . 1 1 50 50 GLN CA C 50 55.741 55.741 55.545 0.196 25061 3126 1 5 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.359 0.206 25061 3127 1 5 . 1 1 50 50 GLN H H 50 7.740 7.740 7.748 -0.008 25061 3128 1 5 . 1 1 51 51 GLY N N 51 109.725 109.725 107.883 1.842 25061 3129 1 5 . 1 1 51 51 GLY C C 51 174.552 174.552 173.673 0.879 25061 3130 1 5 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.462 0.901 25061 3131 1 5 . 1 1 51 51 GLY H H 51 8.027 8.027 7.741 0.286 25061 3132 1 5 . 1 1 52 52 ARG N N 52 119.064 119.064 119.320 -0.256 25061 3133 1 5 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.710 0.187 25061 3134 1 5 . 1 1 52 52 ARG C C 52 173.123 173.123 173.938 -0.815 25061 3135 1 5 . 1 1 52 52 ARG CA C 52 52.247 52.247 52.426 -0.179 25061 3136 1 5 . 1 1 52 52 ARG CB C 52 32.366 32.366 32.581 -0.215 25061 3137 1 5 . 1 1 52 52 ARG H H 52 7.969 7.969 8.085 -0.116 25061 3138 1 5 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.712 0.143 25061 3139 1 5 . 1 1 53 53 PRO C C 53 174.069 174.069 175.752 -1.683 25061 3140 1 5 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.845 -1.027 25061 3141 1 5 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.488 -0.428 25061 3142 1 5 . 1 1 54 54 ILE N N 54 116.301 116.301 121.523 -5.222 25061 3143 1 5 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.594 0.644 25061 3144 1 5 . 1 1 54 54 ILE C C 54 171.709 171.709 173.428 -1.719 25061 3145 1 5 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.958 -2.184 25061 3146 1 5 . 1 1 54 54 ILE CB C 54 41.558 41.558 41.771 -0.213 25061 3147 1 5 . 1 1 54 54 ILE H H 54 7.920 7.920 8.258 -0.338 25061 3148 1 5 . 1 1 55 55 VAL N N 55 126.302 126.302 128.860 -2.558 25061 3149 1 5 . 1 1 55 55 VAL HA H 55 4.924 4.924 4.973 -0.049 25061 3150 1 5 . 1 1 55 55 VAL C C 55 173.624 173.624 175.175 -1.551 25061 3151 1 5 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.588 -0.793 25061 3152 1 5 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.670 0.158 25061 3153 1 5 . 1 1 55 55 VAL H H 55 8.652 8.652 8.636 0.016 25061 3154 1 5 . 1 1 56 56 ILE N N 56 127.503 127.503 128.499 -0.996 25061 3155 1 5 . 1 1 56 56 ILE HA H 56 4.664 4.664 4.935 -0.271 25061 3156 1 5 . 1 1 56 56 ILE C C 56 173.479 173.479 175.418 -1.939 25061 3157 1 5 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.514 0.493 25061 3158 1 5 . 1 1 56 56 ILE CB C 56 40.285 40.285 37.269 3.016 25061 3159 1 5 . 1 1 56 56 ILE H H 56 9.124 9.124 8.086 1.038 25061 3160 1 5 . 1 1 57 57 PHE N N 57 125.302 125.302 128.706 -3.404 25061 3161 1 5 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.150 0.066 25061 3162 1 5 . 1 1 57 57 PHE C C 57 174.536 174.536 175.950 -1.414 25061 3163 1 5 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.596 -0.635 25061 3164 1 5 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.397 1.032 25061 3165 1 5 . 1 1 57 57 PHE H H 57 8.971 8.971 8.375 0.596 25061 3166 1 5 . 1 1 58 58 ILE N N 58 126.472 126.472 116.648 9.824 25061 3167 1 5 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.668 -0.153 25061 3168 1 5 . 1 1 58 58 ILE C C 58 173.391 173.391 174.000 -0.609 25061 3169 1 5 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.332 -0.242 25061 3170 1 5 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.080 -0.338 25061 3171 1 5 . 1 1 58 58 ILE H H 58 9.248 9.248 8.893 0.355 25061 3172 1 5 . 1 1 59 59 ARG N N 59 124.681 124.681 120.903 3.778 25061 3173 1 5 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.271 -0.342 25061 3174 1 5 . 1 1 59 59 ARG C C 59 178.521 178.521 177.936 0.585 25061 3175 1 5 . 1 1 59 59 ARG CA C 59 55.742 55.742 55.328 0.414 25061 3176 1 5 . 1 1 59 59 ARG CB C 59 30.918 30.918 33.447 -2.529 25061 3177 1 5 . 1 1 59 59 ARG H H 59 8.587 8.587 8.747 -0.160 25061 3178 1 5 . 1 1 60 60 GLY N N 60 108.848 108.848 108.971 -0.123 25061 3179 1 5 . 1 1 60 60 GLY C C 60 174.775 174.775 174.922 -0.147 25061 3180 1 5 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.431 -0.464 25061 3181 1 5 . 1 1 60 60 GLY H H 60 7.732 7.732 8.577 -0.845 25061 3182 1 5 . 1 1 61 61 ALA N N 61 120.877 120.877 123.581 -2.704 25061 3183 1 5 . 1 1 61 61 ALA HA H 61 4.144 4.144 3.933 0.211 25061 3184 1 5 . 1 1 61 61 ALA C C 61 177.769 177.769 179.514 -1.745 25061 3185 1 5 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.804 -0.355 25061 3186 1 5 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.374 -0.003 25061 3187 1 5 . 1 1 61 61 ALA H H 61 7.852 7.852 8.064 -0.212 25061 3188 1 5 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.194 0.606 25061 3189 1 5 . 1 1 62 62 TYR CA C 62 63.039 63.039 60.439 2.600 25061 3190 1 5 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.620 -0.180 25061 3191 1 5 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.926 -0.241 25061 3192 1 5 . 1 1 63 63 GLU C C 63 176.251 176.251 178.561 -2.310 25061 3193 1 5 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.207 0.051 25061 3194 1 5 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.132 0.280 25061 3195 1 5 . 1 1 64 64 GLU N N 64 119.209 119.209 119.285 -0.076 25061 3196 1 5 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.142 0.759 25061 3197 1 5 . 1 1 64 64 GLU C C 64 178.251 178.251 178.942 -0.691 25061 3198 1 5 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.661 0.551 25061 3199 1 5 . 1 1 64 64 GLU CB C 64 28.645 28.645 29.271 -0.626 25061 3200 1 5 . 1 1 64 64 GLU H H 64 8.878 8.878 7.421 1.457 25061 3201 1 5 . 1 1 65 65 VAL N N 65 116.728 116.728 118.847 -2.119 25061 3202 1 5 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.795 0.187 25061 3203 1 5 . 1 1 65 65 VAL C C 65 176.915 176.915 178.097 -1.182 25061 3204 1 5 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.236 -0.627 25061 3205 1 5 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.848 0.047 25061 3206 1 5 . 1 1 65 65 VAL H H 65 7.652 7.652 7.550 0.102 25061 3207 1 5 . 1 1 66 66 VAL N N 66 119.462 119.462 119.964 -0.502 25061 3208 1 5 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.681 -0.367 25061 3209 1 5 . 1 1 66 66 VAL C C 66 177.142 177.142 177.304 -0.162 25061 3210 1 5 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.420 0.915 25061 3211 1 5 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.254 0.176 25061 3212 1 5 . 1 1 66 66 VAL H H 66 7.896 7.896 7.737 0.159 25061 3213 1 5 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.047 -0.419 25061 3214 1 5 . 1 1 67 67 ARG C C 67 177.841 177.841 178.456 -0.615 25061 3215 1 5 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.040 1.012 25061 3216 1 5 . 1 1 67 67 ARG CB C 67 29.393 29.393 29.740 -0.347 25061 3217 1 5 . 1 1 68 68 ASP N N 68 118.316 118.316 118.973 -0.657 25061 3218 1 5 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.568 -0.207 25061 3219 1 5 . 1 1 68 68 ASP C C 68 178.945 178.945 178.406 0.539 25061 3220 1 5 . 1 1 68 68 ASP CA C 68 57.311 57.311 56.851 0.460 25061 3221 1 5 . 1 1 68 68 ASP CB C 68 41.514 41.514 41.191 0.323 25061 3222 1 5 . 1 1 68 68 ASP H H 68 7.625 7.625 7.836 -0.211 25061 3223 1 5 . 1 1 69 69 ILE N N 69 119.231 119.231 120.019 -0.788 25061 3224 1 5 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.784 -0.154 25061 3225 1 5 . 1 1 69 69 ILE C C 69 177.138 177.138 177.836 -0.698 25061 3226 1 5 . 1 1 69 69 ILE CA C 69 64.540 64.540 64.545 -0.005 25061 3227 1 5 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.864 -0.814 25061 3228 1 5 . 1 1 69 69 ILE H H 69 8.113 8.113 7.252 0.861 25061 3229 1 5 . 1 1 70 70 VAL N N 70 120.164 120.164 119.915 0.249 25061 3230 1 5 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.520 -0.103 25061 3231 1 5 . 1 1 70 70 VAL C C 70 177.079 177.079 177.442 -0.363 25061 3232 1 5 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.541 -0.267 25061 3233 1 5 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.267 -0.009 25061 3234 1 5 . 1 1 70 70 VAL H H 70 8.478 8.478 8.402 0.076 25061 3235 1 5 . 1 1 71 71 GLU N N 71 118.293 118.293 119.333 -1.040 25061 3236 1 5 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.953 0.101 25061 3237 1 5 . 1 1 71 71 GLU C C 71 179.009 179.009 178.577 0.432 25061 3238 1 5 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.493 -0.077 25061 3239 1 5 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.518 -0.696 25061 3240 1 5 . 1 1 71 71 GLU H H 71 8.152 8.152 8.040 0.112 25061 3241 1 5 . 1 1 72 72 TYR N N 72 120.091 120.091 120.294 -0.203 25061 3242 1 5 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.129 0.033 25061 3243 1 5 . 1 1 72 72 TYR C C 72 176.404 176.404 177.335 -0.931 25061 3244 1 5 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.570 -0.438 25061 3245 1 5 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.307 -0.170 25061 3246 1 5 . 1 1 72 72 TYR H H 72 7.959 7.959 7.585 0.374 25061 3247 1 5 . 1 1 73 73 ALA N N 73 120.133 120.133 119.835 0.298 25061 3248 1 5 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.922 -0.292 25061 3249 1 5 . 1 1 73 73 ALA C C 73 179.182 179.182 179.327 -0.145 25061 3250 1 5 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.281 -0.169 25061 3251 1 5 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.345 -0.154 25061 3252 1 5 . 1 1 73 73 ALA H H 73 8.604 8.604 7.897 0.707 25061 3253 1 5 . 1 1 74 74 GLN N N 74 115.553 115.553 116.814 -1.261 25061 3254 1 5 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.063 0.075 25061 3255 1 5 . 1 1 74 74 GLN C C 74 180.595 180.595 178.661 1.934 25061 3256 1 5 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.119 0.976 25061 3257 1 5 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.857 -0.282 25061 3258 1 5 . 1 1 74 74 GLN H H 74 8.619 8.619 7.894 0.725 25061 3259 1 5 . 1 1 75 75 LYS N N 75 122.396 122.396 119.240 3.156 25061 3260 1 5 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.050 -0.022 25061 3261 1 5 . 1 1 75 75 LYS C C 75 178.521 178.521 178.509 0.012 25061 3262 1 5 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.141 0.917 25061 3263 1 5 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.899 -0.300 25061 3264 1 5 . 1 1 75 75 LYS H H 75 8.123 8.123 7.856 0.267 25061 3265 1 5 . 1 1 76 76 GLU N N 76 116.294 116.294 116.309 -0.015 25061 3266 1 5 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.230 -0.131 25061 3267 1 5 . 1 1 76 76 GLU C C 76 175.957 175.957 177.256 -1.299 25061 3268 1 5 . 1 1 76 76 GLU CA C 76 55.605 55.605 56.167 -0.562 25061 3269 1 5 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.803 0.021 25061 3270 1 5 . 1 1 76 76 GLU H H 76 7.450 7.450 7.723 -0.273 25061 3271 1 5 . 1 1 77 77 GLY N N 77 107.446 107.446 106.745 0.701 25061 3272 1 5 . 1 1 77 77 GLY C C 77 174.520 174.520 175.010 -0.490 25061 3273 1 5 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.475 0.332 25061 3274 1 5 . 1 1 77 77 GLY H H 77 7.763 7.763 7.410 0.353 25061 3275 1 5 . 1 1 78 78 LEU N N 78 120.179 120.179 119.224 0.955 25061 3276 1 5 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.357 0.031 25061 3277 1 5 . 1 1 78 78 LEU C C 78 175.914 175.914 176.804 -0.890 25061 3278 1 5 . 1 1 78 78 LEU CA C 78 53.472 53.472 54.505 -1.033 25061 3279 1 5 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.363 -0.474 25061 3280 1 5 . 1 1 78 78 LEU H H 78 7.930 7.930 7.854 0.076 25061 3281 1 5 . 1 1 79 79 ARG N N 79 122.207 122.207 122.525 -0.318 25061 3282 1 5 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.240 0.157 25061 3283 1 5 . 1 1 79 79 ARG C C 79 174.960 174.960 174.991 -0.031 25061 3284 1 5 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.038 0.611 25061 3285 1 5 . 1 1 79 79 ARG CB C 79 30.476 30.476 30.322 0.154 25061 3286 1 5 . 1 1 79 79 ARG H H 79 8.241 8.241 8.257 -0.016 25061 3287 1 5 . 1 1 80 80 VAL N N 80 123.333 123.333 122.824 0.509 25061 3288 1 5 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.507 0.788 25061 3289 1 5 . 1 1 80 80 VAL C C 80 174.048 174.048 174.087 -0.039 25061 3290 1 5 . 1 1 80 80 VAL CA C 80 60.041 60.041 60.986 -0.945 25061 3291 1 5 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.596 1.709 25061 3292 1 5 . 1 1 80 80 VAL H H 80 8.359 8.359 8.493 -0.134 25061 3293 1 5 . 1 1 81 81 LEU N N 81 128.719 128.719 129.991 -1.272 25061 3294 1 5 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.250 -0.146 25061 3295 1 5 . 1 1 81 81 LEU C C 81 174.484 174.484 174.651 -0.167 25061 3296 1 5 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.850 0.270 25061 3297 1 5 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.669 -0.714 25061 3298 1 5 . 1 1 81 81 LEU H H 81 8.650 8.650 8.500 0.150 25061 3299 1 5 . 1 1 82 82 VAL N N 82 122.487 122.487 127.885 -5.398 25061 3300 1 5 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.457 0.640 25061 3301 1 5 . 1 1 82 82 VAL C C 82 174.525 174.525 174.969 -0.444 25061 3302 1 5 . 1 1 82 82 VAL CA C 82 60.285 60.285 61.222 -0.937 25061 3303 1 5 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.258 2.531 25061 3304 1 5 . 1 1 82 82 VAL H H 82 8.781 8.781 8.547 0.234 25061 3305 1 5 . 1 1 83 83 ILE N N 83 128.082 128.082 129.562 -1.480 25061 3306 1 5 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.704 0.226 25061 3307 1 5 . 1 1 83 83 ILE C C 83 172.925 172.925 174.554 -1.629 25061 3308 1 5 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.515 -0.574 25061 3309 1 5 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.492 1.694 25061 3310 1 5 . 1 1 83 83 ILE H H 83 9.527 9.527 8.839 0.688 25061 3311 1 5 . 1 1 84 84 LYS N N 84 128.493 128.493 128.265 0.228 25061 3312 1 5 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.056 -0.008 25061 3313 1 5 . 1 1 84 84 LYS C C 84 174.027 174.027 174.940 -0.913 25061 3314 1 5 . 1 1 84 84 LYS CA C 84 53.253 53.253 54.135 -0.882 25061 3315 1 5 . 1 1 84 84 LYS CB C 84 34.652 34.652 37.011 -2.359 25061 3316 1 5 . 1 1 84 84 LYS H H 84 8.721 8.721 8.699 0.022 25061 3317 1 5 . 1 1 85 85 VAL N N 85 126.729 126.729 127.070 -0.341 25061 3318 1 5 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.265 0.471 25061 3319 1 5 . 1 1 85 85 VAL C C 85 175.935 175.935 175.310 0.625 25061 3320 1 5 . 1 1 85 85 VAL CA C 85 60.200 60.200 61.393 -1.193 25061 3321 1 5 . 1 1 85 85 VAL CB C 85 30.847 30.847 30.492 0.355 25061 3322 1 5 . 1 1 85 85 VAL H H 85 8.643 8.643 7.930 0.713 25061 3323 1 5 . 1 1 86 86 ALA N N 86 132.930 132.930 131.068 1.862 25061 3324 1 5 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.454 -0.024 25061 3325 1 5 . 1 1 86 86 ALA C C 86 175.635 175.635 176.261 -0.626 25061 3326 1 5 . 1 1 86 86 ALA CA C 86 51.504 51.504 51.755 -0.251 25061 3327 1 5 . 1 1 86 86 ALA CB C 86 20.821 20.821 20.371 0.450 25061 3328 1 5 . 1 1 86 86 ALA H H 86 8.835 8.835 8.075 0.760 25061 3329 1 5 . 1 1 87 87 GLN N N 87 118.719 118.719 124.179 -5.460 25061 3330 1 5 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.423 0.046 25061 3331 1 5 . 1 1 87 87 GLN C C 87 175.949 175.949 175.182 0.767 25061 3332 1 5 . 1 1 87 87 GLN CA C 87 55.260 55.260 55.254 0.006 25061 3333 1 5 . 1 1 87 87 GLN CB C 87 30.432 30.432 29.656 0.776 25061 3334 1 5 . 1 1 87 87 GLN H H 87 8.570 8.570 8.570 -0.000 25061 3335 1 5 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.076 0.404 25061 3336 1 5 . 1 1 88 88 ASP CA C 88 55.454 55.454 57.337 -1.883 25061 3337 1 5 . 1 1 88 88 ASP CB C 88 41.204 41.204 39.922 1.282 25061 3338 1 5 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.008 0.039 25061 3339 1 5 . 1 1 89 89 GLN CA C 89 56.687 56.687 56.187 0.500 25061 3340 1 5 . 1 1 89 89 GLN CB C 89 27.850 27.850 28.358 -0.508 25061 3341 1 5 . 1 1 92 92 LEU N N 92 125.291 125.291 119.606 5.685 25061 3342 1 5 . 1 1 92 92 LEU HA H 92 4.201 4.201 3.975 0.226 25061 3343 1 5 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.857 -2.800 25061 3344 1 5 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.704 0.342 25061 3345 1 5 . 1 1 92 92 LEU H H 92 8.277 8.277 7.914 0.363 25061 3346 1 5 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.445 0.311 25061 3347 1 5 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.146 -0.097 25061 3348 1 5 . 1 1 94 94 ARG C C 94 178.544 178.544 178.644 -0.100 25061 3349 1 5 . 1 1 94 94 ARG CA C 94 58.607 58.607 58.206 0.401 25061 3350 1 5 . 1 1 94 94 ARG CB C 94 29.614 29.614 29.512 0.102 25061 3351 1 5 . 1 1 95 95 PHE N N 95 117.407 117.407 121.064 -3.657 25061 3352 1 5 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.374 0.001 25061 3353 1 5 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.694 -0.463 25061 3354 1 5 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.133 -1.191 25061 3355 1 5 . 1 1 95 95 PHE H H 95 8.419 8.419 7.596 0.823 25061 3356 1 5 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.991 -0.183 25061 3357 1 5 . 1 1 96 96 TYR C C 96 177.728 177.728 177.084 0.644 25061 3358 1 5 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.277 1.879 25061 3359 1 5 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.130 -0.430 25061 3360 1 5 . 1 1 97 97 GLU N N 97 119.054 119.054 117.859 1.195 25061 3361 1 5 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.626 0.437 25061 3362 1 5 . 1 1 97 97 GLU C C 97 179.071 179.071 178.708 0.363 25061 3363 1 5 . 1 1 97 97 GLU CA C 97 58.760 58.760 58.721 0.039 25061 3364 1 5 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.296 -0.124 25061 3365 1 5 . 1 1 97 97 GLU H H 97 7.858 7.858 7.621 0.237 25061 3366 1 5 . 1 1 98 98 GLN N N 98 119.385 119.385 119.183 0.202 25061 3367 1 5 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.935 -0.034 25061 3368 1 5 . 1 1 98 98 GLN C C 98 177.599 177.599 178.616 -1.017 25061 3369 1 5 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.554 -0.243 25061 3370 1 5 . 1 1 98 98 GLN CB C 98 27.766 27.766 28.093 -0.327 25061 3371 1 5 . 1 1 98 98 GLN H H 98 7.747 7.747 7.436 0.311 25061 3372 1 5 . 1 1 99 99 LEU N N 99 118.348 118.348 118.870 -0.522 25061 3373 1 5 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.833 0.186 25061 3374 1 5 . 1 1 99 99 LEU C C 99 178.669 178.669 178.684 -0.015 25061 3375 1 5 . 1 1 99 99 LEU CA C 99 57.430 57.430 57.852 -0.422 25061 3376 1 5 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.369 0.134 25061 3377 1 5 . 1 1 99 99 LEU H H 99 7.891 7.891 7.336 0.555 25061 3378 1 5 . 1 1 100 100 LYS N N 100 118.332 118.332 117.950 0.382 25061 3379 1 5 . 1 1 100 100 LYS HA H 100 4.509 4.509 4.141 0.368 25061 3380 1 5 . 1 1 100 100 LYS C C 100 180.846 180.846 179.063 1.783 25061 3381 1 5 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.892 0.197 25061 3382 1 5 . 1 1 100 100 LYS CB C 100 32.269 32.269 32.135 0.134 25061 3383 1 5 . 1 1 100 100 LYS H H 100 7.560 7.560 7.243 0.317 25061 3384 1 5 . 1 1 101 101 LYS N N 101 121.944 121.944 119.042 2.902 25061 3385 1 5 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.034 0.038 25061 3386 1 5 . 1 1 101 101 LYS C C 101 177.707 177.707 178.418 -0.711 25061 3387 1 5 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.600 0.271 25061 3388 1 5 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.214 -0.119 25061 3389 1 5 . 1 1 101 101 LYS H H 101 7.959 7.959 7.373 0.586 25061 3390 1 5 . 1 1 102 102 ASP N N 102 118.788 118.788 117.355 1.433 25061 3391 1 5 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.522 0.172 25061 3392 1 5 . 1 1 102 102 ASP C C 102 176.359 176.359 177.208 -0.849 25061 3393 1 5 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.168 -0.589 25061 3394 1 5 . 1 1 102 102 ASP CB C 102 40.574 40.574 40.971 -0.397 25061 3395 1 5 . 1 1 102 102 ASP H H 102 7.893 7.893 7.784 0.109 25061 3396 1 5 . 1 1 103 103 GLY N N 103 107.024 107.024 106.493 0.531 25061 3397 1 5 . 1 1 103 103 GLY C C 103 174.328 174.328 174.496 -0.168 25061 3398 1 5 . 1 1 103 103 GLY CA C 103 45.345 45.345 45.194 0.151 25061 3399 1 5 . 1 1 103 103 GLY H H 103 7.866 7.866 7.371 0.495 25061 3400 1 5 . 1 1 104 104 VAL N N 104 123.060 123.060 119.741 3.319 25061 3401 1 5 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.908 0.065 25061 3402 1 5 . 1 1 104 104 VAL C C 104 175.023 175.023 175.318 -0.295 25061 3403 1 5 . 1 1 104 104 VAL CA C 104 61.878 61.878 62.976 -1.098 25061 3404 1 5 . 1 1 104 104 VAL CB C 104 32.088 32.088 32.220 -0.132 25061 3405 1 5 . 1 1 104 104 VAL H H 104 7.955 7.955 7.771 0.184 25061 3406 1 5 . 1 1 105 105 ASP N N 105 127.987 127.987 129.255 -1.268 25061 3407 1 5 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.624 -0.049 25061 3408 1 5 . 1 1 105 105 ASP C C 105 173.624 173.624 174.956 -1.332 25061 3409 1 5 . 1 1 105 105 ASP CA C 105 54.087 54.087 53.365 0.722 25061 3410 1 5 . 1 1 105 105 ASP CB C 105 40.660 40.660 40.875 -0.215 25061 3411 1 5 . 1 1 105 105 ASP H H 105 8.399 8.399 8.348 0.051 25061 3412 1 5 . 1 1 106 106 VAL N N 106 125.798 125.798 124.504 1.294 25061 3413 1 5 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.504 0.311 25061 3414 1 5 . 1 1 106 106 VAL C C 106 174.902 174.902 175.014 -0.112 25061 3415 1 5 . 1 1 106 106 VAL CA C 106 60.194 60.194 61.079 -0.885 25061 3416 1 5 . 1 1 106 106 VAL CB C 106 34.179 34.179 32.884 1.295 25061 3417 1 5 . 1 1 106 106 VAL H H 106 7.550 7.550 7.667 -0.117 25061 3418 1 5 . 1 1 107 107 ARG N N 107 128.099 128.099 131.007 -2.908 25061 3419 1 5 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.550 0.326 25061 3420 1 5 . 1 1 107 107 ARG C C 107 173.815 173.815 175.017 -1.202 25061 3421 1 5 . 1 1 107 107 ARG CA C 107 53.386 53.386 52.689 0.697 25061 3422 1 5 . 1 1 107 107 ARG CB C 107 31.195 31.195 29.475 1.720 25061 3423 1 5 . 1 1 107 107 ARG H H 107 9.132 9.132 8.625 0.507 25061 3424 1 5 . 1 1 108 108 VAL N N 108 123.979 123.979 123.833 0.146 25061 3425 1 5 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.069 -0.127 25061 3426 1 5 . 1 1 108 108 VAL C C 108 175.854 175.854 177.401 -1.547 25061 3427 1 5 . 1 1 108 108 VAL CA C 108 60.017 60.017 60.751 -0.734 25061 3428 1 5 . 1 1 108 108 VAL CB C 108 32.844 32.844 31.666 1.178 25061 3429 1 5 . 1 1 108 108 VAL H H 108 8.561 8.561 8.627 -0.066 25061 3430 1 5 . 1 1 109 109 THR N N 109 120.144 120.144 118.223 1.921 25061 3431 1 5 . 1 1 109 109 THR HA H 109 4.815 4.815 4.142 0.673 25061 3432 1 5 . 1 1 109 109 THR C C 109 171.867 171.867 175.930 -4.063 25061 3433 1 5 . 1 1 109 109 THR CA C 109 59.613 59.613 63.554 -3.941 25061 3434 1 5 . 1 1 109 109 THR CB C 109 69.720 69.720 69.620 0.100 25061 3435 1 5 . 1 1 109 109 THR H H 109 8.803 8.803 8.703 0.100 25061 3436 1 5 . 1 1 110 110 ASP N N 110 123.212 123.212 120.598 2.614 25061 3437 1 5 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.349 0.620 25061 3438 1 5 . 1 1 110 110 ASP C C 110 175.739 175.739 175.807 -0.068 25061 3439 1 5 . 1 1 110 110 ASP CA C 110 53.243 53.243 57.222 -3.979 25061 3440 1 5 . 1 1 110 110 ASP CB C 110 41.351 41.351 39.765 1.586 25061 3441 1 5 . 1 1 110 110 ASP H H 110 8.363 8.363 8.161 0.202 25061 3442 1 5 . 1 1 111 111 ASN N N 111 116.298 116.298 120.446 -4.148 25061 3443 1 5 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.604 0.272 25061 3444 1 5 . 1 1 111 111 ASN C C 111 174.756 174.756 176.764 -2.008 25061 3445 1 5 . 1 1 111 111 ASN CA C 111 52.132 52.132 53.602 -1.470 25061 3446 1 5 . 1 1 111 111 ASN CB C 111 40.765 40.765 38.993 1.772 25061 3447 1 5 . 1 1 111 111 ASN H H 111 8.085 8.085 8.162 -0.077 25061 3448 1 5 . 1 1 112 112 GLU HA H 112 3.848 3.848 4.063 -0.215 25061 3449 1 5 . 1 1 112 112 GLU C C 112 177.016 177.016 177.907 -0.891 25061 3450 1 5 . 1 1 112 112 GLU CA C 112 59.480 59.480 58.907 0.573 25061 3451 1 5 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.375 0.299 25061 3452 1 5 . 1 1 113 113 ASP N N 113 121.033 121.033 120.493 0.540 25061 3453 1 5 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.449 -0.036 25061 3454 1 5 . 1 1 113 113 ASP C C 113 178.988 178.988 177.718 1.270 25061 3455 1 5 . 1 1 113 113 ASP CA C 113 57.855 57.855 56.308 1.547 25061 3456 1 5 . 1 1 113 113 ASP CB C 113 40.502 40.502 41.060 -0.559 25061 3457 1 5 . 1 1 113 113 ASP H H 113 8.219 8.219 8.165 0.054 25061 3458 1 5 . 1 1 114 114 GLU N N 114 121.280 121.280 119.738 1.542 25061 3459 1 5 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.036 0.029 25061 3460 1 5 . 1 1 114 114 GLU C C 114 178.776 178.776 177.993 0.783 25061 3461 1 5 . 1 1 114 114 GLU CA C 114 58.714 58.714 59.121 -0.407 25061 3462 1 5 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.646 -0.433 25061 3463 1 5 . 1 1 114 114 GLU H H 114 8.296 8.296 8.126 0.170 25061 3464 1 5 . 1 1 115 115 ALA N N 115 120.924 120.924 121.875 -0.951 25061 3465 1 5 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.005 -0.167 25061 3466 1 5 . 1 1 115 115 ALA C C 115 178.502 178.502 179.409 -0.907 25061 3467 1 5 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.309 0.329 25061 3468 1 5 . 1 1 115 115 ALA CB C 115 18.497 18.497 17.904 0.593 25061 3469 1 5 . 1 1 115 115 ALA H H 115 7.853 7.853 7.569 0.284 25061 3470 1 5 . 1 1 116 116 LYS N N 116 116.616 116.616 118.410 -1.794 25061 3471 1 5 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.971 -0.252 25061 3472 1 5 . 1 1 116 116 LYS C C 116 178.097 178.097 178.627 -0.530 25061 3473 1 5 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.530 1.222 25061 3474 1 5 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.048 0.507 25061 3475 1 5 . 1 1 116 116 LYS H H 116 8.091 8.091 8.034 0.057 25061 3476 1 5 . 1 1 117 117 LYS N N 117 118.990 118.990 118.387 0.603 25061 3477 1 5 . 1 1 117 117 LYS HA H 117 3.911 3.911 4.020 -0.109 25061 3478 1 5 . 1 1 117 117 LYS C C 117 179.186 179.186 179.512 -0.326 25061 3479 1 5 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.529 0.042 25061 3480 1 5 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.320 0.200 25061 3481 1 5 . 1 1 117 117 LYS H H 117 7.742 7.742 7.404 0.338 25061 3482 1 5 . 1 1 118 118 ARG N N 118 117.441 117.441 118.089 -0.648 25061 3483 1 5 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.050 0.090 25061 3484 1 5 . 1 1 118 118 ARG C C 118 178.921 178.921 178.683 0.238 25061 3485 1 5 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.964 -1.293 25061 3486 1 5 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.997 -0.336 25061 3487 1 5 . 1 1 118 118 ARG H H 118 8.468 8.468 7.995 0.473 25061 3488 1 5 . 1 1 119 119 LEU N N 119 120.100 120.100 121.144 -1.044 25061 3489 1 5 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.894 0.066 25061 3490 1 5 . 1 1 119 119 LEU C C 119 177.554 177.554 178.394 -0.840 25061 3491 1 5 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.244 -0.363 25061 3492 1 5 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.447 0.442 25061 3493 1 5 . 1 1 119 119 LEU H H 119 8.322 8.322 7.916 0.406 25061 3494 1 5 . 1 1 120 120 LYS N N 120 118.238 118.238 119.155 -0.917 25061 3495 1 5 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.857 -0.035 25061 3496 1 5 . 1 1 120 120 LYS C C 120 178.703 178.703 178.729 -0.026 25061 3497 1 5 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.880 0.466 25061 3498 1 5 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.279 -0.043 25061 3499 1 5 . 1 1 120 120 LYS H H 120 7.990 7.990 7.548 0.442 25061 3500 1 5 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.198 -0.176 25061 3501 1 5 . 1 1 121 121 GLU C C 121 177.769 177.769 179.446 -1.677 25061 3502 1 5 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.084 -0.162 25061 3503 1 5 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.125 0.329 25061 3504 1 5 . 1 1 122 122 LEU N N 122 119.454 119.454 120.018 -0.564 25061 3505 1 5 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.282 -0.149 25061 3506 1 5 . 1 1 122 122 LEU C C 122 178.991 178.991 179.341 -0.350 25061 3507 1 5 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.455 -0.129 25061 3508 1 5 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.844 -0.165 25061 3509 1 5 . 1 1 122 122 LEU H H 122 7.930 7.930 7.866 0.064 25061 3510 1 5 . 1 1 123 123 LEU N N 123 117.862 117.862 119.622 -1.760 25061 3511 1 5 . 1 1 123 123 LEU HA H 123 4.067 4.067 3.937 0.130 25061 3512 1 5 . 1 1 123 123 LEU C C 123 179.178 179.178 179.536 -0.358 25061 3513 1 5 . 1 1 123 123 LEU CA C 123 56.920 56.920 58.130 -1.210 25061 3514 1 5 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.466 -0.256 25061 3515 1 5 . 1 1 123 123 LEU H H 123 8.095 8.095 7.993 0.102 25061 3516 1 5 . 1 1 124 124 GLU N N 124 118.975 118.975 117.610 1.365 25061 3517 1 5 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.036 0.093 25061 3518 1 5 . 1 1 124 124 GLU C C 124 177.777 177.777 178.197 -0.420 25061 3519 1 5 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.736 -0.649 25061 3520 1 5 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.530 0.010 25061 3521 1 5 . 1 1 124 124 GLU H H 124 7.930 7.930 7.891 0.039 25061 3522 1 5 . 1 1 125 125 LYS N N 125 118.933 118.933 117.389 1.544 25061 3523 1 5 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.269 0.068 25061 3524 1 5 . 1 1 125 125 LYS C C 125 178.188 178.188 177.173 1.015 25061 3525 1 5 . 1 1 125 125 LYS CA C 125 56.980 56.980 57.937 -0.957 25061 3526 1 5 . 1 1 125 125 LYS CB C 125 32.608 32.608 33.681 -1.073 25061 3527 1 5 . 1 1 125 125 LYS H H 125 7.729 7.729 7.500 0.229 25061 3528 1 5 . 1 1 126 126 VAL N N 126 117.933 117.933 112.779 5.154 25061 3529 1 5 . 1 1 126 126 VAL HA H 126 4.022 4.022 4.168 -0.146 25061 3530 1 5 . 1 1 126 126 VAL C C 126 176.947 176.947 174.013 2.934 25061 3531 1 5 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.388 0.253 25061 3532 1 5 . 1 1 126 126 VAL CB C 126 31.859 31.859 33.425 -1.565 25061 3533 1 5 . 1 1 126 126 VAL H H 126 8.044 8.044 8.564 -0.520 25061 3534 1 5 . 1 1 127 127 GLY N N 127 109.813 109.813 107.494 2.319 25061 3535 1 5 . 1 1 127 127 GLY C C 127 174.264 174.264 172.426 1.838 25061 3536 1 5 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.489 -0.210 25061 3537 1 5 . 1 1 127 127 GLY H H 127 8.279 8.279 8.005 0.274 25061 3538 1 5 . 1 1 128 128 SER N N 128 115.185 115.185 113.801 1.384 25061 3539 1 5 . 1 1 128 128 SER HA H 128 4.462 4.462 4.813 -0.351 25061 3540 1 5 . 1 1 128 128 SER C C 128 174.775 174.775 172.578 2.197 25061 3541 1 5 . 1 1 128 128 SER CA C 128 58.739 58.739 57.155 1.584 25061 3542 1 5 . 1 1 128 128 SER CB C 128 63.850 63.850 65.968 -2.118 25061 3543 1 5 . 1 1 128 128 SER H H 128 8.048 8.048 7.327 0.721 25061 3544 1 5 . 1 1 129 129 LEU N N 129 123.060 123.060 119.394 3.666 25061 3545 1 5 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.746 -0.448 25061 3546 1 5 . 1 1 129 129 LEU C C 129 177.313 177.313 175.768 1.545 25061 3547 1 5 . 1 1 129 129 LEU CA C 129 55.158 55.158 53.512 1.646 25061 3548 1 5 . 1 1 129 129 LEU CB C 129 41.837 41.837 43.474 -1.637 25061 3549 1 5 . 1 1 129 129 LEU H H 129 8.147 8.147 8.221 -0.074 25061 3550 1 5 . 1 1 130 130 GLU N N 130 120.088 120.088 121.908 -1.820 25061 3551 1 5 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.344 -0.163 25061 3552 1 5 . 1 1 130 130 GLU C C 130 176.148 176.148 176.780 -0.632 25061 3553 1 5 . 1 1 130 130 GLU CA C 130 56.726 56.726 57.036 -0.310 25061 3554 1 5 . 1 1 130 130 GLU CB C 130 30.026 30.026 30.451 -0.425 25061 3555 1 5 . 1 1 130 130 GLU H H 130 8.242 8.242 8.817 -0.575 25061 3556 1 6 . 1 1 2 2 GLY CA C 2 45.319 45.319 44.721 0.598 25061 3557 1 6 . 1 1 3 3 THR HA H 3 4.820 4.820 4.348 0.472 25061 3558 1 6 . 1 1 3 3 THR C C 3 172.374 172.374 174.064 -1.690 25061 3559 1 6 . 1 1 3 3 THR CA C 3 62.760 62.760 61.771 0.989 25061 3560 1 6 . 1 1 3 3 THR CB C 3 71.441 71.441 68.898 2.543 25061 3561 1 6 . 1 1 4 4 VAL N N 4 126.881 126.881 128.074 -1.193 25061 3562 1 6 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.716 -0.148 25061 3563 1 6 . 1 1 4 4 VAL C C 4 173.116 173.116 174.585 -1.469 25061 3564 1 6 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.133 -0.678 25061 3565 1 6 . 1 1 4 4 VAL CB C 4 33.800 33.800 33.054 0.746 25061 3566 1 6 . 1 1 4 4 VAL H H 4 9.097 9.097 8.839 0.258 25061 3567 1 6 . 1 1 5 5 VAL N N 5 127.172 127.172 125.145 2.027 25061 3568 1 6 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.370 -0.483 25061 3569 1 6 . 1 1 5 5 VAL C C 5 174.091 174.091 175.052 -0.961 25061 3570 1 6 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.537 0.581 25061 3571 1 6 . 1 1 5 5 VAL CB C 5 32.935 32.935 32.788 0.147 25061 3572 1 6 . 1 1 5 5 VAL H H 5 8.811 8.811 8.833 -0.022 25061 3573 1 6 . 1 1 6 6 ILE N N 6 127.577 127.577 129.140 -1.563 25061 3574 1 6 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.375 0.245 25061 3575 1 6 . 1 1 6 6 ILE C C 6 173.328 173.328 175.366 -2.038 25061 3576 1 6 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.949 -0.117 25061 3577 1 6 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.258 1.672 25061 3578 1 6 . 1 1 6 6 ILE H H 6 9.210 9.210 8.739 0.471 25061 3579 1 6 . 1 1 7 7 VAL N N 7 129.024 129.024 129.681 -0.657 25061 3580 1 6 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.627 0.178 25061 3581 1 6 . 1 1 7 7 VAL C C 7 173.561 173.561 175.299 -1.738 25061 3582 1 6 . 1 1 7 7 VAL CA C 7 60.849 60.849 61.836 -0.987 25061 3583 1 6 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.086 1.274 25061 3584 1 6 . 1 1 7 7 VAL H H 7 9.294 9.294 8.093 1.201 25061 3585 1 6 . 1 1 8 8 VAL N N 8 125.318 125.318 129.237 -3.919 25061 3586 1 6 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.352 0.044 25061 3587 1 6 . 1 1 8 8 VAL C C 8 175.723 175.723 175.758 -0.035 25061 3588 1 6 . 1 1 8 8 VAL CA C 8 59.617 59.617 60.456 -0.839 25061 3589 1 6 . 1 1 8 8 VAL CB C 8 34.915 34.915 34.558 0.357 25061 3590 1 6 . 1 1 8 8 VAL H H 8 8.898 8.898 8.331 0.567 25061 3591 1 6 . 1 1 9 9 SER N N 9 116.544 116.544 117.896 -1.352 25061 3592 1 6 . 1 1 9 9 SER HA H 9 4.724 4.724 4.963 -0.239 25061 3593 1 6 . 1 1 9 9 SER C C 9 174.552 174.552 173.812 0.740 25061 3594 1 6 . 1 1 9 9 SER CA C 9 57.419 57.419 57.003 0.416 25061 3595 1 6 . 1 1 9 9 SER CB C 9 64.998 64.998 67.034 -2.036 25061 3596 1 6 . 1 1 9 9 SER H H 9 7.833 7.833 8.186 -0.353 25061 3597 1 6 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.690 0.222 25061 3598 1 6 . 1 1 10 10 ASN C C 10 176.170 176.170 174.509 1.661 25061 3599 1 6 . 1 1 10 10 ASN CA C 10 54.141 54.141 54.118 0.023 25061 3600 1 6 . 1 1 10 10 ASN CB C 10 38.626 38.626 39.122 -0.496 25061 3601 1 6 . 1 1 11 11 ASP N N 11 120.164 120.164 119.679 0.485 25061 3602 1 6 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.752 0.091 25061 3603 1 6 . 1 1 11 11 ASP C C 11 176.148 176.148 176.553 -0.405 25061 3604 1 6 . 1 1 11 11 ASP CA C 11 52.620 52.620 52.917 -0.297 25061 3605 1 6 . 1 1 11 11 ASP CB C 11 42.631 42.631 42.324 0.307 25061 3606 1 6 . 1 1 11 11 ASP H H 11 8.142 8.142 7.921 0.221 25061 3607 1 6 . 1 1 12 12 GLU N N 12 127.184 127.184 122.939 4.245 25061 3608 1 6 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.192 -0.339 25061 3609 1 6 . 1 1 12 12 GLU C C 12 177.853 177.853 178.485 -0.632 25061 3610 1 6 . 1 1 12 12 GLU CA C 12 59.547 59.547 59.367 0.180 25061 3611 1 6 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.927 -0.108 25061 3612 1 6 . 1 1 12 12 GLU H H 12 9.152 9.152 8.771 0.381 25061 3613 1 6 . 1 1 13 13 ARG N N 13 119.026 119.026 119.437 -0.411 25061 3614 1 6 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.390 -0.287 25061 3615 1 6 . 1 1 13 13 ARG C C 13 179.151 179.151 178.888 0.263 25061 3616 1 6 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.932 0.011 25061 3617 1 6 . 1 1 13 13 ARG CB C 13 28.757 28.757 30.103 -1.346 25061 3618 1 6 . 1 1 13 13 ARG H H 13 8.389 8.389 7.937 0.452 25061 3619 1 6 . 1 1 14 14 ILE N N 14 119.238 119.238 120.658 -1.420 25061 3620 1 6 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.880 -0.279 25061 3621 1 6 . 1 1 14 14 ILE C C 14 177.905 177.905 177.828 0.077 25061 3622 1 6 . 1 1 14 14 ILE CA C 14 64.666 64.666 63.289 1.377 25061 3623 1 6 . 1 1 14 14 ILE CB C 14 36.780 36.780 37.046 -0.266 25061 3624 1 6 . 1 1 14 14 ILE H H 14 7.254 7.254 7.934 -0.680 25061 3625 1 6 . 1 1 15 15 LEU N N 15 117.008 117.008 119.548 -2.540 25061 3626 1 6 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.198 -0.277 25061 3627 1 6 . 1 1 15 15 LEU C C 15 178.062 178.062 179.659 -1.597 25061 3628 1 6 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.094 0.317 25061 3629 1 6 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.517 -0.348 25061 3630 1 6 . 1 1 15 15 LEU H H 15 7.412 7.412 7.641 -0.229 25061 3631 1 6 . 1 1 16 16 GLU N N 16 117.637 117.637 118.860 -1.223 25061 3632 1 6 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.870 -0.169 25061 3633 1 6 . 1 1 16 16 GLU C C 16 179.182 179.182 178.752 0.430 25061 3634 1 6 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.556 -0.139 25061 3635 1 6 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.317 0.142 25061 3636 1 6 . 1 1 16 16 GLU H H 16 7.981 7.981 7.655 0.326 25061 3637 1 6 . 1 1 17 17 GLU N N 17 119.759 119.759 120.070 -0.311 25061 3638 1 6 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.297 -0.281 25061 3639 1 6 . 1 1 17 17 GLU C C 17 179.949 179.949 179.152 0.797 25061 3640 1 6 . 1 1 17 17 GLU CA C 17 59.195 59.195 58.711 0.484 25061 3641 1 6 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.772 -0.232 25061 3642 1 6 . 1 1 17 17 GLU H H 17 8.248 8.248 8.147 0.101 25061 3643 1 6 . 1 1 18 18 LEU N N 18 119.764 119.764 120.087 -0.323 25061 3644 1 6 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.254 -0.173 25061 3645 1 6 . 1 1 18 18 LEU C C 18 177.620 177.620 178.763 -1.143 25061 3646 1 6 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.138 0.540 25061 3647 1 6 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.873 -0.763 25061 3648 1 6 . 1 1 18 18 LEU H H 18 8.486 8.486 8.121 0.365 25061 3649 1 6 . 1 1 19 19 LEU N N 19 123.102 123.102 121.229 1.873 25061 3650 1 6 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.201 0.461 25061 3651 1 6 . 1 1 19 19 LEU C C 19 178.343 178.343 177.870 0.473 25061 3652 1 6 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.269 0.967 25061 3653 1 6 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.263 -0.612 25061 3654 1 6 . 1 1 19 19 LEU H H 19 7.870 7.870 7.852 0.018 25061 3655 1 6 . 1 1 20 20 GLU N N 20 117.884 117.884 118.521 -0.637 25061 3656 1 6 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.938 -0.034 25061 3657 1 6 . 1 1 20 20 GLU C C 20 177.707 177.707 179.097 -1.390 25061 3658 1 6 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.244 0.148 25061 3659 1 6 . 1 1 20 20 GLU CB C 20 28.977 28.977 28.816 0.161 25061 3660 1 6 . 1 1 20 20 GLU H H 20 7.497 7.497 7.745 -0.248 25061 3661 1 6 . 1 1 21 21 VAL N N 21 117.709 117.709 120.650 -2.941 25061 3662 1 6 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.613 0.011 25061 3663 1 6 . 1 1 21 21 VAL C C 21 178.523 178.523 178.244 0.279 25061 3664 1 6 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.128 0.069 25061 3665 1 6 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.796 -0.649 25061 3666 1 6 . 1 1 21 21 VAL H H 21 7.514 7.514 7.168 0.346 25061 3667 1 6 . 1 1 22 22 VAL N N 22 121.233 121.233 119.360 1.873 25061 3668 1 6 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.655 -0.209 25061 3669 1 6 . 1 1 22 22 VAL C C 22 176.868 176.868 178.223 -1.355 25061 3670 1 6 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.498 0.515 25061 3671 1 6 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.825 -0.511 25061 3672 1 6 . 1 1 22 22 VAL H H 22 7.863 7.863 7.455 0.408 25061 3673 1 6 . 1 1 23 23 LEU N N 23 118.101 118.101 119.696 -1.595 25061 3674 1 6 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.132 -0.067 25061 3675 1 6 . 1 1 23 23 LEU C C 23 179.701 179.701 178.139 1.562 25061 3676 1 6 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.743 -0.447 25061 3677 1 6 . 1 1 23 23 LEU CB C 23 41.704 41.704 42.012 -0.308 25061 3678 1 6 . 1 1 23 23 LEU H H 23 8.151 8.151 8.291 -0.140 25061 3679 1 6 . 1 1 24 24 LYS N N 24 114.622 114.622 117.624 -3.002 25061 3680 1 6 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.118 0.019 25061 3681 1 6 . 1 1 24 24 LYS C C 24 178.062 178.062 179.035 -0.973 25061 3682 1 6 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.769 -1.401 25061 3683 1 6 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.064 0.530 25061 3684 1 6 . 1 1 24 24 LYS H H 24 7.823 7.823 8.064 -0.241 25061 3685 1 6 . 1 1 25 25 SER N N 25 115.474 115.474 116.079 -0.605 25061 3686 1 6 . 1 1 25 25 SER HA H 25 4.377 4.377 4.298 0.079 25061 3687 1 6 . 1 1 25 25 SER C C 25 174.520 174.520 174.687 -0.167 25061 3688 1 6 . 1 1 25 25 SER CA C 25 61.049 61.049 61.052 -0.003 25061 3689 1 6 . 1 1 25 25 SER CB C 25 63.777 63.777 63.935 -0.158 25061 3690 1 6 . 1 1 25 25 SER H H 25 7.798 7.798 7.834 -0.036 25061 3691 1 6 . 1 1 26 26 ASP N N 26 117.424 117.424 117.876 -0.452 25061 3692 1 6 . 1 1 26 26 ASP HA H 26 4.886 4.886 4.944 -0.058 25061 3693 1 6 . 1 1 26 26 ASP C C 26 173.521 173.521 174.280 -0.759 25061 3694 1 6 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.353 -0.305 25061 3695 1 6 . 1 1 26 26 ASP CB C 26 42.202 42.202 42.994 -0.792 25061 3696 1 6 . 1 1 26 26 ASP H H 26 7.990 7.990 7.806 0.184 25061 3697 1 6 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.635 0.010 25061 3698 1 6 . 1 1 27 27 PRO C C 27 177.016 177.016 176.787 0.229 25061 3699 1 6 . 1 1 27 27 PRO CA C 27 63.601 63.601 64.123 -0.522 25061 3700 1 6 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.434 -0.261 25061 3701 1 6 . 1 1 28 28 ASN N N 28 115.839 115.839 116.783 -0.944 25061 3702 1 6 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.722 -0.030 25061 3703 1 6 . 1 1 28 28 ASN C C 28 175.701 175.701 175.640 0.061 25061 3704 1 6 . 1 1 28 28 ASN CA C 28 53.472 53.472 53.130 0.342 25061 3705 1 6 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.389 -0.176 25061 3706 1 6 . 1 1 28 28 ASN H H 28 8.608 8.608 7.965 0.643 25061 3707 1 6 . 1 1 29 29 VAL N N 29 120.770 120.770 121.325 -0.555 25061 3708 1 6 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.775 0.040 25061 3709 1 6 . 1 1 29 29 VAL C C 29 175.023 175.023 175.738 -0.715 25061 3710 1 6 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.715 -1.163 25061 3711 1 6 . 1 1 29 29 VAL CB C 29 32.147 32.147 32.368 -0.221 25061 3712 1 6 . 1 1 29 29 VAL H H 29 7.428 7.428 7.743 -0.315 25061 3713 1 6 . 1 1 30 30 LYS N N 30 127.345 127.345 129.184 -1.839 25061 3714 1 6 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.329 0.150 25061 3715 1 6 . 1 1 30 30 LYS C C 30 174.777 174.777 175.622 -0.845 25061 3716 1 6 . 1 1 30 30 LYS CA C 30 55.204 55.204 54.962 0.242 25061 3717 1 6 . 1 1 30 30 LYS CB C 30 31.949 31.949 31.050 0.899 25061 3718 1 6 . 1 1 30 30 LYS H H 30 8.457 8.457 8.522 -0.065 25061 3719 1 6 . 1 1 31 31 THR N N 31 113.552 113.552 118.320 -4.768 25061 3720 1 6 . 1 1 31 31 THR HA H 31 5.723 5.723 4.773 0.950 25061 3721 1 6 . 1 1 31 31 THR C C 31 174.593 174.593 174.653 -0.060 25061 3722 1 6 . 1 1 31 31 THR CA C 31 59.030 59.030 61.581 -2.551 25061 3723 1 6 . 1 1 31 31 THR CB C 31 72.206 72.206 68.849 3.357 25061 3724 1 6 . 1 1 31 31 THR H H 31 8.164 8.164 8.050 0.114 25061 3725 1 6 . 1 1 32 32 VAL N N 32 119.206 119.206 127.875 -8.669 25061 3726 1 6 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.357 0.048 25061 3727 1 6 . 1 1 32 32 VAL C C 32 172.663 172.663 174.437 -1.774 25061 3728 1 6 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.900 -0.828 25061 3729 1 6 . 1 1 32 32 VAL CB C 32 35.051 35.051 34.662 0.389 25061 3730 1 6 . 1 1 32 32 VAL H H 32 8.615 8.615 8.875 -0.260 25061 3731 1 6 . 1 1 33 33 ARG N N 33 130.278 130.278 129.673 0.605 25061 3732 1 6 . 1 1 33 33 ARG HA H 33 5.331 5.331 5.044 0.287 25061 3733 1 6 . 1 1 33 33 ARG C C 33 173.836 173.836 175.661 -1.825 25061 3734 1 6 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.629 -1.479 25061 3735 1 6 . 1 1 33 33 ARG CB C 33 30.028 30.028 30.756 -0.728 25061 3736 1 6 . 1 1 33 33 ARG H H 33 8.996 8.996 8.757 0.239 25061 3737 1 6 . 1 1 34 34 THR N N 34 121.695 121.695 121.595 0.100 25061 3738 1 6 . 1 1 34 34 THR HA H 34 4.483 4.483 4.564 -0.081 25061 3739 1 6 . 1 1 34 34 THR C C 34 169.769 169.769 173.687 -3.918 25061 3740 1 6 . 1 1 34 34 THR CA C 34 60.814 60.814 61.560 -0.747 25061 3741 1 6 . 1 1 34 34 THR CB C 34 67.402 67.402 71.016 -3.614 25061 3742 1 6 . 1 1 34 34 THR H H 34 8.126 8.126 8.171 -0.045 25061 3743 1 6 . 1 1 35 35 ASP N N 35 122.198 122.198 123.463 -1.265 25061 3744 1 6 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.124 0.700 25061 3745 1 6 . 1 1 35 35 ASP C C 35 174.790 174.790 175.573 -0.783 25061 3746 1 6 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.587 -1.202 25061 3747 1 6 . 1 1 35 35 ASP CB C 35 41.848 41.848 40.649 1.199 25061 3748 1 6 . 1 1 35 35 ASP H H 35 7.983 7.983 8.383 -0.400 25061 3749 1 6 . 1 1 36 36 ASP N N 36 121.091 121.091 122.325 -1.234 25061 3750 1 6 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.399 0.194 25061 3751 1 6 . 1 1 36 36 ASP C C 36 176.189 176.189 176.615 -0.426 25061 3752 1 6 . 1 1 36 36 ASP CA C 36 53.055 53.055 54.863 -1.808 25061 3753 1 6 . 1 1 36 36 ASP CB C 36 42.159 42.159 40.063 2.096 25061 3754 1 6 . 1 1 36 36 ASP H H 36 8.157 8.157 8.180 -0.023 25061 3755 1 6 . 1 1 37 37 LYS N N 37 125.839 125.839 126.413 -0.574 25061 3756 1 6 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.889 -0.167 25061 3757 1 6 . 1 1 37 37 LYS C C 37 176.870 176.870 177.853 -0.983 25061 3758 1 6 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.014 0.390 25061 3759 1 6 . 1 1 37 37 LYS CB C 37 32.394 32.394 31.993 0.401 25061 3760 1 6 . 1 1 37 37 LYS H H 37 8.843 8.843 8.400 0.443 25061 3761 1 6 . 1 1 38 38 GLU N N 38 118.369 118.369 118.732 -0.363 25061 3762 1 6 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.984 0.023 25061 3763 1 6 . 1 1 38 38 GLU C C 38 179.502 179.502 178.517 0.985 25061 3764 1 6 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.864 -0.195 25061 3765 1 6 . 1 1 38 38 GLU CB C 38 28.474 28.474 28.419 0.055 25061 3766 1 6 . 1 1 38 38 GLU H H 38 8.182 8.182 8.834 -0.652 25061 3767 1 6 . 1 1 39 39 LYS N N 39 121.722 121.722 120.669 1.053 25061 3768 1 6 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.326 -0.161 25061 3769 1 6 . 1 1 39 39 LYS C C 39 178.500 178.500 178.764 -0.264 25061 3770 1 6 . 1 1 39 39 LYS CA C 39 57.736 57.736 58.692 -0.956 25061 3771 1 6 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.212 -1.074 25061 3772 1 6 . 1 1 39 39 LYS H H 39 7.524 7.524 7.833 -0.309 25061 3773 1 6 . 1 1 40 40 VAL N N 40 117.199 117.199 119.187 -1.988 25061 3774 1 6 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.557 -0.329 25061 3775 1 6 . 1 1 40 40 VAL C C 40 177.362 177.362 177.879 -0.517 25061 3776 1 6 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.657 0.985 25061 3777 1 6 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.417 -0.514 25061 3778 1 6 . 1 1 40 40 VAL H H 40 7.883 7.883 7.904 -0.021 25061 3779 1 6 . 1 1 41 41 LYS N N 41 117.677 117.677 118.409 -0.732 25061 3780 1 6 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.905 -0.463 25061 3781 1 6 . 1 1 41 41 LYS C C 41 177.686 177.686 178.780 -1.094 25061 3782 1 6 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.615 1.194 25061 3783 1 6 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.517 0.098 25061 3784 1 6 . 1 1 41 41 LYS H H 41 7.567 7.567 7.508 0.059 25061 3785 1 6 . 1 1 42 42 GLU N N 42 118.369 118.369 119.344 -0.975 25061 3786 1 6 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.045 -0.038 25061 3787 1 6 . 1 1 42 42 GLU C C 42 179.725 179.725 178.944 0.781 25061 3788 1 6 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.401 -0.332 25061 3789 1 6 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.473 0.066 25061 3790 1 6 . 1 1 42 42 GLU H H 42 7.634 7.634 7.536 0.098 25061 3791 1 6 . 1 1 43 43 GLU N N 43 117.906 117.906 118.990 -1.084 25061 3792 1 6 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.188 -0.005 25061 3793 1 6 . 1 1 43 43 GLU C C 43 179.757 179.757 179.098 0.659 25061 3794 1 6 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.198 0.168 25061 3795 1 6 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.188 -0.347 25061 3796 1 6 . 1 1 43 43 GLU H H 43 8.162 8.162 8.188 -0.026 25061 3797 1 6 . 1 1 44 44 ILE N N 44 122.291 122.291 121.695 0.596 25061 3798 1 6 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.603 0.009 25061 3799 1 6 . 1 1 44 44 ILE C C 44 177.101 177.101 177.524 -0.423 25061 3800 1 6 . 1 1 44 44 ILE CA C 44 66.355 66.355 66.055 0.300 25061 3801 1 6 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.947 -0.487 25061 3802 1 6 . 1 1 44 44 ILE H H 44 8.742 8.742 8.172 0.570 25061 3803 1 6 . 1 1 45 45 GLU N N 45 119.892 119.892 119.728 0.164 25061 3804 1 6 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.059 -0.001 25061 3805 1 6 . 1 1 45 45 GLU C C 45 178.991 178.991 179.434 -0.443 25061 3806 1 6 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.723 -0.058 25061 3807 1 6 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.253 -0.092 25061 3808 1 6 . 1 1 45 45 GLU H H 45 8.171 8.171 7.820 0.351 25061 3809 1 6 . 1 1 46 46 LYS N N 46 118.064 118.064 118.476 -0.412 25061 3810 1 6 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.068 -0.086 25061 3811 1 6 . 1 1 46 46 LYS C C 46 178.837 178.837 178.876 -0.039 25061 3812 1 6 . 1 1 46 46 LYS CA C 46 59.741 59.741 58.684 1.057 25061 3813 1 6 . 1 1 46 46 LYS CB C 46 32.443 32.443 31.850 0.593 25061 3814 1 6 . 1 1 46 46 LYS H H 46 7.785 7.785 7.623 0.162 25061 3815 1 6 . 1 1 47 47 ALA N N 47 121.817 121.817 122.071 -0.254 25061 3816 1 6 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.033 -0.002 25061 3817 1 6 . 1 1 47 47 ALA C C 47 179.859 179.859 179.703 0.156 25061 3818 1 6 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.309 -0.014 25061 3819 1 6 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.584 -0.928 25061 3820 1 6 . 1 1 47 47 ALA H H 47 8.123 8.123 8.073 0.050 25061 3821 1 6 . 1 1 48 48 ARG N N 48 119.080 119.080 118.429 0.651 25061 3822 1 6 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.127 -0.038 25061 3823 1 6 . 1 1 48 48 ARG C C 48 180.155 180.155 178.384 1.771 25061 3824 1 6 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.360 0.837 25061 3825 1 6 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.413 0.097 25061 3826 1 6 . 1 1 48 48 ARG H H 48 8.768 8.768 8.168 0.600 25061 3827 1 6 . 1 1 49 49 LYS N N 49 119.951 119.951 118.320 1.631 25061 3828 1 6 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.177 -0.138 25061 3829 1 6 . 1 1 49 49 LYS C C 49 178.288 178.288 178.050 0.238 25061 3830 1 6 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.015 0.822 25061 3831 1 6 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.370 -0.227 25061 3832 1 6 . 1 1 49 49 LYS H H 49 8.037 8.037 7.623 0.414 25061 3833 1 6 . 1 1 50 50 GLN N N 50 115.284 115.284 116.103 -0.819 25061 3834 1 6 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.469 -0.127 25061 3835 1 6 . 1 1 50 50 GLN C C 50 176.180 176.180 176.065 0.115 25061 3836 1 6 . 1 1 50 50 GLN CA C 50 55.741 55.741 54.921 0.820 25061 3837 1 6 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.370 0.195 25061 3838 1 6 . 1 1 50 50 GLN H H 50 7.740 7.740 7.904 -0.164 25061 3839 1 6 . 1 1 51 51 GLY N N 51 109.725 109.725 108.071 1.654 25061 3840 1 6 . 1 1 51 51 GLY C C 51 174.552 174.552 174.037 0.515 25061 3841 1 6 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.696 0.667 25061 3842 1 6 . 1 1 51 51 GLY H H 51 8.027 8.027 7.424 0.603 25061 3843 1 6 . 1 1 52 52 ARG N N 52 119.064 119.064 119.315 -0.251 25061 3844 1 6 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.746 0.151 25061 3845 1 6 . 1 1 52 52 ARG C C 52 173.123 173.123 173.610 -0.487 25061 3846 1 6 . 1 1 52 52 ARG CA C 52 52.247 52.247 52.684 -0.438 25061 3847 1 6 . 1 1 52 52 ARG CB C 52 32.366 32.366 32.315 0.051 25061 3848 1 6 . 1 1 52 52 ARG H H 52 7.969 7.969 8.132 -0.163 25061 3849 1 6 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.632 0.223 25061 3850 1 6 . 1 1 53 53 PRO C C 53 174.069 174.069 175.579 -1.510 25061 3851 1 6 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.653 -0.835 25061 3852 1 6 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.514 -0.454 25061 3853 1 6 . 1 1 54 54 ILE N N 54 116.301 116.301 122.488 -6.187 25061 3854 1 6 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.872 0.366 25061 3855 1 6 . 1 1 54 54 ILE C C 54 171.709 171.709 173.721 -2.012 25061 3856 1 6 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.239 -1.465 25061 3857 1 6 . 1 1 54 54 ILE CB C 54 41.558 41.558 41.632 -0.074 25061 3858 1 6 . 1 1 54 54 ILE H H 54 7.920 7.920 7.797 0.123 25061 3859 1 6 . 1 1 55 55 VAL N N 55 126.302 126.302 129.601 -3.299 25061 3860 1 6 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.082 -0.158 25061 3861 1 6 . 1 1 55 55 VAL C C 55 173.624 173.624 174.851 -1.227 25061 3862 1 6 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.589 -0.794 25061 3863 1 6 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.828 -0.000 25061 3864 1 6 . 1 1 55 55 VAL H H 55 8.652 8.652 8.930 -0.278 25061 3865 1 6 . 1 1 56 56 ILE N N 56 127.503 127.503 128.344 -0.841 25061 3866 1 6 . 1 1 56 56 ILE HA H 56 4.664 4.664 5.022 -0.358 25061 3867 1 6 . 1 1 56 56 ILE C C 56 173.479 173.479 175.473 -1.994 25061 3868 1 6 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.411 0.596 25061 3869 1 6 . 1 1 56 56 ILE CB C 56 40.285 40.285 37.539 2.746 25061 3870 1 6 . 1 1 56 56 ILE H H 56 9.124 9.124 8.120 1.004 25061 3871 1 6 . 1 1 57 57 PHE N N 57 125.302 125.302 128.704 -3.402 25061 3872 1 6 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.387 -0.171 25061 3873 1 6 . 1 1 57 57 PHE C C 57 174.536 174.536 176.047 -1.511 25061 3874 1 6 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.364 -0.403 25061 3875 1 6 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.248 1.181 25061 3876 1 6 . 1 1 57 57 PHE H H 57 8.971 8.971 8.646 0.325 25061 3877 1 6 . 1 1 58 58 ILE N N 58 126.472 126.472 119.088 7.384 25061 3878 1 6 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.904 -0.389 25061 3879 1 6 . 1 1 58 58 ILE C C 58 173.391 173.391 173.749 -0.358 25061 3880 1 6 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.226 -0.136 25061 3881 1 6 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.759 -1.017 25061 3882 1 6 . 1 1 58 58 ILE H H 58 9.248 9.248 8.825 0.423 25061 3883 1 6 . 1 1 59 59 ARG N N 59 124.681 124.681 121.188 3.493 25061 3884 1 6 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.437 -0.508 25061 3885 1 6 . 1 1 59 59 ARG C C 59 178.521 178.521 177.142 1.379 25061 3886 1 6 . 1 1 59 59 ARG CA C 59 55.742 55.742 54.544 1.198 25061 3887 1 6 . 1 1 59 59 ARG CB C 59 30.918 30.918 33.675 -2.757 25061 3888 1 6 . 1 1 59 59 ARG H H 59 8.587 8.587 8.918 -0.331 25061 3889 1 6 . 1 1 60 60 GLY N N 60 108.848 108.848 116.552 -7.704 25061 3890 1 6 . 1 1 60 60 GLY C C 60 174.775 174.775 174.652 0.123 25061 3891 1 6 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.225 -0.258 25061 3892 1 6 . 1 1 60 60 GLY H H 60 7.732 7.732 8.610 -0.878 25061 3893 1 6 . 1 1 61 61 ALA N N 61 120.877 120.877 126.407 -5.530 25061 3894 1 6 . 1 1 61 61 ALA HA H 61 4.144 4.144 4.165 -0.021 25061 3895 1 6 . 1 1 61 61 ALA C C 61 177.769 177.769 179.324 -1.555 25061 3896 1 6 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.739 -0.290 25061 3897 1 6 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.469 -0.098 25061 3898 1 6 . 1 1 61 61 ALA H H 61 7.852 7.852 7.635 0.217 25061 3899 1 6 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.374 0.426 25061 3900 1 6 . 1 1 62 62 TYR CA C 62 63.039 63.039 57.816 5.223 25061 3901 1 6 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.666 -0.226 25061 3902 1 6 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.967 -0.282 25061 3903 1 6 . 1 1 63 63 GLU C C 63 176.251 176.251 178.132 -1.881 25061 3904 1 6 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.733 -0.476 25061 3905 1 6 . 1 1 63 63 GLU CB C 63 29.412 29.412 28.925 0.487 25061 3906 1 6 . 1 1 64 64 GLU N N 64 119.209 119.209 118.436 0.773 25061 3907 1 6 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.121 0.780 25061 3908 1 6 . 1 1 64 64 GLU C C 64 178.251 178.251 178.693 -0.442 25061 3909 1 6 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.269 0.943 25061 3910 1 6 . 1 1 64 64 GLU CB C 64 28.645 28.645 28.228 0.417 25061 3911 1 6 . 1 1 64 64 GLU H H 64 8.878 8.878 8.026 0.852 25061 3912 1 6 . 1 1 65 65 VAL N N 65 116.728 116.728 120.034 -3.306 25061 3913 1 6 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.697 0.285 25061 3914 1 6 . 1 1 65 65 VAL C C 65 176.915 176.915 177.566 -0.651 25061 3915 1 6 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.564 -0.955 25061 3916 1 6 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.494 0.401 25061 3917 1 6 . 1 1 65 65 VAL H H 65 7.652 7.652 7.535 0.117 25061 3918 1 6 . 1 1 66 66 VAL N N 66 119.462 119.462 119.496 -0.034 25061 3919 1 6 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.612 -0.298 25061 3920 1 6 . 1 1 66 66 VAL C C 66 177.142 177.142 177.686 -0.544 25061 3921 1 6 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.609 0.726 25061 3922 1 6 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.461 -0.031 25061 3923 1 6 . 1 1 66 66 VAL H H 66 7.896 7.896 7.681 0.215 25061 3924 1 6 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.045 -0.417 25061 3925 1 6 . 1 1 67 67 ARG C C 67 177.841 177.841 178.166 -0.325 25061 3926 1 6 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.377 0.675 25061 3927 1 6 . 1 1 67 67 ARG CB C 67 29.393 29.393 29.996 -0.603 25061 3928 1 6 . 1 1 68 68 ASP N N 68 118.316 118.316 120.068 -1.752 25061 3929 1 6 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.547 -0.186 25061 3930 1 6 . 1 1 68 68 ASP C C 68 178.945 178.945 178.442 0.503 25061 3931 1 6 . 1 1 68 68 ASP CA C 68 57.311 57.311 56.929 0.382 25061 3932 1 6 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.829 0.685 25061 3933 1 6 . 1 1 68 68 ASP H H 68 7.625 7.625 7.808 -0.183 25061 3934 1 6 . 1 1 69 69 ILE N N 69 119.231 119.231 120.418 -1.187 25061 3935 1 6 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.730 -0.100 25061 3936 1 6 . 1 1 69 69 ILE C C 69 177.138 177.138 177.854 -0.716 25061 3937 1 6 . 1 1 69 69 ILE CA C 69 64.540 64.540 65.220 -0.680 25061 3938 1 6 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.985 -0.935 25061 3939 1 6 . 1 1 69 69 ILE H H 69 8.113 8.113 7.843 0.270 25061 3940 1 6 . 1 1 70 70 VAL N N 70 120.164 120.164 120.134 0.030 25061 3941 1 6 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.501 -0.084 25061 3942 1 6 . 1 1 70 70 VAL C C 70 177.079 177.079 177.588 -0.509 25061 3943 1 6 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.588 -0.314 25061 3944 1 6 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.236 0.022 25061 3945 1 6 . 1 1 70 70 VAL H H 70 8.478 8.478 8.055 0.423 25061 3946 1 6 . 1 1 71 71 GLU N N 71 118.293 118.293 119.779 -1.486 25061 3947 1 6 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.911 0.143 25061 3948 1 6 . 1 1 71 71 GLU C C 71 179.009 179.009 178.623 0.386 25061 3949 1 6 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.658 -0.242 25061 3950 1 6 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.537 -0.715 25061 3951 1 6 . 1 1 71 71 GLU H H 71 8.152 8.152 7.743 0.409 25061 3952 1 6 . 1 1 72 72 TYR N N 72 120.091 120.091 120.273 -0.182 25061 3953 1 6 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.121 0.041 25061 3954 1 6 . 1 1 72 72 TYR C C 72 176.404 176.404 177.384 -0.980 25061 3955 1 6 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.304 -0.172 25061 3956 1 6 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.451 -0.314 25061 3957 1 6 . 1 1 72 72 TYR H H 72 7.959 7.959 7.552 0.407 25061 3958 1 6 . 1 1 73 73 ALA N N 73 120.133 120.133 120.652 -0.519 25061 3959 1 6 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.859 -0.229 25061 3960 1 6 . 1 1 73 73 ALA C C 73 179.182 179.182 179.550 -0.368 25061 3961 1 6 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.138 -0.026 25061 3962 1 6 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.300 -0.109 25061 3963 1 6 . 1 1 73 73 ALA H H 73 8.604 8.604 8.241 0.363 25061 3964 1 6 . 1 1 74 74 GLN N N 74 115.553 115.553 116.974 -1.421 25061 3965 1 6 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.004 0.134 25061 3966 1 6 . 1 1 74 74 GLN C C 74 180.595 180.595 178.617 1.978 25061 3967 1 6 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.327 0.768 25061 3968 1 6 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.753 -0.178 25061 3969 1 6 . 1 1 74 74 GLN H H 74 8.619 8.619 8.183 0.436 25061 3970 1 6 . 1 1 75 75 LYS N N 75 122.396 122.396 118.686 3.710 25061 3971 1 6 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.081 -0.053 25061 3972 1 6 . 1 1 75 75 LYS C C 75 178.521 178.521 178.354 0.167 25061 3973 1 6 . 1 1 75 75 LYS CA C 75 59.058 59.058 57.926 1.132 25061 3974 1 6 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.805 -0.206 25061 3975 1 6 . 1 1 75 75 LYS H H 75 8.123 8.123 7.480 0.643 25061 3976 1 6 . 1 1 76 76 GLU N N 76 116.294 116.294 116.251 0.043 25061 3977 1 6 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.287 -0.188 25061 3978 1 6 . 1 1 76 76 GLU C C 76 175.957 175.957 176.554 -0.597 25061 3979 1 6 . 1 1 76 76 GLU CA C 76 55.605 55.605 55.732 -0.127 25061 3980 1 6 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.749 0.075 25061 3981 1 6 . 1 1 76 76 GLU H H 76 7.450 7.450 7.505 -0.055 25061 3982 1 6 . 1 1 77 77 GLY N N 77 107.446 107.446 107.923 -0.477 25061 3983 1 6 . 1 1 77 77 GLY C C 77 174.520 174.520 174.472 0.048 25061 3984 1 6 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.764 0.043 25061 3985 1 6 . 1 1 77 77 GLY H H 77 7.763 7.763 7.221 0.542 25061 3986 1 6 . 1 1 78 78 LEU N N 78 120.179 120.179 119.193 0.986 25061 3987 1 6 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.452 -0.064 25061 3988 1 6 . 1 1 78 78 LEU C C 78 175.914 175.914 175.824 0.090 25061 3989 1 6 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.693 -0.221 25061 3990 1 6 . 1 1 78 78 LEU CB C 78 41.889 41.889 43.201 -1.312 25061 3991 1 6 . 1 1 78 78 LEU H H 78 7.930 7.930 7.978 -0.048 25061 3992 1 6 . 1 1 79 79 ARG N N 79 122.207 122.207 121.317 0.890 25061 3993 1 6 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.648 -0.251 25061 3994 1 6 . 1 1 79 79 ARG C C 79 174.960 174.960 173.955 1.005 25061 3995 1 6 . 1 1 79 79 ARG CA C 79 55.648 55.648 54.997 0.651 25061 3996 1 6 . 1 1 79 79 ARG CB C 79 30.476 30.476 32.616 -2.140 25061 3997 1 6 . 1 1 79 79 ARG H H 79 8.241 8.241 8.402 -0.161 25061 3998 1 6 . 1 1 80 80 VAL N N 80 123.333 123.333 126.688 -3.355 25061 3999 1 6 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.425 0.870 25061 4000 1 6 . 1 1 80 80 VAL C C 80 174.048 174.048 173.646 0.402 25061 4001 1 6 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.626 -1.585 25061 4002 1 6 . 1 1 80 80 VAL CB C 80 34.305 34.305 33.154 1.151 25061 4003 1 6 . 1 1 80 80 VAL H H 80 8.359 8.359 8.573 -0.214 25061 4004 1 6 . 1 1 81 81 LEU N N 81 128.719 128.719 129.824 -1.105 25061 4005 1 6 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.330 -0.226 25061 4006 1 6 . 1 1 81 81 LEU C C 81 174.484 174.484 174.405 0.079 25061 4007 1 6 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.838 0.282 25061 4008 1 6 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.862 -0.907 25061 4009 1 6 . 1 1 81 81 LEU H H 81 8.650 8.650 8.788 -0.138 25061 4010 1 6 . 1 1 82 82 VAL N N 82 122.487 122.487 128.100 -5.613 25061 4011 1 6 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.566 0.531 25061 4012 1 6 . 1 1 82 82 VAL C C 82 174.525 174.525 174.012 0.513 25061 4013 1 6 . 1 1 82 82 VAL CA C 82 60.285 60.285 60.546 -0.261 25061 4014 1 6 . 1 1 82 82 VAL CB C 82 34.789 34.789 33.068 1.721 25061 4015 1 6 . 1 1 82 82 VAL H H 82 8.781 8.781 8.244 0.537 25061 4016 1 6 . 1 1 83 83 ILE N N 83 128.082 128.082 130.482 -2.400 25061 4017 1 6 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.847 0.083 25061 4018 1 6 . 1 1 83 83 ILE C C 83 172.925 172.925 174.543 -1.618 25061 4019 1 6 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.354 -0.413 25061 4020 1 6 . 1 1 83 83 ILE CB C 83 40.186 40.186 37.576 2.610 25061 4021 1 6 . 1 1 83 83 ILE H H 83 9.527 9.527 8.457 1.070 25061 4022 1 6 . 1 1 84 84 LYS N N 84 128.493 128.493 126.268 2.225 25061 4023 1 6 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.402 -0.354 25061 4024 1 6 . 1 1 84 84 LYS C C 84 174.027 174.027 175.379 -1.352 25061 4025 1 6 . 1 1 84 84 LYS CA C 84 53.253 53.253 53.932 -0.679 25061 4026 1 6 . 1 1 84 84 LYS CB C 84 34.652 34.652 36.671 -2.019 25061 4027 1 6 . 1 1 84 84 LYS H H 84 8.721 8.721 8.965 -0.244 25061 4028 1 6 . 1 1 85 85 VAL N N 85 126.729 126.729 122.768 3.961 25061 4029 1 6 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.155 0.581 25061 4030 1 6 . 1 1 85 85 VAL C C 85 175.935 175.935 176.014 -0.079 25061 4031 1 6 . 1 1 85 85 VAL CA C 85 60.200 60.200 61.871 -1.671 25061 4032 1 6 . 1 1 85 85 VAL CB C 85 30.847 30.847 31.791 -0.944 25061 4033 1 6 . 1 1 85 85 VAL H H 85 8.643 8.643 7.989 0.654 25061 4034 1 6 . 1 1 86 86 ALA N N 86 132.930 132.930 131.654 1.276 25061 4035 1 6 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.249 0.181 25061 4036 1 6 . 1 1 86 86 ALA C C 86 175.635 175.635 177.189 -1.554 25061 4037 1 6 . 1 1 86 86 ALA CA C 86 51.504 51.504 52.202 -0.698 25061 4038 1 6 . 1 1 86 86 ALA CB C 86 20.821 20.821 17.982 2.839 25061 4039 1 6 . 1 1 86 86 ALA H H 86 8.835 8.835 8.730 0.105 25061 4040 1 6 . 1 1 87 87 GLN N N 87 118.719 118.719 123.965 -5.246 25061 4041 1 6 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.144 0.325 25061 4042 1 6 . 1 1 87 87 GLN C C 87 175.949 175.949 177.011 -1.062 25061 4043 1 6 . 1 1 87 87 GLN CA C 87 55.260 55.260 57.688 -2.428 25061 4044 1 6 . 1 1 87 87 GLN CB C 87 30.432 30.432 28.863 1.569 25061 4045 1 6 . 1 1 87 87 GLN H H 87 8.570 8.570 8.239 0.331 25061 4046 1 6 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.479 0.001 25061 4047 1 6 . 1 1 88 88 ASP CA C 88 55.454 55.454 55.711 -0.257 25061 4048 1 6 . 1 1 88 88 ASP CB C 88 41.204 41.204 40.907 0.297 25061 4049 1 6 . 1 1 89 89 GLN HA H 89 4.047 4.047 3.736 0.311 25061 4050 1 6 . 1 1 89 89 GLN CA C 89 56.687 56.687 58.449 -1.762 25061 4051 1 6 . 1 1 89 89 GLN CB C 89 27.850 27.850 26.746 1.104 25061 4052 1 6 . 1 1 92 92 LEU N N 92 125.291 125.291 119.030 6.261 25061 4053 1 6 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.133 0.068 25061 4054 1 6 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.117 -2.060 25061 4055 1 6 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.769 0.277 25061 4056 1 6 . 1 1 92 92 LEU H H 92 8.277 8.277 7.448 0.829 25061 4057 1 6 . 1 1 93 93 GLU CB C 93 29.756 29.756 28.870 0.886 25061 4058 1 6 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.147 -0.098 25061 4059 1 6 . 1 1 94 94 ARG C C 94 178.544 178.544 178.259 0.285 25061 4060 1 6 . 1 1 94 94 ARG CA C 94 58.607 58.607 58.798 -0.192 25061 4061 1 6 . 1 1 94 94 ARG CB C 94 29.614 29.614 29.782 -0.168 25061 4062 1 6 . 1 1 95 95 PHE N N 95 117.407 117.407 118.915 -1.508 25061 4063 1 6 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.373 0.002 25061 4064 1 6 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.304 -0.073 25061 4065 1 6 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.429 -1.487 25061 4066 1 6 . 1 1 95 95 PHE H H 95 8.419 8.419 7.687 0.732 25061 4067 1 6 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.946 -0.138 25061 4068 1 6 . 1 1 96 96 TYR C C 96 177.728 177.728 177.339 0.389 25061 4069 1 6 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.571 1.585 25061 4070 1 6 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.447 -0.747 25061 4071 1 6 . 1 1 97 97 GLU N N 97 119.054 119.054 117.527 1.527 25061 4072 1 6 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.606 0.457 25061 4073 1 6 . 1 1 97 97 GLU C C 97 179.071 179.071 178.481 0.590 25061 4074 1 6 . 1 1 97 97 GLU CA C 97 58.760 58.760 58.698 0.062 25061 4075 1 6 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.391 -0.219 25061 4076 1 6 . 1 1 97 97 GLU H H 97 7.858 7.858 7.962 -0.104 25061 4077 1 6 . 1 1 98 98 GLN N N 98 119.385 119.385 119.818 -0.433 25061 4078 1 6 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.957 -0.056 25061 4079 1 6 . 1 1 98 98 GLN C C 98 177.599 177.599 178.325 -0.726 25061 4080 1 6 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.409 -0.098 25061 4081 1 6 . 1 1 98 98 GLN CB C 98 27.766 27.766 27.916 -0.150 25061 4082 1 6 . 1 1 98 98 GLN H H 98 7.747 7.747 7.413 0.334 25061 4083 1 6 . 1 1 99 99 LEU N N 99 118.348 118.348 118.043 0.305 25061 4084 1 6 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.882 0.137 25061 4085 1 6 . 1 1 99 99 LEU C C 99 178.669 178.669 179.074 -0.405 25061 4086 1 6 . 1 1 99 99 LEU CA C 99 57.430 57.430 58.283 -0.853 25061 4087 1 6 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.362 0.141 25061 4088 1 6 . 1 1 99 99 LEU H H 99 7.891 7.891 7.347 0.544 25061 4089 1 6 . 1 1 100 100 LYS N N 100 118.332 118.332 118.648 -0.316 25061 4090 1 6 . 1 1 100 100 LYS HA H 100 4.509 4.509 4.110 0.399 25061 4091 1 6 . 1 1 100 100 LYS C C 100 180.846 180.846 179.167 1.679 25061 4092 1 6 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.926 0.162 25061 4093 1 6 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.995 0.274 25061 4094 1 6 . 1 1 100 100 LYS H H 100 7.560 7.560 7.252 0.308 25061 4095 1 6 . 1 1 101 101 LYS N N 101 121.944 121.944 119.109 2.835 25061 4096 1 6 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.053 0.019 25061 4097 1 6 . 1 1 101 101 LYS C C 101 177.707 177.707 178.332 -0.625 25061 4098 1 6 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.656 0.215 25061 4099 1 6 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.330 -0.235 25061 4100 1 6 . 1 1 101 101 LYS H H 101 7.959 7.959 7.583 0.376 25061 4101 1 6 . 1 1 102 102 ASP N N 102 118.788 118.788 116.746 2.042 25061 4102 1 6 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.526 0.168 25061 4103 1 6 . 1 1 102 102 ASP C C 102 176.359 176.359 176.905 -0.546 25061 4104 1 6 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.215 -0.636 25061 4105 1 6 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.537 -0.963 25061 4106 1 6 . 1 1 102 102 ASP H H 102 7.893 7.893 7.636 0.257 25061 4107 1 6 . 1 1 103 103 GLY N N 103 107.024 107.024 108.464 -1.440 25061 4108 1 6 . 1 1 103 103 GLY C C 103 174.328 174.328 173.047 1.281 25061 4109 1 6 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.998 0.346 25061 4110 1 6 . 1 1 103 103 GLY H H 103 7.866 7.866 7.814 0.052 25061 4111 1 6 . 1 1 104 104 VAL N N 104 123.060 123.060 118.492 4.568 25061 4112 1 6 . 1 1 104 104 VAL HA H 104 3.973 3.973 4.248 -0.275 25061 4113 1 6 . 1 1 104 104 VAL C C 104 175.023 175.023 174.124 0.899 25061 4114 1 6 . 1 1 104 104 VAL CA C 104 61.878 61.878 60.916 0.961 25061 4115 1 6 . 1 1 104 104 VAL CB C 104 32.088 32.088 34.608 -2.521 25061 4116 1 6 . 1 1 104 104 VAL H H 104 7.955 7.955 7.569 0.386 25061 4117 1 6 . 1 1 105 105 ASP N N 105 127.987 127.987 126.676 1.311 25061 4118 1 6 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.751 -0.176 25061 4119 1 6 . 1 1 105 105 ASP C C 105 173.624 173.624 174.627 -1.003 25061 4120 1 6 . 1 1 105 105 ASP CA C 105 54.087 54.087 53.913 0.174 25061 4121 1 6 . 1 1 105 105 ASP CB C 105 40.660 40.660 42.999 -2.339 25061 4122 1 6 . 1 1 105 105 ASP H H 105 8.399 8.399 8.138 0.261 25061 4123 1 6 . 1 1 106 106 VAL N N 106 125.798 125.798 117.734 8.064 25061 4124 1 6 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.851 -0.036 25061 4125 1 6 . 1 1 106 106 VAL C C 106 174.902 174.902 174.640 0.262 25061 4126 1 6 . 1 1 106 106 VAL CA C 106 60.194 60.194 60.021 0.173 25061 4127 1 6 . 1 1 106 106 VAL CB C 106 34.179 34.179 35.271 -1.092 25061 4128 1 6 . 1 1 106 106 VAL H H 106 7.550 7.550 7.944 -0.394 25061 4129 1 6 . 1 1 107 107 ARG N N 107 128.099 128.099 125.813 2.286 25061 4130 1 6 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.793 0.083 25061 4131 1 6 . 1 1 107 107 ARG C C 107 173.815 173.815 174.725 -0.910 25061 4132 1 6 . 1 1 107 107 ARG CA C 107 53.386 53.386 54.786 -1.400 25061 4133 1 6 . 1 1 107 107 ARG CB C 107 31.195 31.195 32.087 -0.892 25061 4134 1 6 . 1 1 107 107 ARG H H 107 9.132 9.132 8.806 0.326 25061 4135 1 6 . 1 1 108 108 VAL N N 108 123.979 123.979 123.164 0.815 25061 4136 1 6 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.471 -0.529 25061 4137 1 6 . 1 1 108 108 VAL C C 108 175.854 175.854 176.404 -0.550 25061 4138 1 6 . 1 1 108 108 VAL CA C 108 60.017 60.017 59.250 0.767 25061 4139 1 6 . 1 1 108 108 VAL CB C 108 32.844 32.844 33.340 -0.496 25061 4140 1 6 . 1 1 108 108 VAL H H 108 8.561 8.561 8.576 -0.015 25061 4141 1 6 . 1 1 109 109 THR N N 109 120.144 120.144 115.406 4.738 25061 4142 1 6 . 1 1 109 109 THR HA H 109 4.815 4.815 4.505 0.310 25061 4143 1 6 . 1 1 109 109 THR C C 109 171.867 171.867 175.123 -3.256 25061 4144 1 6 . 1 1 109 109 THR CA C 109 59.613 59.613 61.868 -2.255 25061 4145 1 6 . 1 1 109 109 THR CB C 109 69.720 69.720 70.076 -0.356 25061 4146 1 6 . 1 1 109 109 THR H H 109 8.803 8.803 8.175 0.628 25061 4147 1 6 . 1 1 110 110 ASP N N 110 123.212 123.212 117.763 5.449 25061 4148 1 6 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.311 0.658 25061 4149 1 6 . 1 1 110 110 ASP C C 110 175.739 175.739 174.656 1.083 25061 4150 1 6 . 1 1 110 110 ASP CA C 110 53.243 53.243 55.525 -2.282 25061 4151 1 6 . 1 1 110 110 ASP CB C 110 41.351 41.351 38.706 2.645 25061 4152 1 6 . 1 1 110 110 ASP H H 110 8.363 8.363 8.676 -0.313 25061 4153 1 6 . 1 1 111 111 ASN N N 111 116.298 116.298 115.745 0.553 25061 4154 1 6 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.865 0.011 25061 4155 1 6 . 1 1 111 111 ASN C C 111 174.756 174.756 174.649 0.107 25061 4156 1 6 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.097 0.035 25061 4157 1 6 . 1 1 111 111 ASN CB C 111 40.765 40.765 42.041 -1.276 25061 4158 1 6 . 1 1 111 111 ASN H H 111 8.085 8.085 7.380 0.705 25061 4159 1 6 . 1 1 112 112 GLU HA H 112 3.848 3.848 4.036 -0.188 25061 4160 1 6 . 1 1 112 112 GLU C C 112 177.016 177.016 177.862 -0.846 25061 4161 1 6 . 1 1 112 112 GLU CA C 112 59.480 59.480 60.264 -0.784 25061 4162 1 6 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.729 -0.055 25061 4163 1 6 . 1 1 113 113 ASP N N 113 121.033 121.033 118.930 2.103 25061 4164 1 6 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.420 -0.007 25061 4165 1 6 . 1 1 113 113 ASP C C 113 178.988 178.988 178.172 0.816 25061 4166 1 6 . 1 1 113 113 ASP CA C 113 57.855 57.855 57.878 -0.023 25061 4167 1 6 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.057 0.445 25061 4168 1 6 . 1 1 113 113 ASP H H 113 8.219 8.219 8.745 -0.526 25061 4169 1 6 . 1 1 114 114 GLU N N 114 121.280 121.280 119.568 1.712 25061 4170 1 6 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.169 -0.104 25061 4171 1 6 . 1 1 114 114 GLU C C 114 178.776 178.776 178.410 0.366 25061 4172 1 6 . 1 1 114 114 GLU CA C 114 58.714 58.714 58.765 -0.051 25061 4173 1 6 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.088 0.125 25061 4174 1 6 . 1 1 114 114 GLU H H 114 8.296 8.296 8.738 -0.442 25061 4175 1 6 . 1 1 115 115 ALA N N 115 120.924 120.924 122.698 -1.774 25061 4176 1 6 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.126 -0.288 25061 4177 1 6 . 1 1 115 115 ALA C C 115 178.502 178.502 179.258 -0.756 25061 4178 1 6 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.121 0.517 25061 4179 1 6 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.358 0.139 25061 4180 1 6 . 1 1 115 115 ALA H H 115 7.853 7.853 7.600 0.253 25061 4181 1 6 . 1 1 116 116 LYS N N 116 116.616 116.616 119.522 -2.906 25061 4182 1 6 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.887 -0.168 25061 4183 1 6 . 1 1 116 116 LYS C C 116 178.097 178.097 178.470 -0.373 25061 4184 1 6 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.946 0.806 25061 4185 1 6 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.225 0.330 25061 4186 1 6 . 1 1 116 116 LYS H H 116 8.091 8.091 7.948 0.143 25061 4187 1 6 . 1 1 117 117 LYS N N 117 118.990 118.990 118.212 0.778 25061 4188 1 6 . 1 1 117 117 LYS HA H 117 3.911 3.911 4.070 -0.159 25061 4189 1 6 . 1 1 117 117 LYS C C 117 179.186 179.186 179.026 0.160 25061 4190 1 6 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.148 0.423 25061 4191 1 6 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.321 0.199 25061 4192 1 6 . 1 1 117 117 LYS H H 117 7.742 7.742 7.969 -0.227 25061 4193 1 6 . 1 1 118 118 ARG N N 118 117.441 117.441 119.663 -2.222 25061 4194 1 6 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.191 -0.051 25061 4195 1 6 . 1 1 118 118 ARG C C 118 178.921 178.921 178.855 0.066 25061 4196 1 6 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.836 -1.165 25061 4197 1 6 . 1 1 118 118 ARG CB C 118 29.661 29.661 30.121 -0.460 25061 4198 1 6 . 1 1 118 118 ARG H H 118 8.468 8.468 7.761 0.707 25061 4199 1 6 . 1 1 119 119 LEU N N 119 120.100 120.100 120.936 -0.836 25061 4200 1 6 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.927 0.033 25061 4201 1 6 . 1 1 119 119 LEU C C 119 177.554 177.554 178.427 -0.873 25061 4202 1 6 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.091 -0.210 25061 4203 1 6 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.690 0.200 25061 4204 1 6 . 1 1 119 119 LEU H H 119 8.322 8.322 8.405 -0.083 25061 4205 1 6 . 1 1 120 120 LYS N N 120 118.238 118.238 118.979 -0.741 25061 4206 1 6 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.877 -0.055 25061 4207 1 6 . 1 1 120 120 LYS C C 120 178.703 178.703 178.824 -0.121 25061 4208 1 6 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.825 0.521 25061 4209 1 6 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.206 0.030 25061 4210 1 6 . 1 1 120 120 LYS H H 120 7.990 7.990 7.569 0.421 25061 4211 1 6 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.097 -0.075 25061 4212 1 6 . 1 1 121 121 GLU C C 121 177.769 177.769 179.307 -1.538 25061 4213 1 6 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.044 -0.122 25061 4214 1 6 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.663 -0.209 25061 4215 1 6 . 1 1 122 122 LEU N N 122 119.454 119.454 119.559 -0.105 25061 4216 1 6 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.081 0.052 25061 4217 1 6 . 1 1 122 122 LEU C C 122 178.991 178.991 179.479 -0.488 25061 4218 1 6 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.104 0.222 25061 4219 1 6 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.738 -0.059 25061 4220 1 6 . 1 1 122 122 LEU H H 122 7.930 7.930 8.234 -0.304 25061 4221 1 6 . 1 1 123 123 LEU N N 123 117.862 117.862 119.903 -2.041 25061 4222 1 6 . 1 1 123 123 LEU HA H 123 4.067 4.067 3.994 0.073 25061 4223 1 6 . 1 1 123 123 LEU C C 123 179.178 179.178 179.512 -0.334 25061 4224 1 6 . 1 1 123 123 LEU CA C 123 56.920 56.920 58.526 -1.606 25061 4225 1 6 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.380 -0.170 25061 4226 1 6 . 1 1 123 123 LEU H H 123 8.095 8.095 8.178 -0.083 25061 4227 1 6 . 1 1 124 124 GLU N N 124 118.975 118.975 118.711 0.264 25061 4228 1 6 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.156 -0.027 25061 4229 1 6 . 1 1 124 124 GLU C C 124 177.777 177.777 177.347 0.430 25061 4230 1 6 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.744 -0.657 25061 4231 1 6 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.300 0.239 25061 4232 1 6 . 1 1 124 124 GLU H H 124 7.930 7.930 7.907 0.023 25061 4233 1 6 . 1 1 125 125 LYS N N 125 118.933 118.933 118.563 0.370 25061 4234 1 6 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.338 -0.001 25061 4235 1 6 . 1 1 125 125 LYS C C 125 178.188 178.188 176.258 1.930 25061 4236 1 6 . 1 1 125 125 LYS CA C 125 56.980 56.980 55.757 1.223 25061 4237 1 6 . 1 1 125 125 LYS CB C 125 32.608 32.608 32.465 0.143 25061 4238 1 6 . 1 1 125 125 LYS H H 125 7.729 7.729 7.350 0.379 25061 4239 1 6 . 1 1 126 126 VAL N N 126 117.933 117.933 114.665 3.268 25061 4240 1 6 . 1 1 126 126 VAL HA H 126 4.022 4.022 3.558 0.464 25061 4241 1 6 . 1 1 126 126 VAL C C 126 176.947 176.947 175.428 1.519 25061 4242 1 6 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.322 0.319 25061 4243 1 6 . 1 1 126 126 VAL CB C 126 31.859 31.859 30.080 1.779 25061 4244 1 6 . 1 1 126 126 VAL H H 126 8.044 8.044 7.542 0.502 25061 4245 1 6 . 1 1 127 127 GLY N N 127 109.813 109.813 108.650 1.163 25061 4246 1 6 . 1 1 127 127 GLY C C 127 174.264 174.264 173.550 0.714 25061 4247 1 6 . 1 1 127 127 GLY CA C 127 45.279 45.279 44.572 0.707 25061 4248 1 6 . 1 1 127 127 GLY H H 127 8.279 8.279 8.110 0.169 25061 4249 1 6 . 1 1 128 128 SER N N 128 115.185 115.185 115.227 -0.042 25061 4250 1 6 . 1 1 128 128 SER HA H 128 4.462 4.462 4.097 0.365 25061 4251 1 6 . 1 1 128 128 SER C C 128 174.775 174.775 173.348 1.427 25061 4252 1 6 . 1 1 128 128 SER CA C 128 58.739 58.739 58.837 -0.098 25061 4253 1 6 . 1 1 128 128 SER CB C 128 63.850 63.850 63.290 0.560 25061 4254 1 6 . 1 1 128 128 SER H H 128 8.048 8.048 8.206 -0.158 25061 4255 1 6 . 1 1 129 129 LEU N N 129 123.060 123.060 118.704 4.356 25061 4256 1 6 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.903 -0.605 25061 4257 1 6 . 1 1 129 129 LEU C C 129 177.313 177.313 175.535 1.778 25061 4258 1 6 . 1 1 129 129 LEU CA C 129 55.158 55.158 54.675 0.483 25061 4259 1 6 . 1 1 129 129 LEU CB C 129 41.837 41.837 42.907 -1.070 25061 4260 1 6 . 1 1 129 129 LEU H H 129 8.147 8.147 8.249 -0.102 25061 4261 1 6 . 1 1 130 130 GLU N N 130 120.088 120.088 121.643 -1.555 25061 4262 1 6 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.525 -0.344 25061 4263 1 6 . 1 1 130 130 GLU C C 130 176.148 176.148 176.290 -0.142 25061 4264 1 6 . 1 1 130 130 GLU CA C 130 56.726 56.726 56.600 0.126 25061 4265 1 6 . 1 1 130 130 GLU CB C 130 30.026 30.026 32.378 -2.352 25061 4266 1 6 . 1 1 130 130 GLU H H 130 8.242 8.242 8.305 -0.063 25061 4267 1 7 . 1 1 2 2 GLY CA C 2 45.319 45.319 44.755 0.564 25061 4268 1 7 . 1 1 3 3 THR HA H 3 4.820 4.820 5.159 -0.339 25061 4269 1 7 . 1 1 3 3 THR C C 3 172.374 172.374 173.729 -1.355 25061 4270 1 7 . 1 1 3 3 THR CA C 3 62.760 62.760 61.367 1.393 25061 4271 1 7 . 1 1 3 3 THR CB C 3 71.441 71.441 71.257 0.184 25061 4272 1 7 . 1 1 4 4 VAL N N 4 126.881 126.881 127.402 -0.521 25061 4273 1 7 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.409 0.159 25061 4274 1 7 . 1 1 4 4 VAL C C 4 173.116 173.116 174.824 -1.708 25061 4275 1 7 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.216 -0.761 25061 4276 1 7 . 1 1 4 4 VAL CB C 4 33.800 33.800 31.319 2.481 25061 4277 1 7 . 1 1 4 4 VAL H H 4 9.097 9.097 8.859 0.238 25061 4278 1 7 . 1 1 5 5 VAL N N 5 127.172 127.172 125.079 2.093 25061 4279 1 7 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.459 -0.572 25061 4280 1 7 . 1 1 5 5 VAL C C 5 174.091 174.091 174.635 -0.544 25061 4281 1 7 . 1 1 5 5 VAL CA C 5 60.118 60.118 58.872 1.246 25061 4282 1 7 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.851 -0.916 25061 4283 1 7 . 1 1 5 5 VAL H H 5 8.811 8.811 8.786 0.025 25061 4284 1 7 . 1 1 6 6 ILE N N 6 127.577 127.577 126.949 0.628 25061 4285 1 7 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.518 0.102 25061 4286 1 7 . 1 1 6 6 ILE C C 6 173.328 173.328 174.932 -1.604 25061 4287 1 7 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.862 -0.030 25061 4288 1 7 . 1 1 6 6 ILE CB C 6 39.930 39.930 39.753 0.177 25061 4289 1 7 . 1 1 6 6 ILE H H 6 9.210 9.210 8.674 0.536 25061 4290 1 7 . 1 1 7 7 VAL N N 7 129.024 129.024 129.458 -0.434 25061 4291 1 7 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.600 0.205 25061 4292 1 7 . 1 1 7 7 VAL C C 7 173.561 173.561 174.994 -1.433 25061 4293 1 7 . 1 1 7 7 VAL CA C 7 60.849 60.849 61.776 -0.927 25061 4294 1 7 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.426 0.934 25061 4295 1 7 . 1 1 7 7 VAL H H 7 9.294 9.294 8.453 0.841 25061 4296 1 7 . 1 1 8 8 VAL N N 8 125.318 125.318 127.443 -2.125 25061 4297 1 7 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.467 -0.071 25061 4298 1 7 . 1 1 8 8 VAL C C 8 175.723 175.723 175.461 0.262 25061 4299 1 7 . 1 1 8 8 VAL CA C 8 59.617 59.617 59.544 0.073 25061 4300 1 7 . 1 1 8 8 VAL CB C 8 34.915 34.915 34.830 0.086 25061 4301 1 7 . 1 1 8 8 VAL H H 8 8.898 8.898 8.386 0.512 25061 4302 1 7 . 1 1 9 9 SER N N 9 116.544 116.544 117.174 -0.630 25061 4303 1 7 . 1 1 9 9 SER HA H 9 4.724 4.724 4.790 -0.066 25061 4304 1 7 . 1 1 9 9 SER C C 9 174.552 174.552 173.498 1.054 25061 4305 1 7 . 1 1 9 9 SER CA C 9 57.419 57.419 57.084 0.335 25061 4306 1 7 . 1 1 9 9 SER CB C 9 64.998 64.998 65.478 -0.480 25061 4307 1 7 . 1 1 9 9 SER H H 9 7.833 7.833 8.030 -0.197 25061 4308 1 7 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.726 0.186 25061 4309 1 7 . 1 1 10 10 ASN C C 10 176.170 176.170 174.579 1.591 25061 4310 1 7 . 1 1 10 10 ASN CA C 10 54.141 54.141 54.254 -0.113 25061 4311 1 7 . 1 1 10 10 ASN CB C 10 38.626 38.626 39.053 -0.427 25061 4312 1 7 . 1 1 11 11 ASP N N 11 120.164 120.164 118.866 1.298 25061 4313 1 7 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.830 0.013 25061 4314 1 7 . 1 1 11 11 ASP C C 11 176.148 176.148 176.146 0.002 25061 4315 1 7 . 1 1 11 11 ASP CA C 11 52.620 52.620 52.476 0.144 25061 4316 1 7 . 1 1 11 11 ASP CB C 11 42.631 42.631 43.654 -1.023 25061 4317 1 7 . 1 1 11 11 ASP H H 11 8.142 8.142 7.569 0.573 25061 4318 1 7 . 1 1 12 12 GLU N N 12 127.184 127.184 123.351 3.833 25061 4319 1 7 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.141 -0.288 25061 4320 1 7 . 1 1 12 12 GLU C C 12 177.853 177.853 178.402 -0.549 25061 4321 1 7 . 1 1 12 12 GLU CA C 12 59.547 59.547 59.899 -0.352 25061 4322 1 7 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.933 -0.114 25061 4323 1 7 . 1 1 12 12 GLU H H 12 9.152 9.152 8.813 0.339 25061 4324 1 7 . 1 1 13 13 ARG N N 13 119.026 119.026 118.631 0.395 25061 4325 1 7 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.283 -0.180 25061 4326 1 7 . 1 1 13 13 ARG C C 13 179.151 179.151 178.811 0.340 25061 4327 1 7 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.720 0.223 25061 4328 1 7 . 1 1 13 13 ARG CB C 13 28.757 28.757 29.460 -0.703 25061 4329 1 7 . 1 1 13 13 ARG H H 13 8.389 8.389 7.865 0.524 25061 4330 1 7 . 1 1 14 14 ILE N N 14 119.238 119.238 120.734 -1.496 25061 4331 1 7 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.883 -0.282 25061 4332 1 7 . 1 1 14 14 ILE C C 14 177.905 177.905 177.698 0.207 25061 4333 1 7 . 1 1 14 14 ILE CA C 14 64.666 64.666 63.082 1.584 25061 4334 1 7 . 1 1 14 14 ILE CB C 14 36.780 36.780 37.087 -0.307 25061 4335 1 7 . 1 1 14 14 ILE H H 14 7.254 7.254 7.897 -0.643 25061 4336 1 7 . 1 1 15 15 LEU N N 15 117.008 117.008 119.746 -2.738 25061 4337 1 7 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.203 -0.282 25061 4338 1 7 . 1 1 15 15 LEU C C 15 178.062 178.062 179.470 -1.408 25061 4339 1 7 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.307 0.104 25061 4340 1 7 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.564 -0.395 25061 4341 1 7 . 1 1 15 15 LEU H H 15 7.412 7.412 7.536 -0.124 25061 4342 1 7 . 1 1 16 16 GLU N N 16 117.637 117.637 118.914 -1.277 25061 4343 1 7 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.910 -0.209 25061 4344 1 7 . 1 1 16 16 GLU C C 16 179.182 179.182 178.830 0.352 25061 4345 1 7 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.589 -0.172 25061 4346 1 7 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.363 0.096 25061 4347 1 7 . 1 1 16 16 GLU H H 16 7.981 7.981 8.296 -0.315 25061 4348 1 7 . 1 1 17 17 GLU N N 17 119.759 119.759 121.054 -1.295 25061 4349 1 7 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.362 -0.346 25061 4350 1 7 . 1 1 17 17 GLU C C 17 179.949 179.949 179.291 0.658 25061 4351 1 7 . 1 1 17 17 GLU CA C 17 59.195 59.195 59.052 0.143 25061 4352 1 7 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.825 -0.285 25061 4353 1 7 . 1 1 17 17 GLU H H 17 8.248 8.248 7.966 0.282 25061 4354 1 7 . 1 1 18 18 LEU N N 18 119.764 119.764 119.636 0.128 25061 4355 1 7 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.187 -0.106 25061 4356 1 7 . 1 1 18 18 LEU C C 18 177.620 177.620 179.166 -1.546 25061 4357 1 7 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.512 0.166 25061 4358 1 7 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.644 -0.534 25061 4359 1 7 . 1 1 18 18 LEU H H 18 8.486 8.486 8.103 0.383 25061 4360 1 7 . 1 1 19 19 LEU N N 19 123.102 123.102 121.194 1.908 25061 4361 1 7 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.522 0.140 25061 4362 1 7 . 1 1 19 19 LEU C C 19 178.343 178.343 178.194 0.149 25061 4363 1 7 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.488 0.748 25061 4364 1 7 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.302 -0.651 25061 4365 1 7 . 1 1 19 19 LEU H H 19 7.870 7.870 7.801 0.069 25061 4366 1 7 . 1 1 20 20 GLU N N 20 117.884 117.884 118.170 -0.286 25061 4367 1 7 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.868 0.036 25061 4368 1 7 . 1 1 20 20 GLU C C 20 177.707 177.707 179.012 -1.305 25061 4369 1 7 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.475 -0.083 25061 4370 1 7 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.391 -0.414 25061 4371 1 7 . 1 1 20 20 GLU H H 20 7.497 7.497 7.656 -0.159 25061 4372 1 7 . 1 1 21 21 VAL N N 21 117.709 117.709 119.690 -1.981 25061 4373 1 7 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.774 -0.150 25061 4374 1 7 . 1 1 21 21 VAL C C 21 178.523 178.523 178.191 0.332 25061 4375 1 7 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.115 0.082 25061 4376 1 7 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.160 -0.013 25061 4377 1 7 . 1 1 21 21 VAL H H 21 7.514 7.514 7.539 -0.025 25061 4378 1 7 . 1 1 22 22 VAL N N 22 121.233 121.233 119.743 1.490 25061 4379 1 7 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.610 -0.164 25061 4380 1 7 . 1 1 22 22 VAL C C 22 176.868 176.868 178.393 -1.525 25061 4381 1 7 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.636 0.377 25061 4382 1 7 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.593 -0.279 25061 4383 1 7 . 1 1 22 22 VAL H H 22 7.863 7.863 7.661 0.202 25061 4384 1 7 . 1 1 23 23 LEU N N 23 118.101 118.101 119.089 -0.988 25061 4385 1 7 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.101 -0.036 25061 4386 1 7 . 1 1 23 23 LEU C C 23 179.701 179.701 178.311 1.390 25061 4387 1 7 . 1 1 23 23 LEU CA C 23 57.296 57.296 58.023 -0.726 25061 4388 1 7 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.715 -0.012 25061 4389 1 7 . 1 1 23 23 LEU H H 23 8.151 8.151 8.197 -0.046 25061 4390 1 7 . 1 1 24 24 LYS N N 24 114.622 114.622 116.144 -1.522 25061 4391 1 7 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.200 -0.063 25061 4392 1 7 . 1 1 24 24 LYS C C 24 178.062 178.062 178.431 -0.369 25061 4393 1 7 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.017 -0.649 25061 4394 1 7 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.371 0.223 25061 4395 1 7 . 1 1 24 24 LYS H H 24 7.823 7.823 7.850 -0.027 25061 4396 1 7 . 1 1 25 25 SER N N 25 115.474 115.474 116.160 -0.686 25061 4397 1 7 . 1 1 25 25 SER HA H 25 4.377 4.377 4.314 0.063 25061 4398 1 7 . 1 1 25 25 SER C C 25 174.520 174.520 174.161 0.359 25061 4399 1 7 . 1 1 25 25 SER CA C 25 61.049 61.049 60.835 0.214 25061 4400 1 7 . 1 1 25 25 SER CB C 25 63.777 63.777 64.614 -0.837 25061 4401 1 7 . 1 1 25 25 SER H H 25 7.798 7.798 7.841 -0.043 25061 4402 1 7 . 1 1 26 26 ASP N N 26 117.424 117.424 117.431 -0.007 25061 4403 1 7 . 1 1 26 26 ASP HA H 26 4.886 4.886 4.963 -0.077 25061 4404 1 7 . 1 1 26 26 ASP C C 26 173.521 173.521 174.142 -0.621 25061 4405 1 7 . 1 1 26 26 ASP CA C 26 52.048 52.048 53.072 -1.024 25061 4406 1 7 . 1 1 26 26 ASP CB C 26 42.202 42.202 42.743 -0.541 25061 4407 1 7 . 1 1 26 26 ASP H H 26 7.990 7.990 8.080 -0.090 25061 4408 1 7 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.492 0.153 25061 4409 1 7 . 1 1 27 27 PRO C C 27 177.016 177.016 176.785 0.231 25061 4410 1 7 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.801 -0.200 25061 4411 1 7 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.398 -0.225 25061 4412 1 7 . 1 1 28 28 ASN N N 28 115.839 115.839 117.182 -1.343 25061 4413 1 7 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.649 0.043 25061 4414 1 7 . 1 1 28 28 ASN C C 28 175.701 175.701 176.000 -0.299 25061 4415 1 7 . 1 1 28 28 ASN CA C 28 53.472 53.472 53.792 -0.320 25061 4416 1 7 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.392 -0.179 25061 4417 1 7 . 1 1 28 28 ASN H H 28 8.608 8.608 7.991 0.617 25061 4418 1 7 . 1 1 29 29 VAL N N 29 120.770 120.770 122.663 -1.893 25061 4419 1 7 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.989 -0.174 25061 4420 1 7 . 1 1 29 29 VAL C C 29 175.023 175.023 175.594 -0.571 25061 4421 1 7 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.483 -0.931 25061 4422 1 7 . 1 1 29 29 VAL CB C 29 32.147 32.147 30.784 1.363 25061 4423 1 7 . 1 1 29 29 VAL H H 29 7.428 7.428 7.789 -0.361 25061 4424 1 7 . 1 1 30 30 LYS N N 30 127.345 127.345 129.125 -1.780 25061 4425 1 7 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.342 0.137 25061 4426 1 7 . 1 1 30 30 LYS C C 30 174.777 174.777 176.543 -1.766 25061 4427 1 7 . 1 1 30 30 LYS CA C 30 55.204 55.204 55.120 0.083 25061 4428 1 7 . 1 1 30 30 LYS CB C 30 31.949 31.949 31.444 0.505 25061 4429 1 7 . 1 1 30 30 LYS H H 30 8.457 8.457 8.460 -0.003 25061 4430 1 7 . 1 1 31 31 THR N N 31 113.552 113.552 116.853 -3.301 25061 4431 1 7 . 1 1 31 31 THR HA H 31 5.723 5.723 5.063 0.660 25061 4432 1 7 . 1 1 31 31 THR C C 31 174.593 174.593 174.865 -0.272 25061 4433 1 7 . 1 1 31 31 THR CA C 31 59.030 59.030 61.130 -2.100 25061 4434 1 7 . 1 1 31 31 THR CB C 31 72.206 72.206 69.638 2.568 25061 4435 1 7 . 1 1 31 31 THR H H 31 8.164 8.164 8.314 -0.150 25061 4436 1 7 . 1 1 32 32 VAL N N 32 119.206 119.206 126.210 -7.004 25061 4437 1 7 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.341 0.064 25061 4438 1 7 . 1 1 32 32 VAL C C 32 172.663 172.663 174.654 -1.991 25061 4439 1 7 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.383 -0.311 25061 4440 1 7 . 1 1 32 32 VAL CB C 32 35.051 35.051 34.281 0.770 25061 4441 1 7 . 1 1 32 32 VAL H H 32 8.615 8.615 9.100 -0.485 25061 4442 1 7 . 1 1 33 33 ARG N N 33 130.278 130.278 129.380 0.898 25061 4443 1 7 . 1 1 33 33 ARG HA H 33 5.331 5.331 4.868 0.463 25061 4444 1 7 . 1 1 33 33 ARG C C 33 173.836 173.836 175.546 -1.710 25061 4445 1 7 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.867 -1.717 25061 4446 1 7 . 1 1 33 33 ARG CB C 33 30.028 30.028 29.986 0.042 25061 4447 1 7 . 1 1 33 33 ARG H H 33 8.996 8.996 8.778 0.218 25061 4448 1 7 . 1 1 34 34 THR N N 34 121.695 121.695 119.014 2.681 25061 4449 1 7 . 1 1 34 34 THR HA H 34 4.483 4.483 4.442 0.041 25061 4450 1 7 . 1 1 34 34 THR C C 34 169.769 169.769 173.362 -3.593 25061 4451 1 7 . 1 1 34 34 THR CA C 34 60.814 60.814 60.889 -0.075 25061 4452 1 7 . 1 1 34 34 THR CB C 34 67.402 67.402 70.129 -2.727 25061 4453 1 7 . 1 1 34 34 THR H H 34 8.126 8.126 8.360 -0.234 25061 4454 1 7 . 1 1 35 35 ASP N N 35 122.198 122.198 124.687 -2.489 25061 4455 1 7 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.446 0.378 25061 4456 1 7 . 1 1 35 35 ASP C C 35 174.790 174.790 175.912 -1.122 25061 4457 1 7 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.831 -1.445 25061 4458 1 7 . 1 1 35 35 ASP CB C 35 41.848 41.848 41.265 0.583 25061 4459 1 7 . 1 1 35 35 ASP H H 35 7.983 7.983 8.497 -0.514 25061 4460 1 7 . 1 1 36 36 ASP N N 36 121.091 121.091 121.547 -0.456 25061 4461 1 7 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.505 0.088 25061 4462 1 7 . 1 1 36 36 ASP C C 36 176.189 176.189 176.871 -0.682 25061 4463 1 7 . 1 1 36 36 ASP CA C 36 53.055 53.055 55.042 -1.987 25061 4464 1 7 . 1 1 36 36 ASP CB C 36 42.159 42.159 40.916 1.244 25061 4465 1 7 . 1 1 36 36 ASP H H 36 8.157 8.157 7.577 0.580 25061 4466 1 7 . 1 1 37 37 LYS N N 37 125.839 125.839 127.242 -1.403 25061 4467 1 7 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.813 -0.091 25061 4468 1 7 . 1 1 37 37 LYS C C 37 176.870 176.870 177.740 -0.870 25061 4469 1 7 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.854 -0.450 25061 4470 1 7 . 1 1 37 37 LYS CB C 37 32.394 32.394 31.953 0.441 25061 4471 1 7 . 1 1 37 37 LYS H H 37 8.843 8.843 8.454 0.389 25061 4472 1 7 . 1 1 38 38 GLU N N 38 118.369 118.369 118.156 0.213 25061 4473 1 7 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.853 0.154 25061 4474 1 7 . 1 1 38 38 GLU C C 38 179.502 179.502 178.695 0.807 25061 4475 1 7 . 1 1 38 38 GLU CA C 38 58.670 58.670 59.178 -0.508 25061 4476 1 7 . 1 1 38 38 GLU CB C 38 28.474 28.474 28.673 -0.199 25061 4477 1 7 . 1 1 38 38 GLU H H 38 8.182 8.182 8.853 -0.671 25061 4478 1 7 . 1 1 39 39 LYS N N 39 121.722 121.722 120.565 1.157 25061 4479 1 7 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.354 -0.189 25061 4480 1 7 . 1 1 39 39 LYS C C 39 178.500 178.500 178.719 -0.219 25061 4481 1 7 . 1 1 39 39 LYS CA C 39 57.736 57.736 58.809 -1.073 25061 4482 1 7 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.600 -1.462 25061 4483 1 7 . 1 1 39 39 LYS H H 39 7.524 7.524 7.257 0.267 25061 4484 1 7 . 1 1 40 40 VAL N N 40 117.199 117.199 119.694 -2.495 25061 4485 1 7 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.500 -0.272 25061 4486 1 7 . 1 1 40 40 VAL C C 40 177.362 177.362 177.901 -0.539 25061 4487 1 7 . 1 1 40 40 VAL CA C 40 67.642 67.642 67.186 0.456 25061 4488 1 7 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.576 -0.673 25061 4489 1 7 . 1 1 40 40 VAL H H 40 7.883 7.883 7.831 0.052 25061 4490 1 7 . 1 1 41 41 LYS N N 41 117.677 117.677 118.898 -1.221 25061 4491 1 7 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.552 -0.110 25061 4492 1 7 . 1 1 41 41 LYS C C 41 177.686 177.686 178.554 -0.868 25061 4493 1 7 . 1 1 41 41 LYS CA C 41 60.809 60.809 60.000 0.809 25061 4494 1 7 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.474 0.141 25061 4495 1 7 . 1 1 41 41 LYS H H 41 7.567 7.567 7.810 -0.243 25061 4496 1 7 . 1 1 42 42 GLU N N 42 118.369 118.369 118.559 -0.190 25061 4497 1 7 . 1 1 42 42 GLU HA H 42 4.007 4.007 3.970 0.037 25061 4498 1 7 . 1 1 42 42 GLU C C 42 179.725 179.725 178.958 0.767 25061 4499 1 7 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.604 -0.535 25061 4500 1 7 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.254 0.285 25061 4501 1 7 . 1 1 42 42 GLU H H 42 7.634 7.634 7.627 0.007 25061 4502 1 7 . 1 1 43 43 GLU N N 43 117.906 117.906 118.791 -0.885 25061 4503 1 7 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.139 0.044 25061 4504 1 7 . 1 1 43 43 GLU C C 43 179.757 179.757 179.198 0.559 25061 4505 1 7 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.441 -0.076 25061 4506 1 7 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.070 -0.229 25061 4507 1 7 . 1 1 43 43 GLU H H 43 8.162 8.162 7.886 0.276 25061 4508 1 7 . 1 1 44 44 ILE N N 44 122.291 122.291 120.566 1.725 25061 4509 1 7 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.641 -0.029 25061 4510 1 7 . 1 1 44 44 ILE C C 44 177.101 177.101 177.923 -0.822 25061 4511 1 7 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.925 0.430 25061 4512 1 7 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.843 -0.383 25061 4513 1 7 . 1 1 44 44 ILE H H 44 8.742 8.742 8.109 0.633 25061 4514 1 7 . 1 1 45 45 GLU N N 45 119.892 119.892 120.193 -0.301 25061 4515 1 7 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.101 -0.043 25061 4516 1 7 . 1 1 45 45 GLU C C 45 178.991 178.991 178.890 0.101 25061 4517 1 7 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.811 -0.146 25061 4518 1 7 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.557 -0.396 25061 4519 1 7 . 1 1 45 45 GLU H H 45 8.171 8.171 8.020 0.151 25061 4520 1 7 . 1 1 46 46 LYS N N 46 118.064 118.064 119.287 -1.223 25061 4521 1 7 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.069 -0.087 25061 4522 1 7 . 1 1 46 46 LYS C C 46 178.837 178.837 178.996 -0.159 25061 4523 1 7 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.135 0.606 25061 4524 1 7 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.260 0.183 25061 4525 1 7 . 1 1 46 46 LYS H H 46 7.785 7.785 7.727 0.058 25061 4526 1 7 . 1 1 47 47 ALA N N 47 121.817 121.817 122.491 -0.674 25061 4527 1 7 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.091 -0.060 25061 4528 1 7 . 1 1 47 47 ALA C C 47 179.859 179.859 179.169 0.690 25061 4529 1 7 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.326 -0.031 25061 4530 1 7 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.573 -0.917 25061 4531 1 7 . 1 1 47 47 ALA H H 47 8.123 8.123 7.963 0.160 25061 4532 1 7 . 1 1 48 48 ARG N N 48 119.080 119.080 117.338 1.742 25061 4533 1 7 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.075 0.014 25061 4534 1 7 . 1 1 48 48 ARG C C 48 180.155 180.155 178.488 1.667 25061 4535 1 7 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.611 0.586 25061 4536 1 7 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.831 -0.321 25061 4537 1 7 . 1 1 48 48 ARG H H 48 8.768 8.768 7.713 1.055 25061 4538 1 7 . 1 1 49 49 LYS N N 49 119.951 119.951 119.937 0.014 25061 4539 1 7 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.105 -0.066 25061 4540 1 7 . 1 1 49 49 LYS C C 49 178.288 178.288 178.487 -0.199 25061 4541 1 7 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.718 0.119 25061 4542 1 7 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.518 -0.375 25061 4543 1 7 . 1 1 49 49 LYS H H 49 8.037 8.037 7.842 0.195 25061 4544 1 7 . 1 1 50 50 GLN N N 50 115.284 115.284 117.631 -2.347 25061 4545 1 7 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.241 0.101 25061 4546 1 7 . 1 1 50 50 GLN C C 50 176.180 176.180 176.465 -0.285 25061 4547 1 7 . 1 1 50 50 GLN CA C 50 55.741 55.741 55.941 -0.200 25061 4548 1 7 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.532 0.033 25061 4549 1 7 . 1 1 50 50 GLN H H 50 7.740 7.740 7.799 -0.059 25061 4550 1 7 . 1 1 51 51 GLY N N 51 109.725 109.725 108.551 1.174 25061 4551 1 7 . 1 1 51 51 GLY C C 51 174.552 174.552 173.479 1.073 25061 4552 1 7 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.070 1.293 25061 4553 1 7 . 1 1 51 51 GLY H H 51 8.027 8.027 7.861 0.166 25061 4554 1 7 . 1 1 52 52 ARG N N 52 119.064 119.064 120.128 -1.064 25061 4555 1 7 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.739 0.158 25061 4556 1 7 . 1 1 52 52 ARG C C 52 173.123 173.123 173.303 -0.180 25061 4557 1 7 . 1 1 52 52 ARG CA C 52 52.247 52.247 53.217 -0.970 25061 4558 1 7 . 1 1 52 52 ARG CB C 52 32.366 32.366 29.995 2.371 25061 4559 1 7 . 1 1 52 52 ARG H H 52 7.969 7.969 7.881 0.088 25061 4560 1 7 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.651 0.204 25061 4561 1 7 . 1 1 53 53 PRO C C 53 174.069 174.069 175.811 -1.742 25061 4562 1 7 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.253 -0.435 25061 4563 1 7 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.559 -0.499 25061 4564 1 7 . 1 1 54 54 ILE N N 54 116.301 116.301 118.228 -1.927 25061 4565 1 7 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.709 0.529 25061 4566 1 7 . 1 1 54 54 ILE C C 54 171.709 171.709 173.577 -1.868 25061 4567 1 7 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.590 -1.816 25061 4568 1 7 . 1 1 54 54 ILE CB C 54 41.558 41.558 42.009 -0.451 25061 4569 1 7 . 1 1 54 54 ILE H H 54 7.920 7.920 7.672 0.248 25061 4570 1 7 . 1 1 55 55 VAL N N 55 126.302 126.302 126.145 0.157 25061 4571 1 7 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.361 -0.437 25061 4572 1 7 . 1 1 55 55 VAL C C 55 173.624 173.624 174.969 -1.345 25061 4573 1 7 . 1 1 55 55 VAL CA C 55 59.795 59.795 59.896 -0.101 25061 4574 1 7 . 1 1 55 55 VAL CB C 55 32.828 32.828 35.274 -2.446 25061 4575 1 7 . 1 1 55 55 VAL H H 55 8.652 8.652 8.507 0.145 25061 4576 1 7 . 1 1 56 56 ILE N N 56 127.503 127.503 124.305 3.198 25061 4577 1 7 . 1 1 56 56 ILE HA H 56 4.664 4.664 5.039 -0.375 25061 4578 1 7 . 1 1 56 56 ILE C C 56 173.479 173.479 174.746 -1.267 25061 4579 1 7 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.118 0.889 25061 4580 1 7 . 1 1 56 56 ILE CB C 56 40.285 40.285 40.073 0.212 25061 4581 1 7 . 1 1 56 56 ILE H H 56 9.124 9.124 8.414 0.710 25061 4582 1 7 . 1 1 57 57 PHE N N 57 125.302 125.302 126.832 -1.530 25061 4583 1 7 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.474 -0.258 25061 4584 1 7 . 1 1 57 57 PHE C C 57 174.536 174.536 175.902 -1.366 25061 4585 1 7 . 1 1 57 57 PHE CA C 57 56.961 56.961 56.895 0.066 25061 4586 1 7 . 1 1 57 57 PHE CB C 57 40.429 40.429 40.612 -0.183 25061 4587 1 7 . 1 1 57 57 PHE H H 57 8.971 8.971 8.459 0.512 25061 4588 1 7 . 1 1 58 58 ILE N N 58 126.472 126.472 117.990 8.482 25061 4589 1 7 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.868 -0.353 25061 4590 1 7 . 1 1 58 58 ILE C C 58 173.391 173.391 173.386 0.005 25061 4591 1 7 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.536 -0.446 25061 4592 1 7 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.535 -0.793 25061 4593 1 7 . 1 1 58 58 ILE H H 58 9.248 9.248 8.787 0.461 25061 4594 1 7 . 1 1 59 59 ARG N N 59 124.681 124.681 123.019 1.662 25061 4595 1 7 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.113 -0.184 25061 4596 1 7 . 1 1 59 59 ARG C C 59 178.521 178.521 177.372 1.149 25061 4597 1 7 . 1 1 59 59 ARG CA C 59 55.742 55.742 54.401 1.341 25061 4598 1 7 . 1 1 59 59 ARG CB C 59 30.918 30.918 31.784 -0.866 25061 4599 1 7 . 1 1 59 59 ARG H H 59 8.587 8.587 8.732 -0.145 25061 4600 1 7 . 1 1 60 60 GLY N N 60 108.848 108.848 117.003 -8.155 25061 4601 1 7 . 1 1 60 60 GLY C C 60 174.775 174.775 175.276 -0.501 25061 4602 1 7 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.048 -0.081 25061 4603 1 7 . 1 1 60 60 GLY H H 60 7.732 7.732 8.638 -0.906 25061 4604 1 7 . 1 1 61 61 ALA N N 61 120.877 120.877 127.841 -6.964 25061 4605 1 7 . 1 1 61 61 ALA HA H 61 4.144 4.144 4.094 0.050 25061 4606 1 7 . 1 1 61 61 ALA C C 61 177.769 177.769 179.859 -2.090 25061 4607 1 7 . 1 1 61 61 ALA CA C 61 53.449 53.449 54.296 -0.847 25061 4608 1 7 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.534 -0.163 25061 4609 1 7 . 1 1 61 61 ALA H H 61 7.852 7.852 8.042 -0.190 25061 4610 1 7 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.400 0.400 25061 4611 1 7 . 1 1 62 62 TYR CA C 62 63.039 63.039 57.341 5.698 25061 4612 1 7 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.166 0.274 25061 4613 1 7 . 1 1 63 63 GLU HA H 63 3.685 3.685 4.030 -0.345 25061 4614 1 7 . 1 1 63 63 GLU C C 63 176.251 176.251 178.768 -2.517 25061 4615 1 7 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.099 0.159 25061 4616 1 7 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.250 0.162 25061 4617 1 7 . 1 1 64 64 GLU N N 64 119.209 119.209 119.585 -0.376 25061 4618 1 7 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.002 0.899 25061 4619 1 7 . 1 1 64 64 GLU C C 64 178.251 178.251 178.804 -0.553 25061 4620 1 7 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.527 0.685 25061 4621 1 7 . 1 1 64 64 GLU CB C 64 28.645 28.645 28.774 -0.129 25061 4622 1 7 . 1 1 64 64 GLU H H 64 8.878 8.878 7.576 1.302 25061 4623 1 7 . 1 1 65 65 VAL N N 65 116.728 116.728 118.906 -2.178 25061 4624 1 7 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.760 0.222 25061 4625 1 7 . 1 1 65 65 VAL C C 65 176.915 176.915 177.863 -0.948 25061 4626 1 7 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.870 -1.261 25061 4627 1 7 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.527 0.368 25061 4628 1 7 . 1 1 65 65 VAL H H 65 7.652 7.652 7.463 0.189 25061 4629 1 7 . 1 1 66 66 VAL N N 66 119.462 119.462 119.832 -0.370 25061 4630 1 7 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.641 -0.327 25061 4631 1 7 . 1 1 66 66 VAL C C 66 177.142 177.142 177.396 -0.254 25061 4632 1 7 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.628 0.707 25061 4633 1 7 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.465 -0.035 25061 4634 1 7 . 1 1 66 66 VAL H H 66 7.896 7.896 7.697 0.199 25061 4635 1 7 . 1 1 67 67 ARG HA H 67 3.628 3.628 3.997 -0.369 25061 4636 1 7 . 1 1 67 67 ARG C C 67 177.841 177.841 178.137 -0.296 25061 4637 1 7 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.610 0.442 25061 4638 1 7 . 1 1 67 67 ARG CB C 67 29.393 29.393 29.994 -0.601 25061 4639 1 7 . 1 1 68 68 ASP N N 68 118.316 118.316 118.885 -0.569 25061 4640 1 7 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.539 -0.178 25061 4641 1 7 . 1 1 68 68 ASP C C 68 178.945 178.945 178.727 0.218 25061 4642 1 7 . 1 1 68 68 ASP CA C 68 57.311 57.311 56.863 0.448 25061 4643 1 7 . 1 1 68 68 ASP CB C 68 41.514 41.514 41.407 0.107 25061 4644 1 7 . 1 1 68 68 ASP H H 68 7.625 7.625 7.792 -0.167 25061 4645 1 7 . 1 1 69 69 ILE N N 69 119.231 119.231 121.027 -1.796 25061 4646 1 7 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.756 -0.126 25061 4647 1 7 . 1 1 69 69 ILE C C 69 177.138 177.138 178.001 -0.863 25061 4648 1 7 . 1 1 69 69 ILE CA C 69 64.540 64.540 64.725 -0.185 25061 4649 1 7 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.895 -0.845 25061 4650 1 7 . 1 1 69 69 ILE H H 69 8.113 8.113 7.388 0.725 25061 4651 1 7 . 1 1 70 70 VAL N N 70 120.164 120.164 119.876 0.288 25061 4652 1 7 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.520 -0.103 25061 4653 1 7 . 1 1 70 70 VAL C C 70 177.079 177.079 177.419 -0.340 25061 4654 1 7 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.564 -0.289 25061 4655 1 7 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.288 -0.030 25061 4656 1 7 . 1 1 70 70 VAL H H 70 8.478 8.478 8.359 0.119 25061 4657 1 7 . 1 1 71 71 GLU N N 71 118.293 118.293 119.307 -1.014 25061 4658 1 7 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.909 0.145 25061 4659 1 7 . 1 1 71 71 GLU C C 71 179.009 179.009 178.280 0.729 25061 4660 1 7 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.692 -0.276 25061 4661 1 7 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.513 -0.691 25061 4662 1 7 . 1 1 71 71 GLU H H 71 8.152 8.152 8.036 0.116 25061 4663 1 7 . 1 1 72 72 TYR N N 72 120.091 120.091 120.802 -0.711 25061 4664 1 7 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.173 -0.011 25061 4665 1 7 . 1 1 72 72 TYR C C 72 176.404 176.404 177.600 -1.196 25061 4666 1 7 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.486 -0.354 25061 4667 1 7 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.333 -0.196 25061 4668 1 7 . 1 1 72 72 TYR H H 72 7.959 7.959 7.625 0.334 25061 4669 1 7 . 1 1 73 73 ALA N N 73 120.133 120.133 119.857 0.276 25061 4670 1 7 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.919 -0.289 25061 4671 1 7 . 1 1 73 73 ALA C C 73 179.182 179.182 179.582 -0.400 25061 4672 1 7 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.225 -0.113 25061 4673 1 7 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.322 -0.131 25061 4674 1 7 . 1 1 73 73 ALA H H 73 8.604 8.604 7.806 0.798 25061 4675 1 7 . 1 1 74 74 GLN N N 74 115.553 115.553 118.071 -2.518 25061 4676 1 7 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.103 0.035 25061 4677 1 7 . 1 1 74 74 GLN C C 74 180.595 180.595 179.290 1.305 25061 4678 1 7 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.380 0.715 25061 4679 1 7 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.688 -0.112 25061 4680 1 7 . 1 1 74 74 GLN H H 74 8.619 8.619 8.162 0.457 25061 4681 1 7 . 1 1 75 75 LYS N N 75 122.396 122.396 118.470 3.926 25061 4682 1 7 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.088 -0.060 25061 4683 1 7 . 1 1 75 75 LYS C C 75 178.521 178.521 178.177 0.344 25061 4684 1 7 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.315 0.743 25061 4685 1 7 . 1 1 75 75 LYS CB C 75 31.599 31.599 32.041 -0.442 25061 4686 1 7 . 1 1 75 75 LYS H H 75 8.123 8.123 7.791 0.332 25061 4687 1 7 . 1 1 76 76 GLU N N 76 116.294 116.294 117.805 -1.511 25061 4688 1 7 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.293 -0.194 25061 4689 1 7 . 1 1 76 76 GLU C C 76 175.957 175.957 176.646 -0.689 25061 4690 1 7 . 1 1 76 76 GLU CA C 76 55.605 55.605 55.254 0.351 25061 4691 1 7 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.608 0.216 25061 4692 1 7 . 1 1 76 76 GLU H H 76 7.450 7.450 7.607 -0.157 25061 4693 1 7 . 1 1 77 77 GLY N N 77 107.446 107.446 107.065 0.381 25061 4694 1 7 . 1 1 77 77 GLY C C 77 174.520 174.520 174.415 0.105 25061 4695 1 7 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.915 -0.108 25061 4696 1 7 . 1 1 77 77 GLY H H 77 7.763 7.763 7.603 0.160 25061 4697 1 7 . 1 1 78 78 LEU N N 78 120.179 120.179 119.784 0.395 25061 4698 1 7 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.720 -0.332 25061 4699 1 7 . 1 1 78 78 LEU C C 78 175.914 175.914 175.975 -0.061 25061 4700 1 7 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.568 -0.096 25061 4701 1 7 . 1 1 78 78 LEU CB C 78 41.889 41.889 43.912 -2.023 25061 4702 1 7 . 1 1 78 78 LEU H H 78 7.930 7.930 8.078 -0.148 25061 4703 1 7 . 1 1 79 79 ARG N N 79 122.207 122.207 124.219 -2.012 25061 4704 1 7 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.329 0.068 25061 4705 1 7 . 1 1 79 79 ARG C C 79 174.960 174.960 174.673 0.287 25061 4706 1 7 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.371 0.277 25061 4707 1 7 . 1 1 79 79 ARG CB C 79 30.476 30.476 31.692 -1.216 25061 4708 1 7 . 1 1 79 79 ARG H H 79 8.241 8.241 8.068 0.173 25061 4709 1 7 . 1 1 80 80 VAL N N 80 123.333 123.333 120.917 2.416 25061 4710 1 7 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.972 0.323 25061 4711 1 7 . 1 1 80 80 VAL C C 80 174.048 174.048 174.033 0.015 25061 4712 1 7 . 1 1 80 80 VAL CA C 80 60.041 60.041 60.784 -0.743 25061 4713 1 7 . 1 1 80 80 VAL CB C 80 34.305 34.305 33.068 1.237 25061 4714 1 7 . 1 1 80 80 VAL H H 80 8.359 8.359 8.529 -0.170 25061 4715 1 7 . 1 1 81 81 LEU N N 81 128.719 128.719 128.399 0.320 25061 4716 1 7 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.355 -0.251 25061 4717 1 7 . 1 1 81 81 LEU C C 81 174.484 174.484 174.803 -0.319 25061 4718 1 7 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.423 0.697 25061 4719 1 7 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.266 -0.311 25061 4720 1 7 . 1 1 81 81 LEU H H 81 8.650 8.650 8.837 -0.187 25061 4721 1 7 . 1 1 82 82 VAL N N 82 122.487 122.487 127.552 -5.065 25061 4722 1 7 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.437 0.660 25061 4723 1 7 . 1 1 82 82 VAL C C 82 174.525 174.525 174.824 -0.299 25061 4724 1 7 . 1 1 82 82 VAL CA C 82 60.285 60.285 61.407 -1.122 25061 4725 1 7 . 1 1 82 82 VAL CB C 82 34.789 34.789 31.999 2.790 25061 4726 1 7 . 1 1 82 82 VAL H H 82 8.781 8.781 8.287 0.494 25061 4727 1 7 . 1 1 83 83 ILE N N 83 128.082 128.082 130.574 -2.492 25061 4728 1 7 . 1 1 83 83 ILE HA H 83 4.930 4.930 5.045 -0.115 25061 4729 1 7 . 1 1 83 83 ILE C C 83 172.925 172.925 174.800 -1.875 25061 4730 1 7 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.101 -0.160 25061 4731 1 7 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.993 1.192 25061 4732 1 7 . 1 1 83 83 ILE H H 83 9.527 9.527 9.025 0.502 25061 4733 1 7 . 1 1 84 84 LYS N N 84 128.493 128.493 128.015 0.478 25061 4734 1 7 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.249 -0.201 25061 4735 1 7 . 1 1 84 84 LYS C C 84 174.027 174.027 174.824 -0.797 25061 4736 1 7 . 1 1 84 84 LYS CA C 84 53.253 53.253 53.241 0.012 25061 4737 1 7 . 1 1 84 84 LYS CB C 84 34.652 34.652 35.919 -1.267 25061 4738 1 7 . 1 1 84 84 LYS H H 84 8.721 8.721 7.992 0.729 25061 4739 1 7 . 1 1 85 85 VAL N N 85 126.729 126.729 123.232 3.497 25061 4740 1 7 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.129 0.607 25061 4741 1 7 . 1 1 85 85 VAL C C 85 175.935 175.935 174.941 0.994 25061 4742 1 7 . 1 1 85 85 VAL CA C 85 60.200 60.200 61.384 -1.184 25061 4743 1 7 . 1 1 85 85 VAL CB C 85 30.847 30.847 32.954 -2.107 25061 4744 1 7 . 1 1 85 85 VAL H H 85 8.643 8.643 7.719 0.924 25061 4745 1 7 . 1 1 86 86 ALA N N 86 132.930 132.930 130.882 2.048 25061 4746 1 7 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.433 -0.003 25061 4747 1 7 . 1 1 86 86 ALA C C 86 175.635 175.635 176.060 -0.425 25061 4748 1 7 . 1 1 86 86 ALA CA C 86 51.504 51.504 52.244 -0.740 25061 4749 1 7 . 1 1 86 86 ALA CB C 86 20.821 20.821 19.858 0.963 25061 4750 1 7 . 1 1 86 86 ALA H H 86 8.835 8.835 8.322 0.513 25061 4751 1 7 . 1 1 87 87 GLN N N 87 118.719 118.719 117.971 0.748 25061 4752 1 7 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.510 -0.041 25061 4753 1 7 . 1 1 87 87 GLN C C 87 175.949 175.949 173.687 2.262 25061 4754 1 7 . 1 1 87 87 GLN CA C 87 55.260 55.260 54.472 0.788 25061 4755 1 7 . 1 1 87 87 GLN CB C 87 30.432 30.432 30.941 -0.509 25061 4756 1 7 . 1 1 87 87 GLN H H 87 8.570 8.570 8.071 0.499 25061 4757 1 7 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.471 0.009 25061 4758 1 7 . 1 1 88 88 ASP CA C 88 55.454 55.454 54.975 0.479 25061 4759 1 7 . 1 1 88 88 ASP CB C 88 41.204 41.204 40.275 0.929 25061 4760 1 7 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.613 -0.566 25061 4761 1 7 . 1 1 89 89 GLN CA C 89 56.687 56.687 54.977 1.710 25061 4762 1 7 . 1 1 89 89 GLN CB C 89 27.850 27.850 31.912 -4.062 25061 4763 1 7 . 1 1 92 92 LEU N N 92 125.291 125.291 118.685 6.606 25061 4764 1 7 . 1 1 92 92 LEU HA H 92 4.201 4.201 3.978 0.223 25061 4765 1 7 . 1 1 92 92 LEU CA C 92 55.057 55.057 58.286 -3.229 25061 4766 1 7 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.832 0.214 25061 4767 1 7 . 1 1 92 92 LEU H H 92 8.277 8.277 8.062 0.215 25061 4768 1 7 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.430 0.326 25061 4769 1 7 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.149 -0.100 25061 4770 1 7 . 1 1 94 94 ARG C C 94 178.544 178.544 178.587 -0.043 25061 4771 1 7 . 1 1 94 94 ARG CA C 94 58.607 58.607 59.364 -0.757 25061 4772 1 7 . 1 1 94 94 ARG CB C 94 29.614 29.614 30.407 -0.793 25061 4773 1 7 . 1 1 95 95 PHE N N 95 117.407 117.407 119.930 -2.523 25061 4774 1 7 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.484 -0.109 25061 4775 1 7 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.176 0.055 25061 4776 1 7 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.208 -1.266 25061 4777 1 7 . 1 1 95 95 PHE H H 95 8.419 8.419 7.942 0.477 25061 4778 1 7 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.958 -0.150 25061 4779 1 7 . 1 1 96 96 TYR C C 96 177.728 177.728 177.101 0.627 25061 4780 1 7 . 1 1 96 96 TYR CA C 96 63.156 63.156 60.775 2.381 25061 4781 1 7 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.221 -0.521 25061 4782 1 7 . 1 1 97 97 GLU N N 97 119.054 119.054 117.887 1.167 25061 4783 1 7 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.572 0.491 25061 4784 1 7 . 1 1 97 97 GLU C C 97 179.071 179.071 178.603 0.468 25061 4785 1 7 . 1 1 97 97 GLU CA C 97 58.760 58.760 58.700 0.060 25061 4786 1 7 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.130 0.042 25061 4787 1 7 . 1 1 97 97 GLU H H 97 7.858 7.858 7.581 0.277 25061 4788 1 7 . 1 1 98 98 GLN N N 98 119.385 119.385 118.671 0.714 25061 4789 1 7 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.956 -0.055 25061 4790 1 7 . 1 1 98 98 GLN C C 98 177.599 177.599 178.650 -1.051 25061 4791 1 7 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.455 -0.144 25061 4792 1 7 . 1 1 98 98 GLN CB C 98 27.766 27.766 27.976 -0.210 25061 4793 1 7 . 1 1 98 98 GLN H H 98 7.747 7.747 7.510 0.237 25061 4794 1 7 . 1 1 99 99 LEU N N 99 118.348 118.348 119.985 -1.637 25061 4795 1 7 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.850 0.169 25061 4796 1 7 . 1 1 99 99 LEU C C 99 178.669 178.669 178.611 0.058 25061 4797 1 7 . 1 1 99 99 LEU CA C 99 57.430 57.430 58.197 -0.767 25061 4798 1 7 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.340 0.163 25061 4799 1 7 . 1 1 99 99 LEU H H 99 7.891 7.891 7.360 0.531 25061 4800 1 7 . 1 1 100 100 LYS N N 100 118.332 118.332 118.619 -0.287 25061 4801 1 7 . 1 1 100 100 LYS HA H 100 4.509 4.509 3.934 0.575 25061 4802 1 7 . 1 1 100 100 LYS C C 100 180.846 180.846 179.245 1.601 25061 4803 1 7 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.756 0.332 25061 4804 1 7 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.972 0.297 25061 4805 1 7 . 1 1 100 100 LYS H H 100 7.560 7.560 7.276 0.284 25061 4806 1 7 . 1 1 101 101 LYS N N 101 121.944 121.944 119.392 2.552 25061 4807 1 7 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.014 0.058 25061 4808 1 7 . 1 1 101 101 LYS C C 101 177.707 177.707 178.175 -0.468 25061 4809 1 7 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.748 0.123 25061 4810 1 7 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.124 -0.029 25061 4811 1 7 . 1 1 101 101 LYS H H 101 7.959 7.959 7.747 0.212 25061 4812 1 7 . 1 1 102 102 ASP N N 102 118.788 118.788 116.374 2.414 25061 4813 1 7 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.509 0.185 25061 4814 1 7 . 1 1 102 102 ASP C C 102 176.359 176.359 177.393 -1.034 25061 4815 1 7 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.001 -0.422 25061 4816 1 7 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.778 -1.204 25061 4817 1 7 . 1 1 102 102 ASP H H 102 7.893 7.893 7.658 0.235 25061 4818 1 7 . 1 1 103 103 GLY N N 103 107.024 107.024 106.036 0.988 25061 4819 1 7 . 1 1 103 103 GLY C C 103 174.328 174.328 174.462 -0.134 25061 4820 1 7 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.534 0.811 25061 4821 1 7 . 1 1 103 103 GLY H H 103 7.866 7.866 7.885 -0.019 25061 4822 1 7 . 1 1 104 104 VAL N N 104 123.060 123.060 121.272 1.788 25061 4823 1 7 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.834 0.139 25061 4824 1 7 . 1 1 104 104 VAL C C 104 175.023 175.023 176.050 -1.027 25061 4825 1 7 . 1 1 104 104 VAL CA C 104 61.878 61.878 63.703 -1.825 25061 4826 1 7 . 1 1 104 104 VAL CB C 104 32.088 32.088 32.135 -0.047 25061 4827 1 7 . 1 1 104 104 VAL H H 104 7.955 7.955 7.762 0.193 25061 4828 1 7 . 1 1 105 105 ASP N N 105 127.987 127.987 129.945 -1.958 25061 4829 1 7 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.621 -0.046 25061 4830 1 7 . 1 1 105 105 ASP C C 105 173.624 173.624 174.948 -1.324 25061 4831 1 7 . 1 1 105 105 ASP CA C 105 54.087 54.087 54.399 -0.312 25061 4832 1 7 . 1 1 105 105 ASP CB C 105 40.660 40.660 39.915 0.745 25061 4833 1 7 . 1 1 105 105 ASP H H 105 8.399 8.399 8.392 0.007 25061 4834 1 7 . 1 1 106 106 VAL N N 106 125.798 125.798 121.911 3.887 25061 4835 1 7 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.406 0.409 25061 4836 1 7 . 1 1 106 106 VAL C C 106 174.902 174.902 174.998 -0.096 25061 4837 1 7 . 1 1 106 106 VAL CA C 106 60.194 60.194 61.463 -1.269 25061 4838 1 7 . 1 1 106 106 VAL CB C 106 34.179 34.179 32.615 1.564 25061 4839 1 7 . 1 1 106 106 VAL H H 106 7.550 7.550 7.628 -0.078 25061 4840 1 7 . 1 1 107 107 ARG N N 107 128.099 128.099 130.169 -2.070 25061 4841 1 7 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.725 0.151 25061 4842 1 7 . 1 1 107 107 ARG C C 107 173.815 173.815 175.067 -1.252 25061 4843 1 7 . 1 1 107 107 ARG CA C 107 53.386 53.386 53.202 0.184 25061 4844 1 7 . 1 1 107 107 ARG CB C 107 31.195 31.195 30.298 0.897 25061 4845 1 7 . 1 1 107 107 ARG H H 107 9.132 9.132 8.564 0.568 25061 4846 1 7 . 1 1 108 108 VAL N N 108 123.979 123.979 120.925 3.054 25061 4847 1 7 . 1 1 108 108 VAL HA H 108 4.942 4.942 4.949 -0.007 25061 4848 1 7 . 1 1 108 108 VAL C C 108 175.854 175.854 175.763 0.091 25061 4849 1 7 . 1 1 108 108 VAL CA C 108 60.017 60.017 60.825 -0.808 25061 4850 1 7 . 1 1 108 108 VAL CB C 108 32.844 32.844 32.614 0.230 25061 4851 1 7 . 1 1 108 108 VAL H H 108 8.561 8.561 8.672 -0.111 25061 4852 1 7 . 1 1 109 109 THR N N 109 120.144 120.144 119.190 0.954 25061 4853 1 7 . 1 1 109 109 THR HA H 109 4.815 4.815 4.652 0.163 25061 4854 1 7 . 1 1 109 109 THR C C 109 171.867 171.867 173.518 -1.651 25061 4855 1 7 . 1 1 109 109 THR CA C 109 59.613 59.613 60.429 -0.816 25061 4856 1 7 . 1 1 109 109 THR CB C 109 69.720 69.720 69.148 0.572 25061 4857 1 7 . 1 1 109 109 THR H H 109 8.803 8.803 8.166 0.637 25061 4858 1 7 . 1 1 110 110 ASP N N 110 123.212 123.212 128.695 -5.483 25061 4859 1 7 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.706 0.263 25061 4860 1 7 . 1 1 110 110 ASP C C 110 175.739 175.739 175.234 0.505 25061 4861 1 7 . 1 1 110 110 ASP CA C 110 53.243 53.243 54.420 -1.177 25061 4862 1 7 . 1 1 110 110 ASP CB C 110 41.351 41.351 38.917 2.434 25061 4863 1 7 . 1 1 110 110 ASP H H 110 8.363 8.363 8.721 -0.358 25061 4864 1 7 . 1 1 111 111 ASN N N 111 116.298 116.298 120.560 -4.262 25061 4865 1 7 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.730 0.146 25061 4866 1 7 . 1 1 111 111 ASN C C 111 174.756 174.756 174.496 0.260 25061 4867 1 7 . 1 1 111 111 ASN CA C 111 52.132 52.132 53.412 -1.280 25061 4868 1 7 . 1 1 111 111 ASN CB C 111 40.765 40.765 40.746 0.019 25061 4869 1 7 . 1 1 111 111 ASN H H 111 8.085 8.085 8.007 0.078 25061 4870 1 7 . 1 1 112 112 GLU HA H 112 3.848 3.848 3.982 -0.134 25061 4871 1 7 . 1 1 112 112 GLU C C 112 177.016 177.016 177.459 -0.443 25061 4872 1 7 . 1 1 112 112 GLU CA C 112 59.480 59.480 59.166 0.314 25061 4873 1 7 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.794 -0.120 25061 4874 1 7 . 1 1 113 113 ASP N N 113 121.033 121.033 119.599 1.434 25061 4875 1 7 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.397 0.016 25061 4876 1 7 . 1 1 113 113 ASP C C 113 178.988 178.988 178.432 0.556 25061 4877 1 7 . 1 1 113 113 ASP CA C 113 57.855 57.855 57.831 0.024 25061 4878 1 7 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.322 0.180 25061 4879 1 7 . 1 1 113 113 ASP H H 113 8.219 8.219 8.702 -0.483 25061 4880 1 7 . 1 1 114 114 GLU N N 114 121.280 121.280 120.423 0.857 25061 4881 1 7 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.141 -0.076 25061 4882 1 7 . 1 1 114 114 GLU C C 114 178.776 178.776 178.173 0.603 25061 4883 1 7 . 1 1 114 114 GLU CA C 114 58.714 58.714 58.793 -0.079 25061 4884 1 7 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.581 -0.368 25061 4885 1 7 . 1 1 114 114 GLU H H 114 8.296 8.296 8.342 -0.046 25061 4886 1 7 . 1 1 115 115 ALA N N 115 120.924 120.924 122.232 -1.308 25061 4887 1 7 . 1 1 115 115 ALA HA H 115 3.838 3.838 3.989 -0.151 25061 4888 1 7 . 1 1 115 115 ALA C C 115 178.502 178.502 179.126 -0.624 25061 4889 1 7 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.557 0.081 25061 4890 1 7 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.188 0.309 25061 4891 1 7 . 1 1 115 115 ALA H H 115 7.853 7.853 8.144 -0.291 25061 4892 1 7 . 1 1 116 116 LYS N N 116 116.616 116.616 118.293 -1.677 25061 4893 1 7 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.987 -0.268 25061 4894 1 7 . 1 1 116 116 LYS C C 116 178.097 178.097 178.788 -0.691 25061 4895 1 7 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.468 1.284 25061 4896 1 7 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.227 0.328 25061 4897 1 7 . 1 1 116 116 LYS H H 116 8.091 8.091 7.717 0.374 25061 4898 1 7 . 1 1 117 117 LYS N N 117 118.990 118.990 118.816 0.174 25061 4899 1 7 . 1 1 117 117 LYS HA H 117 3.911 3.911 4.032 -0.121 25061 4900 1 7 . 1 1 117 117 LYS C C 117 179.186 179.186 179.234 -0.048 25061 4901 1 7 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.758 -0.187 25061 4902 1 7 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.361 0.159 25061 4903 1 7 . 1 1 117 117 LYS H H 117 7.742 7.742 7.508 0.234 25061 4904 1 7 . 1 1 118 118 ARG N N 118 117.441 117.441 119.366 -1.925 25061 4905 1 7 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.061 0.079 25061 4906 1 7 . 1 1 118 118 ARG C C 118 178.921 178.921 178.999 -0.078 25061 4907 1 7 . 1 1 118 118 ARG CA C 118 57.671 57.671 59.209 -1.538 25061 4908 1 7 . 1 1 118 118 ARG CB C 118 29.661 29.661 30.100 -0.439 25061 4909 1 7 . 1 1 118 118 ARG H H 118 8.468 8.468 8.137 0.331 25061 4910 1 7 . 1 1 119 119 LEU N N 119 120.100 120.100 120.190 -0.090 25061 4911 1 7 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.936 0.024 25061 4912 1 7 . 1 1 119 119 LEU C C 119 177.554 177.554 178.583 -1.029 25061 4913 1 7 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.050 -0.168 25061 4914 1 7 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.541 0.348 25061 4915 1 7 . 1 1 119 119 LEU H H 119 8.322 8.322 7.901 0.421 25061 4916 1 7 . 1 1 120 120 LYS N N 120 118.238 118.238 119.175 -0.937 25061 4917 1 7 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.988 -0.166 25061 4918 1 7 . 1 1 120 120 LYS C C 120 178.703 178.703 178.996 -0.293 25061 4919 1 7 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.232 1.114 25061 4920 1 7 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.369 -0.133 25061 4921 1 7 . 1 1 120 120 LYS H H 120 7.990 7.990 7.485 0.505 25061 4922 1 7 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.057 -0.035 25061 4923 1 7 . 1 1 121 121 GLU C C 121 177.769 177.769 179.352 -1.583 25061 4924 1 7 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.100 -0.178 25061 4925 1 7 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.182 0.272 25061 4926 1 7 . 1 1 122 122 LEU N N 122 119.454 119.454 119.560 -0.106 25061 4927 1 7 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.367 -0.234 25061 4928 1 7 . 1 1 122 122 LEU C C 122 178.991 178.991 179.806 -0.815 25061 4929 1 7 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.418 -0.092 25061 4930 1 7 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.954 -0.275 25061 4931 1 7 . 1 1 122 122 LEU H H 122 7.930 7.930 7.530 0.400 25061 4932 1 7 . 1 1 123 123 LEU N N 123 117.862 117.862 119.091 -1.229 25061 4933 1 7 . 1 1 123 123 LEU HA H 123 4.067 4.067 4.041 0.026 25061 4934 1 7 . 1 1 123 123 LEU C C 123 179.178 179.178 179.709 -0.531 25061 4935 1 7 . 1 1 123 123 LEU CA C 123 56.920 56.920 58.011 -1.091 25061 4936 1 7 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.545 -0.335 25061 4937 1 7 . 1 1 123 123 LEU H H 123 8.095 8.095 7.560 0.535 25061 4938 1 7 . 1 1 124 124 GLU N N 124 118.975 118.975 118.233 0.742 25061 4939 1 7 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.163 -0.034 25061 4940 1 7 . 1 1 124 124 GLU C C 124 177.777 177.777 177.407 0.370 25061 4941 1 7 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.749 -0.662 25061 4942 1 7 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.720 -0.180 25061 4943 1 7 . 1 1 124 124 GLU H H 124 7.930 7.930 8.103 -0.173 25061 4944 1 7 . 1 1 125 125 LYS N N 125 118.933 118.933 116.620 2.313 25061 4945 1 7 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.510 -0.173 25061 4946 1 7 . 1 1 125 125 LYS C C 125 178.188 178.188 175.143 3.045 25061 4947 1 7 . 1 1 125 125 LYS CA C 125 56.980 56.980 55.294 1.686 25061 4948 1 7 . 1 1 125 125 LYS CB C 125 32.608 32.608 32.984 -0.376 25061 4949 1 7 . 1 1 125 125 LYS H H 125 7.729 7.729 7.409 0.320 25061 4950 1 7 . 1 1 126 126 VAL N N 126 117.933 117.933 119.176 -1.243 25061 4951 1 7 . 1 1 126 126 VAL HA H 126 4.022 4.022 3.591 0.431 25061 4952 1 7 . 1 1 126 126 VAL C C 126 176.947 176.947 175.797 1.150 25061 4953 1 7 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.024 0.617 25061 4954 1 7 . 1 1 126 126 VAL CB C 126 31.859 31.859 29.855 2.004 25061 4955 1 7 . 1 1 126 126 VAL H H 126 8.044 8.044 7.562 0.482 25061 4956 1 7 . 1 1 127 127 GLY N N 127 109.813 109.813 110.870 -1.057 25061 4957 1 7 . 1 1 127 127 GLY C C 127 174.264 174.264 173.402 0.862 25061 4958 1 7 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.834 -0.555 25061 4959 1 7 . 1 1 127 127 GLY H H 127 8.279 8.279 8.382 -0.103 25061 4960 1 7 . 1 1 128 128 SER N N 128 115.185 115.185 112.856 2.329 25061 4961 1 7 . 1 1 128 128 SER HA H 128 4.462 4.462 4.934 -0.472 25061 4962 1 7 . 1 1 128 128 SER C C 128 174.775 174.775 172.537 2.238 25061 4963 1 7 . 1 1 128 128 SER CA C 128 58.739 58.739 57.142 1.597 25061 4964 1 7 . 1 1 128 128 SER CB C 128 63.850 63.850 65.911 -2.061 25061 4965 1 7 . 1 1 128 128 SER H H 128 8.048 8.048 7.693 0.355 25061 4966 1 7 . 1 1 129 129 LEU N N 129 123.060 123.060 116.290 6.770 25061 4967 1 7 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.709 -0.411 25061 4968 1 7 . 1 1 129 129 LEU C C 129 177.313 177.313 175.591 1.722 25061 4969 1 7 . 1 1 129 129 LEU CA C 129 55.158 55.158 54.493 0.665 25061 4970 1 7 . 1 1 129 129 LEU CB C 129 41.837 41.837 44.156 -2.319 25061 4971 1 7 . 1 1 129 129 LEU H H 129 8.147 8.147 8.129 0.019 25061 4972 1 7 . 1 1 130 130 GLU N N 130 120.088 120.088 118.391 1.697 25061 4973 1 7 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.280 -0.099 25061 4974 1 7 . 1 1 130 130 GLU C C 130 176.148 176.148 176.783 -0.635 25061 4975 1 7 . 1 1 130 130 GLU CA C 130 56.726 56.726 55.102 1.624 25061 4976 1 7 . 1 1 130 130 GLU CB C 130 30.026 30.026 30.547 -0.521 25061 4977 1 7 . 1 1 130 130 GLU H H 130 8.242 8.242 8.730 -0.488 25061 4978 1 8 . 1 1 2 2 GLY CA C 2 45.319 45.319 45.688 -0.369 25061 4979 1 8 . 1 1 3 3 THR HA H 3 4.820 4.820 5.294 -0.474 25061 4980 1 8 . 1 1 3 3 THR C C 3 172.374 172.374 173.327 -0.953 25061 4981 1 8 . 1 1 3 3 THR CA C 3 62.760 62.760 59.623 3.137 25061 4982 1 8 . 1 1 3 3 THR CB C 3 71.441 71.441 70.936 0.505 25061 4983 1 8 . 1 1 4 4 VAL N N 4 126.881 126.881 124.173 2.708 25061 4984 1 8 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.611 -0.043 25061 4985 1 8 . 1 1 4 4 VAL C C 4 173.116 173.116 174.258 -1.142 25061 4986 1 8 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.240 -0.785 25061 4987 1 8 . 1 1 4 4 VAL CB C 4 33.800 33.800 33.445 0.355 25061 4988 1 8 . 1 1 4 4 VAL H H 4 9.097 9.097 8.799 0.298 25061 4989 1 8 . 1 1 5 5 VAL N N 5 127.172 127.172 125.012 2.160 25061 4990 1 8 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.433 -0.546 25061 4991 1 8 . 1 1 5 5 VAL C C 5 174.091 174.091 175.002 -0.911 25061 4992 1 8 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.576 0.542 25061 4993 1 8 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.260 -0.325 25061 4994 1 8 . 1 1 5 5 VAL H H 5 8.811 8.811 8.408 0.403 25061 4995 1 8 . 1 1 6 6 ILE N N 6 127.577 127.577 128.967 -1.390 25061 4996 1 8 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.602 0.018 25061 4997 1 8 . 1 1 6 6 ILE C C 6 173.328 173.328 175.513 -2.185 25061 4998 1 8 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.714 0.118 25061 4999 1 8 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.536 1.394 25061 5000 1 8 . 1 1 6 6 ILE H H 6 9.210 9.210 8.027 1.183 25061 5001 1 8 . 1 1 7 7 VAL N N 7 129.024 129.024 129.175 -0.151 25061 5002 1 8 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.373 0.432 25061 5003 1 8 . 1 1 7 7 VAL C C 7 173.561 173.561 174.898 -1.337 25061 5004 1 8 . 1 1 7 7 VAL CA C 7 60.849 60.849 62.022 -1.173 25061 5005 1 8 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.215 1.145 25061 5006 1 8 . 1 1 7 7 VAL H H 7 9.294 9.294 8.257 1.037 25061 5007 1 8 . 1 1 8 8 VAL N N 8 125.318 125.318 127.739 -2.421 25061 5008 1 8 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.423 -0.027 25061 5009 1 8 . 1 1 8 8 VAL C C 8 175.723 175.723 174.912 0.811 25061 5010 1 8 . 1 1 8 8 VAL CA C 8 59.617 59.617 59.882 -0.265 25061 5011 1 8 . 1 1 8 8 VAL CB C 8 34.915 34.915 35.046 -0.131 25061 5012 1 8 . 1 1 8 8 VAL H H 8 8.898 8.898 8.913 -0.015 25061 5013 1 8 . 1 1 9 9 SER N N 9 116.544 116.544 118.335 -1.791 25061 5014 1 8 . 1 1 9 9 SER HA H 9 4.724 4.724 4.847 -0.123 25061 5015 1 8 . 1 1 9 9 SER C C 9 174.552 174.552 173.444 1.108 25061 5016 1 8 . 1 1 9 9 SER CA C 9 57.419 57.419 56.914 0.504 25061 5017 1 8 . 1 1 9 9 SER CB C 9 64.998 64.998 65.227 -0.229 25061 5018 1 8 . 1 1 9 9 SER H H 9 7.833 7.833 8.142 -0.309 25061 5019 1 8 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.538 0.374 25061 5020 1 8 . 1 1 10 10 ASN C C 10 176.170 176.170 174.819 1.351 25061 5021 1 8 . 1 1 10 10 ASN CA C 10 54.141 54.141 54.874 -0.733 25061 5022 1 8 . 1 1 10 10 ASN CB C 10 38.626 38.626 38.874 -0.248 25061 5023 1 8 . 1 1 11 11 ASP N N 11 120.164 120.164 119.111 1.053 25061 5024 1 8 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.695 0.148 25061 5025 1 8 . 1 1 11 11 ASP C C 11 176.148 176.148 176.079 0.069 25061 5026 1 8 . 1 1 11 11 ASP CA C 11 52.620 52.620 54.326 -1.706 25061 5027 1 8 . 1 1 11 11 ASP CB C 11 42.631 42.631 42.236 0.395 25061 5028 1 8 . 1 1 11 11 ASP H H 11 8.142 8.142 7.552 0.590 25061 5029 1 8 . 1 1 12 12 GLU N N 12 127.184 127.184 126.764 0.420 25061 5030 1 8 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.211 -0.358 25061 5031 1 8 . 1 1 12 12 GLU C C 12 177.853 177.853 178.033 -0.180 25061 5032 1 8 . 1 1 12 12 GLU CA C 12 59.547 59.547 58.246 1.301 25061 5033 1 8 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.963 -0.144 25061 5034 1 8 . 1 1 12 12 GLU H H 12 9.152 9.152 8.907 0.245 25061 5035 1 8 . 1 1 13 13 ARG N N 13 119.026 119.026 119.309 -0.283 25061 5036 1 8 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.376 -0.273 25061 5037 1 8 . 1 1 13 13 ARG C C 13 179.151 179.151 178.923 0.228 25061 5038 1 8 . 1 1 13 13 ARG CA C 13 58.943 58.943 59.040 -0.097 25061 5039 1 8 . 1 1 13 13 ARG CB C 13 28.757 28.757 30.145 -1.389 25061 5040 1 8 . 1 1 13 13 ARG H H 13 8.389 8.389 7.988 0.401 25061 5041 1 8 . 1 1 14 14 ILE N N 14 119.238 119.238 121.141 -1.903 25061 5042 1 8 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.858 -0.257 25061 5043 1 8 . 1 1 14 14 ILE C C 14 177.905 177.905 177.919 -0.014 25061 5044 1 8 . 1 1 14 14 ILE CA C 14 64.666 64.666 64.015 0.651 25061 5045 1 8 . 1 1 14 14 ILE CB C 14 36.780 36.780 37.733 -0.952 25061 5046 1 8 . 1 1 14 14 ILE H H 14 7.254 7.254 7.736 -0.482 25061 5047 1 8 . 1 1 15 15 LEU N N 15 117.008 117.008 119.363 -2.355 25061 5048 1 8 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.108 -0.187 25061 5049 1 8 . 1 1 15 15 LEU C C 15 178.062 178.062 179.354 -1.292 25061 5050 1 8 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.266 0.145 25061 5051 1 8 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.497 -0.328 25061 5052 1 8 . 1 1 15 15 LEU H H 15 7.412 7.412 7.492 -0.080 25061 5053 1 8 . 1 1 16 16 GLU N N 16 117.637 117.637 119.000 -1.363 25061 5054 1 8 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.875 -0.174 25061 5055 1 8 . 1 1 16 16 GLU C C 16 179.182 179.182 178.845 0.337 25061 5056 1 8 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.603 -0.186 25061 5057 1 8 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.319 0.140 25061 5058 1 8 . 1 1 16 16 GLU H H 16 7.981 7.981 8.118 -0.137 25061 5059 1 8 . 1 1 17 17 GLU N N 17 119.759 119.759 120.896 -1.137 25061 5060 1 8 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.222 -0.206 25061 5061 1 8 . 1 1 17 17 GLU C C 17 179.949 179.949 179.236 0.713 25061 5062 1 8 . 1 1 17 17 GLU CA C 17 59.195 59.195 59.135 0.060 25061 5063 1 8 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.794 -0.254 25061 5064 1 8 . 1 1 17 17 GLU H H 17 8.248 8.248 8.150 0.098 25061 5065 1 8 . 1 1 18 18 LEU N N 18 119.764 119.764 119.236 0.528 25061 5066 1 8 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.175 -0.094 25061 5067 1 8 . 1 1 18 18 LEU C C 18 177.620 177.620 178.970 -1.350 25061 5068 1 8 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.466 0.212 25061 5069 1 8 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.631 -0.521 25061 5070 1 8 . 1 1 18 18 LEU H H 18 8.486 8.486 8.117 0.369 25061 5071 1 8 . 1 1 19 19 LEU N N 19 123.102 123.102 120.919 2.183 25061 5072 1 8 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.044 0.618 25061 5073 1 8 . 1 1 19 19 LEU C C 19 178.343 178.343 178.200 0.143 25061 5074 1 8 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.178 1.058 25061 5075 1 8 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.213 -0.562 25061 5076 1 8 . 1 1 19 19 LEU H H 19 7.870 7.870 7.719 0.151 25061 5077 1 8 . 1 1 20 20 GLU N N 20 117.884 117.884 118.519 -0.635 25061 5078 1 8 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.909 -0.005 25061 5079 1 8 . 1 1 20 20 GLU C C 20 177.707 177.707 179.275 -1.568 25061 5080 1 8 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.467 -0.075 25061 5081 1 8 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.360 -0.383 25061 5082 1 8 . 1 1 20 20 GLU H H 20 7.497 7.497 7.621 -0.124 25061 5083 1 8 . 1 1 21 21 VAL N N 21 117.709 117.709 119.474 -1.765 25061 5084 1 8 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.680 -0.056 25061 5085 1 8 . 1 1 21 21 VAL C C 21 178.523 178.523 177.831 0.692 25061 5086 1 8 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.442 -0.245 25061 5087 1 8 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.517 -0.370 25061 5088 1 8 . 1 1 21 21 VAL H H 21 7.514 7.514 7.541 -0.027 25061 5089 1 8 . 1 1 22 22 VAL N N 22 121.233 121.233 118.890 2.343 25061 5090 1 8 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.783 -0.337 25061 5091 1 8 . 1 1 22 22 VAL C C 22 176.868 176.868 178.390 -1.522 25061 5092 1 8 . 1 1 22 22 VAL CA C 22 67.013 67.013 65.405 1.608 25061 5093 1 8 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.034 0.280 25061 5094 1 8 . 1 1 22 22 VAL H H 22 7.863 7.863 7.404 0.459 25061 5095 1 8 . 1 1 23 23 LEU N N 23 118.101 118.101 119.256 -1.155 25061 5096 1 8 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.057 0.008 25061 5097 1 8 . 1 1 23 23 LEU C C 23 179.701 179.701 178.520 1.181 25061 5098 1 8 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.850 -0.554 25061 5099 1 8 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.668 0.036 25061 5100 1 8 . 1 1 23 23 LEU H H 23 8.151 8.151 8.206 -0.055 25061 5101 1 8 . 1 1 24 24 LYS N N 24 114.622 114.622 116.245 -1.623 25061 5102 1 8 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.167 -0.030 25061 5103 1 8 . 1 1 24 24 LYS C C 24 178.062 178.062 178.388 -0.326 25061 5104 1 8 . 1 1 24 24 LYS CA C 24 57.368 57.368 57.906 -0.538 25061 5105 1 8 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.275 0.319 25061 5106 1 8 . 1 1 24 24 LYS H H 24 7.823 7.823 7.994 -0.171 25061 5107 1 8 . 1 1 25 25 SER N N 25 115.474 115.474 116.050 -0.576 25061 5108 1 8 . 1 1 25 25 SER HA H 25 4.377 4.377 4.257 0.120 25061 5109 1 8 . 1 1 25 25 SER C C 25 174.520 174.520 174.943 -0.423 25061 5110 1 8 . 1 1 25 25 SER CA C 25 61.049 61.049 60.624 0.425 25061 5111 1 8 . 1 1 25 25 SER CB C 25 63.777 63.777 63.981 -0.204 25061 5112 1 8 . 1 1 25 25 SER H H 25 7.798 7.798 7.850 -0.052 25061 5113 1 8 . 1 1 26 26 ASP N N 26 117.424 117.424 116.689 0.735 25061 5114 1 8 . 1 1 26 26 ASP HA H 26 4.886 4.886 4.917 -0.031 25061 5115 1 8 . 1 1 26 26 ASP C C 26 173.521 173.521 173.777 -0.256 25061 5116 1 8 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.947 -0.899 25061 5117 1 8 . 1 1 26 26 ASP CB C 26 42.202 42.202 42.392 -0.190 25061 5118 1 8 . 1 1 26 26 ASP H H 26 7.990 7.990 7.949 0.041 25061 5119 1 8 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.511 0.134 25061 5120 1 8 . 1 1 27 27 PRO C C 27 177.016 177.016 176.906 0.110 25061 5121 1 8 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.419 0.182 25061 5122 1 8 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.254 -0.081 25061 5123 1 8 . 1 1 28 28 ASN N N 28 115.839 115.839 117.416 -1.577 25061 5124 1 8 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.593 0.099 25061 5125 1 8 . 1 1 28 28 ASN C C 28 175.701 175.701 175.664 0.037 25061 5126 1 8 . 1 1 28 28 ASN CA C 28 53.472 53.472 54.071 -0.599 25061 5127 1 8 . 1 1 28 28 ASN CB C 28 39.213 39.213 38.428 0.785 25061 5128 1 8 . 1 1 28 28 ASN H H 28 8.608 8.608 8.537 0.071 25061 5129 1 8 . 1 1 29 29 VAL N N 29 120.770 120.770 121.137 -0.367 25061 5130 1 8 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.861 -0.046 25061 5131 1 8 . 1 1 29 29 VAL C C 29 175.023 175.023 176.400 -1.377 25061 5132 1 8 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.709 -1.157 25061 5133 1 8 . 1 1 29 29 VAL CB C 29 32.147 32.147 31.982 0.165 25061 5134 1 8 . 1 1 29 29 VAL H H 29 7.428 7.428 7.902 -0.474 25061 5135 1 8 . 1 1 30 30 LYS N N 30 127.345 127.345 128.225 -0.880 25061 5136 1 8 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.278 0.201 25061 5137 1 8 . 1 1 30 30 LYS C C 30 174.777 174.777 176.024 -1.247 25061 5138 1 8 . 1 1 30 30 LYS CA C 30 55.204 55.204 55.446 -0.242 25061 5139 1 8 . 1 1 30 30 LYS CB C 30 31.949 31.949 30.124 1.825 25061 5140 1 8 . 1 1 30 30 LYS H H 30 8.457 8.457 8.291 0.166 25061 5141 1 8 . 1 1 31 31 THR N N 31 113.552 113.552 116.267 -2.715 25061 5142 1 8 . 1 1 31 31 THR HA H 31 5.723 5.723 4.984 0.739 25061 5143 1 8 . 1 1 31 31 THR C C 31 174.593 174.593 174.237 0.356 25061 5144 1 8 . 1 1 31 31 THR CA C 31 59.030 59.030 60.916 -1.886 25061 5145 1 8 . 1 1 31 31 THR CB C 31 72.206 72.206 69.024 3.182 25061 5146 1 8 . 1 1 31 31 THR H H 31 8.164 8.164 8.166 -0.002 25061 5147 1 8 . 1 1 32 32 VAL N N 32 119.206 119.206 125.872 -6.666 25061 5148 1 8 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.350 0.055 25061 5149 1 8 . 1 1 32 32 VAL C C 32 172.663 172.663 174.732 -2.069 25061 5150 1 8 . 1 1 32 32 VAL CA C 32 61.072 61.072 60.719 0.353 25061 5151 1 8 . 1 1 32 32 VAL CB C 32 35.051 35.051 34.248 0.803 25061 5152 1 8 . 1 1 32 32 VAL H H 32 8.615 8.615 8.762 -0.147 25061 5153 1 8 . 1 1 33 33 ARG N N 33 130.278 130.278 128.986 1.292 25061 5154 1 8 . 1 1 33 33 ARG HA H 33 5.331 5.331 4.718 0.613 25061 5155 1 8 . 1 1 33 33 ARG C C 33 173.836 173.836 175.442 -1.606 25061 5156 1 8 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.832 -1.682 25061 5157 1 8 . 1 1 33 33 ARG CB C 33 30.028 30.028 29.239 0.789 25061 5158 1 8 . 1 1 33 33 ARG H H 33 8.996 8.996 8.794 0.202 25061 5159 1 8 . 1 1 34 34 THR N N 34 121.695 121.695 120.106 1.589 25061 5160 1 8 . 1 1 34 34 THR HA H 34 4.483 4.483 4.620 -0.137 25061 5161 1 8 . 1 1 34 34 THR C C 34 169.769 169.769 173.385 -3.616 25061 5162 1 8 . 1 1 34 34 THR CA C 34 60.814 60.814 61.564 -0.750 25061 5163 1 8 . 1 1 34 34 THR CB C 34 67.402 67.402 71.117 -3.715 25061 5164 1 8 . 1 1 34 34 THR H H 34 8.126 8.126 7.945 0.181 25061 5165 1 8 . 1 1 35 35 ASP N N 35 122.198 122.198 122.192 0.006 25061 5166 1 8 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.602 0.222 25061 5167 1 8 . 1 1 35 35 ASP C C 35 174.790 174.790 175.425 -0.635 25061 5168 1 8 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.183 -0.797 25061 5169 1 8 . 1 1 35 35 ASP CB C 35 41.848 41.848 41.291 0.557 25061 5170 1 8 . 1 1 35 35 ASP H H 35 7.983 7.983 8.522 -0.539 25061 5171 1 8 . 1 1 36 36 ASP N N 36 121.091 121.091 122.892 -1.801 25061 5172 1 8 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.579 0.014 25061 5173 1 8 . 1 1 36 36 ASP C C 36 176.189 176.189 176.944 -0.755 25061 5174 1 8 . 1 1 36 36 ASP CA C 36 53.055 53.055 54.593 -1.538 25061 5175 1 8 . 1 1 36 36 ASP CB C 36 42.159 42.159 39.643 2.516 25061 5176 1 8 . 1 1 36 36 ASP H H 36 8.157 8.157 8.342 -0.185 25061 5177 1 8 . 1 1 37 37 LYS N N 37 125.839 125.839 125.752 0.087 25061 5178 1 8 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.796 -0.074 25061 5179 1 8 . 1 1 37 37 LYS C C 37 176.870 176.870 177.757 -0.887 25061 5180 1 8 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.550 -0.146 25061 5181 1 8 . 1 1 37 37 LYS CB C 37 32.394 32.394 31.880 0.514 25061 5182 1 8 . 1 1 37 37 LYS H H 37 8.843 8.843 8.165 0.678 25061 5183 1 8 . 1 1 38 38 GLU N N 38 118.369 118.369 118.169 0.200 25061 5184 1 8 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.967 0.040 25061 5185 1 8 . 1 1 38 38 GLU C C 38 179.502 179.502 178.469 1.033 25061 5186 1 8 . 1 1 38 38 GLU CA C 38 58.670 58.670 59.010 -0.340 25061 5187 1 8 . 1 1 38 38 GLU CB C 38 28.474 28.474 28.549 -0.075 25061 5188 1 8 . 1 1 38 38 GLU H H 38 8.182 8.182 8.705 -0.523 25061 5189 1 8 . 1 1 39 39 LYS N N 39 121.722 121.722 120.825 0.897 25061 5190 1 8 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.088 0.077 25061 5191 1 8 . 1 1 39 39 LYS C C 39 178.500 178.500 178.733 -0.233 25061 5192 1 8 . 1 1 39 39 LYS CA C 39 57.736 57.736 59.189 -1.453 25061 5193 1 8 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.220 -1.082 25061 5194 1 8 . 1 1 39 39 LYS H H 39 7.524 7.524 7.261 0.263 25061 5195 1 8 . 1 1 40 40 VAL N N 40 117.199 117.199 118.763 -1.564 25061 5196 1 8 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.908 -0.680 25061 5197 1 8 . 1 1 40 40 VAL C C 40 177.362 177.362 178.305 -0.943 25061 5198 1 8 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.164 1.478 25061 5199 1 8 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.156 -0.253 25061 5200 1 8 . 1 1 40 40 VAL H H 40 7.883 7.883 8.014 -0.131 25061 5201 1 8 . 1 1 41 41 LYS N N 41 117.677 117.677 117.958 -0.281 25061 5202 1 8 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.798 -0.356 25061 5203 1 8 . 1 1 41 41 LYS C C 41 177.686 177.686 178.735 -1.049 25061 5204 1 8 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.837 0.972 25061 5205 1 8 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.391 0.224 25061 5206 1 8 . 1 1 41 41 LYS H H 41 7.567 7.567 7.522 0.045 25061 5207 1 8 . 1 1 42 42 GLU N N 42 118.369 118.369 119.805 -1.436 25061 5208 1 8 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.081 -0.074 25061 5209 1 8 . 1 1 42 42 GLU C C 42 179.725 179.725 178.573 1.152 25061 5210 1 8 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.164 -0.095 25061 5211 1 8 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.657 -0.118 25061 5212 1 8 . 1 1 42 42 GLU H H 42 7.634 7.634 7.586 0.048 25061 5213 1 8 . 1 1 43 43 GLU N N 43 117.906 117.906 119.414 -1.508 25061 5214 1 8 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.150 0.033 25061 5215 1 8 . 1 1 43 43 GLU C C 43 179.757 179.757 179.276 0.481 25061 5216 1 8 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.623 -0.258 25061 5217 1 8 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.659 -0.818 25061 5218 1 8 . 1 1 43 43 GLU H H 43 8.162 8.162 7.511 0.651 25061 5219 1 8 . 1 1 44 44 ILE N N 44 122.291 122.291 121.269 1.022 25061 5220 1 8 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.579 0.033 25061 5221 1 8 . 1 1 44 44 ILE C C 44 177.101 177.101 177.370 -0.269 25061 5222 1 8 . 1 1 44 44 ILE CA C 44 66.355 66.355 66.172 0.183 25061 5223 1 8 . 1 1 44 44 ILE CB C 44 37.460 37.460 38.110 -0.650 25061 5224 1 8 . 1 1 44 44 ILE H H 44 8.742 8.742 8.521 0.221 25061 5225 1 8 . 1 1 45 45 GLU N N 45 119.892 119.892 120.123 -0.231 25061 5226 1 8 . 1 1 45 45 GLU HA H 45 4.058 4.058 3.883 0.175 25061 5227 1 8 . 1 1 45 45 GLU C C 45 178.991 178.991 178.817 0.174 25061 5228 1 8 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.964 -0.299 25061 5229 1 8 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.434 -0.273 25061 5230 1 8 . 1 1 45 45 GLU H H 45 8.171 8.171 7.913 0.258 25061 5231 1 8 . 1 1 46 46 LYS N N 46 118.064 118.064 118.576 -0.512 25061 5232 1 8 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.047 -0.065 25061 5233 1 8 . 1 1 46 46 LYS C C 46 178.837 178.837 179.042 -0.205 25061 5234 1 8 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.115 0.626 25061 5235 1 8 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.260 0.183 25061 5236 1 8 . 1 1 46 46 LYS H H 46 7.785 7.785 7.486 0.299 25061 5237 1 8 . 1 1 47 47 ALA N N 47 121.817 121.817 122.299 -0.482 25061 5238 1 8 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.085 -0.054 25061 5239 1 8 . 1 1 47 47 ALA C C 47 179.859 179.859 179.281 0.578 25061 5240 1 8 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.200 0.095 25061 5241 1 8 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.708 -1.052 25061 5242 1 8 . 1 1 47 47 ALA H H 47 8.123 8.123 7.782 0.341 25061 5243 1 8 . 1 1 48 48 ARG N N 48 119.080 119.080 117.823 1.257 25061 5244 1 8 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.146 -0.057 25061 5245 1 8 . 1 1 48 48 ARG C C 48 180.155 180.155 178.471 1.684 25061 5246 1 8 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.096 1.101 25061 5247 1 8 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.327 0.183 25061 5248 1 8 . 1 1 48 48 ARG H H 48 8.768 8.768 8.039 0.729 25061 5249 1 8 . 1 1 49 49 LYS N N 49 119.951 119.951 120.481 -0.530 25061 5250 1 8 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.100 -0.061 25061 5251 1 8 . 1 1 49 49 LYS C C 49 178.288 178.288 178.494 -0.206 25061 5252 1 8 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.725 0.112 25061 5253 1 8 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.418 -0.275 25061 5254 1 8 . 1 1 49 49 LYS H H 49 8.037 8.037 7.874 0.163 25061 5255 1 8 . 1 1 50 50 GLN N N 50 115.284 115.284 116.186 -0.902 25061 5256 1 8 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.233 0.109 25061 5257 1 8 . 1 1 50 50 GLN C C 50 176.180 176.180 177.189 -1.009 25061 5258 1 8 . 1 1 50 50 GLN CA C 50 55.741 55.741 56.531 -0.790 25061 5259 1 8 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.371 0.194 25061 5260 1 8 . 1 1 50 50 GLN H H 50 7.740 7.740 7.784 -0.044 25061 5261 1 8 . 1 1 51 51 GLY N N 51 109.725 109.725 108.991 0.734 25061 5262 1 8 . 1 1 51 51 GLY C C 51 174.552 174.552 174.567 -0.015 25061 5263 1 8 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.084 1.279 25061 5264 1 8 . 1 1 51 51 GLY H H 51 8.027 8.027 7.802 0.225 25061 5265 1 8 . 1 1 52 52 ARG N N 52 119.064 119.064 120.865 -1.801 25061 5266 1 8 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.788 0.109 25061 5267 1 8 . 1 1 52 52 ARG C C 52 173.123 173.123 173.942 -0.819 25061 5268 1 8 . 1 1 52 52 ARG CA C 52 52.247 52.247 53.059 -0.812 25061 5269 1 8 . 1 1 52 52 ARG CB C 52 32.366 32.366 31.192 1.174 25061 5270 1 8 . 1 1 52 52 ARG H H 52 7.969 7.969 7.526 0.443 25061 5271 1 8 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.654 0.201 25061 5272 1 8 . 1 1 53 53 PRO C C 53 174.069 174.069 175.749 -1.680 25061 5273 1 8 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.599 -0.781 25061 5274 1 8 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.894 -0.834 25061 5275 1 8 . 1 1 54 54 ILE N N 54 116.301 116.301 118.652 -2.351 25061 5276 1 8 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.660 0.578 25061 5277 1 8 . 1 1 54 54 ILE C C 54 171.709 171.709 174.035 -2.326 25061 5278 1 8 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.707 -1.933 25061 5279 1 8 . 1 1 54 54 ILE CB C 54 41.558 41.558 40.489 1.069 25061 5280 1 8 . 1 1 54 54 ILE H H 54 7.920 7.920 7.671 0.249 25061 5281 1 8 . 1 1 55 55 VAL N N 55 126.302 126.302 130.536 -4.234 25061 5282 1 8 . 1 1 55 55 VAL HA H 55 4.924 4.924 4.950 -0.026 25061 5283 1 8 . 1 1 55 55 VAL C C 55 173.624 173.624 175.142 -1.518 25061 5284 1 8 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.839 -1.044 25061 5285 1 8 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.395 0.433 25061 5286 1 8 . 1 1 55 55 VAL H H 55 8.652 8.652 8.414 0.238 25061 5287 1 8 . 1 1 56 56 ILE N N 56 127.503 127.503 128.418 -0.915 25061 5288 1 8 . 1 1 56 56 ILE HA H 56 4.664 4.664 5.002 -0.338 25061 5289 1 8 . 1 1 56 56 ILE C C 56 173.479 173.479 175.506 -2.027 25061 5290 1 8 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.169 0.838 25061 5291 1 8 . 1 1 56 56 ILE CB C 56 40.285 40.285 38.197 2.088 25061 5292 1 8 . 1 1 56 56 ILE H H 56 9.124 9.124 8.089 1.035 25061 5293 1 8 . 1 1 57 57 PHE N N 57 125.302 125.302 127.797 -2.495 25061 5294 1 8 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.307 -0.091 25061 5295 1 8 . 1 1 57 57 PHE C C 57 174.536 174.536 175.801 -1.265 25061 5296 1 8 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.496 -0.535 25061 5297 1 8 . 1 1 57 57 PHE CB C 57 40.429 40.429 40.756 -0.327 25061 5298 1 8 . 1 1 57 57 PHE H H 57 8.971 8.971 8.234 0.737 25061 5299 1 8 . 1 1 58 58 ILE N N 58 126.472 126.472 123.139 3.333 25061 5300 1 8 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.408 0.107 25061 5301 1 8 . 1 1 58 58 ILE C C 58 173.391 173.391 174.495 -1.104 25061 5302 1 8 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.432 -0.342 25061 5303 1 8 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.725 -0.983 25061 5304 1 8 . 1 1 58 58 ILE H H 58 9.248 9.248 9.092 0.156 25061 5305 1 8 . 1 1 59 59 ARG N N 59 124.681 124.681 124.120 0.561 25061 5306 1 8 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.159 -0.230 25061 5307 1 8 . 1 1 59 59 ARG C C 59 178.521 178.521 178.016 0.505 25061 5308 1 8 . 1 1 59 59 ARG CA C 59 55.742 55.742 54.880 0.862 25061 5309 1 8 . 1 1 59 59 ARG CB C 59 30.918 30.918 33.106 -2.188 25061 5310 1 8 . 1 1 59 59 ARG H H 59 8.587 8.587 8.530 0.057 25061 5311 1 8 . 1 1 60 60 GLY N N 60 108.848 108.848 110.777 -1.929 25061 5312 1 8 . 1 1 60 60 GLY C C 60 174.775 174.775 174.759 0.016 25061 5313 1 8 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.427 -0.460 25061 5314 1 8 . 1 1 60 60 GLY H H 60 7.732 7.732 8.408 -0.676 25061 5315 1 8 . 1 1 61 61 ALA N N 61 120.877 120.877 123.314 -2.437 25061 5316 1 8 . 1 1 61 61 ALA HA H 61 4.144 4.144 4.145 -0.001 25061 5317 1 8 . 1 1 61 61 ALA C C 61 177.769 177.769 179.816 -2.047 25061 5318 1 8 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.851 -0.402 25061 5319 1 8 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.467 -0.096 25061 5320 1 8 . 1 1 61 61 ALA H H 61 7.852 7.852 8.208 -0.356 25061 5321 1 8 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.232 0.568 25061 5322 1 8 . 1 1 62 62 TYR CA C 62 63.039 63.039 60.258 2.781 25061 5323 1 8 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.836 -0.396 25061 5324 1 8 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.722 -0.037 25061 5325 1 8 . 1 1 63 63 GLU C C 63 176.251 176.251 177.850 -1.599 25061 5326 1 8 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.181 0.077 25061 5327 1 8 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.020 0.392 25061 5328 1 8 . 1 1 64 64 GLU N N 64 119.209 119.209 118.736 0.473 25061 5329 1 8 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.868 0.033 25061 5330 1 8 . 1 1 64 64 GLU C C 64 178.251 178.251 179.215 -0.964 25061 5331 1 8 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.652 0.560 25061 5332 1 8 . 1 1 64 64 GLU CB C 64 28.645 28.645 29.121 -0.476 25061 5333 1 8 . 1 1 64 64 GLU H H 64 8.878 8.878 7.580 1.298 25061 5334 1 8 . 1 1 65 65 VAL N N 65 116.728 116.728 118.746 -2.018 25061 5335 1 8 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.773 0.209 25061 5336 1 8 . 1 1 65 65 VAL C C 65 176.915 176.915 178.164 -1.249 25061 5337 1 8 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.412 -0.803 25061 5338 1 8 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.712 0.183 25061 5339 1 8 . 1 1 65 65 VAL H H 65 7.652 7.652 7.770 -0.118 25061 5340 1 8 . 1 1 66 66 VAL N N 66 119.462 119.462 119.718 -0.256 25061 5341 1 8 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.618 -0.304 25061 5342 1 8 . 1 1 66 66 VAL C C 66 177.142 177.142 177.330 -0.188 25061 5343 1 8 . 1 1 66 66 VAL CA C 66 67.335 67.335 65.897 1.438 25061 5344 1 8 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.404 0.027 25061 5345 1 8 . 1 1 66 66 VAL H H 66 7.896 7.896 7.386 0.510 25061 5346 1 8 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.053 -0.425 25061 5347 1 8 . 1 1 67 67 ARG C C 67 177.841 177.841 178.011 -0.170 25061 5348 1 8 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.702 0.350 25061 5349 1 8 . 1 1 67 67 ARG CB C 67 29.393 29.393 30.083 -0.690 25061 5350 1 8 . 1 1 68 68 ASP N N 68 118.316 118.316 118.143 0.173 25061 5351 1 8 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.509 -0.148 25061 5352 1 8 . 1 1 68 68 ASP C C 68 178.945 178.945 178.328 0.617 25061 5353 1 8 . 1 1 68 68 ASP CA C 68 57.311 57.311 57.390 -0.079 25061 5354 1 8 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.870 0.644 25061 5355 1 8 . 1 1 68 68 ASP H H 68 7.625 7.625 7.757 -0.132 25061 5356 1 8 . 1 1 69 69 ILE N N 69 119.231 119.231 119.775 -0.544 25061 5357 1 8 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.761 -0.131 25061 5358 1 8 . 1 1 69 69 ILE C C 69 177.138 177.138 178.109 -0.971 25061 5359 1 8 . 1 1 69 69 ILE CA C 69 64.540 64.540 64.636 -0.096 25061 5360 1 8 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.989 -0.939 25061 5361 1 8 . 1 1 69 69 ILE H H 69 8.113 8.113 7.375 0.738 25061 5362 1 8 . 1 1 70 70 VAL N N 70 120.164 120.164 119.857 0.307 25061 5363 1 8 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.566 -0.149 25061 5364 1 8 . 1 1 70 70 VAL C C 70 177.079 177.079 177.903 -0.824 25061 5365 1 8 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.450 -0.176 25061 5366 1 8 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.109 0.149 25061 5367 1 8 . 1 1 70 70 VAL H H 70 8.478 8.478 8.055 0.423 25061 5368 1 8 . 1 1 71 71 GLU N N 71 118.293 118.293 119.776 -1.483 25061 5369 1 8 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.926 0.128 25061 5370 1 8 . 1 1 71 71 GLU C C 71 179.009 179.009 178.877 0.132 25061 5371 1 8 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.739 -0.323 25061 5372 1 8 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.452 -0.630 25061 5373 1 8 . 1 1 71 71 GLU H H 71 8.152 8.152 7.761 0.391 25061 5374 1 8 . 1 1 72 72 TYR N N 72 120.091 120.091 120.395 -0.304 25061 5375 1 8 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.127 0.035 25061 5376 1 8 . 1 1 72 72 TYR C C 72 176.404 176.404 177.150 -0.746 25061 5377 1 8 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.470 -0.338 25061 5378 1 8 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.457 -0.320 25061 5379 1 8 . 1 1 72 72 TYR H H 72 7.959 7.959 7.537 0.422 25061 5380 1 8 . 1 1 73 73 ALA N N 73 120.133 120.133 120.983 -0.850 25061 5381 1 8 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.958 -0.328 25061 5382 1 8 . 1 1 73 73 ALA C C 73 179.182 179.182 179.818 -0.636 25061 5383 1 8 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.264 -0.152 25061 5384 1 8 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.188 0.003 25061 5385 1 8 . 1 1 73 73 ALA H H 73 8.604 8.604 8.276 0.328 25061 5386 1 8 . 1 1 74 74 GLN N N 74 115.553 115.553 116.903 -1.350 25061 5387 1 8 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.041 0.097 25061 5388 1 8 . 1 1 74 74 GLN C C 74 180.595 180.595 178.640 1.955 25061 5389 1 8 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.044 1.051 25061 5390 1 8 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.709 -0.134 25061 5391 1 8 . 1 1 74 74 GLN H H 74 8.619 8.619 7.973 0.646 25061 5392 1 8 . 1 1 75 75 LYS N N 75 122.396 122.396 119.605 2.791 25061 5393 1 8 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.032 -0.004 25061 5394 1 8 . 1 1 75 75 LYS C C 75 178.521 178.521 178.486 0.035 25061 5395 1 8 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.283 0.775 25061 5396 1 8 . 1 1 75 75 LYS CB C 75 31.599 31.599 32.047 -0.448 25061 5397 1 8 . 1 1 75 75 LYS H H 75 8.123 8.123 7.697 0.426 25061 5398 1 8 . 1 1 76 76 GLU N N 76 116.294 116.294 115.331 0.963 25061 5399 1 8 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.282 -0.183 25061 5400 1 8 . 1 1 76 76 GLU C C 76 175.957 175.957 176.625 -0.668 25061 5401 1 8 . 1 1 76 76 GLU CA C 76 55.605 55.605 55.432 0.173 25061 5402 1 8 . 1 1 76 76 GLU CB C 76 29.824 29.824 28.714 1.110 25061 5403 1 8 . 1 1 76 76 GLU H H 76 7.450 7.450 7.580 -0.130 25061 5404 1 8 . 1 1 77 77 GLY N N 77 107.446 107.446 106.886 0.560 25061 5405 1 8 . 1 1 77 77 GLY C C 77 174.520 174.520 174.588 -0.068 25061 5406 1 8 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.768 0.039 25061 5407 1 8 . 1 1 77 77 GLY H H 77 7.763 7.763 7.479 0.284 25061 5408 1 8 . 1 1 78 78 LEU N N 78 120.179 120.179 119.279 0.900 25061 5409 1 8 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.499 -0.111 25061 5410 1 8 . 1 1 78 78 LEU C C 78 175.914 175.914 176.760 -0.846 25061 5411 1 8 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.961 -0.488 25061 5412 1 8 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.755 -0.866 25061 5413 1 8 . 1 1 78 78 LEU H H 78 7.930 7.930 7.815 0.115 25061 5414 1 8 . 1 1 79 79 ARG N N 79 122.207 122.207 124.065 -1.858 25061 5415 1 8 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.226 0.171 25061 5416 1 8 . 1 1 79 79 ARG C C 79 174.960 174.960 174.663 0.297 25061 5417 1 8 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.156 0.492 25061 5418 1 8 . 1 1 79 79 ARG CB C 79 30.476 30.476 29.829 0.647 25061 5419 1 8 . 1 1 79 79 ARG H H 79 8.241 8.241 8.280 -0.039 25061 5420 1 8 . 1 1 80 80 VAL N N 80 123.333 123.333 126.839 -3.506 25061 5421 1 8 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.484 0.811 25061 5422 1 8 . 1 1 80 80 VAL C C 80 174.048 174.048 174.230 -0.182 25061 5423 1 8 . 1 1 80 80 VAL CA C 80 60.041 60.041 62.038 -1.997 25061 5424 1 8 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.773 1.532 25061 5425 1 8 . 1 1 80 80 VAL H H 80 8.359 8.359 8.516 -0.157 25061 5426 1 8 . 1 1 81 81 LEU N N 81 128.719 128.719 130.084 -1.365 25061 5427 1 8 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.163 -0.059 25061 5428 1 8 . 1 1 81 81 LEU C C 81 174.484 174.484 174.653 -0.169 25061 5429 1 8 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.598 0.522 25061 5430 1 8 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.850 -0.895 25061 5431 1 8 . 1 1 81 81 LEU H H 81 8.650 8.650 8.928 -0.278 25061 5432 1 8 . 1 1 82 82 VAL N N 82 122.487 122.487 123.027 -0.540 25061 5433 1 8 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.513 0.584 25061 5434 1 8 . 1 1 82 82 VAL C C 82 174.525 174.525 174.646 -0.121 25061 5435 1 8 . 1 1 82 82 VAL CA C 82 60.285 60.285 60.759 -0.474 25061 5436 1 8 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.421 2.368 25061 5437 1 8 . 1 1 82 82 VAL H H 82 8.781 8.781 8.374 0.407 25061 5438 1 8 . 1 1 83 83 ILE N N 83 128.082 128.082 128.463 -0.381 25061 5439 1 8 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.625 0.305 25061 5440 1 8 . 1 1 83 83 ILE C C 83 172.925 172.925 174.942 -2.017 25061 5441 1 8 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.672 -0.731 25061 5442 1 8 . 1 1 83 83 ILE CB C 83 40.186 40.186 37.778 2.409 25061 5443 1 8 . 1 1 83 83 ILE H H 83 9.527 9.527 8.515 1.012 25061 5444 1 8 . 1 1 84 84 LYS N N 84 128.493 128.493 126.244 2.249 25061 5445 1 8 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.267 -0.219 25061 5446 1 8 . 1 1 84 84 LYS C C 84 174.027 174.027 175.454 -1.427 25061 5447 1 8 . 1 1 84 84 LYS CA C 84 53.253 53.253 53.768 -0.515 25061 5448 1 8 . 1 1 84 84 LYS CB C 84 34.652 34.652 36.127 -1.474 25061 5449 1 8 . 1 1 84 84 LYS H H 84 8.721 8.721 9.086 -0.365 25061 5450 1 8 . 1 1 85 85 VAL N N 85 126.729 126.729 125.051 1.678 25061 5451 1 8 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.220 0.516 25061 5452 1 8 . 1 1 85 85 VAL C C 85 175.935 175.935 175.670 0.265 25061 5453 1 8 . 1 1 85 85 VAL CA C 85 60.200 60.200 61.914 -1.714 25061 5454 1 8 . 1 1 85 85 VAL CB C 85 30.847 30.847 32.156 -1.309 25061 5455 1 8 . 1 1 85 85 VAL H H 85 8.643 8.643 8.077 0.566 25061 5456 1 8 . 1 1 86 86 ALA N N 86 132.930 132.930 129.747 3.183 25061 5457 1 8 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.484 -0.054 25061 5458 1 8 . 1 1 86 86 ALA C C 86 175.635 175.635 176.955 -1.320 25061 5459 1 8 . 1 1 86 86 ALA CA C 86 51.504 51.504 52.268 -0.764 25061 5460 1 8 . 1 1 86 86 ALA CB C 86 20.821 20.821 19.950 0.872 25061 5461 1 8 . 1 1 86 86 ALA H H 86 8.835 8.835 8.606 0.229 25061 5462 1 8 . 1 1 87 87 GLN N N 87 118.719 118.719 120.318 -1.599 25061 5463 1 8 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.350 0.119 25061 5464 1 8 . 1 1 87 87 GLN C C 87 175.949 175.949 175.973 -0.024 25061 5465 1 8 . 1 1 87 87 GLN CA C 87 55.260 55.260 56.054 -0.794 25061 5466 1 8 . 1 1 87 87 GLN CB C 87 30.432 30.432 29.874 0.558 25061 5467 1 8 . 1 1 87 87 GLN H H 87 8.570 8.570 8.582 -0.012 25061 5468 1 8 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.459 0.021 25061 5469 1 8 . 1 1 88 88 ASP CA C 88 55.454 55.454 55.892 -0.438 25061 5470 1 8 . 1 1 88 88 ASP CB C 88 41.204 41.204 41.113 0.091 25061 5471 1 8 . 1 1 89 89 GLN HA H 89 4.047 4.047 3.767 0.280 25061 5472 1 8 . 1 1 89 89 GLN CA C 89 56.687 56.687 58.515 -1.828 25061 5473 1 8 . 1 1 89 89 GLN CB C 89 27.850 27.850 27.113 0.737 25061 5474 1 8 . 1 1 92 92 LEU N N 92 125.291 125.291 120.312 4.979 25061 5475 1 8 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.084 0.117 25061 5476 1 8 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.543 -2.486 25061 5477 1 8 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.589 0.458 25061 5478 1 8 . 1 1 92 92 LEU H H 92 8.277 8.277 7.991 0.286 25061 5479 1 8 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.358 0.398 25061 5480 1 8 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.103 -0.054 25061 5481 1 8 . 1 1 94 94 ARG C C 94 178.544 178.544 178.459 0.085 25061 5482 1 8 . 1 1 94 94 ARG CA C 94 58.607 58.607 58.977 -0.370 25061 5483 1 8 . 1 1 94 94 ARG CB C 94 29.614 29.614 29.726 -0.112 25061 5484 1 8 . 1 1 95 95 PHE N N 95 117.407 117.407 119.076 -1.669 25061 5485 1 8 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.322 0.053 25061 5486 1 8 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.497 -0.266 25061 5487 1 8 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.324 -1.382 25061 5488 1 8 . 1 1 95 95 PHE H H 95 8.419 8.419 7.752 0.667 25061 5489 1 8 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.974 -0.166 25061 5490 1 8 . 1 1 96 96 TYR C C 96 177.728 177.728 177.288 0.440 25061 5491 1 8 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.792 1.364 25061 5492 1 8 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.563 -0.863 25061 5493 1 8 . 1 1 97 97 GLU N N 97 119.054 119.054 118.574 0.480 25061 5494 1 8 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.798 0.265 25061 5495 1 8 . 1 1 97 97 GLU C C 97 179.071 179.071 178.790 0.281 25061 5496 1 8 . 1 1 97 97 GLU CA C 97 58.760 58.760 59.568 -0.808 25061 5497 1 8 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.525 -0.353 25061 5498 1 8 . 1 1 97 97 GLU H H 97 7.858 7.858 8.227 -0.369 25061 5499 1 8 . 1 1 98 98 GLN N N 98 119.385 119.385 118.093 1.292 25061 5500 1 8 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.966 -0.065 25061 5501 1 8 . 1 1 98 98 GLN C C 98 177.599 177.599 178.896 -1.297 25061 5502 1 8 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.277 0.034 25061 5503 1 8 . 1 1 98 98 GLN CB C 98 27.766 27.766 28.146 -0.380 25061 5504 1 8 . 1 1 98 98 GLN H H 98 7.747 7.747 7.602 0.145 25061 5505 1 8 . 1 1 99 99 LEU N N 99 118.348 118.348 120.378 -2.030 25061 5506 1 8 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.818 0.201 25061 5507 1 8 . 1 1 99 99 LEU C C 99 178.669 178.669 178.737 -0.068 25061 5508 1 8 . 1 1 99 99 LEU CA C 99 57.430 57.430 57.928 -0.499 25061 5509 1 8 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.339 0.164 25061 5510 1 8 . 1 1 99 99 LEU H H 99 7.891 7.891 7.510 0.381 25061 5511 1 8 . 1 1 100 100 LYS N N 100 118.332 118.332 118.153 0.179 25061 5512 1 8 . 1 1 100 100 LYS HA H 100 4.509 4.509 4.184 0.325 25061 5513 1 8 . 1 1 100 100 LYS C C 100 180.846 180.846 179.200 1.646 25061 5514 1 8 . 1 1 100 100 LYS CA C 100 59.088 59.088 57.928 1.160 25061 5515 1 8 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.814 0.455 25061 5516 1 8 . 1 1 100 100 LYS H H 100 7.560 7.560 7.456 0.104 25061 5517 1 8 . 1 1 101 101 LYS N N 101 121.944 121.944 119.146 2.798 25061 5518 1 8 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.119 -0.047 25061 5519 1 8 . 1 1 101 101 LYS C C 101 177.707 177.707 177.650 0.057 25061 5520 1 8 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.469 0.402 25061 5521 1 8 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.523 -0.428 25061 5522 1 8 . 1 1 101 101 LYS H H 101 7.959 7.959 7.851 0.108 25061 5523 1 8 . 1 1 102 102 ASP N N 102 118.788 118.788 117.722 1.066 25061 5524 1 8 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.440 0.254 25061 5525 1 8 . 1 1 102 102 ASP C C 102 176.359 176.359 177.294 -0.935 25061 5526 1 8 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.399 -0.820 25061 5527 1 8 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.822 -1.248 25061 5528 1 8 . 1 1 102 102 ASP H H 102 7.893 7.893 7.694 0.199 25061 5529 1 8 . 1 1 103 103 GLY N N 103 107.024 107.024 106.136 0.888 25061 5530 1 8 . 1 1 103 103 GLY C C 103 174.328 174.328 173.493 0.835 25061 5531 1 8 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.662 0.683 25061 5532 1 8 . 1 1 103 103 GLY H H 103 7.866 7.866 7.999 -0.133 25061 5533 1 8 . 1 1 104 104 VAL N N 104 123.060 123.060 120.173 2.887 25061 5534 1 8 . 1 1 104 104 VAL HA H 104 3.973 3.973 4.210 -0.237 25061 5535 1 8 . 1 1 104 104 VAL C C 104 175.023 175.023 174.475 0.548 25061 5536 1 8 . 1 1 104 104 VAL CA C 104 61.878 61.878 61.062 0.816 25061 5537 1 8 . 1 1 104 104 VAL CB C 104 32.088 32.088 32.479 -0.391 25061 5538 1 8 . 1 1 104 104 VAL H H 104 7.955 7.955 8.021 -0.066 25061 5539 1 8 . 1 1 105 105 ASP N N 105 127.987 127.987 125.622 2.365 25061 5540 1 8 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.743 -0.168 25061 5541 1 8 . 1 1 105 105 ASP C C 105 173.624 173.624 174.563 -0.939 25061 5542 1 8 . 1 1 105 105 ASP CA C 105 54.087 54.087 53.917 0.170 25061 5543 1 8 . 1 1 105 105 ASP CB C 105 40.660 40.660 42.984 -2.324 25061 5544 1 8 . 1 1 105 105 ASP H H 105 8.399 8.399 8.042 0.357 25061 5545 1 8 . 1 1 106 106 VAL N N 106 125.798 125.798 121.505 4.293 25061 5546 1 8 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.649 0.166 25061 5547 1 8 . 1 1 106 106 VAL C C 106 174.902 174.902 175.486 -0.584 25061 5548 1 8 . 1 1 106 106 VAL CA C 106 60.194 60.194 60.478 -0.284 25061 5549 1 8 . 1 1 106 106 VAL CB C 106 34.179 34.179 34.868 -0.689 25061 5550 1 8 . 1 1 106 106 VAL H H 106 7.550 7.550 8.314 -0.764 25061 5551 1 8 . 1 1 107 107 ARG N N 107 128.099 128.099 126.825 1.274 25061 5552 1 8 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.804 0.072 25061 5553 1 8 . 1 1 107 107 ARG C C 107 173.815 173.815 174.710 -0.895 25061 5554 1 8 . 1 1 107 107 ARG CA C 107 53.386 53.386 53.080 0.306 25061 5555 1 8 . 1 1 107 107 ARG CB C 107 31.195 31.195 30.569 0.626 25061 5556 1 8 . 1 1 107 107 ARG H H 107 9.132 9.132 9.047 0.085 25061 5557 1 8 . 1 1 108 108 VAL N N 108 123.979 123.979 122.982 0.997 25061 5558 1 8 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.212 -0.270 25061 5559 1 8 . 1 1 108 108 VAL C C 108 175.854 175.854 176.726 -0.872 25061 5560 1 8 . 1 1 108 108 VAL CA C 108 60.017 60.017 60.795 -0.779 25061 5561 1 8 . 1 1 108 108 VAL CB C 108 32.844 32.844 31.632 1.212 25061 5562 1 8 . 1 1 108 108 VAL H H 108 8.561 8.561 8.729 -0.168 25061 5563 1 8 . 1 1 109 109 THR N N 109 120.144 120.144 116.099 4.045 25061 5564 1 8 . 1 1 109 109 THR HA H 109 4.815 4.815 4.384 0.431 25061 5565 1 8 . 1 1 109 109 THR C C 109 171.867 171.867 175.412 -3.545 25061 5566 1 8 . 1 1 109 109 THR CA C 109 59.613 59.613 61.971 -2.358 25061 5567 1 8 . 1 1 109 109 THR CB C 109 69.720 69.720 70.326 -0.606 25061 5568 1 8 . 1 1 109 109 THR H H 109 8.803 8.803 8.052 0.751 25061 5569 1 8 . 1 1 110 110 ASP N N 110 123.212 123.212 122.785 0.427 25061 5570 1 8 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.322 0.647 25061 5571 1 8 . 1 1 110 110 ASP C C 110 175.739 175.739 175.179 0.560 25061 5572 1 8 . 1 1 110 110 ASP CA C 110 53.243 53.243 57.015 -3.772 25061 5573 1 8 . 1 1 110 110 ASP CB C 110 41.351 41.351 39.446 1.905 25061 5574 1 8 . 1 1 110 110 ASP H H 110 8.363 8.363 8.577 -0.214 25061 5575 1 8 . 1 1 111 111 ASN N N 111 116.298 116.298 121.580 -5.282 25061 5576 1 8 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.694 0.182 25061 5577 1 8 . 1 1 111 111 ASN C C 111 174.756 174.756 176.368 -1.612 25061 5578 1 8 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.984 -0.852 25061 5579 1 8 . 1 1 111 111 ASN CB C 111 40.765 40.765 39.285 1.480 25061 5580 1 8 . 1 1 111 111 ASN H H 111 8.085 8.085 8.162 -0.077 25061 5581 1 8 . 1 1 112 112 GLU HA H 112 3.848 3.848 3.977 -0.129 25061 5582 1 8 . 1 1 112 112 GLU C C 112 177.016 177.016 178.064 -1.048 25061 5583 1 8 . 1 1 112 112 GLU CA C 112 59.480 59.480 59.377 0.103 25061 5584 1 8 . 1 1 112 112 GLU CB C 112 29.674 29.674 28.919 0.754 25061 5585 1 8 . 1 1 113 113 ASP N N 113 121.033 121.033 119.653 1.380 25061 5586 1 8 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.321 0.092 25061 5587 1 8 . 1 1 113 113 ASP C C 113 178.988 178.988 178.187 0.801 25061 5588 1 8 . 1 1 113 113 ASP CA C 113 57.855 57.855 57.632 0.223 25061 5589 1 8 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.486 0.016 25061 5590 1 8 . 1 1 113 113 ASP H H 113 8.219 8.219 8.417 -0.198 25061 5591 1 8 . 1 1 114 114 GLU N N 114 121.280 121.280 120.338 0.942 25061 5592 1 8 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.012 0.053 25061 5593 1 8 . 1 1 114 114 GLU C C 114 178.776 178.776 178.135 0.641 25061 5594 1 8 . 1 1 114 114 GLU CA C 114 58.714 58.714 59.206 -0.492 25061 5595 1 8 . 1 1 114 114 GLU CB C 114 29.213 29.213 28.988 0.225 25061 5596 1 8 . 1 1 114 114 GLU H H 114 8.296 8.296 8.421 -0.125 25061 5597 1 8 . 1 1 115 115 ALA N N 115 120.924 120.924 122.064 -1.140 25061 5598 1 8 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.034 -0.196 25061 5599 1 8 . 1 1 115 115 ALA C C 115 178.502 178.502 179.508 -1.006 25061 5600 1 8 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.231 0.407 25061 5601 1 8 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.247 0.250 25061 5602 1 8 . 1 1 115 115 ALA H H 115 7.853 7.853 7.917 -0.064 25061 5603 1 8 . 1 1 116 116 LYS N N 116 116.616 116.616 118.016 -1.400 25061 5604 1 8 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.986 -0.267 25061 5605 1 8 . 1 1 116 116 LYS C C 116 178.097 178.097 178.973 -0.876 25061 5606 1 8 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.482 1.270 25061 5607 1 8 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.294 0.261 25061 5608 1 8 . 1 1 116 116 LYS H H 116 8.091 8.091 8.035 0.056 25061 5609 1 8 . 1 1 117 117 LYS N N 117 118.990 118.990 119.143 -0.153 25061 5610 1 8 . 1 1 117 117 LYS HA H 117 3.911 3.911 3.980 -0.069 25061 5611 1 8 . 1 1 117 117 LYS C C 117 179.186 179.186 179.223 -0.037 25061 5612 1 8 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.503 0.068 25061 5613 1 8 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.249 0.271 25061 5614 1 8 . 1 1 117 117 LYS H H 117 7.742 7.742 7.432 0.310 25061 5615 1 8 . 1 1 118 118 ARG N N 118 117.441 117.441 118.534 -1.093 25061 5616 1 8 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.001 0.139 25061 5617 1 8 . 1 1 118 118 ARG C C 118 178.921 178.921 178.745 0.176 25061 5618 1 8 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.323 -0.652 25061 5619 1 8 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.670 -0.009 25061 5620 1 8 . 1 1 118 118 ARG H H 118 8.468 8.468 7.681 0.787 25061 5621 1 8 . 1 1 119 119 LEU N N 119 120.100 120.100 119.682 0.418 25061 5622 1 8 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.945 0.015 25061 5623 1 8 . 1 1 119 119 LEU C C 119 177.554 177.554 178.782 -1.228 25061 5624 1 8 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.414 -0.533 25061 5625 1 8 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.146 0.743 25061 5626 1 8 . 1 1 119 119 LEU H H 119 8.322 8.322 8.129 0.193 25061 5627 1 8 . 1 1 120 120 LYS N N 120 118.238 118.238 119.633 -1.395 25061 5628 1 8 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.923 -0.101 25061 5629 1 8 . 1 1 120 120 LYS C C 120 178.703 178.703 178.903 -0.200 25061 5630 1 8 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.515 0.831 25061 5631 1 8 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.047 0.189 25061 5632 1 8 . 1 1 120 120 LYS H H 120 7.990 7.990 7.924 0.066 25061 5633 1 8 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.211 -0.189 25061 5634 1 8 . 1 1 121 121 GLU C C 121 177.769 177.769 179.347 -1.578 25061 5635 1 8 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.204 -0.282 25061 5636 1 8 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.477 -0.023 25061 5637 1 8 . 1 1 122 122 LEU N N 122 119.454 119.454 119.243 0.211 25061 5638 1 8 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.220 -0.087 25061 5639 1 8 . 1 1 122 122 LEU C C 122 178.991 178.991 179.195 -0.204 25061 5640 1 8 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.245 0.081 25061 5641 1 8 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.884 -0.205 25061 5642 1 8 . 1 1 122 122 LEU H H 122 7.930 7.930 8.067 -0.137 25061 5643 1 8 . 1 1 123 123 LEU N N 123 117.862 117.862 119.454 -1.592 25061 5644 1 8 . 1 1 123 123 LEU HA H 123 4.067 4.067 3.984 0.083 25061 5645 1 8 . 1 1 123 123 LEU C C 123 179.178 179.178 179.573 -0.395 25061 5646 1 8 . 1 1 123 123 LEU CA C 123 56.920 56.920 58.230 -1.310 25061 5647 1 8 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.128 0.082 25061 5648 1 8 . 1 1 123 123 LEU H H 123 8.095 8.095 7.731 0.364 25061 5649 1 8 . 1 1 124 124 GLU N N 124 118.975 118.975 119.748 -0.773 25061 5650 1 8 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.079 0.050 25061 5651 1 8 . 1 1 124 124 GLU C C 124 177.777 177.777 177.215 0.562 25061 5652 1 8 . 1 1 124 124 GLU CA C 124 58.087 58.087 59.069 -0.982 25061 5653 1 8 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.440 0.100 25061 5654 1 8 . 1 1 124 124 GLU H H 124 7.930 7.930 7.965 -0.035 25061 5655 1 8 . 1 1 125 125 LYS N N 125 118.933 118.933 115.877 3.056 25061 5656 1 8 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.522 -0.185 25061 5657 1 8 . 1 1 125 125 LYS C C 125 178.188 178.188 175.842 2.346 25061 5658 1 8 . 1 1 125 125 LYS CA C 125 56.980 56.980 55.363 1.617 25061 5659 1 8 . 1 1 125 125 LYS CB C 125 32.608 32.608 32.323 0.285 25061 5660 1 8 . 1 1 125 125 LYS H H 125 7.729 7.729 7.851 -0.122 25061 5661 1 8 . 1 1 126 126 VAL N N 126 117.933 117.933 118.520 -0.587 25061 5662 1 8 . 1 1 126 126 VAL HA H 126 4.022 4.022 3.537 0.485 25061 5663 1 8 . 1 1 126 126 VAL C C 126 176.947 176.947 174.615 2.332 25061 5664 1 8 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.845 -0.204 25061 5665 1 8 . 1 1 126 126 VAL CB C 126 31.859 31.859 31.159 0.700 25061 5666 1 8 . 1 1 126 126 VAL H H 126 8.044 8.044 7.612 0.432 25061 5667 1 8 . 1 1 127 127 GLY N N 127 109.813 109.813 103.542 6.271 25061 5668 1 8 . 1 1 127 127 GLY C C 127 174.264 174.264 172.643 1.621 25061 5669 1 8 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.111 0.168 25061 5670 1 8 . 1 1 127 127 GLY H H 127 8.279 8.279 8.262 0.017 25061 5671 1 8 . 1 1 128 128 SER N N 128 115.185 115.185 114.082 1.103 25061 5672 1 8 . 1 1 128 128 SER HA H 128 4.462 4.462 4.247 0.215 25061 5673 1 8 . 1 1 128 128 SER C C 128 174.775 174.775 173.787 0.988 25061 5674 1 8 . 1 1 128 128 SER CA C 128 58.739 58.739 59.463 -0.724 25061 5675 1 8 . 1 1 128 128 SER CB C 128 63.850 63.850 63.212 0.638 25061 5676 1 8 . 1 1 128 128 SER H H 128 8.048 8.048 8.092 -0.044 25061 5677 1 8 . 1 1 129 129 LEU N N 129 123.060 123.060 113.222 9.838 25061 5678 1 8 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.645 -0.347 25061 5679 1 8 . 1 1 129 129 LEU C C 129 177.313 177.313 175.647 1.666 25061 5680 1 8 . 1 1 129 129 LEU CA C 129 55.158 55.158 55.269 -0.111 25061 5681 1 8 . 1 1 129 129 LEU CB C 129 41.837 41.837 43.309 -1.472 25061 5682 1 8 . 1 1 129 129 LEU H H 129 8.147 8.147 8.011 0.136 25061 5683 1 8 . 1 1 130 130 GLU N N 130 120.088 120.088 122.444 -2.356 25061 5684 1 8 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.249 -0.068 25061 5685 1 8 . 1 1 130 130 GLU C C 130 176.148 176.148 174.711 1.437 25061 5686 1 8 . 1 1 130 130 GLU CA C 130 56.726 56.726 56.360 0.366 25061 5687 1 8 . 1 1 130 130 GLU CB C 130 30.026 30.026 28.688 1.338 25061 5688 1 8 . 1 1 130 130 GLU H H 130 8.242 8.242 8.456 -0.214 25061 5689 1 9 . 1 1 2 2 GLY CA C 2 45.319 45.319 45.596 -0.277 25061 5690 1 9 . 1 1 3 3 THR HA H 3 4.820 4.820 4.202 0.618 25061 5691 1 9 . 1 1 3 3 THR C C 3 172.374 172.374 174.100 -1.726 25061 5692 1 9 . 1 1 3 3 THR CA C 3 62.760 62.760 63.982 -1.222 25061 5693 1 9 . 1 1 3 3 THR CB C 3 71.441 71.441 69.568 1.873 25061 5694 1 9 . 1 1 4 4 VAL N N 4 126.881 126.881 126.932 -0.051 25061 5695 1 9 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.477 0.091 25061 5696 1 9 . 1 1 4 4 VAL C C 4 173.116 173.116 174.675 -1.559 25061 5697 1 9 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.677 -1.222 25061 5698 1 9 . 1 1 4 4 VAL CB C 4 33.800 33.800 32.101 1.699 25061 5699 1 9 . 1 1 4 4 VAL H H 4 9.097 9.097 8.699 0.398 25061 5700 1 9 . 1 1 5 5 VAL N N 5 127.172 127.172 123.347 3.825 25061 5701 1 9 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.402 -0.515 25061 5702 1 9 . 1 1 5 5 VAL C C 5 174.091 174.091 175.052 -0.961 25061 5703 1 9 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.316 0.802 25061 5704 1 9 . 1 1 5 5 VAL CB C 5 32.935 32.935 34.351 -1.416 25061 5705 1 9 . 1 1 5 5 VAL H H 5 8.811 8.811 8.817 -0.006 25061 5706 1 9 . 1 1 6 6 ILE N N 6 127.577 127.577 127.034 0.543 25061 5707 1 9 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.463 0.157 25061 5708 1 9 . 1 1 6 6 ILE C C 6 173.328 173.328 175.394 -2.066 25061 5709 1 9 . 1 1 6 6 ILE CA C 6 59.832 59.832 58.213 1.619 25061 5710 1 9 . 1 1 6 6 ILE CB C 6 39.930 39.930 37.320 2.610 25061 5711 1 9 . 1 1 6 6 ILE H H 6 9.210 9.210 8.442 0.768 25061 5712 1 9 . 1 1 7 7 VAL N N 7 129.024 129.024 129.424 -0.400 25061 5713 1 9 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.432 0.373 25061 5714 1 9 . 1 1 7 7 VAL C C 7 173.561 173.561 175.088 -1.527 25061 5715 1 9 . 1 1 7 7 VAL CA C 7 60.849 60.849 61.795 -0.946 25061 5716 1 9 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.019 1.341 25061 5717 1 9 . 1 1 7 7 VAL H H 7 9.294 9.294 8.214 1.080 25061 5718 1 9 . 1 1 8 8 VAL N N 8 125.318 125.318 128.772 -3.454 25061 5719 1 9 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.233 0.163 25061 5720 1 9 . 1 1 8 8 VAL C C 8 175.723 175.723 175.694 0.029 25061 5721 1 9 . 1 1 8 8 VAL CA C 8 59.617 59.617 60.563 -0.946 25061 5722 1 9 . 1 1 8 8 VAL CB C 8 34.915 34.915 34.251 0.664 25061 5723 1 9 . 1 1 8 8 VAL H H 8 8.898 8.898 8.754 0.144 25061 5724 1 9 . 1 1 9 9 SER N N 9 116.544 116.544 119.491 -2.947 25061 5725 1 9 . 1 1 9 9 SER HA H 9 4.724 4.724 4.880 -0.156 25061 5726 1 9 . 1 1 9 9 SER C C 9 174.552 174.552 173.361 1.191 25061 5727 1 9 . 1 1 9 9 SER CA C 9 57.419 57.419 56.692 0.727 25061 5728 1 9 . 1 1 9 9 SER CB C 9 64.998 64.998 66.624 -1.626 25061 5729 1 9 . 1 1 9 9 SER H H 9 7.833 7.833 8.175 -0.342 25061 5730 1 9 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.687 0.225 25061 5731 1 9 . 1 1 10 10 ASN C C 10 176.170 176.170 174.968 1.202 25061 5732 1 9 . 1 1 10 10 ASN CA C 10 54.141 54.141 54.099 0.042 25061 5733 1 9 . 1 1 10 10 ASN CB C 10 38.626 38.626 38.953 -0.327 25061 5734 1 9 . 1 1 11 11 ASP N N 11 120.164 120.164 120.178 -0.014 25061 5735 1 9 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.658 0.185 25061 5736 1 9 . 1 1 11 11 ASP C C 11 176.148 176.148 177.155 -1.007 25061 5737 1 9 . 1 1 11 11 ASP CA C 11 52.620 52.620 54.736 -2.116 25061 5738 1 9 . 1 1 11 11 ASP CB C 11 42.631 42.631 42.157 0.473 25061 5739 1 9 . 1 1 11 11 ASP H H 11 8.142 8.142 8.246 -0.104 25061 5740 1 9 . 1 1 12 12 GLU N N 12 127.184 127.184 122.775 4.409 25061 5741 1 9 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.071 -0.218 25061 5742 1 9 . 1 1 12 12 GLU C C 12 177.853 177.853 178.709 -0.856 25061 5743 1 9 . 1 1 12 12 GLU CA C 12 59.547 59.547 59.737 -0.190 25061 5744 1 9 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.852 -0.033 25061 5745 1 9 . 1 1 12 12 GLU H H 12 9.152 9.152 8.868 0.284 25061 5746 1 9 . 1 1 13 13 ARG N N 13 119.026 119.026 119.306 -0.280 25061 5747 1 9 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.161 -0.058 25061 5748 1 9 . 1 1 13 13 ARG C C 13 179.151 179.151 178.156 0.995 25061 5749 1 9 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.893 0.050 25061 5750 1 9 . 1 1 13 13 ARG CB C 13 28.757 28.757 29.056 -0.299 25061 5751 1 9 . 1 1 13 13 ARG H H 13 8.389 8.389 8.586 -0.197 25061 5752 1 9 . 1 1 14 14 ILE N N 14 119.238 119.238 119.735 -0.497 25061 5753 1 9 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.997 -0.396 25061 5754 1 9 . 1 1 14 14 ILE C C 14 177.905 177.905 178.079 -0.174 25061 5755 1 9 . 1 1 14 14 ILE CA C 14 64.666 64.666 62.583 2.083 25061 5756 1 9 . 1 1 14 14 ILE CB C 14 36.780 36.780 36.876 -0.096 25061 5757 1 9 . 1 1 14 14 ILE H H 14 7.254 7.254 7.940 -0.686 25061 5758 1 9 . 1 1 15 15 LEU N N 15 117.008 117.008 120.818 -3.810 25061 5759 1 9 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.201 -0.280 25061 5760 1 9 . 1 1 15 15 LEU C C 15 178.062 178.062 179.531 -1.469 25061 5761 1 9 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.298 0.113 25061 5762 1 9 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.694 -0.525 25061 5763 1 9 . 1 1 15 15 LEU H H 15 7.412 7.412 7.615 -0.203 25061 5764 1 9 . 1 1 16 16 GLU N N 16 117.637 117.637 119.467 -1.830 25061 5765 1 9 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.866 -0.165 25061 5766 1 9 . 1 1 16 16 GLU C C 16 179.182 179.182 178.565 0.617 25061 5767 1 9 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.707 -0.290 25061 5768 1 9 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.510 -0.051 25061 5769 1 9 . 1 1 16 16 GLU H H 16 7.981 7.981 8.053 -0.072 25061 5770 1 9 . 1 1 17 17 GLU N N 17 119.759 119.759 120.296 -0.537 25061 5771 1 9 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.250 -0.234 25061 5772 1 9 . 1 1 17 17 GLU C C 17 179.949 179.949 179.369 0.580 25061 5773 1 9 . 1 1 17 17 GLU CA C 17 59.195 59.195 59.135 0.060 25061 5774 1 9 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.692 -0.152 25061 5775 1 9 . 1 1 17 17 GLU H H 17 8.248 8.248 8.031 0.217 25061 5776 1 9 . 1 1 18 18 LEU N N 18 119.764 119.764 119.441 0.323 25061 5777 1 9 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.191 -0.110 25061 5778 1 9 . 1 1 18 18 LEU C C 18 177.620 177.620 179.308 -1.688 25061 5779 1 9 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.472 0.206 25061 5780 1 9 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.706 -0.596 25061 5781 1 9 . 1 1 18 18 LEU H H 18 8.486 8.486 8.011 0.475 25061 5782 1 9 . 1 1 19 19 LEU N N 19 123.102 123.102 121.141 1.961 25061 5783 1 9 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.569 0.093 25061 5784 1 9 . 1 1 19 19 LEU C C 19 178.343 178.343 178.241 0.102 25061 5785 1 9 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.218 1.018 25061 5786 1 9 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.191 -0.540 25061 5787 1 9 . 1 1 19 19 LEU H H 19 7.870 7.870 7.816 0.054 25061 5788 1 9 . 1 1 20 20 GLU N N 20 117.884 117.884 118.654 -0.770 25061 5789 1 9 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.944 -0.040 25061 5790 1 9 . 1 1 20 20 GLU C C 20 177.707 177.707 179.397 -1.690 25061 5791 1 9 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.496 -0.104 25061 5792 1 9 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.323 -0.346 25061 5793 1 9 . 1 1 20 20 GLU H H 20 7.497 7.497 7.780 -0.283 25061 5794 1 9 . 1 1 21 21 VAL N N 21 117.709 117.709 119.057 -1.348 25061 5795 1 9 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.716 -0.092 25061 5796 1 9 . 1 1 21 21 VAL C C 21 178.523 178.523 177.946 0.577 25061 5797 1 9 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.214 -0.017 25061 5798 1 9 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.675 -0.528 25061 5799 1 9 . 1 1 21 21 VAL H H 21 7.514 7.514 7.365 0.149 25061 5800 1 9 . 1 1 22 22 VAL N N 22 121.233 121.233 119.420 1.813 25061 5801 1 9 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.754 -0.308 25061 5802 1 9 . 1 1 22 22 VAL C C 22 176.868 176.868 177.637 -0.769 25061 5803 1 9 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.355 0.658 25061 5804 1 9 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.710 -0.396 25061 5805 1 9 . 1 1 22 22 VAL H H 22 7.863 7.863 7.218 0.645 25061 5806 1 9 . 1 1 23 23 LEU N N 23 118.101 118.101 118.398 -0.297 25061 5807 1 9 . 1 1 23 23 LEU HA H 23 4.065 4.065 3.953 0.112 25061 5808 1 9 . 1 1 23 23 LEU C C 23 179.701 179.701 179.122 0.579 25061 5809 1 9 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.763 -0.467 25061 5810 1 9 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.451 0.253 25061 5811 1 9 . 1 1 23 23 LEU H H 23 8.151 8.151 8.142 0.009 25061 5812 1 9 . 1 1 24 24 LYS N N 24 114.622 114.622 116.134 -1.512 25061 5813 1 9 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.154 -0.017 25061 5814 1 9 . 1 1 24 24 LYS C C 24 178.062 178.062 178.790 -0.728 25061 5815 1 9 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.476 -1.108 25061 5816 1 9 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.014 0.580 25061 5817 1 9 . 1 1 24 24 LYS H H 24 7.823 7.823 7.821 0.002 25061 5818 1 9 . 1 1 25 25 SER N N 25 115.474 115.474 116.137 -0.663 25061 5819 1 9 . 1 1 25 25 SER HA H 25 4.377 4.377 4.360 0.017 25061 5820 1 9 . 1 1 25 25 SER C C 25 174.520 174.520 174.045 0.475 25061 5821 1 9 . 1 1 25 25 SER CA C 25 61.049 61.049 61.005 0.044 25061 5822 1 9 . 1 1 25 25 SER CB C 25 63.777 63.777 64.202 -0.425 25061 5823 1 9 . 1 1 25 25 SER H H 25 7.798 7.798 7.567 0.231 25061 5824 1 9 . 1 1 26 26 ASP N N 26 117.424 117.424 117.898 -0.474 25061 5825 1 9 . 1 1 26 26 ASP HA H 26 4.886 4.886 5.013 -0.127 25061 5826 1 9 . 1 1 26 26 ASP C C 26 173.521 173.521 173.933 -0.412 25061 5827 1 9 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.877 -0.829 25061 5828 1 9 . 1 1 26 26 ASP CB C 26 42.202 42.202 43.587 -1.385 25061 5829 1 9 . 1 1 26 26 ASP H H 26 7.990 7.990 7.816 0.174 25061 5830 1 9 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.567 0.078 25061 5831 1 9 . 1 1 27 27 PRO C C 27 177.016 177.016 176.847 0.169 25061 5832 1 9 . 1 1 27 27 PRO CA C 27 63.601 63.601 64.030 -0.429 25061 5833 1 9 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.938 -0.765 25061 5834 1 9 . 1 1 28 28 ASN N N 28 115.839 115.839 115.970 -0.131 25061 5835 1 9 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.699 -0.007 25061 5836 1 9 . 1 1 28 28 ASN C C 28 175.701 175.701 175.914 -0.213 25061 5837 1 9 . 1 1 28 28 ASN CA C 28 53.472 53.472 52.924 0.548 25061 5838 1 9 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.673 -0.460 25061 5839 1 9 . 1 1 28 28 ASN H H 28 8.608 8.608 8.288 0.320 25061 5840 1 9 . 1 1 29 29 VAL N N 29 120.770 120.770 123.309 -2.539 25061 5841 1 9 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.776 0.039 25061 5842 1 9 . 1 1 29 29 VAL C C 29 175.023 175.023 174.982 0.041 25061 5843 1 9 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.512 -0.960 25061 5844 1 9 . 1 1 29 29 VAL CB C 29 32.147 32.147 31.570 0.577 25061 5845 1 9 . 1 1 29 29 VAL H H 29 7.428 7.428 7.966 -0.538 25061 5846 1 9 . 1 1 30 30 LYS N N 30 127.345 127.345 130.376 -3.031 25061 5847 1 9 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.391 0.088 25061 5848 1 9 . 1 1 30 30 LYS C C 30 174.777 174.777 175.719 -0.942 25061 5849 1 9 . 1 1 30 30 LYS CA C 30 55.204 55.204 54.949 0.255 25061 5850 1 9 . 1 1 30 30 LYS CB C 30 31.949 31.949 32.891 -0.942 25061 5851 1 9 . 1 1 30 30 LYS H H 30 8.457 8.457 8.136 0.321 25061 5852 1 9 . 1 1 31 31 THR N N 31 113.552 113.552 119.495 -5.943 25061 5853 1 9 . 1 1 31 31 THR HA H 31 5.723 5.723 5.036 0.687 25061 5854 1 9 . 1 1 31 31 THR C C 31 174.593 174.593 174.544 0.049 25061 5855 1 9 . 1 1 31 31 THR CA C 31 59.030 59.030 60.980 -1.950 25061 5856 1 9 . 1 1 31 31 THR CB C 31 72.206 72.206 69.358 2.848 25061 5857 1 9 . 1 1 31 31 THR H H 31 8.164 8.164 8.329 -0.165 25061 5858 1 9 . 1 1 32 32 VAL N N 32 119.206 119.206 127.052 -7.846 25061 5859 1 9 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.371 0.034 25061 5860 1 9 . 1 1 32 32 VAL C C 32 172.663 172.663 174.613 -1.950 25061 5861 1 9 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.123 -0.051 25061 5862 1 9 . 1 1 32 32 VAL CB C 32 35.051 35.051 33.714 1.337 25061 5863 1 9 . 1 1 32 32 VAL H H 32 8.615 8.615 9.031 -0.416 25061 5864 1 9 . 1 1 33 33 ARG N N 33 130.278 130.278 128.724 1.554 25061 5865 1 9 . 1 1 33 33 ARG HA H 33 5.331 5.331 4.761 0.570 25061 5866 1 9 . 1 1 33 33 ARG C C 33 173.836 173.836 175.325 -1.489 25061 5867 1 9 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.980 -1.830 25061 5868 1 9 . 1 1 33 33 ARG CB C 33 30.028 30.028 29.433 0.595 25061 5869 1 9 . 1 1 33 33 ARG H H 33 8.996 8.996 8.752 0.244 25061 5870 1 9 . 1 1 34 34 THR N N 34 121.695 121.695 121.050 0.645 25061 5871 1 9 . 1 1 34 34 THR HA H 34 4.483 4.483 4.466 0.017 25061 5872 1 9 . 1 1 34 34 THR C C 34 169.769 169.769 173.213 -3.444 25061 5873 1 9 . 1 1 34 34 THR CA C 34 60.814 60.814 61.031 -0.217 25061 5874 1 9 . 1 1 34 34 THR CB C 34 67.402 67.402 71.559 -4.157 25061 5875 1 9 . 1 1 34 34 THR H H 34 8.126 8.126 8.165 -0.039 25061 5876 1 9 . 1 1 35 35 ASP N N 35 122.198 122.198 121.220 0.978 25061 5877 1 9 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.546 0.278 25061 5878 1 9 . 1 1 35 35 ASP C C 35 174.790 174.790 175.414 -0.624 25061 5879 1 9 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.293 -0.907 25061 5880 1 9 . 1 1 35 35 ASP CB C 35 41.848 41.848 41.213 0.635 25061 5881 1 9 . 1 1 35 35 ASP H H 35 7.983 7.983 8.375 -0.392 25061 5882 1 9 . 1 1 36 36 ASP N N 36 121.091 121.091 123.586 -2.495 25061 5883 1 9 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.453 0.140 25061 5884 1 9 . 1 1 36 36 ASP C C 36 176.189 176.189 177.280 -1.091 25061 5885 1 9 . 1 1 36 36 ASP CA C 36 53.055 53.055 54.806 -1.751 25061 5886 1 9 . 1 1 36 36 ASP CB C 36 42.159 42.159 40.079 2.080 25061 5887 1 9 . 1 1 36 36 ASP H H 36 8.157 8.157 8.403 -0.246 25061 5888 1 9 . 1 1 37 37 LYS N N 37 125.839 125.839 126.141 -0.302 25061 5889 1 9 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.844 -0.122 25061 5890 1 9 . 1 1 37 37 LYS C C 37 176.870 176.870 178.053 -1.183 25061 5891 1 9 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.592 -0.188 25061 5892 1 9 . 1 1 37 37 LYS CB C 37 32.394 32.394 31.664 0.730 25061 5893 1 9 . 1 1 37 37 LYS H H 37 8.843 8.843 8.428 0.415 25061 5894 1 9 . 1 1 38 38 GLU N N 38 118.369 118.369 118.791 -0.422 25061 5895 1 9 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.990 0.017 25061 5896 1 9 . 1 1 38 38 GLU C C 38 179.502 179.502 178.790 0.712 25061 5897 1 9 . 1 1 38 38 GLU CA C 38 58.670 58.670 59.032 -0.362 25061 5898 1 9 . 1 1 38 38 GLU CB C 38 28.474 28.474 28.732 -0.258 25061 5899 1 9 . 1 1 38 38 GLU H H 38 8.182 8.182 8.830 -0.648 25061 5900 1 9 . 1 1 39 39 LYS N N 39 121.722 121.722 120.273 1.449 25061 5901 1 9 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.100 0.065 25061 5902 1 9 . 1 1 39 39 LYS C C 39 178.500 178.500 178.712 -0.212 25061 5903 1 9 . 1 1 39 39 LYS CA C 39 57.736 57.736 58.911 -1.175 25061 5904 1 9 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.656 -1.518 25061 5905 1 9 . 1 1 39 39 LYS H H 39 7.524 7.524 7.504 0.020 25061 5906 1 9 . 1 1 40 40 VAL N N 40 117.199 117.199 119.903 -2.704 25061 5907 1 9 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.614 -0.386 25061 5908 1 9 . 1 1 40 40 VAL C C 40 177.362 177.362 178.094 -0.732 25061 5909 1 9 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.389 1.253 25061 5910 1 9 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.124 -0.221 25061 5911 1 9 . 1 1 40 40 VAL H H 40 7.883 7.883 8.245 -0.362 25061 5912 1 9 . 1 1 41 41 LYS N N 41 117.677 117.677 118.740 -1.063 25061 5913 1 9 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.763 -0.321 25061 5914 1 9 . 1 1 41 41 LYS C C 41 177.686 177.686 178.601 -0.915 25061 5915 1 9 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.945 0.864 25061 5916 1 9 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.489 0.126 25061 5917 1 9 . 1 1 41 41 LYS H H 41 7.567 7.567 7.703 -0.136 25061 5918 1 9 . 1 1 42 42 GLU N N 42 118.369 118.369 120.002 -1.633 25061 5919 1 9 . 1 1 42 42 GLU HA H 42 4.007 4.007 3.908 0.099 25061 5920 1 9 . 1 1 42 42 GLU C C 42 179.725 179.725 178.662 1.063 25061 5921 1 9 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.514 -0.445 25061 5922 1 9 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.501 0.038 25061 5923 1 9 . 1 1 42 42 GLU H H 42 7.634 7.634 7.471 0.163 25061 5924 1 9 . 1 1 43 43 GLU N N 43 117.906 117.906 118.539 -0.633 25061 5925 1 9 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.118 0.065 25061 5926 1 9 . 1 1 43 43 GLU C C 43 179.757 179.757 179.417 0.340 25061 5927 1 9 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.653 -0.287 25061 5928 1 9 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.144 -0.303 25061 5929 1 9 . 1 1 43 43 GLU H H 43 8.162 8.162 8.113 0.049 25061 5930 1 9 . 1 1 44 44 ILE N N 44 122.291 122.291 120.893 1.398 25061 5931 1 9 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.633 -0.021 25061 5932 1 9 . 1 1 44 44 ILE C C 44 177.101 177.101 177.848 -0.747 25061 5933 1 9 . 1 1 44 44 ILE CA C 44 66.355 66.355 66.029 0.326 25061 5934 1 9 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.949 -0.489 25061 5935 1 9 . 1 1 44 44 ILE H H 44 8.742 8.742 8.040 0.702 25061 5936 1 9 . 1 1 45 45 GLU N N 45 119.892 119.892 120.796 -0.904 25061 5937 1 9 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.065 -0.007 25061 5938 1 9 . 1 1 45 45 GLU C C 45 178.991 178.991 178.934 0.057 25061 5939 1 9 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.631 0.034 25061 5940 1 9 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.753 -0.592 25061 5941 1 9 . 1 1 45 45 GLU H H 45 8.171 8.171 7.909 0.262 25061 5942 1 9 . 1 1 46 46 LYS N N 46 118.064 118.064 118.711 -0.647 25061 5943 1 9 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.056 -0.074 25061 5944 1 9 . 1 1 46 46 LYS C C 46 178.837 178.837 179.061 -0.224 25061 5945 1 9 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.405 0.336 25061 5946 1 9 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.310 0.133 25061 5947 1 9 . 1 1 46 46 LYS H H 46 7.785 7.785 8.009 -0.224 25061 5948 1 9 . 1 1 47 47 ALA N N 47 121.817 121.817 121.971 -0.154 25061 5949 1 9 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.105 -0.074 25061 5950 1 9 . 1 1 47 47 ALA C C 47 179.859 179.859 179.213 0.646 25061 5951 1 9 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.183 0.112 25061 5952 1 9 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.715 -1.058 25061 5953 1 9 . 1 1 47 47 ALA H H 47 8.123 8.123 8.058 0.065 25061 5954 1 9 . 1 1 48 48 ARG N N 48 119.080 119.080 117.599 1.481 25061 5955 1 9 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.134 -0.045 25061 5956 1 9 . 1 1 48 48 ARG C C 48 180.155 180.155 178.893 1.262 25061 5957 1 9 . 1 1 48 48 ARG CA C 48 59.197 59.197 57.942 1.255 25061 5958 1 9 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.295 0.215 25061 5959 1 9 . 1 1 48 48 ARG H H 48 8.768 8.768 7.791 0.977 25061 5960 1 9 . 1 1 49 49 LYS N N 49 119.951 119.951 120.186 -0.235 25061 5961 1 9 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.124 -0.085 25061 5962 1 9 . 1 1 49 49 LYS C C 49 178.288 178.288 178.175 0.113 25061 5963 1 9 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.682 0.155 25061 5964 1 9 . 1 1 49 49 LYS CB C 49 32.143 32.143 31.972 0.171 25061 5965 1 9 . 1 1 49 49 LYS H H 49 8.037 8.037 7.970 0.067 25061 5966 1 9 . 1 1 50 50 GLN N N 50 115.284 115.284 115.303 -0.019 25061 5967 1 9 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.306 0.036 25061 5968 1 9 . 1 1 50 50 GLN C C 50 176.180 176.180 177.371 -1.191 25061 5969 1 9 . 1 1 50 50 GLN CA C 50 55.741 55.741 56.142 -0.400 25061 5970 1 9 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.528 0.037 25061 5971 1 9 . 1 1 50 50 GLN H H 50 7.740 7.740 7.679 0.061 25061 5972 1 9 . 1 1 51 51 GLY N N 51 109.725 109.725 107.482 2.243 25061 5973 1 9 . 1 1 51 51 GLY C C 51 174.552 174.552 173.847 0.705 25061 5974 1 9 . 1 1 51 51 GLY CA C 51 46.363 46.363 44.984 1.379 25061 5975 1 9 . 1 1 51 51 GLY H H 51 8.027 8.027 8.224 -0.197 25061 5976 1 9 . 1 1 52 52 ARG N N 52 119.064 119.064 121.040 -1.976 25061 5977 1 9 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.848 0.049 25061 5978 1 9 . 1 1 52 52 ARG C C 52 173.123 173.123 174.105 -0.982 25061 5979 1 9 . 1 1 52 52 ARG CA C 52 52.247 52.247 53.232 -0.985 25061 5980 1 9 . 1 1 52 52 ARG CB C 52 32.366 32.366 30.106 2.260 25061 5981 1 9 . 1 1 52 52 ARG H H 52 7.969 7.969 7.982 -0.013 25061 5982 1 9 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.734 0.121 25061 5983 1 9 . 1 1 53 53 PRO C C 53 174.069 174.069 175.454 -1.385 25061 5984 1 9 . 1 1 53 53 PRO CA C 53 61.818 61.818 63.269 -1.451 25061 5985 1 9 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.074 -0.014 25061 5986 1 9 . 1 1 54 54 ILE N N 54 116.301 116.301 124.496 -8.195 25061 5987 1 9 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.751 0.487 25061 5988 1 9 . 1 1 54 54 ILE C C 54 171.709 171.709 174.231 -2.522 25061 5989 1 9 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.203 -1.429 25061 5990 1 9 . 1 1 54 54 ILE CB C 54 41.558 41.558 41.166 0.392 25061 5991 1 9 . 1 1 54 54 ILE H H 54 7.920 7.920 8.394 -0.474 25061 5992 1 9 . 1 1 55 55 VAL N N 55 126.302 126.302 130.062 -3.760 25061 5993 1 9 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.178 -0.254 25061 5994 1 9 . 1 1 55 55 VAL C C 55 173.624 173.624 174.869 -1.245 25061 5995 1 9 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.320 -0.525 25061 5996 1 9 . 1 1 55 55 VAL CB C 55 32.828 32.828 33.367 -0.539 25061 5997 1 9 . 1 1 55 55 VAL H H 55 8.652 8.652 8.923 -0.271 25061 5998 1 9 . 1 1 56 56 ILE N N 56 127.503 127.503 128.597 -1.094 25061 5999 1 9 . 1 1 56 56 ILE HA H 56 4.664 4.664 4.973 -0.309 25061 6000 1 9 . 1 1 56 56 ILE C C 56 173.479 173.479 175.237 -1.758 25061 6001 1 9 . 1 1 56 56 ILE CA C 56 59.007 59.007 59.447 -0.440 25061 6002 1 9 . 1 1 56 56 ILE CB C 56 40.285 40.285 38.659 1.626 25061 6003 1 9 . 1 1 56 56 ILE H H 56 9.124 9.124 7.988 1.136 25061 6004 1 9 . 1 1 57 57 PHE N N 57 125.302 125.302 128.634 -3.332 25061 6005 1 9 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.336 -0.120 25061 6006 1 9 . 1 1 57 57 PHE C C 57 174.536 174.536 175.838 -1.302 25061 6007 1 9 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.465 -0.504 25061 6008 1 9 . 1 1 57 57 PHE CB C 57 40.429 40.429 40.149 0.280 25061 6009 1 9 . 1 1 57 57 PHE H H 57 8.971 8.971 8.147 0.824 25061 6010 1 9 . 1 1 58 58 ILE N N 58 126.472 126.472 116.365 10.107 25061 6011 1 9 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.768 -0.253 25061 6012 1 9 . 1 1 58 58 ILE C C 58 173.391 173.391 173.939 -0.548 25061 6013 1 9 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.682 -0.592 25061 6014 1 9 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.042 -0.300 25061 6015 1 9 . 1 1 58 58 ILE H H 58 9.248 9.248 8.704 0.544 25061 6016 1 9 . 1 1 59 59 ARG N N 59 124.681 124.681 120.599 4.082 25061 6017 1 9 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.319 -0.390 25061 6018 1 9 . 1 1 59 59 ARG C C 59 178.521 178.521 177.920 0.601 25061 6019 1 9 . 1 1 59 59 ARG CA C 59 55.742 55.742 55.215 0.527 25061 6020 1 9 . 1 1 59 59 ARG CB C 59 30.918 30.918 33.114 -2.196 25061 6021 1 9 . 1 1 59 59 ARG H H 59 8.587 8.587 8.921 -0.334 25061 6022 1 9 . 1 1 60 60 GLY N N 60 108.848 108.848 108.843 0.005 25061 6023 1 9 . 1 1 60 60 GLY C C 60 174.775 174.775 174.943 -0.168 25061 6024 1 9 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.336 -0.369 25061 6025 1 9 . 1 1 60 60 GLY H H 60 7.732 7.732 8.320 -0.588 25061 6026 1 9 . 1 1 61 61 ALA N N 61 120.877 120.877 123.504 -2.627 25061 6027 1 9 . 1 1 61 61 ALA HA H 61 4.144 4.144 4.024 0.120 25061 6028 1 9 . 1 1 61 61 ALA C C 61 177.769 177.769 179.782 -2.013 25061 6029 1 9 . 1 1 61 61 ALA CA C 61 53.449 53.449 54.086 -0.636 25061 6030 1 9 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.219 0.152 25061 6031 1 9 . 1 1 61 61 ALA H H 61 7.852 7.852 7.906 -0.054 25061 6032 1 9 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.252 0.548 25061 6033 1 9 . 1 1 62 62 TYR CA C 62 63.039 63.039 59.212 3.827 25061 6034 1 9 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.586 -0.146 25061 6035 1 9 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.949 -0.264 25061 6036 1 9 . 1 1 63 63 GLU C C 63 176.251 176.251 178.096 -1.845 25061 6037 1 9 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.150 0.108 25061 6038 1 9 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.298 0.114 25061 6039 1 9 . 1 1 64 64 GLU N N 64 119.209 119.209 118.592 0.617 25061 6040 1 9 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.805 0.096 25061 6041 1 9 . 1 1 64 64 GLU C C 64 178.251 178.251 178.593 -0.342 25061 6042 1 9 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.741 0.471 25061 6043 1 9 . 1 1 64 64 GLU CB C 64 28.645 28.645 29.092 -0.447 25061 6044 1 9 . 1 1 64 64 GLU H H 64 8.878 8.878 7.530 1.348 25061 6045 1 9 . 1 1 65 65 VAL N N 65 116.728 116.728 117.876 -1.148 25061 6046 1 9 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.891 0.091 25061 6047 1 9 . 1 1 65 65 VAL C C 65 176.915 176.915 177.681 -0.766 25061 6048 1 9 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.712 -1.103 25061 6049 1 9 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.957 -0.062 25061 6050 1 9 . 1 1 65 65 VAL H H 65 7.652 7.652 7.619 0.033 25061 6051 1 9 . 1 1 66 66 VAL N N 66 119.462 119.462 120.333 -0.871 25061 6052 1 9 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.600 -0.286 25061 6053 1 9 . 1 1 66 66 VAL C C 66 177.142 177.142 177.186 -0.044 25061 6054 1 9 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.214 1.121 25061 6055 1 9 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.424 0.006 25061 6056 1 9 . 1 1 66 66 VAL H H 66 7.896 7.896 7.488 0.408 25061 6057 1 9 . 1 1 67 67 ARG HA H 67 3.628 3.628 3.957 -0.329 25061 6058 1 9 . 1 1 67 67 ARG C C 67 177.841 177.841 177.918 -0.077 25061 6059 1 9 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.625 0.427 25061 6060 1 9 . 1 1 67 67 ARG CB C 67 29.393 29.393 29.784 -0.391 25061 6061 1 9 . 1 1 68 68 ASP N N 68 118.316 118.316 118.890 -0.574 25061 6062 1 9 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.519 -0.159 25061 6063 1 9 . 1 1 68 68 ASP C C 68 178.945 178.945 178.778 0.167 25061 6064 1 9 . 1 1 68 68 ASP CA C 68 57.311 57.311 56.868 0.443 25061 6065 1 9 . 1 1 68 68 ASP CB C 68 41.514 41.514 41.337 0.177 25061 6066 1 9 . 1 1 68 68 ASP H H 68 7.625 7.625 7.737 -0.112 25061 6067 1 9 . 1 1 69 69 ILE N N 69 119.231 119.231 121.204 -1.973 25061 6068 1 9 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.723 -0.093 25061 6069 1 9 . 1 1 69 69 ILE C C 69 177.138 177.138 178.144 -1.006 25061 6070 1 9 . 1 1 69 69 ILE CA C 69 64.540 64.540 64.887 -0.347 25061 6071 1 9 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.902 -0.852 25061 6072 1 9 . 1 1 69 69 ILE H H 69 8.113 8.113 7.351 0.762 25061 6073 1 9 . 1 1 70 70 VAL N N 70 120.164 120.164 119.162 1.002 25061 6074 1 9 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.580 -0.163 25061 6075 1 9 . 1 1 70 70 VAL C C 70 177.079 177.079 177.462 -0.383 25061 6076 1 9 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.053 0.221 25061 6077 1 9 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.159 0.099 25061 6078 1 9 . 1 1 70 70 VAL H H 70 8.478 8.478 8.265 0.213 25061 6079 1 9 . 1 1 71 71 GLU N N 71 118.293 118.293 120.147 -1.854 25061 6080 1 9 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.906 0.148 25061 6081 1 9 . 1 1 71 71 GLU C C 71 179.009 179.009 178.304 0.705 25061 6082 1 9 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.710 -0.294 25061 6083 1 9 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.541 -0.719 25061 6084 1 9 . 1 1 71 71 GLU H H 71 8.152 8.152 7.833 0.319 25061 6085 1 9 . 1 1 72 72 TYR N N 72 120.091 120.091 120.368 -0.277 25061 6086 1 9 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.145 0.017 25061 6087 1 9 . 1 1 72 72 TYR C C 72 176.404 176.404 177.163 -0.759 25061 6088 1 9 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.351 -0.219 25061 6089 1 9 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.281 -0.144 25061 6090 1 9 . 1 1 72 72 TYR H H 72 7.959 7.959 7.631 0.328 25061 6091 1 9 . 1 1 73 73 ALA N N 73 120.133 120.133 120.452 -0.319 25061 6092 1 9 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.839 -0.209 25061 6093 1 9 . 1 1 73 73 ALA C C 73 179.182 179.182 179.309 -0.127 25061 6094 1 9 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.136 -0.024 25061 6095 1 9 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.223 -0.032 25061 6096 1 9 . 1 1 73 73 ALA H H 73 8.604 8.604 7.776 0.828 25061 6097 1 9 . 1 1 74 74 GLN N N 74 115.553 115.553 116.993 -1.440 25061 6098 1 9 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.989 0.149 25061 6099 1 9 . 1 1 74 74 GLN C C 74 180.595 180.595 178.656 1.939 25061 6100 1 9 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.361 0.734 25061 6101 1 9 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.738 -0.162 25061 6102 1 9 . 1 1 74 74 GLN H H 74 8.619 8.619 8.046 0.573 25061 6103 1 9 . 1 1 75 75 LYS N N 75 122.396 122.396 118.991 3.405 25061 6104 1 9 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.041 -0.013 25061 6105 1 9 . 1 1 75 75 LYS C C 75 178.521 178.521 178.606 -0.085 25061 6106 1 9 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.079 0.979 25061 6107 1 9 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.723 -0.123 25061 6108 1 9 . 1 1 75 75 LYS H H 75 8.123 8.123 7.465 0.658 25061 6109 1 9 . 1 1 76 76 GLU N N 76 116.294 116.294 116.511 -0.217 25061 6110 1 9 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.141 -0.042 25061 6111 1 9 . 1 1 76 76 GLU C C 76 175.957 175.957 177.660 -1.703 25061 6112 1 9 . 1 1 76 76 GLU CA C 76 55.605 55.605 56.468 -0.863 25061 6113 1 9 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.444 0.380 25061 6114 1 9 . 1 1 76 76 GLU H H 76 7.450 7.450 7.664 -0.214 25061 6115 1 9 . 1 1 77 77 GLY N N 77 107.446 107.446 107.461 -0.015 25061 6116 1 9 . 1 1 77 77 GLY C C 77 174.520 174.520 174.385 0.135 25061 6117 1 9 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.516 0.291 25061 6118 1 9 . 1 1 77 77 GLY H H 77 7.763 7.763 7.664 0.099 25061 6119 1 9 . 1 1 78 78 LEU N N 78 120.179 120.179 119.547 0.632 25061 6120 1 9 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.470 -0.082 25061 6121 1 9 . 1 1 78 78 LEU C C 78 175.914 175.914 176.811 -0.897 25061 6122 1 9 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.440 0.032 25061 6123 1 9 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.714 -0.825 25061 6124 1 9 . 1 1 78 78 LEU H H 78 7.930 7.930 7.802 0.128 25061 6125 1 9 . 1 1 79 79 ARG N N 79 122.207 122.207 123.187 -0.980 25061 6126 1 9 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.274 0.123 25061 6127 1 9 . 1 1 79 79 ARG C C 79 174.960 174.960 174.881 0.079 25061 6128 1 9 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.793 -0.145 25061 6129 1 9 . 1 1 79 79 ARG CB C 79 30.476 30.476 29.913 0.563 25061 6130 1 9 . 1 1 79 79 ARG H H 79 8.241 8.241 8.521 -0.280 25061 6131 1 9 . 1 1 80 80 VAL N N 80 123.333 123.333 126.300 -2.967 25061 6132 1 9 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.422 0.873 25061 6133 1 9 . 1 1 80 80 VAL C C 80 174.048 174.048 174.365 -0.317 25061 6134 1 9 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.959 -1.918 25061 6135 1 9 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.722 1.583 25061 6136 1 9 . 1 1 80 80 VAL H H 80 8.359 8.359 8.570 -0.211 25061 6137 1 9 . 1 1 81 81 LEU N N 81 128.719 128.719 129.816 -1.097 25061 6138 1 9 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.239 -0.135 25061 6139 1 9 . 1 1 81 81 LEU C C 81 174.484 174.484 174.778 -0.294 25061 6140 1 9 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.882 0.238 25061 6141 1 9 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.870 -0.914 25061 6142 1 9 . 1 1 81 81 LEU H H 81 8.650 8.650 8.842 -0.192 25061 6143 1 9 . 1 1 82 82 VAL N N 82 122.487 122.487 127.969 -5.482 25061 6144 1 9 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.330 0.767 25061 6145 1 9 . 1 1 82 82 VAL C C 82 174.525 174.525 174.855 -0.330 25061 6146 1 9 . 1 1 82 82 VAL CA C 82 60.285 60.285 62.023 -1.738 25061 6147 1 9 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.124 2.665 25061 6148 1 9 . 1 1 82 82 VAL H H 82 8.781 8.781 8.576 0.205 25061 6149 1 9 . 1 1 83 83 ILE N N 83 128.082 128.082 129.605 -1.523 25061 6150 1 9 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.838 0.092 25061 6151 1 9 . 1 1 83 83 ILE C C 83 172.925 172.925 174.774 -1.849 25061 6152 1 9 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.337 -0.396 25061 6153 1 9 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.328 1.858 25061 6154 1 9 . 1 1 83 83 ILE H H 83 9.527 9.527 8.549 0.978 25061 6155 1 9 . 1 1 84 84 LYS N N 84 128.493 128.493 128.669 -0.176 25061 6156 1 9 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.241 -0.193 25061 6157 1 9 . 1 1 84 84 LYS C C 84 174.027 174.027 175.170 -1.143 25061 6158 1 9 . 1 1 84 84 LYS CA C 84 53.253 53.253 54.124 -0.871 25061 6159 1 9 . 1 1 84 84 LYS CB C 84 34.652 34.652 36.736 -2.084 25061 6160 1 9 . 1 1 84 84 LYS H H 84 8.721 8.721 8.714 0.007 25061 6161 1 9 . 1 1 85 85 VAL N N 85 126.729 126.729 126.666 0.063 25061 6162 1 9 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.576 0.160 25061 6163 1 9 . 1 1 85 85 VAL C C 85 175.935 175.935 175.756 0.179 25061 6164 1 9 . 1 1 85 85 VAL CA C 85 60.200 60.200 61.555 -1.355 25061 6165 1 9 . 1 1 85 85 VAL CB C 85 30.847 30.847 31.056 -0.209 25061 6166 1 9 . 1 1 85 85 VAL H H 85 8.643 8.643 8.384 0.259 25061 6167 1 9 . 1 1 86 86 ALA N N 86 132.930 132.930 132.263 0.667 25061 6168 1 9 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.514 -0.084 25061 6169 1 9 . 1 1 86 86 ALA C C 86 175.635 175.635 177.010 -1.375 25061 6170 1 9 . 1 1 86 86 ALA CA C 86 51.504 51.504 50.916 0.588 25061 6171 1 9 . 1 1 86 86 ALA CB C 86 20.821 20.821 18.617 2.204 25061 6172 1 9 . 1 1 86 86 ALA H H 86 8.835 8.835 8.437 0.398 25061 6173 1 9 . 1 1 87 87 GLN N N 87 118.719 118.719 126.230 -7.511 25061 6174 1 9 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.164 0.305 25061 6175 1 9 . 1 1 87 87 GLN C C 87 175.949 175.949 175.382 0.567 25061 6176 1 9 . 1 1 87 87 GLN CA C 87 55.260 55.260 55.202 0.058 25061 6177 1 9 . 1 1 87 87 GLN CB C 87 30.432 30.432 27.080 3.352 25061 6178 1 9 . 1 1 87 87 GLN H H 87 8.570 8.570 8.292 0.278 25061 6179 1 9 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.273 0.207 25061 6180 1 9 . 1 1 88 88 ASP CA C 88 55.454 55.454 55.155 0.299 25061 6181 1 9 . 1 1 88 88 ASP CB C 88 41.204 41.204 40.663 0.541 25061 6182 1 9 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.238 -0.191 25061 6183 1 9 . 1 1 89 89 GLN CA C 89 56.687 56.687 55.985 0.702 25061 6184 1 9 . 1 1 89 89 GLN CB C 89 27.850 27.850 28.720 -0.870 25061 6185 1 9 . 1 1 92 92 LEU N N 92 125.291 125.291 119.287 6.004 25061 6186 1 9 . 1 1 92 92 LEU HA H 92 4.201 4.201 3.937 0.264 25061 6187 1 9 . 1 1 92 92 LEU CA C 92 55.057 55.057 58.036 -2.979 25061 6188 1 9 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.929 0.117 25061 6189 1 9 . 1 1 92 92 LEU H H 92 8.277 8.277 8.078 0.199 25061 6190 1 9 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.232 0.524 25061 6191 1 9 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.115 -0.066 25061 6192 1 9 . 1 1 94 94 ARG C C 94 178.544 178.544 178.204 0.340 25061 6193 1 9 . 1 1 94 94 ARG CA C 94 58.607 58.607 59.553 -0.946 25061 6194 1 9 . 1 1 94 94 ARG CB C 94 29.614 29.614 30.299 -0.685 25061 6195 1 9 . 1 1 95 95 PHE N N 95 117.407 117.407 118.885 -1.478 25061 6196 1 9 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.282 0.093 25061 6197 1 9 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.707 -0.476 25061 6198 1 9 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.155 -1.213 25061 6199 1 9 . 1 1 95 95 PHE H H 95 8.419 8.419 7.707 0.712 25061 6200 1 9 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.949 -0.141 25061 6201 1 9 . 1 1 96 96 TYR C C 96 177.728 177.728 177.220 0.508 25061 6202 1 9 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.527 1.629 25061 6203 1 9 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.392 -0.692 25061 6204 1 9 . 1 1 97 97 GLU N N 97 119.054 119.054 117.728 1.326 25061 6205 1 9 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.635 0.428 25061 6206 1 9 . 1 1 97 97 GLU C C 97 179.071 179.071 178.247 0.824 25061 6207 1 9 . 1 1 97 97 GLU CA C 97 58.760 58.760 58.972 -0.212 25061 6208 1 9 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.339 -0.167 25061 6209 1 9 . 1 1 97 97 GLU H H 97 7.858 7.858 7.902 -0.044 25061 6210 1 9 . 1 1 98 98 GLN N N 98 119.385 119.385 118.078 1.307 25061 6211 1 9 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.965 -0.064 25061 6212 1 9 . 1 1 98 98 GLN C C 98 177.599 177.599 178.775 -1.176 25061 6213 1 9 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.267 0.043 25061 6214 1 9 . 1 1 98 98 GLN CB C 98 27.766 27.766 27.986 -0.220 25061 6215 1 9 . 1 1 98 98 GLN H H 98 7.747 7.747 7.348 0.399 25061 6216 1 9 . 1 1 99 99 LEU N N 99 118.348 118.348 120.027 -1.679 25061 6217 1 9 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.873 0.146 25061 6218 1 9 . 1 1 99 99 LEU C C 99 178.669 178.669 178.714 -0.045 25061 6219 1 9 . 1 1 99 99 LEU CA C 99 57.430 57.430 58.280 -0.850 25061 6220 1 9 . 1 1 99 99 LEU CB C 99 41.503 41.503 40.976 0.527 25061 6221 1 9 . 1 1 99 99 LEU H H 99 7.891 7.891 7.421 0.470 25061 6222 1 9 . 1 1 100 100 LYS N N 100 118.332 118.332 118.693 -0.361 25061 6223 1 9 . 1 1 100 100 LYS HA H 100 4.509 4.509 4.114 0.395 25061 6224 1 9 . 1 1 100 100 LYS C C 100 180.846 180.846 179.060 1.786 25061 6225 1 9 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.499 0.589 25061 6226 1 9 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.811 0.458 25061 6227 1 9 . 1 1 100 100 LYS H H 100 7.560 7.560 7.293 0.267 25061 6228 1 9 . 1 1 101 101 LYS N N 101 121.944 121.944 117.870 4.074 25061 6229 1 9 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.092 -0.020 25061 6230 1 9 . 1 1 101 101 LYS C C 101 177.707 177.707 178.091 -0.384 25061 6231 1 9 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.155 0.716 25061 6232 1 9 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.459 -0.364 25061 6233 1 9 . 1 1 101 101 LYS H H 101 7.959 7.959 7.707 0.252 25061 6234 1 9 . 1 1 102 102 ASP N N 102 118.788 118.788 117.542 1.246 25061 6235 1 9 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.430 0.264 25061 6236 1 9 . 1 1 102 102 ASP C C 102 176.359 176.359 177.216 -0.857 25061 6237 1 9 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.599 -1.020 25061 6238 1 9 . 1 1 102 102 ASP CB C 102 40.574 40.574 42.034 -1.460 25061 6239 1 9 . 1 1 102 102 ASP H H 102 7.893 7.893 7.771 0.122 25061 6240 1 9 . 1 1 103 103 GLY N N 103 107.024 107.024 105.270 1.754 25061 6241 1 9 . 1 1 103 103 GLY C C 103 174.328 174.328 173.868 0.460 25061 6242 1 9 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.889 0.456 25061 6243 1 9 . 1 1 103 103 GLY H H 103 7.866 7.866 7.968 -0.102 25061 6244 1 9 . 1 1 104 104 VAL N N 104 123.060 123.060 122.500 0.560 25061 6245 1 9 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.998 -0.025 25061 6246 1 9 . 1 1 104 104 VAL C C 104 175.023 175.023 174.478 0.545 25061 6247 1 9 . 1 1 104 104 VAL CA C 104 61.878 61.878 61.965 -0.087 25061 6248 1 9 . 1 1 104 104 VAL CB C 104 32.088 32.088 31.829 0.259 25061 6249 1 9 . 1 1 104 104 VAL H H 104 7.955 7.955 7.703 0.252 25061 6250 1 9 . 1 1 105 105 ASP N N 105 127.987 127.987 127.662 0.325 25061 6251 1 9 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.661 -0.086 25061 6252 1 9 . 1 1 105 105 ASP C C 105 173.624 173.624 174.851 -1.227 25061 6253 1 9 . 1 1 105 105 ASP CA C 105 54.087 54.087 54.310 -0.223 25061 6254 1 9 . 1 1 105 105 ASP CB C 105 40.660 40.660 41.268 -0.608 25061 6255 1 9 . 1 1 105 105 ASP H H 105 8.399 8.399 8.663 -0.264 25061 6256 1 9 . 1 1 106 106 VAL N N 106 125.798 125.798 123.579 2.219 25061 6257 1 9 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.419 0.396 25061 6258 1 9 . 1 1 106 106 VAL C C 106 174.902 174.902 174.966 -0.064 25061 6259 1 9 . 1 1 106 106 VAL CA C 106 60.194 60.194 61.282 -1.089 25061 6260 1 9 . 1 1 106 106 VAL CB C 106 34.179 34.179 32.785 1.394 25061 6261 1 9 . 1 1 106 106 VAL H H 106 7.550 7.550 7.641 -0.091 25061 6262 1 9 . 1 1 107 107 ARG N N 107 128.099 128.099 130.574 -2.475 25061 6263 1 9 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.602 0.274 25061 6264 1 9 . 1 1 107 107 ARG C C 107 173.815 173.815 174.947 -1.132 25061 6265 1 9 . 1 1 107 107 ARG CA C 107 53.386 53.386 53.106 0.280 25061 6266 1 9 . 1 1 107 107 ARG CB C 107 31.195 31.195 30.077 1.118 25061 6267 1 9 . 1 1 107 107 ARG H H 107 9.132 9.132 8.607 0.525 25061 6268 1 9 . 1 1 108 108 VAL N N 108 123.979 123.979 123.391 0.588 25061 6269 1 9 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.273 -0.331 25061 6270 1 9 . 1 1 108 108 VAL C C 108 175.854 175.854 176.302 -0.448 25061 6271 1 9 . 1 1 108 108 VAL CA C 108 60.017 60.017 60.051 -0.034 25061 6272 1 9 . 1 1 108 108 VAL CB C 108 32.844 32.844 31.747 1.097 25061 6273 1 9 . 1 1 108 108 VAL H H 108 8.561 8.561 8.592 -0.031 25061 6274 1 9 . 1 1 109 109 THR N N 109 120.144 120.144 123.496 -3.352 25061 6275 1 9 . 1 1 109 109 THR HA H 109 4.815 4.815 4.534 0.281 25061 6276 1 9 . 1 1 109 109 THR C C 109 171.867 171.867 175.079 -3.212 25061 6277 1 9 . 1 1 109 109 THR CA C 109 59.613 59.613 61.575 -1.962 25061 6278 1 9 . 1 1 109 109 THR CB C 109 69.720 69.720 70.151 -0.431 25061 6279 1 9 . 1 1 109 109 THR H H 109 8.803 8.803 8.766 0.037 25061 6280 1 9 . 1 1 110 110 ASP N N 110 123.212 123.212 126.400 -3.188 25061 6281 1 9 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.490 0.479 25061 6282 1 9 . 1 1 110 110 ASP C C 110 175.739 175.739 175.845 -0.106 25061 6283 1 9 . 1 1 110 110 ASP CA C 110 53.243 53.243 57.423 -4.180 25061 6284 1 9 . 1 1 110 110 ASP CB C 110 41.351 41.351 41.335 0.016 25061 6285 1 9 . 1 1 110 110 ASP H H 110 8.363 8.363 8.867 -0.504 25061 6286 1 9 . 1 1 111 111 ASN N N 111 116.298 116.298 115.969 0.329 25061 6287 1 9 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.875 0.001 25061 6288 1 9 . 1 1 111 111 ASN C C 111 174.756 174.756 175.975 -1.219 25061 6289 1 9 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.630 -0.498 25061 6290 1 9 . 1 1 111 111 ASN CB C 111 40.765 40.765 39.771 0.994 25061 6291 1 9 . 1 1 111 111 ASN H H 111 8.085 8.085 8.027 0.058 25061 6292 1 9 . 1 1 112 112 GLU HA H 112 3.848 3.848 4.051 -0.203 25061 6293 1 9 . 1 1 112 112 GLU C C 112 177.016 177.016 178.174 -1.158 25061 6294 1 9 . 1 1 112 112 GLU CA C 112 59.480 59.480 59.881 -0.401 25061 6295 1 9 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.704 -0.031 25061 6296 1 9 . 1 1 113 113 ASP N N 113 121.033 121.033 118.822 2.211 25061 6297 1 9 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.420 -0.007 25061 6298 1 9 . 1 1 113 113 ASP C C 113 178.988 178.988 178.526 0.462 25061 6299 1 9 . 1 1 113 113 ASP CA C 113 57.855 57.855 57.271 0.584 25061 6300 1 9 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.676 -0.174 25061 6301 1 9 . 1 1 113 113 ASP H H 113 8.219 8.219 8.459 -0.240 25061 6302 1 9 . 1 1 114 114 GLU N N 114 121.280 121.280 119.606 1.674 25061 6303 1 9 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.134 -0.069 25061 6304 1 9 . 1 1 114 114 GLU C C 114 178.776 178.776 178.270 0.506 25061 6305 1 9 . 1 1 114 114 GLU CA C 114 58.714 58.714 59.280 -0.566 25061 6306 1 9 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.199 0.014 25061 6307 1 9 . 1 1 114 114 GLU H H 114 8.296 8.296 8.628 -0.332 25061 6308 1 9 . 1 1 115 115 ALA N N 115 120.924 120.924 120.773 0.151 25061 6309 1 9 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.063 -0.225 25061 6310 1 9 . 1 1 115 115 ALA C C 115 178.502 178.502 179.361 -0.859 25061 6311 1 9 . 1 1 115 115 ALA CA C 115 55.638 55.638 54.901 0.737 25061 6312 1 9 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.082 0.415 25061 6313 1 9 . 1 1 115 115 ALA H H 115 7.853 7.853 7.638 0.215 25061 6314 1 9 . 1 1 116 116 LYS N N 116 116.616 116.616 118.798 -2.182 25061 6315 1 9 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.934 -0.215 25061 6316 1 9 . 1 1 116 116 LYS C C 116 178.097 178.097 178.652 -0.555 25061 6317 1 9 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.843 0.909 25061 6318 1 9 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.247 0.308 25061 6319 1 9 . 1 1 116 116 LYS H H 116 8.091 8.091 7.704 0.387 25061 6320 1 9 . 1 1 117 117 LYS N N 117 118.990 118.990 118.631 0.359 25061 6321 1 9 . 1 1 117 117 LYS HA H 117 3.911 3.911 3.984 -0.073 25061 6322 1 9 . 1 1 117 117 LYS C C 117 179.186 179.186 179.240 -0.054 25061 6323 1 9 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.492 0.079 25061 6324 1 9 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.267 0.253 25061 6325 1 9 . 1 1 117 117 LYS H H 117 7.742 7.742 7.450 0.292 25061 6326 1 9 . 1 1 118 118 ARG N N 118 117.441 117.441 120.196 -2.755 25061 6327 1 9 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.402 -0.262 25061 6328 1 9 . 1 1 118 118 ARG C C 118 178.921 178.921 178.872 0.049 25061 6329 1 9 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.371 -0.700 25061 6330 1 9 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.652 0.009 25061 6331 1 9 . 1 1 118 118 ARG H H 118 8.468 8.468 7.818 0.650 25061 6332 1 9 . 1 1 119 119 LEU N N 119 120.100 120.100 120.414 -0.314 25061 6333 1 9 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.897 0.063 25061 6334 1 9 . 1 1 119 119 LEU C C 119 177.554 177.554 178.975 -1.421 25061 6335 1 9 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.133 -0.252 25061 6336 1 9 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.514 0.375 25061 6337 1 9 . 1 1 119 119 LEU H H 119 8.322 8.322 8.320 0.002 25061 6338 1 9 . 1 1 120 120 LYS N N 120 118.238 118.238 118.958 -0.720 25061 6339 1 9 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.937 -0.115 25061 6340 1 9 . 1 1 120 120 LYS C C 120 178.703 178.703 179.266 -0.563 25061 6341 1 9 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.081 1.265 25061 6342 1 9 . 1 1 120 120 LYS CB C 120 32.236 32.236 31.916 0.320 25061 6343 1 9 . 1 1 120 120 LYS H H 120 7.990 7.990 7.645 0.345 25061 6344 1 9 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.000 0.022 25061 6345 1 9 . 1 1 121 121 GLU C C 121 177.769 177.769 179.391 -1.622 25061 6346 1 9 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.232 -0.310 25061 6347 1 9 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.530 -0.076 25061 6348 1 9 . 1 1 122 122 LEU N N 122 119.454 119.454 119.118 0.336 25061 6349 1 9 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.115 0.018 25061 6350 1 9 . 1 1 122 122 LEU C C 122 178.991 178.991 178.935 0.056 25061 6351 1 9 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.835 -0.509 25061 6352 1 9 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.954 -0.275 25061 6353 1 9 . 1 1 122 122 LEU H H 122 7.930 7.930 7.641 0.289 25061 6354 1 9 . 1 1 123 123 LEU N N 123 117.862 117.862 118.643 -0.781 25061 6355 1 9 . 1 1 123 123 LEU HA H 123 4.067 4.067 4.364 -0.297 25061 6356 1 9 . 1 1 123 123 LEU C C 123 179.178 179.178 179.992 -0.814 25061 6357 1 9 . 1 1 123 123 LEU CA C 123 56.920 56.920 56.530 0.390 25061 6358 1 9 . 1 1 123 123 LEU CB C 123 41.210 41.210 40.868 0.342 25061 6359 1 9 . 1 1 123 123 LEU H H 123 8.095 8.095 8.034 0.061 25061 6360 1 9 . 1 1 124 124 GLU N N 124 118.975 118.975 118.691 0.284 25061 6361 1 9 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.104 0.025 25061 6362 1 9 . 1 1 124 124 GLU C C 124 177.777 177.777 177.626 0.151 25061 6363 1 9 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.849 -0.762 25061 6364 1 9 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.358 0.182 25061 6365 1 9 . 1 1 124 124 GLU H H 124 7.930 7.930 8.126 -0.196 25061 6366 1 9 . 1 1 125 125 LYS N N 125 118.933 118.933 116.360 2.573 25061 6367 1 9 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.362 -0.025 25061 6368 1 9 . 1 1 125 125 LYS C C 125 178.188 178.188 177.272 0.916 25061 6369 1 9 . 1 1 125 125 LYS CA C 125 56.980 56.980 57.350 -0.370 25061 6370 1 9 . 1 1 125 125 LYS CB C 125 32.608 32.608 34.611 -2.003 25061 6371 1 9 . 1 1 125 125 LYS H H 125 7.729 7.729 7.753 -0.024 25061 6372 1 9 . 1 1 126 126 VAL N N 126 117.933 117.933 116.333 1.600 25061 6373 1 9 . 1 1 126 126 VAL HA H 126 4.022 4.022 4.209 -0.187 25061 6374 1 9 . 1 1 126 126 VAL C C 126 176.947 176.947 174.787 2.160 25061 6375 1 9 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.219 0.422 25061 6376 1 9 . 1 1 126 126 VAL CB C 126 31.859 31.859 33.973 -2.114 25061 6377 1 9 . 1 1 126 126 VAL H H 126 8.044 8.044 7.968 0.076 25061 6378 1 9 . 1 1 127 127 GLY N N 127 109.813 109.813 108.634 1.179 25061 6379 1 9 . 1 1 127 127 GLY C C 127 174.264 174.264 173.247 1.017 25061 6380 1 9 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.446 -0.167 25061 6381 1 9 . 1 1 127 127 GLY H H 127 8.279 8.279 7.719 0.560 25061 6382 1 9 . 1 1 128 128 SER N N 128 115.185 115.185 115.834 -0.649 25061 6383 1 9 . 1 1 128 128 SER HA H 128 4.462 4.462 4.712 -0.250 25061 6384 1 9 . 1 1 128 128 SER C C 128 174.775 174.775 172.070 2.705 25061 6385 1 9 . 1 1 128 128 SER CA C 128 58.739 58.739 58.580 0.159 25061 6386 1 9 . 1 1 128 128 SER CB C 128 63.850 63.850 64.917 -1.067 25061 6387 1 9 . 1 1 128 128 SER H H 128 8.048 8.048 7.796 0.252 25061 6388 1 9 . 1 1 129 129 LEU N N 129 123.060 123.060 125.399 -2.339 25061 6389 1 9 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.475 -0.177 25061 6390 1 9 . 1 1 129 129 LEU C C 129 177.313 177.313 175.304 2.009 25061 6391 1 9 . 1 1 129 129 LEU CA C 129 55.158 55.158 55.347 -0.189 25061 6392 1 9 . 1 1 129 129 LEU CB C 129 41.837 41.837 45.023 -3.186 25061 6393 1 9 . 1 1 129 129 LEU H H 129 8.147 8.147 8.387 -0.240 25061 6394 1 9 . 1 1 130 130 GLU N N 130 120.088 120.088 123.686 -3.598 25061 6395 1 9 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.100 0.081 25061 6396 1 9 . 1 1 130 130 GLU C C 130 176.148 176.148 175.581 0.567 25061 6397 1 9 . 1 1 130 130 GLU CA C 130 56.726 56.726 57.278 -0.552 25061 6398 1 9 . 1 1 130 130 GLU CB C 130 30.026 30.026 29.240 0.786 25061 6399 1 9 . 1 1 130 130 GLU H H 130 8.242 8.242 8.694 -0.452 25061 6400 1 10 . 1 1 2 2 GLY CA C 2 45.319 45.319 44.926 0.393 25061 6401 1 10 . 1 1 3 3 THR HA H 3 4.820 4.820 5.507 -0.687 25061 6402 1 10 . 1 1 3 3 THR C C 3 172.374 172.374 173.411 -1.037 25061 6403 1 10 . 1 1 3 3 THR CA C 3 62.760 62.760 59.817 2.943 25061 6404 1 10 . 1 1 3 3 THR CB C 3 71.441 71.441 71.983 -0.542 25061 6405 1 10 . 1 1 4 4 VAL N N 4 126.881 126.881 121.352 5.529 25061 6406 1 10 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.438 0.130 25061 6407 1 10 . 1 1 4 4 VAL C C 4 173.116 173.116 174.513 -1.397 25061 6408 1 10 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.333 -0.878 25061 6409 1 10 . 1 1 4 4 VAL CB C 4 33.800 33.800 33.366 0.434 25061 6410 1 10 . 1 1 4 4 VAL H H 4 9.097 9.097 8.601 0.496 25061 6411 1 10 . 1 1 5 5 VAL N N 5 127.172 127.172 123.387 3.785 25061 6412 1 10 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.471 -0.584 25061 6413 1 10 . 1 1 5 5 VAL C C 5 174.091 174.091 174.904 -0.813 25061 6414 1 10 . 1 1 5 5 VAL CA C 5 60.118 60.118 58.985 1.133 25061 6415 1 10 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.799 -0.864 25061 6416 1 10 . 1 1 5 5 VAL H H 5 8.811 8.811 8.501 0.310 25061 6417 1 10 . 1 1 6 6 ILE N N 6 127.577 127.577 127.419 0.158 25061 6418 1 10 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.505 0.115 25061 6419 1 10 . 1 1 6 6 ILE C C 6 173.328 173.328 175.337 -2.009 25061 6420 1 10 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.447 0.385 25061 6421 1 10 . 1 1 6 6 ILE CB C 6 39.930 39.930 40.194 -0.265 25061 6422 1 10 . 1 1 6 6 ILE H H 6 9.210 9.210 7.916 1.294 25061 6423 1 10 . 1 1 7 7 VAL N N 7 129.024 129.024 129.409 -0.385 25061 6424 1 10 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.382 0.423 25061 6425 1 10 . 1 1 7 7 VAL C C 7 173.561 173.561 175.009 -1.448 25061 6426 1 10 . 1 1 7 7 VAL CA C 7 60.849 60.849 62.010 -1.161 25061 6427 1 10 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.099 1.260 25061 6428 1 10 . 1 1 7 7 VAL H H 7 9.294 9.294 8.459 0.835 25061 6429 1 10 . 1 1 8 8 VAL N N 8 125.318 125.318 130.486 -5.168 25061 6430 1 10 . 1 1 8 8 VAL HA H 8 5.396 5.396 4.679 0.717 25061 6431 1 10 . 1 1 8 8 VAL C C 8 175.723 175.723 175.118 0.605 25061 6432 1 10 . 1 1 8 8 VAL CA C 8 59.617 59.617 61.755 -2.138 25061 6433 1 10 . 1 1 8 8 VAL CB C 8 34.915 34.915 32.708 2.207 25061 6434 1 10 . 1 1 8 8 VAL H H 8 8.898 8.898 8.612 0.286 25061 6435 1 10 . 1 1 9 9 SER N N 9 116.544 116.544 122.056 -5.512 25061 6436 1 10 . 1 1 9 9 SER HA H 9 4.724 4.724 5.178 -0.454 25061 6437 1 10 . 1 1 9 9 SER C C 9 174.552 174.552 173.597 0.955 25061 6438 1 10 . 1 1 9 9 SER CA C 9 57.419 57.419 56.946 0.473 25061 6439 1 10 . 1 1 9 9 SER CB C 9 64.998 64.998 66.377 -1.379 25061 6440 1 10 . 1 1 9 9 SER H H 9 7.833 7.833 7.912 -0.079 25061 6441 1 10 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.467 0.445 25061 6442 1 10 . 1 1 10 10 ASN C C 10 176.170 176.170 174.360 1.810 25061 6443 1 10 . 1 1 10 10 ASN CA C 10 54.141 54.141 55.541 -1.400 25061 6444 1 10 . 1 1 10 10 ASN CB C 10 38.626 38.626 39.536 -0.910 25061 6445 1 10 . 1 1 11 11 ASP N N 11 120.164 120.164 117.330 2.834 25061 6446 1 10 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.799 0.044 25061 6447 1 10 . 1 1 11 11 ASP C C 11 176.148 176.148 176.310 -0.162 25061 6448 1 10 . 1 1 11 11 ASP CA C 11 52.620 52.620 52.515 0.105 25061 6449 1 10 . 1 1 11 11 ASP CB C 11 42.631 42.631 43.228 -0.597 25061 6450 1 10 . 1 1 11 11 ASP H H 11 8.142 8.142 7.646 0.496 25061 6451 1 10 . 1 1 12 12 GLU N N 12 127.184 127.184 124.622 2.562 25061 6452 1 10 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.191 -0.338 25061 6453 1 10 . 1 1 12 12 GLU C C 12 177.853 177.853 178.468 -0.615 25061 6454 1 10 . 1 1 12 12 GLU CA C 12 59.547 59.547 58.755 0.792 25061 6455 1 10 . 1 1 12 12 GLU CB C 12 29.819 29.819 30.044 -0.225 25061 6456 1 10 . 1 1 12 12 GLU H H 12 9.152 9.152 8.781 0.371 25061 6457 1 10 . 1 1 13 13 ARG N N 13 119.026 119.026 119.789 -0.763 25061 6458 1 10 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.125 -0.022 25061 6459 1 10 . 1 1 13 13 ARG C C 13 179.151 179.151 179.055 0.096 25061 6460 1 10 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.908 0.035 25061 6461 1 10 . 1 1 13 13 ARG CB C 13 28.757 28.757 30.004 -1.247 25061 6462 1 10 . 1 1 13 13 ARG H H 13 8.389 8.389 7.803 0.586 25061 6463 1 10 . 1 1 14 14 ILE N N 14 119.238 119.238 120.607 -1.369 25061 6464 1 10 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.824 -0.223 25061 6465 1 10 . 1 1 14 14 ILE C C 14 177.905 177.905 177.781 0.124 25061 6466 1 10 . 1 1 14 14 ILE CA C 14 64.666 64.666 63.627 1.039 25061 6467 1 10 . 1 1 14 14 ILE CB C 14 36.780 36.780 36.904 -0.124 25061 6468 1 10 . 1 1 14 14 ILE H H 14 7.254 7.254 8.092 -0.838 25061 6469 1 10 . 1 1 15 15 LEU N N 15 117.008 117.008 119.707 -2.699 25061 6470 1 10 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.193 -0.272 25061 6471 1 10 . 1 1 15 15 LEU C C 15 178.062 178.062 179.728 -1.666 25061 6472 1 10 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.060 0.351 25061 6473 1 10 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.576 -0.407 25061 6474 1 10 . 1 1 15 15 LEU H H 15 7.412 7.412 7.578 -0.166 25061 6475 1 10 . 1 1 16 16 GLU N N 16 117.637 117.637 119.379 -1.742 25061 6476 1 10 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.946 -0.245 25061 6477 1 10 . 1 1 16 16 GLU C C 16 179.182 179.182 178.735 0.447 25061 6478 1 10 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.224 0.193 25061 6479 1 10 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.228 0.231 25061 6480 1 10 . 1 1 16 16 GLU H H 16 7.981 7.981 7.743 0.238 25061 6481 1 10 . 1 1 17 17 GLU N N 17 119.759 119.759 120.795 -1.036 25061 6482 1 10 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.234 -0.218 25061 6483 1 10 . 1 1 17 17 GLU C C 17 179.949 179.949 179.181 0.768 25061 6484 1 10 . 1 1 17 17 GLU CA C 17 59.195 59.195 58.765 0.430 25061 6485 1 10 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.289 0.251 25061 6486 1 10 . 1 1 17 17 GLU H H 17 8.248 8.248 8.057 0.191 25061 6487 1 10 . 1 1 18 18 LEU N N 18 119.764 119.764 119.267 0.497 25061 6488 1 10 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.206 -0.125 25061 6489 1 10 . 1 1 18 18 LEU C C 18 177.620 177.620 179.014 -1.394 25061 6490 1 10 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.387 0.291 25061 6491 1 10 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.710 -0.600 25061 6492 1 10 . 1 1 18 18 LEU H H 18 8.486 8.486 8.313 0.173 25061 6493 1 10 . 1 1 19 19 LEU N N 19 123.102 123.102 121.082 2.020 25061 6494 1 10 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.408 0.254 25061 6495 1 10 . 1 1 19 19 LEU C C 19 178.343 178.343 178.224 0.119 25061 6496 1 10 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.479 0.757 25061 6497 1 10 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.359 -0.708 25061 6498 1 10 . 1 1 19 19 LEU H H 19 7.870 7.870 7.764 0.106 25061 6499 1 10 . 1 1 20 20 GLU N N 20 117.884 117.884 118.331 -0.447 25061 6500 1 10 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.965 -0.061 25061 6501 1 10 . 1 1 20 20 GLU C C 20 177.707 177.707 179.410 -1.703 25061 6502 1 10 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.494 -0.102 25061 6503 1 10 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.337 -0.360 25061 6504 1 10 . 1 1 20 20 GLU H H 20 7.497 7.497 7.662 -0.165 25061 6505 1 10 . 1 1 21 21 VAL N N 21 117.709 117.709 119.691 -1.982 25061 6506 1 10 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.656 -0.032 25061 6507 1 10 . 1 1 21 21 VAL C C 21 178.523 178.523 177.601 0.922 25061 6508 1 10 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.392 -0.195 25061 6509 1 10 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.721 -0.574 25061 6510 1 10 . 1 1 21 21 VAL H H 21 7.514 7.514 7.290 0.224 25061 6511 1 10 . 1 1 22 22 VAL N N 22 121.233 121.233 119.549 1.684 25061 6512 1 10 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.624 -0.178 25061 6513 1 10 . 1 1 22 22 VAL C C 22 176.868 176.868 178.139 -1.271 25061 6514 1 10 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.713 0.300 25061 6515 1 10 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.658 -0.344 25061 6516 1 10 . 1 1 22 22 VAL H H 22 7.863 7.863 7.440 0.423 25061 6517 1 10 . 1 1 23 23 LEU N N 23 118.101 118.101 119.408 -1.307 25061 6518 1 10 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.027 0.038 25061 6519 1 10 . 1 1 23 23 LEU C C 23 179.701 179.701 178.573 1.128 25061 6520 1 10 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.842 -0.546 25061 6521 1 10 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.701 0.003 25061 6522 1 10 . 1 1 23 23 LEU H H 23 8.151 8.151 8.138 0.013 25061 6523 1 10 . 1 1 24 24 LYS N N 24 114.622 114.622 116.730 -2.108 25061 6524 1 10 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.088 0.049 25061 6525 1 10 . 1 1 24 24 LYS C C 24 178.062 178.062 178.883 -0.821 25061 6526 1 10 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.478 -1.111 25061 6527 1 10 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.474 0.120 25061 6528 1 10 . 1 1 24 24 LYS H H 24 7.823 7.823 7.989 -0.166 25061 6529 1 10 . 1 1 25 25 SER N N 25 115.474 115.474 115.131 0.343 25061 6530 1 10 . 1 1 25 25 SER HA H 25 4.377 4.377 4.317 0.060 25061 6531 1 10 . 1 1 25 25 SER C C 25 174.520 174.520 174.673 -0.153 25061 6532 1 10 . 1 1 25 25 SER CA C 25 61.049 61.049 61.364 -0.314 25061 6533 1 10 . 1 1 25 25 SER CB C 25 63.777 63.777 64.187 -0.410 25061 6534 1 10 . 1 1 25 25 SER H H 25 7.798 7.798 7.795 0.003 25061 6535 1 10 . 1 1 26 26 ASP N N 26 117.424 117.424 118.472 -1.048 25061 6536 1 10 . 1 1 26 26 ASP HA H 26 4.886 4.886 5.004 -0.118 25061 6537 1 10 . 1 1 26 26 ASP C C 26 173.521 173.521 174.076 -0.555 25061 6538 1 10 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.148 -0.100 25061 6539 1 10 . 1 1 26 26 ASP CB C 26 42.202 42.202 43.187 -0.985 25061 6540 1 10 . 1 1 26 26 ASP H H 26 7.990 7.990 8.005 -0.015 25061 6541 1 10 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.646 -0.001 25061 6542 1 10 . 1 1 27 27 PRO C C 27 177.016 177.016 177.094 -0.078 25061 6543 1 10 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.599 0.002 25061 6544 1 10 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.574 -0.401 25061 6545 1 10 . 1 1 28 28 ASN N N 28 115.839 115.839 117.154 -1.315 25061 6546 1 10 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.802 -0.110 25061 6547 1 10 . 1 1 28 28 ASN C C 28 175.701 175.701 175.789 -0.088 25061 6548 1 10 . 1 1 28 28 ASN CA C 28 53.472 53.472 53.725 -0.253 25061 6549 1 10 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.146 0.067 25061 6550 1 10 . 1 1 28 28 ASN H H 28 8.608 8.608 8.262 0.346 25061 6551 1 10 . 1 1 29 29 VAL N N 29 120.770 120.770 118.127 2.643 25061 6552 1 10 . 1 1 29 29 VAL HA H 29 3.815 3.815 4.152 -0.337 25061 6553 1 10 . 1 1 29 29 VAL C C 29 175.023 175.023 176.273 -1.250 25061 6554 1 10 . 1 1 29 29 VAL CA C 29 62.552 62.552 62.457 0.095 25061 6555 1 10 . 1 1 29 29 VAL CB C 29 32.147 32.147 32.135 0.012 25061 6556 1 10 . 1 1 29 29 VAL H H 29 7.428 7.428 7.911 -0.483 25061 6557 1 10 . 1 1 30 30 LYS N N 30 127.345 127.345 125.575 1.770 25061 6558 1 10 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.369 0.110 25061 6559 1 10 . 1 1 30 30 LYS C C 30 174.777 174.777 176.383 -1.606 25061 6560 1 10 . 1 1 30 30 LYS CA C 30 55.204 55.204 54.998 0.206 25061 6561 1 10 . 1 1 30 30 LYS CB C 30 31.949 31.949 30.216 1.733 25061 6562 1 10 . 1 1 30 30 LYS H H 30 8.457 8.457 8.404 0.053 25061 6563 1 10 . 1 1 31 31 THR N N 31 113.552 113.552 116.048 -2.496 25061 6564 1 10 . 1 1 31 31 THR HA H 31 5.723 5.723 4.820 0.903 25061 6565 1 10 . 1 1 31 31 THR C C 31 174.593 174.593 174.758 -0.165 25061 6566 1 10 . 1 1 31 31 THR CA C 31 59.030 59.030 61.860 -2.830 25061 6567 1 10 . 1 1 31 31 THR CB C 31 72.206 72.206 68.456 3.750 25061 6568 1 10 . 1 1 31 31 THR H H 31 8.164 8.164 8.179 -0.015 25061 6569 1 10 . 1 1 32 32 VAL N N 32 119.206 119.206 127.616 -8.410 25061 6570 1 10 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.416 -0.011 25061 6571 1 10 . 1 1 32 32 VAL C C 32 172.663 172.663 174.668 -2.005 25061 6572 1 10 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.254 -0.182 25061 6573 1 10 . 1 1 32 32 VAL CB C 32 35.051 35.051 33.522 1.529 25061 6574 1 10 . 1 1 32 32 VAL H H 32 8.615 8.615 8.695 -0.080 25061 6575 1 10 . 1 1 33 33 ARG N N 33 130.278 130.278 127.225 3.053 25061 6576 1 10 . 1 1 33 33 ARG HA H 33 5.331 5.331 5.244 0.087 25061 6577 1 10 . 1 1 33 33 ARG C C 33 173.836 173.836 176.008 -2.172 25061 6578 1 10 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.048 -0.898 25061 6579 1 10 . 1 1 33 33 ARG CB C 33 30.028 30.028 31.352 -1.324 25061 6580 1 10 . 1 1 33 33 ARG H H 33 8.996 8.996 8.832 0.164 25061 6581 1 10 . 1 1 34 34 THR N N 34 121.695 121.695 119.247 2.448 25061 6582 1 10 . 1 1 34 34 THR HA H 34 4.483 4.483 4.350 0.133 25061 6583 1 10 . 1 1 34 34 THR C C 34 169.769 169.769 173.219 -3.450 25061 6584 1 10 . 1 1 34 34 THR CA C 34 60.814 60.814 61.331 -0.517 25061 6585 1 10 . 1 1 34 34 THR CB C 34 67.402 67.402 69.991 -2.589 25061 6586 1 10 . 1 1 34 34 THR H H 34 8.126 8.126 8.349 -0.223 25061 6587 1 10 . 1 1 35 35 ASP N N 35 122.198 122.198 122.706 -0.508 25061 6588 1 10 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.297 0.527 25061 6589 1 10 . 1 1 35 35 ASP C C 35 174.790 174.790 175.888 -1.098 25061 6590 1 10 . 1 1 35 35 ASP CA C 35 53.386 53.386 53.829 -0.443 25061 6591 1 10 . 1 1 35 35 ASP CB C 35 41.848 41.848 40.267 1.581 25061 6592 1 10 . 1 1 35 35 ASP H H 35 7.983 7.983 8.329 -0.346 25061 6593 1 10 . 1 1 36 36 ASP N N 36 121.091 121.091 121.444 -0.353 25061 6594 1 10 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.389 0.204 25061 6595 1 10 . 1 1 36 36 ASP C C 36 176.189 176.189 176.647 -0.458 25061 6596 1 10 . 1 1 36 36 ASP CA C 36 53.055 53.055 55.948 -2.893 25061 6597 1 10 . 1 1 36 36 ASP CB C 36 42.159 42.159 41.628 0.531 25061 6598 1 10 . 1 1 36 36 ASP H H 36 8.157 8.157 7.701 0.456 25061 6599 1 10 . 1 1 37 37 LYS N N 37 125.839 125.839 114.973 10.866 25061 6600 1 10 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.706 0.016 25061 6601 1 10 . 1 1 37 37 LYS C C 37 176.870 176.870 177.624 -0.754 25061 6602 1 10 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.529 -0.125 25061 6603 1 10 . 1 1 37 37 LYS CB C 37 32.394 32.394 30.815 1.579 25061 6604 1 10 . 1 1 37 37 LYS H H 37 8.843 8.843 8.255 0.588 25061 6605 1 10 . 1 1 38 38 GLU N N 38 118.369 118.369 119.375 -1.006 25061 6606 1 10 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.840 0.167 25061 6607 1 10 . 1 1 38 38 GLU C C 38 179.502 179.502 178.033 1.469 25061 6608 1 10 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.822 -0.152 25061 6609 1 10 . 1 1 38 38 GLU CB C 38 28.474 28.474 29.259 -0.785 25061 6610 1 10 . 1 1 38 38 GLU H H 38 8.182 8.182 8.139 0.043 25061 6611 1 10 . 1 1 39 39 LYS N N 39 121.722 121.722 120.521 1.201 25061 6612 1 10 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.010 0.155 25061 6613 1 10 . 1 1 39 39 LYS C C 39 178.500 178.500 178.402 0.098 25061 6614 1 10 . 1 1 39 39 LYS CA C 39 57.736 57.736 59.249 -1.513 25061 6615 1 10 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.292 -1.154 25061 6616 1 10 . 1 1 39 39 LYS H H 39 7.524 7.524 7.600 -0.076 25061 6617 1 10 . 1 1 40 40 VAL N N 40 117.199 117.199 118.814 -1.615 25061 6618 1 10 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.571 -0.343 25061 6619 1 10 . 1 1 40 40 VAL C C 40 177.362 177.362 177.955 -0.593 25061 6620 1 10 . 1 1 40 40 VAL CA C 40 67.642 67.642 65.785 1.857 25061 6621 1 10 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.539 -0.636 25061 6622 1 10 . 1 1 40 40 VAL H H 40 7.883 7.883 7.563 0.320 25061 6623 1 10 . 1 1 41 41 LYS N N 41 117.677 117.677 119.315 -1.638 25061 6624 1 10 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.662 -0.220 25061 6625 1 10 . 1 1 41 41 LYS C C 41 177.686 177.686 178.860 -1.174 25061 6626 1 10 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.079 1.730 25061 6627 1 10 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.092 0.523 25061 6628 1 10 . 1 1 41 41 LYS H H 41 7.567 7.567 7.409 0.158 25061 6629 1 10 . 1 1 42 42 GLU N N 42 118.369 118.369 119.459 -1.090 25061 6630 1 10 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.017 -0.010 25061 6631 1 10 . 1 1 42 42 GLU C C 42 179.725 179.725 179.126 0.599 25061 6632 1 10 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.552 -0.483 25061 6633 1 10 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.095 0.444 25061 6634 1 10 . 1 1 42 42 GLU H H 42 7.634 7.634 7.577 0.057 25061 6635 1 10 . 1 1 43 43 GLU N N 43 117.906 117.906 119.054 -1.148 25061 6636 1 10 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.143 0.040 25061 6637 1 10 . 1 1 43 43 GLU C C 43 179.757 179.757 179.413 0.344 25061 6638 1 10 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.578 -0.212 25061 6639 1 10 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.245 -0.405 25061 6640 1 10 . 1 1 43 43 GLU H H 43 8.162 8.162 8.212 -0.050 25061 6641 1 10 . 1 1 44 44 ILE N N 44 122.291 122.291 121.471 0.820 25061 6642 1 10 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.628 -0.016 25061 6643 1 10 . 1 1 44 44 ILE C C 44 177.101 177.101 177.703 -0.602 25061 6644 1 10 . 1 1 44 44 ILE CA C 44 66.355 66.355 66.102 0.254 25061 6645 1 10 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.915 -0.455 25061 6646 1 10 . 1 1 44 44 ILE H H 44 8.742 8.742 8.390 0.352 25061 6647 1 10 . 1 1 45 45 GLU N N 45 119.892 119.892 120.999 -1.107 25061 6648 1 10 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.199 -0.141 25061 6649 1 10 . 1 1 45 45 GLU C C 45 178.991 178.991 179.232 -0.241 25061 6650 1 10 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.652 0.013 25061 6651 1 10 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.459 -0.298 25061 6652 1 10 . 1 1 45 45 GLU H H 45 8.171 8.171 8.082 0.089 25061 6653 1 10 . 1 1 46 46 LYS N N 46 118.064 118.064 118.547 -0.483 25061 6654 1 10 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.043 -0.061 25061 6655 1 10 . 1 1 46 46 LYS C C 46 178.837 178.837 179.042 -0.205 25061 6656 1 10 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.239 0.502 25061 6657 1 10 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.288 0.155 25061 6658 1 10 . 1 1 46 46 LYS H H 46 7.785 7.785 8.084 -0.299 25061 6659 1 10 . 1 1 47 47 ALA N N 47 121.817 121.817 121.943 -0.126 25061 6660 1 10 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.069 -0.038 25061 6661 1 10 . 1 1 47 47 ALA C C 47 179.859 179.859 179.866 -0.007 25061 6662 1 10 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.209 0.086 25061 6663 1 10 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.617 -0.961 25061 6664 1 10 . 1 1 47 47 ALA H H 47 8.123 8.123 7.970 0.153 25061 6665 1 10 . 1 1 48 48 ARG N N 48 119.080 119.080 118.919 0.161 25061 6666 1 10 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.157 -0.068 25061 6667 1 10 . 1 1 48 48 ARG C C 48 180.155 180.155 178.563 1.592 25061 6668 1 10 . 1 1 48 48 ARG CA C 48 59.197 59.197 57.987 1.210 25061 6669 1 10 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.262 0.248 25061 6670 1 10 . 1 1 48 48 ARG H H 48 8.768 8.768 8.235 0.533 25061 6671 1 10 . 1 1 49 49 LYS N N 49 119.951 119.951 120.385 -0.434 25061 6672 1 10 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.057 -0.018 25061 6673 1 10 . 1 1 49 49 LYS C C 49 178.288 178.288 178.328 -0.040 25061 6674 1 10 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.989 -0.152 25061 6675 1 10 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.207 -0.064 25061 6676 1 10 . 1 1 49 49 LYS H H 49 8.037 8.037 8.050 -0.013 25061 6677 1 10 . 1 1 50 50 GLN N N 50 115.284 115.284 116.831 -1.547 25061 6678 1 10 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.252 0.090 25061 6679 1 10 . 1 1 50 50 GLN C C 50 176.180 176.180 176.686 -0.506 25061 6680 1 10 . 1 1 50 50 GLN CA C 50 55.741 55.741 55.538 0.203 25061 6681 1 10 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.476 0.089 25061 6682 1 10 . 1 1 50 50 GLN H H 50 7.740 7.740 7.682 0.058 25061 6683 1 10 . 1 1 51 51 GLY N N 51 109.725 109.725 108.062 1.663 25061 6684 1 10 . 1 1 51 51 GLY C C 51 174.552 174.552 174.286 0.266 25061 6685 1 10 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.158 1.205 25061 6686 1 10 . 1 1 51 51 GLY H H 51 8.027 8.027 7.781 0.246 25061 6687 1 10 . 1 1 52 52 ARG N N 52 119.064 119.064 119.897 -0.833 25061 6688 1 10 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.768 0.129 25061 6689 1 10 . 1 1 52 52 ARG C C 52 173.123 173.123 173.778 -0.655 25061 6690 1 10 . 1 1 52 52 ARG CA C 52 52.247 52.247 53.159 -0.912 25061 6691 1 10 . 1 1 52 52 ARG CB C 52 32.366 32.366 31.692 0.674 25061 6692 1 10 . 1 1 52 52 ARG H H 52 7.969 7.969 8.089 -0.120 25061 6693 1 10 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.976 -0.121 25061 6694 1 10 . 1 1 53 53 PRO C C 53 174.069 174.069 175.799 -1.730 25061 6695 1 10 . 1 1 53 53 PRO CA C 53 61.818 61.818 61.995 -0.176 25061 6696 1 10 . 1 1 53 53 PRO CB C 53 32.060 32.060 33.045 -0.985 25061 6697 1 10 . 1 1 54 54 ILE N N 54 116.301 116.301 119.575 -3.274 25061 6698 1 10 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.541 0.697 25061 6699 1 10 . 1 1 54 54 ILE C C 54 171.709 171.709 173.420 -1.711 25061 6700 1 10 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.773 -1.999 25061 6701 1 10 . 1 1 54 54 ILE CB C 54 41.558 41.558 41.595 -0.037 25061 6702 1 10 . 1 1 54 54 ILE H H 54 7.920 7.920 7.889 0.031 25061 6703 1 10 . 1 1 55 55 VAL N N 55 126.302 126.302 128.775 -2.473 25061 6704 1 10 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.205 -0.281 25061 6705 1 10 . 1 1 55 55 VAL C C 55 173.624 173.624 174.997 -1.373 25061 6706 1 10 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.042 -0.247 25061 6707 1 10 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.424 0.404 25061 6708 1 10 . 1 1 55 55 VAL H H 55 8.652 8.652 8.510 0.142 25061 6709 1 10 . 1 1 56 56 ILE N N 56 127.503 127.503 128.703 -1.200 25061 6710 1 10 . 1 1 56 56 ILE HA H 56 4.664 4.664 4.968 -0.304 25061 6711 1 10 . 1 1 56 56 ILE C C 56 173.479 173.479 175.311 -1.832 25061 6712 1 10 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.629 0.378 25061 6713 1 10 . 1 1 56 56 ILE CB C 56 40.285 40.285 38.139 2.146 25061 6714 1 10 . 1 1 56 56 ILE H H 56 9.124 9.124 8.101 1.023 25061 6715 1 10 . 1 1 57 57 PHE N N 57 125.302 125.302 128.604 -3.302 25061 6716 1 10 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.026 0.190 25061 6717 1 10 . 1 1 57 57 PHE C C 57 174.536 174.536 175.739 -1.203 25061 6718 1 10 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.460 -0.499 25061 6719 1 10 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.577 0.853 25061 6720 1 10 . 1 1 57 57 PHE H H 57 8.971 8.971 8.414 0.557 25061 6721 1 10 . 1 1 58 58 ILE N N 58 126.472 126.472 118.687 7.785 25061 6722 1 10 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.831 -0.316 25061 6723 1 10 . 1 1 58 58 ILE C C 58 173.391 173.391 173.726 -0.335 25061 6724 1 10 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.719 -0.629 25061 6725 1 10 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.456 -0.714 25061 6726 1 10 . 1 1 58 58 ILE H H 58 9.248 9.248 8.643 0.605 25061 6727 1 10 . 1 1 59 59 ARG N N 59 124.681 124.681 123.761 0.920 25061 6728 1 10 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.387 -0.458 25061 6729 1 10 . 1 1 59 59 ARG C C 59 178.521 178.521 177.454 1.067 25061 6730 1 10 . 1 1 59 59 ARG CA C 59 55.742 55.742 54.424 1.318 25061 6731 1 10 . 1 1 59 59 ARG CB C 59 30.918 30.918 32.257 -1.339 25061 6732 1 10 . 1 1 59 59 ARG H H 59 8.587 8.587 8.932 -0.345 25061 6733 1 10 . 1 1 60 60 GLY N N 60 108.848 108.848 116.957 -8.109 25061 6734 1 10 . 1 1 60 60 GLY C C 60 174.775 174.775 174.724 0.051 25061 6735 1 10 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.009 -0.042 25061 6736 1 10 . 1 1 60 60 GLY H H 60 7.732 7.732 8.496 -0.764 25061 6737 1 10 . 1 1 61 61 ALA N N 61 120.877 120.877 126.797 -5.920 25061 6738 1 10 . 1 1 61 61 ALA HA H 61 4.144 4.144 4.118 0.026 25061 6739 1 10 . 1 1 61 61 ALA C C 61 177.769 177.769 179.860 -2.091 25061 6740 1 10 . 1 1 61 61 ALA CA C 61 53.449 53.449 54.246 -0.797 25061 6741 1 10 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.479 -0.108 25061 6742 1 10 . 1 1 61 61 ALA H H 61 7.852 7.852 7.767 0.085 25061 6743 1 10 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.277 0.523 25061 6744 1 10 . 1 1 62 62 TYR CA C 62 63.039 63.039 57.599 5.440 25061 6745 1 10 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.313 0.127 25061 6746 1 10 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.841 -0.156 25061 6747 1 10 . 1 1 63 63 GLU C C 63 176.251 176.251 178.282 -2.031 25061 6748 1 10 . 1 1 63 63 GLU CA C 63 59.258 59.258 58.893 0.365 25061 6749 1 10 . 1 1 63 63 GLU CB C 63 29.412 29.412 28.280 1.132 25061 6750 1 10 . 1 1 64 64 GLU N N 64 119.209 119.209 120.368 -1.159 25061 6751 1 10 . 1 1 64 64 GLU HA H 64 3.901 3.901 4.062 -0.161 25061 6752 1 10 . 1 1 64 64 GLU C C 64 178.251 178.251 178.840 -0.589 25061 6753 1 10 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.833 0.379 25061 6754 1 10 . 1 1 64 64 GLU CB C 64 28.645 28.645 29.378 -0.733 25061 6755 1 10 . 1 1 64 64 GLU H H 64 8.878 8.878 7.730 1.148 25061 6756 1 10 . 1 1 65 65 VAL N N 65 116.728 116.728 119.354 -2.626 25061 6757 1 10 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.936 0.046 25061 6758 1 10 . 1 1 65 65 VAL C C 65 176.915 176.915 177.980 -1.065 25061 6759 1 10 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.412 -0.803 25061 6760 1 10 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.876 0.019 25061 6761 1 10 . 1 1 65 65 VAL H H 65 7.652 7.652 7.533 0.119 25061 6762 1 10 . 1 1 66 66 VAL N N 66 119.462 119.462 119.415 0.047 25061 6763 1 10 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.656 -0.342 25061 6764 1 10 . 1 1 66 66 VAL C C 66 177.142 177.142 177.421 -0.279 25061 6765 1 10 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.258 1.077 25061 6766 1 10 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.402 0.028 25061 6767 1 10 . 1 1 66 66 VAL H H 66 7.896 7.896 7.675 0.221 25061 6768 1 10 . 1 1 67 67 ARG HA H 67 3.628 3.628 3.957 -0.329 25061 6769 1 10 . 1 1 67 67 ARG C C 67 177.841 177.841 177.944 -0.103 25061 6770 1 10 . 1 1 67 67 ARG CA C 67 60.052 60.052 60.076 -0.024 25061 6771 1 10 . 1 1 67 67 ARG CB C 67 29.393 29.393 30.231 -0.838 25061 6772 1 10 . 1 1 68 68 ASP N N 68 118.316 118.316 117.445 0.871 25061 6773 1 10 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.822 -0.461 25061 6774 1 10 . 1 1 68 68 ASP C C 68 178.945 178.945 178.583 0.362 25061 6775 1 10 . 1 1 68 68 ASP CA C 68 57.311 57.311 56.495 0.816 25061 6776 1 10 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.354 1.160 25061 6777 1 10 . 1 1 68 68 ASP H H 68 7.625 7.625 7.834 -0.209 25061 6778 1 10 . 1 1 69 69 ILE N N 69 119.231 119.231 120.695 -1.464 25061 6779 1 10 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.726 -0.096 25061 6780 1 10 . 1 1 69 69 ILE C C 69 177.138 177.138 177.949 -0.811 25061 6781 1 10 . 1 1 69 69 ILE CA C 69 64.540 64.540 65.190 -0.650 25061 6782 1 10 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.781 -0.731 25061 6783 1 10 . 1 1 69 69 ILE H H 69 8.113 8.113 7.905 0.208 25061 6784 1 10 . 1 1 70 70 VAL N N 70 120.164 120.164 120.218 -0.054 25061 6785 1 10 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.561 -0.144 25061 6786 1 10 . 1 1 70 70 VAL C C 70 177.079 177.079 177.668 -0.589 25061 6787 1 10 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.529 -0.255 25061 6788 1 10 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.420 -0.162 25061 6789 1 10 . 1 1 70 70 VAL H H 70 8.478 8.478 8.360 0.118 25061 6790 1 10 . 1 1 71 71 GLU N N 71 118.293 118.293 119.799 -1.506 25061 6791 1 10 . 1 1 71 71 GLU HA H 71 4.054 4.054 4.240 -0.186 25061 6792 1 10 . 1 1 71 71 GLU C C 71 179.009 179.009 179.212 -0.203 25061 6793 1 10 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.313 0.103 25061 6794 1 10 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.498 -0.676 25061 6795 1 10 . 1 1 71 71 GLU H H 71 8.152 8.152 7.633 0.519 25061 6796 1 10 . 1 1 72 72 TYR N N 72 120.091 120.091 120.302 -0.211 25061 6797 1 10 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.117 0.045 25061 6798 1 10 . 1 1 72 72 TYR C C 72 176.404 176.404 177.060 -0.656 25061 6799 1 10 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.496 -0.364 25061 6800 1 10 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.526 -0.389 25061 6801 1 10 . 1 1 72 72 TYR H H 72 7.959 7.959 7.769 0.190 25061 6802 1 10 . 1 1 73 73 ALA N N 73 120.133 120.133 120.465 -0.332 25061 6803 1 10 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.828 -0.198 25061 6804 1 10 . 1 1 73 73 ALA C C 73 179.182 179.182 179.339 -0.157 25061 6805 1 10 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.069 0.043 25061 6806 1 10 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.255 -0.064 25061 6807 1 10 . 1 1 73 73 ALA H H 73 8.604 8.604 8.227 0.377 25061 6808 1 10 . 1 1 74 74 GLN N N 74 115.553 115.553 116.529 -0.976 25061 6809 1 10 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.987 0.151 25061 6810 1 10 . 1 1 74 74 GLN C C 74 180.595 180.595 178.261 2.334 25061 6811 1 10 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.470 0.625 25061 6812 1 10 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.685 -0.110 25061 6813 1 10 . 1 1 74 74 GLN H H 74 8.619 8.619 8.152 0.467 25061 6814 1 10 . 1 1 75 75 LYS N N 75 122.396 122.396 118.614 3.782 25061 6815 1 10 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.039 -0.011 25061 6816 1 10 . 1 1 75 75 LYS C C 75 178.521 178.521 178.177 0.344 25061 6817 1 10 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.109 0.949 25061 6818 1 10 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.435 0.164 25061 6819 1 10 . 1 1 75 75 LYS H H 75 8.123 8.123 7.235 0.888 25061 6820 1 10 . 1 1 76 76 GLU N N 76 116.294 116.294 116.380 -0.086 25061 6821 1 10 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.183 -0.084 25061 6822 1 10 . 1 1 76 76 GLU C C 76 175.957 175.957 177.556 -1.599 25061 6823 1 10 . 1 1 76 76 GLU CA C 76 55.605 55.605 56.270 -0.665 25061 6824 1 10 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.454 0.370 25061 6825 1 10 . 1 1 76 76 GLU H H 76 7.450 7.450 7.498 -0.048 25061 6826 1 10 . 1 1 77 77 GLY N N 77 107.446 107.446 108.031 -0.585 25061 6827 1 10 . 1 1 77 77 GLY C C 77 174.520 174.520 174.200 0.320 25061 6828 1 10 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.520 0.287 25061 6829 1 10 . 1 1 77 77 GLY H H 77 7.763 7.763 7.679 0.084 25061 6830 1 10 . 1 1 78 78 LEU N N 78 120.179 120.179 119.151 1.028 25061 6831 1 10 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.506 -0.118 25061 6832 1 10 . 1 1 78 78 LEU C C 78 175.914 175.914 176.552 -0.638 25061 6833 1 10 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.900 -0.428 25061 6834 1 10 . 1 1 78 78 LEU CB C 78 41.889 41.889 43.091 -1.202 25061 6835 1 10 . 1 1 78 78 LEU H H 78 7.930 7.930 7.997 -0.067 25061 6836 1 10 . 1 1 79 79 ARG N N 79 122.207 122.207 123.978 -1.771 25061 6837 1 10 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.284 0.113 25061 6838 1 10 . 1 1 79 79 ARG C C 79 174.960 174.960 174.512 0.448 25061 6839 1 10 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.655 -0.007 25061 6840 1 10 . 1 1 79 79 ARG CB C 79 30.476 30.476 30.010 0.466 25061 6841 1 10 . 1 1 79 79 ARG H H 79 8.241 8.241 8.185 0.056 25061 6842 1 10 . 1 1 80 80 VAL N N 80 123.333 123.333 126.296 -2.963 25061 6843 1 10 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.508 0.787 25061 6844 1 10 . 1 1 80 80 VAL C C 80 174.048 174.048 174.379 -0.331 25061 6845 1 10 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.813 -1.772 25061 6846 1 10 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.936 1.369 25061 6847 1 10 . 1 1 80 80 VAL H H 80 8.359 8.359 8.590 -0.231 25061 6848 1 10 . 1 1 81 81 LEU N N 81 128.719 128.719 130.517 -1.798 25061 6849 1 10 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.148 -0.044 25061 6850 1 10 . 1 1 81 81 LEU C C 81 174.484 174.484 174.465 0.019 25061 6851 1 10 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.870 0.250 25061 6852 1 10 . 1 1 81 81 LEU CB C 81 44.955 44.955 46.207 -1.252 25061 6853 1 10 . 1 1 81 81 LEU H H 81 8.650 8.650 8.909 -0.259 25061 6854 1 10 . 1 1 82 82 VAL N N 82 122.487 122.487 124.422 -1.935 25061 6855 1 10 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.716 0.381 25061 6856 1 10 . 1 1 82 82 VAL C C 82 174.525 174.525 174.312 0.213 25061 6857 1 10 . 1 1 82 82 VAL CA C 82 60.285 60.285 60.454 -0.169 25061 6858 1 10 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.981 1.808 25061 6859 1 10 . 1 1 82 82 VAL H H 82 8.781 8.781 8.610 0.171 25061 6860 1 10 . 1 1 83 83 ILE N N 83 128.082 128.082 127.883 0.199 25061 6861 1 10 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.499 0.431 25061 6862 1 10 . 1 1 83 83 ILE C C 83 172.925 172.925 174.749 -1.824 25061 6863 1 10 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.725 -0.784 25061 6864 1 10 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.086 2.100 25061 6865 1 10 . 1 1 83 83 ILE H H 83 9.527 9.527 8.640 0.887 25061 6866 1 10 . 1 1 84 84 LYS N N 84 128.493 128.493 128.979 -0.486 25061 6867 1 10 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.431 -0.383 25061 6868 1 10 . 1 1 84 84 LYS C C 84 174.027 174.027 174.250 -0.223 25061 6869 1 10 . 1 1 84 84 LYS CA C 84 53.253 53.253 54.133 -0.880 25061 6870 1 10 . 1 1 84 84 LYS CB C 84 34.652 34.652 37.060 -2.408 25061 6871 1 10 . 1 1 84 84 LYS H H 84 8.721 8.721 9.000 -0.279 25061 6872 1 10 . 1 1 85 85 VAL N N 85 126.729 126.729 126.235 0.494 25061 6873 1 10 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.631 0.105 25061 6874 1 10 . 1 1 85 85 VAL C C 85 175.935 175.935 173.425 2.510 25061 6875 1 10 . 1 1 85 85 VAL CA C 85 60.200 60.200 59.674 0.526 25061 6876 1 10 . 1 1 85 85 VAL CB C 85 30.847 30.847 33.916 -3.069 25061 6877 1 10 . 1 1 85 85 VAL H H 85 8.643 8.643 8.543 0.100 25061 6878 1 10 . 1 1 86 86 ALA N N 86 132.930 132.930 130.960 1.970 25061 6879 1 10 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.627 -0.197 25061 6880 1 10 . 1 1 86 86 ALA C C 86 175.635 175.635 176.372 -0.737 25061 6881 1 10 . 1 1 86 86 ALA CA C 86 51.504 51.504 50.876 0.628 25061 6882 1 10 . 1 1 86 86 ALA CB C 86 20.821 20.821 20.462 0.359 25061 6883 1 10 . 1 1 86 86 ALA H H 86 8.835 8.835 8.675 0.160 25061 6884 1 10 . 1 1 87 87 GLN N N 87 118.719 118.719 120.878 -2.159 25061 6885 1 10 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.370 0.099 25061 6886 1 10 . 1 1 87 87 GLN C C 87 175.949 175.949 174.896 1.053 25061 6887 1 10 . 1 1 87 87 GLN CA C 87 55.260 55.260 55.095 0.165 25061 6888 1 10 . 1 1 87 87 GLN CB C 87 30.432 30.432 29.336 1.096 25061 6889 1 10 . 1 1 87 87 GLN H H 87 8.570 8.570 8.718 -0.148 25061 6890 1 10 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.372 0.108 25061 6891 1 10 . 1 1 88 88 ASP CA C 88 55.454 55.454 54.651 0.803 25061 6892 1 10 . 1 1 88 88 ASP CB C 88 41.204 41.204 40.733 0.471 25061 6893 1 10 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.527 -0.480 25061 6894 1 10 . 1 1 89 89 GLN CA C 89 56.687 56.687 54.903 1.784 25061 6895 1 10 . 1 1 89 89 GLN CB C 89 27.850 27.850 30.849 -2.999 25061 6896 1 10 . 1 1 92 92 LEU N N 92 125.291 125.291 118.227 7.064 25061 6897 1 10 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.089 0.112 25061 6898 1 10 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.519 -2.462 25061 6899 1 10 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.531 0.516 25061 6900 1 10 . 1 1 92 92 LEU H H 92 8.277 8.277 7.960 0.317 25061 6901 1 10 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.090 0.666 25061 6902 1 10 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.130 -0.081 25061 6903 1 10 . 1 1 94 94 ARG C C 94 178.544 178.544 178.194 0.350 25061 6904 1 10 . 1 1 94 94 ARG CA C 94 58.607 58.607 59.607 -1.000 25061 6905 1 10 . 1 1 94 94 ARG CB C 94 29.614 29.614 30.283 -0.669 25061 6906 1 10 . 1 1 95 95 PHE N N 95 117.407 117.407 118.970 -1.563 25061 6907 1 10 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.221 0.154 25061 6908 1 10 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.756 -0.525 25061 6909 1 10 . 1 1 95 95 PHE CB C 95 37.942 37.942 38.777 -0.835 25061 6910 1 10 . 1 1 95 95 PHE H H 95 8.419 8.419 7.633 0.786 25061 6911 1 10 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.773 0.035 25061 6912 1 10 . 1 1 96 96 TYR C C 96 177.728 177.728 177.419 0.309 25061 6913 1 10 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.405 1.751 25061 6914 1 10 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.412 -0.712 25061 6915 1 10 . 1 1 97 97 GLU N N 97 119.054 119.054 117.733 1.321 25061 6916 1 10 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.600 0.463 25061 6917 1 10 . 1 1 97 97 GLU C C 97 179.071 179.071 178.609 0.462 25061 6918 1 10 . 1 1 97 97 GLU CA C 97 58.760 58.760 58.896 -0.136 25061 6919 1 10 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.317 -0.145 25061 6920 1 10 . 1 1 97 97 GLU H H 97 7.858 7.858 8.067 -0.209 25061 6921 1 10 . 1 1 98 98 GLN N N 98 119.385 119.385 119.724 -0.339 25061 6922 1 10 . 1 1 98 98 GLN HA H 98 3.901 3.901 4.022 -0.121 25061 6923 1 10 . 1 1 98 98 GLN C C 98 177.599 177.599 178.582 -0.983 25061 6924 1 10 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.439 -0.128 25061 6925 1 10 . 1 1 98 98 GLN CB C 98 27.766 27.766 28.168 -0.401 25061 6926 1 10 . 1 1 98 98 GLN H H 98 7.747 7.747 7.573 0.174 25061 6927 1 10 . 1 1 99 99 LEU N N 99 118.348 118.348 118.912 -0.564 25061 6928 1 10 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.937 0.082 25061 6929 1 10 . 1 1 99 99 LEU C C 99 178.669 178.669 178.738 -0.069 25061 6930 1 10 . 1 1 99 99 LEU CA C 99 57.430 57.430 57.887 -0.457 25061 6931 1 10 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.224 0.279 25061 6932 1 10 . 1 1 99 99 LEU H H 99 7.891 7.891 7.431 0.460 25061 6933 1 10 . 1 1 100 100 LYS N N 100 118.332 118.332 118.871 -0.539 25061 6934 1 10 . 1 1 100 100 LYS HA H 100 4.509 4.509 4.021 0.488 25061 6935 1 10 . 1 1 100 100 LYS C C 100 180.846 180.846 178.473 2.373 25061 6936 1 10 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.069 1.019 25061 6937 1 10 . 1 1 100 100 LYS CB C 100 32.269 32.269 32.061 0.208 25061 6938 1 10 . 1 1 100 100 LYS H H 100 7.560 7.560 7.306 0.254 25061 6939 1 10 . 1 1 101 101 LYS N N 101 121.944 121.944 116.742 5.202 25061 6940 1 10 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.175 -0.103 25061 6941 1 10 . 1 1 101 101 LYS C C 101 177.707 177.707 177.241 0.466 25061 6942 1 10 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.095 0.776 25061 6943 1 10 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.277 -0.182 25061 6944 1 10 . 1 1 101 101 LYS H H 101 7.959 7.959 7.771 0.188 25061 6945 1 10 . 1 1 102 102 ASP N N 102 118.788 118.788 119.634 -0.846 25061 6946 1 10 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.438 0.256 25061 6947 1 10 . 1 1 102 102 ASP C C 102 176.359 176.359 177.591 -1.232 25061 6948 1 10 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.475 -0.896 25061 6949 1 10 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.848 -1.274 25061 6950 1 10 . 1 1 102 102 ASP H H 102 7.893 7.893 7.635 0.258 25061 6951 1 10 . 1 1 103 103 GLY N N 103 107.024 107.024 105.657 1.367 25061 6952 1 10 . 1 1 103 103 GLY C C 103 174.328 174.328 174.366 -0.038 25061 6953 1 10 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.849 0.496 25061 6954 1 10 . 1 1 103 103 GLY H H 103 7.866 7.866 8.158 -0.292 25061 6955 1 10 . 1 1 104 104 VAL N N 104 123.060 123.060 123.453 -0.393 25061 6956 1 10 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.857 0.116 25061 6957 1 10 . 1 1 104 104 VAL C C 104 175.023 175.023 174.531 0.492 25061 6958 1 10 . 1 1 104 104 VAL CA C 104 61.878 61.878 63.225 -1.347 25061 6959 1 10 . 1 1 104 104 VAL CB C 104 32.088 32.088 31.678 0.410 25061 6960 1 10 . 1 1 104 104 VAL H H 104 7.955 7.955 7.654 0.301 25061 6961 1 10 . 1 1 105 105 ASP N N 105 127.987 127.987 126.446 1.541 25061 6962 1 10 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.711 -0.136 25061 6963 1 10 . 1 1 105 105 ASP C C 105 173.624 173.624 174.607 -0.983 25061 6964 1 10 . 1 1 105 105 ASP CA C 105 54.087 54.087 53.843 0.244 25061 6965 1 10 . 1 1 105 105 ASP CB C 105 40.660 40.660 42.997 -2.337 25061 6966 1 10 . 1 1 105 105 ASP H H 105 8.399 8.399 8.012 0.387 25061 6967 1 10 . 1 1 106 106 VAL N N 106 125.798 125.798 122.268 3.530 25061 6968 1 10 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.746 0.069 25061 6969 1 10 . 1 1 106 106 VAL C C 106 174.902 174.902 175.660 -0.758 25061 6970 1 10 . 1 1 106 106 VAL CA C 106 60.194 60.194 60.856 -0.662 25061 6971 1 10 . 1 1 106 106 VAL CB C 106 34.179 34.179 32.997 1.182 25061 6972 1 10 . 1 1 106 106 VAL H H 106 7.550 7.550 8.361 -0.811 25061 6973 1 10 . 1 1 107 107 ARG N N 107 128.099 128.099 128.361 -0.262 25061 6974 1 10 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.562 0.314 25061 6975 1 10 . 1 1 107 107 ARG C C 107 173.815 173.815 175.436 -1.621 25061 6976 1 10 . 1 1 107 107 ARG CA C 107 53.386 53.386 53.602 -0.216 25061 6977 1 10 . 1 1 107 107 ARG CB C 107 31.195 31.195 29.588 1.607 25061 6978 1 10 . 1 1 107 107 ARG H H 107 9.132 9.132 8.948 0.184 25061 6979 1 10 . 1 1 108 108 VAL N N 108 123.979 123.979 122.496 1.483 25061 6980 1 10 . 1 1 108 108 VAL HA H 108 4.942 4.942 4.750 0.192 25061 6981 1 10 . 1 1 108 108 VAL C C 108 175.854 175.854 176.040 -0.186 25061 6982 1 10 . 1 1 108 108 VAL CA C 108 60.017 60.017 61.448 -1.431 25061 6983 1 10 . 1 1 108 108 VAL CB C 108 32.844 32.844 31.694 1.150 25061 6984 1 10 . 1 1 108 108 VAL H H 108 8.561 8.561 8.405 0.156 25061 6985 1 10 . 1 1 109 109 THR N N 109 120.144 120.144 118.854 1.290 25061 6986 1 10 . 1 1 109 109 THR HA H 109 4.815 4.815 4.511 0.304 25061 6987 1 10 . 1 1 109 109 THR C C 109 171.867 171.867 175.271 -3.404 25061 6988 1 10 . 1 1 109 109 THR CA C 109 59.613 59.613 62.483 -2.870 25061 6989 1 10 . 1 1 109 109 THR CB C 109 69.720 69.720 70.460 -0.740 25061 6990 1 10 . 1 1 109 109 THR H H 109 8.803 8.803 8.775 0.028 25061 6991 1 10 . 1 1 110 110 ASP N N 110 123.212 123.212 118.179 5.033 25061 6992 1 10 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.525 0.444 25061 6993 1 10 . 1 1 110 110 ASP C C 110 175.739 175.739 174.151 1.588 25061 6994 1 10 . 1 1 110 110 ASP CA C 110 53.243 53.243 55.794 -2.551 25061 6995 1 10 . 1 1 110 110 ASP CB C 110 41.351 41.351 39.140 2.211 25061 6996 1 10 . 1 1 110 110 ASP H H 110 8.363 8.363 8.181 0.182 25061 6997 1 10 . 1 1 111 111 ASN N N 111 116.298 116.298 115.147 1.151 25061 6998 1 10 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.907 -0.031 25061 6999 1 10 . 1 1 111 111 ASN C C 111 174.756 174.756 175.324 -0.568 25061 7000 1 10 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.478 -0.346 25061 7001 1 10 . 1 1 111 111 ASN CB C 111 40.765 40.765 41.716 -0.951 25061 7002 1 10 . 1 1 111 111 ASN H H 111 8.085 8.085 7.405 0.679 25061 7003 1 10 . 1 1 112 112 GLU HA H 112 3.848 3.848 3.874 -0.026 25061 7004 1 10 . 1 1 112 112 GLU C C 112 177.016 177.016 178.171 -1.155 25061 7005 1 10 . 1 1 112 112 GLU CA C 112 59.480 59.480 60.442 -0.962 25061 7006 1 10 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.724 -0.051 25061 7007 1 10 . 1 1 113 113 ASP N N 113 121.033 121.033 118.677 2.356 25061 7008 1 10 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.472 -0.059 25061 7009 1 10 . 1 1 113 113 ASP C C 113 178.988 178.988 178.329 0.659 25061 7010 1 10 . 1 1 113 113 ASP CA C 113 57.855 57.855 56.905 0.950 25061 7011 1 10 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.694 -0.192 25061 7012 1 10 . 1 1 113 113 ASP H H 113 8.219 8.219 8.201 0.018 25061 7013 1 10 . 1 1 114 114 GLU N N 114 121.280 121.280 119.370 1.910 25061 7014 1 10 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.124 -0.059 25061 7015 1 10 . 1 1 114 114 GLU C C 114 178.776 178.776 178.218 0.558 25061 7016 1 10 . 1 1 114 114 GLU CA C 114 58.714 58.714 58.668 0.046 25061 7017 1 10 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.073 0.140 25061 7018 1 10 . 1 1 114 114 GLU H H 114 8.296 8.296 8.561 -0.265 25061 7019 1 10 . 1 1 115 115 ALA N N 115 120.924 120.924 122.731 -1.807 25061 7020 1 10 . 1 1 115 115 ALA HA H 115 3.838 3.838 3.970 -0.132 25061 7021 1 10 . 1 1 115 115 ALA C C 115 178.502 178.502 179.422 -0.920 25061 7022 1 10 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.738 -0.100 25061 7023 1 10 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.412 0.085 25061 7024 1 10 . 1 1 115 115 ALA H H 115 7.853 7.853 8.115 -0.262 25061 7025 1 10 . 1 1 116 116 LYS N N 116 116.616 116.616 116.850 -0.234 25061 7026 1 10 . 1 1 116 116 LYS HA H 116 3.719 3.719 4.068 -0.349 25061 7027 1 10 . 1 1 116 116 LYS C C 116 178.097 178.097 178.909 -0.812 25061 7028 1 10 . 1 1 116 116 LYS CA C 116 60.752 60.752 58.993 1.759 25061 7029 1 10 . 1 1 116 116 LYS CB C 116 32.555 32.555 31.941 0.614 25061 7030 1 10 . 1 1 116 116 LYS H H 116 8.091 8.091 7.579 0.512 25061 7031 1 10 . 1 1 117 117 LYS N N 117 118.990 118.990 120.466 -1.476 25061 7032 1 10 . 1 1 117 117 LYS HA H 117 3.911 3.911 3.941 -0.030 25061 7033 1 10 . 1 1 117 117 LYS C C 117 179.186 179.186 178.873 0.313 25061 7034 1 10 . 1 1 117 117 LYS CA C 117 59.571 59.571 60.155 -0.584 25061 7035 1 10 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.383 0.137 25061 7036 1 10 . 1 1 117 117 LYS H H 117 7.742 7.742 7.751 -0.009 25061 7037 1 10 . 1 1 118 118 ARG N N 118 117.441 117.441 118.756 -1.315 25061 7038 1 10 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.114 0.026 25061 7039 1 10 . 1 1 118 118 ARG C C 118 178.921 178.921 178.951 -0.030 25061 7040 1 10 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.741 -1.070 25061 7041 1 10 . 1 1 118 118 ARG CB C 118 29.661 29.661 30.106 -0.445 25061 7042 1 10 . 1 1 118 118 ARG H H 118 8.468 8.468 8.105 0.363 25061 7043 1 10 . 1 1 119 119 LEU N N 119 120.100 120.100 121.434 -1.334 25061 7044 1 10 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.904 0.056 25061 7045 1 10 . 1 1 119 119 LEU C C 119 177.554 177.554 178.491 -0.937 25061 7046 1 10 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.216 -0.335 25061 7047 1 10 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.518 0.371 25061 7048 1 10 . 1 1 119 119 LEU H H 119 8.322 8.322 8.166 0.156 25061 7049 1 10 . 1 1 120 120 LYS N N 120 118.238 118.238 118.835 -0.597 25061 7050 1 10 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.883 -0.061 25061 7051 1 10 . 1 1 120 120 LYS C C 120 178.703 178.703 178.444 0.259 25061 7052 1 10 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.752 0.594 25061 7053 1 10 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.261 -0.025 25061 7054 1 10 . 1 1 120 120 LYS H H 120 7.990 7.990 7.655 0.335 25061 7055 1 10 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.030 -0.008 25061 7056 1 10 . 1 1 121 121 GLU C C 121 177.769 177.769 179.140 -1.371 25061 7057 1 10 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.341 -0.419 25061 7058 1 10 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.538 -0.084 25061 7059 1 10 . 1 1 122 122 LEU N N 122 119.454 119.454 118.098 1.356 25061 7060 1 10 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.243 -0.110 25061 7061 1 10 . 1 1 122 122 LEU C C 122 178.991 178.991 179.636 -0.645 25061 7062 1 10 . 1 1 122 122 LEU CA C 122 57.326 57.326 56.720 0.606 25061 7063 1 10 . 1 1 122 122 LEU CB C 122 41.679 41.679 42.194 -0.515 25061 7064 1 10 . 1 1 122 122 LEU H H 122 7.930 7.930 7.783 0.147 25061 7065 1 10 . 1 1 123 123 LEU N N 123 117.862 117.862 120.629 -2.767 25061 7066 1 10 . 1 1 123 123 LEU HA H 123 4.067 4.067 4.089 -0.022 25061 7067 1 10 . 1 1 123 123 LEU C C 123 179.178 179.178 178.470 0.708 25061 7068 1 10 . 1 1 123 123 LEU CA C 123 56.920 56.920 57.819 -0.899 25061 7069 1 10 . 1 1 123 123 LEU CB C 123 41.210 41.210 42.004 -0.794 25061 7070 1 10 . 1 1 123 123 LEU H H 123 8.095 8.095 7.978 0.117 25061 7071 1 10 . 1 1 124 124 GLU N N 124 118.975 118.975 118.155 0.820 25061 7072 1 10 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.090 0.039 25061 7073 1 10 . 1 1 124 124 GLU C C 124 177.777 177.777 177.869 -0.092 25061 7074 1 10 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.657 -0.570 25061 7075 1 10 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.697 -0.157 25061 7076 1 10 . 1 1 124 124 GLU H H 124 7.930 7.930 7.916 0.014 25061 7077 1 10 . 1 1 125 125 LYS N N 125 118.933 118.933 117.415 1.518 25061 7078 1 10 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.413 -0.076 25061 7079 1 10 . 1 1 125 125 LYS C C 125 178.188 178.188 175.189 2.999 25061 7080 1 10 . 1 1 125 125 LYS CA C 125 56.980 56.980 55.858 1.122 25061 7081 1 10 . 1 1 125 125 LYS CB C 125 32.608 32.608 33.064 -0.456 25061 7082 1 10 . 1 1 125 125 LYS H H 125 7.729 7.729 7.584 0.145 25061 7083 1 10 . 1 1 126 126 VAL N N 126 117.933 117.933 118.735 -0.802 25061 7084 1 10 . 1 1 126 126 VAL HA H 126 4.022 4.022 3.728 0.294 25061 7085 1 10 . 1 1 126 126 VAL C C 126 176.947 176.947 175.913 1.034 25061 7086 1 10 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.371 0.270 25061 7087 1 10 . 1 1 126 126 VAL CB C 126 31.859 31.859 30.078 1.781 25061 7088 1 10 . 1 1 126 126 VAL H H 126 8.044 8.044 7.603 0.441 25061 7089 1 10 . 1 1 127 127 GLY N N 127 109.813 109.813 111.755 -1.942 25061 7090 1 10 . 1 1 127 127 GLY C C 127 174.264 174.264 173.512 0.752 25061 7091 1 10 . 1 1 127 127 GLY CA C 127 45.279 45.279 46.402 -1.123 25061 7092 1 10 . 1 1 127 127 GLY H H 127 8.279 8.279 8.376 -0.097 25061 7093 1 10 . 1 1 128 128 SER N N 128 115.185 115.185 112.303 2.882 25061 7094 1 10 . 1 1 128 128 SER HA H 128 4.462 4.462 4.717 -0.255 25061 7095 1 10 . 1 1 128 128 SER C C 128 174.775 174.775 172.856 1.919 25061 7096 1 10 . 1 1 128 128 SER CA C 128 58.739 58.739 57.197 1.542 25061 7097 1 10 . 1 1 128 128 SER CB C 128 63.850 63.850 66.924 -3.075 25061 7098 1 10 . 1 1 128 128 SER H H 128 8.048 8.048 7.325 0.723 25061 7099 1 10 . 1 1 129 129 LEU N N 129 123.060 123.060 121.522 1.538 25061 7100 1 10 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.418 -0.120 25061 7101 1 10 . 1 1 129 129 LEU C C 129 177.313 177.313 175.430 1.883 25061 7102 1 10 . 1 1 129 129 LEU CA C 129 55.158 55.158 56.304 -1.146 25061 7103 1 10 . 1 1 129 129 LEU CB C 129 41.837 41.837 42.166 -0.329 25061 7104 1 10 . 1 1 129 129 LEU H H 129 8.147 8.147 8.605 -0.458 25061 7105 1 10 . 1 1 130 130 GLU N N 130 120.088 120.088 120.309 -0.221 25061 7106 1 10 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.005 0.176 25061 7107 1 10 . 1 1 130 130 GLU C C 130 176.148 176.148 175.271 0.877 25061 7108 1 10 . 1 1 130 130 GLU CA C 130 56.726 56.726 57.618 -0.892 25061 7109 1 10 . 1 1 130 130 GLU CB C 130 30.026 30.026 28.207 1.819 25061 7110 1 10 . 1 1 130 130 GLU H H 130 8.242 8.242 8.469 -0.227 25061 7111 1 11 . 1 1 2 2 GLY CA C 2 45.319 45.319 45.132 0.187 25061 7112 1 11 . 1 1 3 3 THR HA H 3 4.820 4.820 5.197 -0.377 25061 7113 1 11 . 1 1 3 3 THR C C 3 172.374 172.374 173.358 -0.984 25061 7114 1 11 . 1 1 3 3 THR CA C 3 62.760 62.760 59.841 2.919 25061 7115 1 11 . 1 1 3 3 THR CB C 3 71.441 71.441 71.444 -0.003 25061 7116 1 11 . 1 1 4 4 VAL N N 4 126.881 126.881 124.032 2.849 25061 7117 1 11 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.653 -0.085 25061 7118 1 11 . 1 1 4 4 VAL C C 4 173.116 173.116 174.515 -1.399 25061 7119 1 11 . 1 1 4 4 VAL CA C 4 60.455 60.455 60.874 -0.419 25061 7120 1 11 . 1 1 4 4 VAL CB C 4 33.800 33.800 32.503 1.297 25061 7121 1 11 . 1 1 4 4 VAL H H 4 9.097 9.097 8.990 0.107 25061 7122 1 11 . 1 1 5 5 VAL N N 5 127.172 127.172 123.579 3.593 25061 7123 1 11 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.429 -0.542 25061 7124 1 11 . 1 1 5 5 VAL C C 5 174.091 174.091 175.167 -1.076 25061 7125 1 11 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.149 0.969 25061 7126 1 11 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.228 -0.293 25061 7127 1 11 . 1 1 5 5 VAL H H 5 8.811 8.811 8.909 -0.098 25061 7128 1 11 . 1 1 6 6 ILE N N 6 127.577 127.577 128.323 -0.746 25061 7129 1 11 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.578 0.042 25061 7130 1 11 . 1 1 6 6 ILE C C 6 173.328 173.328 175.630 -2.302 25061 7131 1 11 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.492 0.340 25061 7132 1 11 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.078 1.852 25061 7133 1 11 . 1 1 6 6 ILE H H 6 9.210 9.210 8.566 0.644 25061 7134 1 11 . 1 1 7 7 VAL N N 7 129.024 129.024 129.481 -0.457 25061 7135 1 11 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.512 0.293 25061 7136 1 11 . 1 1 7 7 VAL C C 7 173.561 173.561 175.332 -1.771 25061 7137 1 11 . 1 1 7 7 VAL CA C 7 60.849 60.849 61.866 -1.017 25061 7138 1 11 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.330 1.030 25061 7139 1 11 . 1 1 7 7 VAL H H 7 9.294 9.294 8.242 1.052 25061 7140 1 11 . 1 1 8 8 VAL N N 8 125.318 125.318 129.442 -4.124 25061 7141 1 11 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.364 0.032 25061 7142 1 11 . 1 1 8 8 VAL C C 8 175.723 175.723 175.110 0.613 25061 7143 1 11 . 1 1 8 8 VAL CA C 8 59.617 59.617 60.693 -1.076 25061 7144 1 11 . 1 1 8 8 VAL CB C 8 34.915 34.915 34.357 0.558 25061 7145 1 11 . 1 1 8 8 VAL H H 8 8.898 8.898 8.870 0.028 25061 7146 1 11 . 1 1 9 9 SER N N 9 116.544 116.544 118.379 -1.835 25061 7147 1 11 . 1 1 9 9 SER HA H 9 4.724 4.724 4.885 -0.161 25061 7148 1 11 . 1 1 9 9 SER C C 9 174.552 174.552 173.740 0.812 25061 7149 1 11 . 1 1 9 9 SER CA C 9 57.419 57.419 56.959 0.460 25061 7150 1 11 . 1 1 9 9 SER CB C 9 64.998 64.998 65.492 -0.494 25061 7151 1 11 . 1 1 9 9 SER H H 9 7.833 7.833 8.261 -0.428 25061 7152 1 11 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.516 0.396 25061 7153 1 11 . 1 1 10 10 ASN C C 10 176.170 176.170 174.507 1.663 25061 7154 1 11 . 1 1 10 10 ASN CA C 10 54.141 54.141 54.572 -0.431 25061 7155 1 11 . 1 1 10 10 ASN CB C 10 38.626 38.626 39.181 -0.555 25061 7156 1 11 . 1 1 11 11 ASP N N 11 120.164 120.164 117.919 2.245 25061 7157 1 11 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.827 0.016 25061 7158 1 11 . 1 1 11 11 ASP C C 11 176.148 176.148 175.988 0.160 25061 7159 1 11 . 1 1 11 11 ASP CA C 11 52.620 52.620 53.121 -0.501 25061 7160 1 11 . 1 1 11 11 ASP CB C 11 42.631 42.631 43.509 -0.878 25061 7161 1 11 . 1 1 11 11 ASP H H 11 8.142 8.142 7.392 0.750 25061 7162 1 11 . 1 1 12 12 GLU N N 12 127.184 127.184 124.500 2.684 25061 7163 1 11 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.206 -0.353 25061 7164 1 11 . 1 1 12 12 GLU C C 12 177.853 177.853 178.274 -0.421 25061 7165 1 11 . 1 1 12 12 GLU CA C 12 59.547 59.547 58.938 0.609 25061 7166 1 11 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.996 -0.177 25061 7167 1 11 . 1 1 12 12 GLU H H 12 9.152 9.152 8.919 0.233 25061 7168 1 11 . 1 1 13 13 ARG N N 13 119.026 119.026 119.405 -0.379 25061 7169 1 11 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.149 -0.046 25061 7170 1 11 . 1 1 13 13 ARG C C 13 179.151 179.151 179.030 0.121 25061 7171 1 11 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.972 -0.029 25061 7172 1 11 . 1 1 13 13 ARG CB C 13 28.757 28.757 30.151 -1.395 25061 7173 1 11 . 1 1 13 13 ARG H H 13 8.389 8.389 8.025 0.364 25061 7174 1 11 . 1 1 14 14 ILE N N 14 119.238 119.238 120.828 -1.590 25061 7175 1 11 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.940 -0.339 25061 7176 1 11 . 1 1 14 14 ILE C C 14 177.905 177.905 177.866 0.039 25061 7177 1 11 . 1 1 14 14 ILE CA C 14 64.666 64.666 62.589 2.077 25061 7178 1 11 . 1 1 14 14 ILE CB C 14 36.780 36.780 37.007 -0.227 25061 7179 1 11 . 1 1 14 14 ILE H H 14 7.254 7.254 7.911 -0.657 25061 7180 1 11 . 1 1 15 15 LEU N N 15 117.008 117.008 119.894 -2.886 25061 7181 1 11 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.155 -0.234 25061 7182 1 11 . 1 1 15 15 LEU C C 15 178.062 178.062 179.758 -1.696 25061 7183 1 11 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.346 0.065 25061 7184 1 11 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.449 -0.280 25061 7185 1 11 . 1 1 15 15 LEU H H 15 7.412 7.412 7.779 -0.367 25061 7186 1 11 . 1 1 16 16 GLU N N 16 117.637 117.637 118.556 -0.919 25061 7187 1 11 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.982 -0.281 25061 7188 1 11 . 1 1 16 16 GLU C C 16 179.182 179.182 178.787 0.395 25061 7189 1 11 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.386 0.031 25061 7190 1 11 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.223 0.236 25061 7191 1 11 . 1 1 16 16 GLU H H 16 7.981 7.981 8.064 -0.083 25061 7192 1 11 . 1 1 17 17 GLU N N 17 119.759 119.759 121.214 -1.455 25061 7193 1 11 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.290 -0.274 25061 7194 1 11 . 1 1 17 17 GLU C C 17 179.949 179.949 179.274 0.675 25061 7195 1 11 . 1 1 17 17 GLU CA C 17 59.195 59.195 59.239 -0.044 25061 7196 1 11 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.625 -0.085 25061 7197 1 11 . 1 1 17 17 GLU H H 17 8.248 8.248 8.126 0.122 25061 7198 1 11 . 1 1 18 18 LEU N N 18 119.764 119.764 119.415 0.349 25061 7199 1 11 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.182 -0.101 25061 7200 1 11 . 1 1 18 18 LEU C C 18 177.620 177.620 179.173 -1.553 25061 7201 1 11 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.759 -0.081 25061 7202 1 11 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.495 -0.385 25061 7203 1 11 . 1 1 18 18 LEU H H 18 8.486 8.486 8.198 0.288 25061 7204 1 11 . 1 1 19 19 LEU N N 19 123.102 123.102 120.996 2.106 25061 7205 1 11 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.773 -0.111 25061 7206 1 11 . 1 1 19 19 LEU C C 19 178.343 178.343 178.328 0.015 25061 7207 1 11 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.372 0.864 25061 7208 1 11 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.388 -0.737 25061 7209 1 11 . 1 1 19 19 LEU H H 19 7.870 7.870 7.808 0.062 25061 7210 1 11 . 1 1 20 20 GLU N N 20 117.884 117.884 118.930 -1.046 25061 7211 1 11 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.939 -0.035 25061 7212 1 11 . 1 1 20 20 GLU C C 20 177.707 177.707 179.259 -1.552 25061 7213 1 11 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.593 -0.201 25061 7214 1 11 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.466 -0.489 25061 7215 1 11 . 1 1 20 20 GLU H H 20 7.497 7.497 7.845 -0.348 25061 7216 1 11 . 1 1 21 21 VAL N N 21 117.709 117.709 120.185 -2.476 25061 7217 1 11 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.741 -0.117 25061 7218 1 11 . 1 1 21 21 VAL C C 21 178.523 178.523 177.968 0.555 25061 7219 1 11 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.728 -0.531 25061 7220 1 11 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.428 -0.281 25061 7221 1 11 . 1 1 21 21 VAL H H 21 7.514 7.514 7.977 -0.463 25061 7222 1 11 . 1 1 22 22 VAL N N 22 121.233 121.233 118.724 2.509 25061 7223 1 11 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.747 -0.301 25061 7224 1 11 . 1 1 22 22 VAL C C 22 176.868 176.868 178.120 -1.252 25061 7225 1 11 . 1 1 22 22 VAL CA C 22 67.013 67.013 65.847 1.166 25061 7226 1 11 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.298 0.016 25061 7227 1 11 . 1 1 22 22 VAL H H 22 7.863 7.863 7.553 0.310 25061 7228 1 11 . 1 1 23 23 LEU N N 23 118.101 118.101 118.517 -0.416 25061 7229 1 11 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.120 -0.055 25061 7230 1 11 . 1 1 23 23 LEU C C 23 179.701 179.701 177.919 1.782 25061 7231 1 11 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.542 -0.246 25061 7232 1 11 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.738 -0.034 25061 7233 1 11 . 1 1 23 23 LEU H H 23 8.151 8.151 8.206 -0.055 25061 7234 1 11 . 1 1 24 24 LYS N N 24 114.622 114.622 115.890 -1.268 25061 7235 1 11 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.160 -0.023 25061 7236 1 11 . 1 1 24 24 LYS C C 24 178.062 178.062 177.587 0.475 25061 7237 1 11 . 1 1 24 24 LYS CA C 24 57.368 57.368 57.966 -0.598 25061 7238 1 11 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.378 0.216 25061 7239 1 11 . 1 1 24 24 LYS H H 24 7.823 7.823 7.951 -0.128 25061 7240 1 11 . 1 1 25 25 SER N N 25 115.474 115.474 116.026 -0.552 25061 7241 1 11 . 1 1 25 25 SER HA H 25 4.377 4.377 4.430 -0.053 25061 7242 1 11 . 1 1 25 25 SER C C 25 174.520 174.520 173.864 0.656 25061 7243 1 11 . 1 1 25 25 SER CA C 25 61.049 61.049 60.297 0.752 25061 7244 1 11 . 1 1 25 25 SER CB C 25 63.777 63.777 64.625 -0.848 25061 7245 1 11 . 1 1 25 25 SER H H 25 7.798 7.798 7.643 0.155 25061 7246 1 11 . 1 1 26 26 ASP N N 26 117.424 117.424 121.288 -3.864 25061 7247 1 11 . 1 1 26 26 ASP HA H 26 4.886 4.886 5.117 -0.231 25061 7248 1 11 . 1 1 26 26 ASP C C 26 173.521 173.521 174.997 -1.476 25061 7249 1 11 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.075 -0.027 25061 7250 1 11 . 1 1 26 26 ASP CB C 26 42.202 42.202 43.211 -1.009 25061 7251 1 11 . 1 1 26 26 ASP H H 26 7.990 7.990 8.269 -0.279 25061 7252 1 11 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.410 0.235 25061 7253 1 11 . 1 1 27 27 PRO C C 27 177.016 177.016 177.098 -0.082 25061 7254 1 11 . 1 1 27 27 PRO CA C 27 63.601 63.601 64.076 -0.475 25061 7255 1 11 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.122 0.051 25061 7256 1 11 . 1 1 28 28 ASN N N 28 115.839 115.839 115.342 0.497 25061 7257 1 11 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.576 0.116 25061 7258 1 11 . 1 1 28 28 ASN C C 28 175.701 175.701 175.497 0.204 25061 7259 1 11 . 1 1 28 28 ASN CA C 28 53.472 53.472 53.937 -0.465 25061 7260 1 11 . 1 1 28 28 ASN CB C 28 39.213 39.213 38.129 1.084 25061 7261 1 11 . 1 1 28 28 ASN H H 28 8.608 8.608 8.507 0.101 25061 7262 1 11 . 1 1 29 29 VAL N N 29 120.770 120.770 121.047 -0.277 25061 7263 1 11 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.929 -0.114 25061 7264 1 11 . 1 1 29 29 VAL C C 29 175.023 175.023 176.303 -1.280 25061 7265 1 11 . 1 1 29 29 VAL CA C 29 62.552 62.552 62.819 -0.267 25061 7266 1 11 . 1 1 29 29 VAL CB C 29 32.147 32.147 31.924 0.223 25061 7267 1 11 . 1 1 29 29 VAL H H 29 7.428 7.428 7.367 0.061 25061 7268 1 11 . 1 1 30 30 LYS N N 30 127.345 127.345 127.356 -0.011 25061 7269 1 11 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.323 0.156 25061 7270 1 11 . 1 1 30 30 LYS C C 30 174.777 174.777 175.972 -1.195 25061 7271 1 11 . 1 1 30 30 LYS CA C 30 55.204 55.204 55.239 -0.035 25061 7272 1 11 . 1 1 30 30 LYS CB C 30 31.949 31.949 30.484 1.465 25061 7273 1 11 . 1 1 30 30 LYS H H 30 8.457 8.457 8.299 0.158 25061 7274 1 11 . 1 1 31 31 THR N N 31 113.552 113.552 117.198 -3.646 25061 7275 1 11 . 1 1 31 31 THR HA H 31 5.723 5.723 5.189 0.534 25061 7276 1 11 . 1 1 31 31 THR C C 31 174.593 174.593 174.389 0.204 25061 7277 1 11 . 1 1 31 31 THR CA C 31 59.030 59.030 60.834 -1.804 25061 7278 1 11 . 1 1 31 31 THR CB C 31 72.206 72.206 69.306 2.900 25061 7279 1 11 . 1 1 31 31 THR H H 31 8.164 8.164 8.154 0.010 25061 7280 1 11 . 1 1 32 32 VAL N N 32 119.206 119.206 127.178 -7.972 25061 7281 1 11 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.305 0.100 25061 7282 1 11 . 1 1 32 32 VAL C C 32 172.663 172.663 174.619 -1.956 25061 7283 1 11 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.120 -0.048 25061 7284 1 11 . 1 1 32 32 VAL CB C 32 35.051 35.051 34.328 0.723 25061 7285 1 11 . 1 1 32 32 VAL H H 32 8.615 8.615 8.706 -0.091 25061 7286 1 11 . 1 1 33 33 ARG N N 33 130.278 130.278 128.868 1.410 25061 7287 1 11 . 1 1 33 33 ARG HA H 33 5.331 5.331 4.854 0.477 25061 7288 1 11 . 1 1 33 33 ARG C C 33 173.836 173.836 175.527 -1.691 25061 7289 1 11 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.695 -1.545 25061 7290 1 11 . 1 1 33 33 ARG CB C 33 30.028 30.028 30.348 -0.320 25061 7291 1 11 . 1 1 33 33 ARG H H 33 8.996 8.996 8.803 0.193 25061 7292 1 11 . 1 1 34 34 THR N N 34 121.695 121.695 119.534 2.161 25061 7293 1 11 . 1 1 34 34 THR HA H 34 4.483 4.483 4.487 -0.004 25061 7294 1 11 . 1 1 34 34 THR C C 34 169.769 169.769 173.849 -4.080 25061 7295 1 11 . 1 1 34 34 THR CA C 34 60.814 60.814 60.994 -0.180 25061 7296 1 11 . 1 1 34 34 THR CB C 34 67.402 67.402 71.256 -3.854 25061 7297 1 11 . 1 1 34 34 THR H H 34 8.126 8.126 8.160 -0.034 25061 7298 1 11 . 1 1 35 35 ASP N N 35 122.198 122.198 123.274 -1.076 25061 7299 1 11 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.436 0.388 25061 7300 1 11 . 1 1 35 35 ASP C C 35 174.790 174.790 175.688 -0.898 25061 7301 1 11 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.096 -0.710 25061 7302 1 11 . 1 1 35 35 ASP CB C 35 41.848 41.848 40.708 1.140 25061 7303 1 11 . 1 1 35 35 ASP H H 35 7.983 7.983 8.317 -0.334 25061 7304 1 11 . 1 1 36 36 ASP N N 36 121.091 121.091 122.944 -1.853 25061 7305 1 11 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.442 0.151 25061 7306 1 11 . 1 1 36 36 ASP C C 36 176.189 176.189 176.844 -0.655 25061 7307 1 11 . 1 1 36 36 ASP CA C 36 53.055 53.055 54.311 -1.256 25061 7308 1 11 . 1 1 36 36 ASP CB C 36 42.159 42.159 41.621 0.538 25061 7309 1 11 . 1 1 36 36 ASP H H 36 8.157 8.157 7.516 0.641 25061 7310 1 11 . 1 1 37 37 LYS N N 37 125.839 125.839 128.199 -2.360 25061 7311 1 11 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.840 -0.118 25061 7312 1 11 . 1 1 37 37 LYS C C 37 176.870 176.870 177.989 -1.119 25061 7313 1 11 . 1 1 37 37 LYS CA C 37 59.404 59.404 60.026 -0.622 25061 7314 1 11 . 1 1 37 37 LYS CB C 37 32.394 32.394 32.695 -0.301 25061 7315 1 11 . 1 1 37 37 LYS H H 37 8.843 8.843 8.626 0.217 25061 7316 1 11 . 1 1 38 38 GLU N N 38 118.369 118.369 116.418 1.951 25061 7317 1 11 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.969 0.038 25061 7318 1 11 . 1 1 38 38 GLU C C 38 179.502 179.502 178.332 1.170 25061 7319 1 11 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.891 -0.221 25061 7320 1 11 . 1 1 38 38 GLU CB C 38 28.474 28.474 28.975 -0.501 25061 7321 1 11 . 1 1 38 38 GLU H H 38 8.182 8.182 8.556 -0.374 25061 7322 1 11 . 1 1 39 39 LYS N N 39 121.722 121.722 120.856 0.866 25061 7323 1 11 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.050 0.115 25061 7324 1 11 . 1 1 39 39 LYS C C 39 178.500 178.500 178.658 -0.158 25061 7325 1 11 . 1 1 39 39 LYS CA C 39 57.736 57.736 58.987 -1.251 25061 7326 1 11 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.446 -1.308 25061 7327 1 11 . 1 1 39 39 LYS H H 39 7.524 7.524 7.431 0.093 25061 7328 1 11 . 1 1 40 40 VAL N N 40 117.199 117.199 119.366 -2.167 25061 7329 1 11 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.516 -0.288 25061 7330 1 11 . 1 1 40 40 VAL C C 40 177.362 177.362 177.982 -0.620 25061 7331 1 11 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.711 0.931 25061 7332 1 11 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.378 -0.475 25061 7333 1 11 . 1 1 40 40 VAL H H 40 7.883 7.883 8.049 -0.166 25061 7334 1 11 . 1 1 41 41 LYS N N 41 117.677 117.677 118.562 -0.885 25061 7335 1 11 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.562 -0.120 25061 7336 1 11 . 1 1 41 41 LYS C C 41 177.686 177.686 178.548 -0.862 25061 7337 1 11 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.584 1.225 25061 7338 1 11 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.361 0.254 25061 7339 1 11 . 1 1 41 41 LYS H H 41 7.567 7.567 7.201 0.366 25061 7340 1 11 . 1 1 42 42 GLU N N 42 118.369 118.369 119.056 -0.687 25061 7341 1 11 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.001 0.006 25061 7342 1 11 . 1 1 42 42 GLU C C 42 179.725 179.725 179.046 0.679 25061 7343 1 11 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.077 -0.008 25061 7344 1 11 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.255 0.284 25061 7345 1 11 . 1 1 42 42 GLU H H 42 7.634 7.634 7.454 0.180 25061 7346 1 11 . 1 1 43 43 GLU N N 43 117.906 117.906 118.770 -0.864 25061 7347 1 11 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.138 0.045 25061 7348 1 11 . 1 1 43 43 GLU C C 43 179.757 179.757 179.277 0.480 25061 7349 1 11 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.339 0.027 25061 7350 1 11 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.104 -0.263 25061 7351 1 11 . 1 1 43 43 GLU H H 43 8.162 8.162 7.889 0.273 25061 7352 1 11 . 1 1 44 44 ILE N N 44 122.291 122.291 120.599 1.692 25061 7353 1 11 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.663 -0.051 25061 7354 1 11 . 1 1 44 44 ILE C C 44 177.101 177.101 177.733 -0.632 25061 7355 1 11 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.855 0.500 25061 7356 1 11 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.770 -0.310 25061 7357 1 11 . 1 1 44 44 ILE H H 44 8.742 8.742 7.467 1.275 25061 7358 1 11 . 1 1 45 45 GLU N N 45 119.892 119.892 120.020 -0.128 25061 7359 1 11 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.082 -0.024 25061 7360 1 11 . 1 1 45 45 GLU C C 45 178.991 178.991 178.838 0.153 25061 7361 1 11 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.245 0.420 25061 7362 1 11 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.591 -0.430 25061 7363 1 11 . 1 1 45 45 GLU H H 45 8.171 8.171 7.849 0.322 25061 7364 1 11 . 1 1 46 46 LYS N N 46 118.064 118.064 119.325 -1.261 25061 7365 1 11 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.057 -0.075 25061 7366 1 11 . 1 1 46 46 LYS C C 46 178.837 178.837 178.764 0.073 25061 7367 1 11 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.369 0.372 25061 7368 1 11 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.251 0.192 25061 7369 1 11 . 1 1 46 46 LYS H H 46 7.785 7.785 7.507 0.278 25061 7370 1 11 . 1 1 47 47 ALA N N 47 121.817 121.817 122.561 -0.744 25061 7371 1 11 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.074 -0.043 25061 7372 1 11 . 1 1 47 47 ALA C C 47 179.859 179.859 179.303 0.556 25061 7373 1 11 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.304 -0.009 25061 7374 1 11 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.549 -0.893 25061 7375 1 11 . 1 1 47 47 ALA H H 47 8.123 8.123 7.812 0.311 25061 7376 1 11 . 1 1 48 48 ARG N N 48 119.080 119.080 117.186 1.894 25061 7377 1 11 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.026 0.063 25061 7378 1 11 . 1 1 48 48 ARG C C 48 180.155 180.155 178.592 1.563 25061 7379 1 11 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.690 0.507 25061 7380 1 11 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.734 -0.224 25061 7381 1 11 . 1 1 48 48 ARG H H 48 8.768 8.768 7.791 0.977 25061 7382 1 11 . 1 1 49 49 LYS N N 49 119.951 119.951 120.086 -0.135 25061 7383 1 11 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.113 -0.074 25061 7384 1 11 . 1 1 49 49 LYS C C 49 178.288 178.288 178.609 -0.321 25061 7385 1 11 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.655 0.182 25061 7386 1 11 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.301 -0.158 25061 7387 1 11 . 1 1 49 49 LYS H H 49 8.037 8.037 7.506 0.531 25061 7388 1 11 . 1 1 50 50 GLN N N 50 115.284 115.284 115.309 -0.025 25061 7389 1 11 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.248 0.094 25061 7390 1 11 . 1 1 50 50 GLN C C 50 176.180 176.180 177.155 -0.975 25061 7391 1 11 . 1 1 50 50 GLN CA C 50 55.741 55.741 55.974 -0.232 25061 7392 1 11 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.224 0.341 25061 7393 1 11 . 1 1 50 50 GLN H H 50 7.740 7.740 7.829 -0.089 25061 7394 1 11 . 1 1 51 51 GLY N N 51 109.725 109.725 106.756 2.969 25061 7395 1 11 . 1 1 51 51 GLY C C 51 174.552 174.552 173.903 0.649 25061 7396 1 11 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.554 0.809 25061 7397 1 11 . 1 1 51 51 GLY H H 51 8.027 8.027 7.686 0.341 25061 7398 1 11 . 1 1 52 52 ARG N N 52 119.064 119.064 119.593 -0.529 25061 7399 1 11 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.783 0.114 25061 7400 1 11 . 1 1 52 52 ARG C C 52 173.123 173.123 174.110 -0.987 25061 7401 1 11 . 1 1 52 52 ARG CA C 52 52.247 52.247 52.325 -0.078 25061 7402 1 11 . 1 1 52 52 ARG CB C 52 32.366 32.366 31.489 0.877 25061 7403 1 11 . 1 1 52 52 ARG H H 52 7.969 7.969 7.740 0.229 25061 7404 1 11 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.598 0.257 25061 7405 1 11 . 1 1 53 53 PRO C C 53 174.069 174.069 175.807 -1.738 25061 7406 1 11 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.694 -0.876 25061 7407 1 11 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.639 -0.579 25061 7408 1 11 . 1 1 54 54 ILE N N 54 116.301 116.301 117.893 -1.592 25061 7409 1 11 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.607 0.631 25061 7410 1 11 . 1 1 54 54 ILE C C 54 171.709 171.709 173.409 -1.700 25061 7411 1 11 . 1 1 54 54 ILE CA C 54 57.774 57.774 60.007 -2.233 25061 7412 1 11 . 1 1 54 54 ILE CB C 54 41.558 41.558 42.196 -0.638 25061 7413 1 11 . 1 1 54 54 ILE H H 54 7.920 7.920 7.958 -0.038 25061 7414 1 11 . 1 1 55 55 VAL N N 55 126.302 126.302 128.841 -2.539 25061 7415 1 11 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.115 -0.191 25061 7416 1 11 . 1 1 55 55 VAL C C 55 173.624 173.624 174.829 -1.205 25061 7417 1 11 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.706 -0.911 25061 7418 1 11 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.945 -0.117 25061 7419 1 11 . 1 1 55 55 VAL H H 55 8.652 8.652 8.543 0.109 25061 7420 1 11 . 1 1 56 56 ILE N N 56 127.503 127.503 127.749 -0.246 25061 7421 1 11 . 1 1 56 56 ILE HA H 56 4.664 4.664 5.014 -0.350 25061 7422 1 11 . 1 1 56 56 ILE C C 56 173.479 173.479 175.238 -1.759 25061 7423 1 11 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.641 0.366 25061 7424 1 11 . 1 1 56 56 ILE CB C 56 40.285 40.285 38.667 1.618 25061 7425 1 11 . 1 1 56 56 ILE H H 56 9.124 9.124 8.113 1.011 25061 7426 1 11 . 1 1 57 57 PHE N N 57 125.302 125.302 127.600 -2.298 25061 7427 1 11 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.360 -0.144 25061 7428 1 11 . 1 1 57 57 PHE C C 57 174.536 174.536 175.843 -1.307 25061 7429 1 11 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.012 -0.051 25061 7430 1 11 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.942 0.487 25061 7431 1 11 . 1 1 57 57 PHE H H 57 8.971 8.971 8.539 0.432 25061 7432 1 11 . 1 1 58 58 ILE N N 58 126.472 126.472 124.052 2.420 25061 7433 1 11 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.558 -0.043 25061 7434 1 11 . 1 1 58 58 ILE C C 58 173.391 173.391 175.184 -1.793 25061 7435 1 11 . 1 1 58 58 ILE CA C 58 59.090 59.090 58.924 0.166 25061 7436 1 11 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.079 -0.337 25061 7437 1 11 . 1 1 58 58 ILE H H 58 9.248 9.248 8.797 0.451 25061 7438 1 11 . 1 1 59 59 ARG N N 59 124.681 124.681 123.204 1.477 25061 7439 1 11 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.225 -0.296 25061 7440 1 11 . 1 1 59 59 ARG C C 59 178.521 178.521 177.926 0.595 25061 7441 1 11 . 1 1 59 59 ARG CA C 59 55.742 55.742 54.977 0.765 25061 7442 1 11 . 1 1 59 59 ARG CB C 59 30.918 30.918 33.170 -2.252 25061 7443 1 11 . 1 1 59 59 ARG H H 59 8.587 8.587 8.756 -0.169 25061 7444 1 11 . 1 1 60 60 GLY N N 60 108.848 108.848 111.307 -2.459 25061 7445 1 11 . 1 1 60 60 GLY C C 60 174.775 174.775 174.594 0.181 25061 7446 1 11 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.420 -0.453 25061 7447 1 11 . 1 1 60 60 GLY H H 60 7.732 7.732 8.342 -0.610 25061 7448 1 11 . 1 1 61 61 ALA N N 61 120.877 120.877 122.842 -1.965 25061 7449 1 11 . 1 1 61 61 ALA HA H 61 4.144 4.144 3.986 0.158 25061 7450 1 11 . 1 1 61 61 ALA C C 61 177.769 177.769 179.618 -1.849 25061 7451 1 11 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.746 -0.297 25061 7452 1 11 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.456 -0.085 25061 7453 1 11 . 1 1 61 61 ALA H H 61 7.852 7.852 8.005 -0.153 25061 7454 1 11 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.241 0.559 25061 7455 1 11 . 1 1 62 62 TYR CA C 62 63.039 63.039 58.897 4.142 25061 7456 1 11 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.362 0.078 25061 7457 1 11 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.932 -0.247 25061 7458 1 11 . 1 1 63 63 GLU C C 63 176.251 176.251 178.547 -2.296 25061 7459 1 11 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.421 -0.163 25061 7460 1 11 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.137 0.275 25061 7461 1 11 . 1 1 64 64 GLU N N 64 119.209 119.209 118.421 0.788 25061 7462 1 11 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.339 0.562 25061 7463 1 11 . 1 1 64 64 GLU C C 64 178.251 178.251 178.716 -0.465 25061 7464 1 11 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.476 0.736 25061 7465 1 11 . 1 1 64 64 GLU CB C 64 28.645 28.645 28.767 -0.122 25061 7466 1 11 . 1 1 64 64 GLU H H 64 8.878 8.878 7.693 1.185 25061 7467 1 11 . 1 1 65 65 VAL N N 65 116.728 116.728 119.746 -3.018 25061 7468 1 11 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.748 0.234 25061 7469 1 11 . 1 1 65 65 VAL C C 65 176.915 176.915 177.834 -0.919 25061 7470 1 11 . 1 1 65 65 VAL CA C 65 64.609 64.609 66.212 -1.603 25061 7471 1 11 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.602 0.293 25061 7472 1 11 . 1 1 65 65 VAL H H 65 7.652 7.652 8.067 -0.415 25061 7473 1 11 . 1 1 66 66 VAL N N 66 119.462 119.462 118.947 0.515 25061 7474 1 11 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.611 -0.297 25061 7475 1 11 . 1 1 66 66 VAL C C 66 177.142 177.142 177.299 -0.157 25061 7476 1 11 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.297 1.038 25061 7477 1 11 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.484 -0.054 25061 7478 1 11 . 1 1 66 66 VAL H H 66 7.896 7.896 7.804 0.092 25061 7479 1 11 . 1 1 67 67 ARG HA H 67 3.628 3.628 3.957 -0.329 25061 7480 1 11 . 1 1 67 67 ARG C C 67 177.841 177.841 178.116 -0.275 25061 7481 1 11 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.963 0.089 25061 7482 1 11 . 1 1 67 67 ARG CB C 67 29.393 29.393 30.050 -0.657 25061 7483 1 11 . 1 1 68 68 ASP N N 68 118.316 118.316 118.644 -0.328 25061 7484 1 11 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.549 -0.188 25061 7485 1 11 . 1 1 68 68 ASP C C 68 178.945 178.945 178.649 0.296 25061 7486 1 11 . 1 1 68 68 ASP CA C 68 57.311 57.311 57.018 0.293 25061 7487 1 11 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.868 0.646 25061 7488 1 11 . 1 1 68 68 ASP H H 68 7.625 7.625 7.827 -0.202 25061 7489 1 11 . 1 1 69 69 ILE N N 69 119.231 119.231 119.867 -0.636 25061 7490 1 11 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.839 -0.209 25061 7491 1 11 . 1 1 69 69 ILE C C 69 177.138 177.138 177.949 -0.811 25061 7492 1 11 . 1 1 69 69 ILE CA C 69 64.540 64.540 62.877 1.663 25061 7493 1 11 . 1 1 69 69 ILE CB C 69 37.050 37.050 36.905 0.145 25061 7494 1 11 . 1 1 69 69 ILE H H 69 8.113 8.113 7.588 0.525 25061 7495 1 11 . 1 1 70 70 VAL N N 70 120.164 120.164 120.221 -0.057 25061 7496 1 11 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.615 -0.198 25061 7497 1 11 . 1 1 70 70 VAL C C 70 177.079 177.079 177.916 -0.837 25061 7498 1 11 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.717 -0.443 25061 7499 1 11 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.080 0.178 25061 7500 1 11 . 1 1 70 70 VAL H H 70 8.478 8.478 8.348 0.130 25061 7501 1 11 . 1 1 71 71 GLU N N 71 118.293 118.293 119.607 -1.314 25061 7502 1 11 . 1 1 71 71 GLU HA H 71 4.054 4.054 4.025 0.029 25061 7503 1 11 . 1 1 71 71 GLU C C 71 179.009 179.009 178.610 0.399 25061 7504 1 11 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.608 -0.192 25061 7505 1 11 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.267 -0.445 25061 7506 1 11 . 1 1 71 71 GLU H H 71 8.152 8.152 7.959 0.193 25061 7507 1 11 . 1 1 72 72 TYR N N 72 120.091 120.091 119.524 0.567 25061 7508 1 11 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.178 -0.016 25061 7509 1 11 . 1 1 72 72 TYR C C 72 176.404 176.404 177.197 -0.793 25061 7510 1 11 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.419 -0.287 25061 7511 1 11 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.293 -0.156 25061 7512 1 11 . 1 1 72 72 TYR H H 72 7.959 7.959 7.437 0.522 25061 7513 1 11 . 1 1 73 73 ALA N N 73 120.133 120.133 120.843 -0.710 25061 7514 1 11 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.908 -0.278 25061 7515 1 11 . 1 1 73 73 ALA C C 73 179.182 179.182 179.230 -0.048 25061 7516 1 11 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.260 -0.148 25061 7517 1 11 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.245 -0.054 25061 7518 1 11 . 1 1 73 73 ALA H H 73 8.604 8.604 8.262 0.342 25061 7519 1 11 . 1 1 74 74 GLN N N 74 115.553 115.553 116.506 -0.953 25061 7520 1 11 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.021 0.117 25061 7521 1 11 . 1 1 74 74 GLN C C 74 180.595 180.595 178.663 1.932 25061 7522 1 11 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.161 0.934 25061 7523 1 11 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.736 -0.161 25061 7524 1 11 . 1 1 74 74 GLN H H 74 8.619 8.619 8.015 0.604 25061 7525 1 11 . 1 1 75 75 LYS N N 75 122.396 122.396 119.554 2.842 25061 7526 1 11 . 1 1 75 75 LYS HA H 75 4.028 4.028 3.979 0.049 25061 7527 1 11 . 1 1 75 75 LYS C C 75 178.521 178.521 178.741 -0.220 25061 7528 1 11 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.139 0.919 25061 7529 1 11 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.782 -0.183 25061 7530 1 11 . 1 1 75 75 LYS H H 75 8.123 8.123 7.395 0.728 25061 7531 1 11 . 1 1 76 76 GLU N N 76 116.294 116.294 115.892 0.402 25061 7532 1 11 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.139 -0.040 25061 7533 1 11 . 1 1 76 76 GLU C C 76 175.957 175.957 177.645 -1.688 25061 7534 1 11 . 1 1 76 76 GLU CA C 76 55.605 55.605 56.491 -0.886 25061 7535 1 11 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.924 -0.100 25061 7536 1 11 . 1 1 76 76 GLU H H 76 7.450 7.450 7.686 -0.236 25061 7537 1 11 . 1 1 77 77 GLY N N 77 107.446 107.446 107.425 0.021 25061 7538 1 11 . 1 1 77 77 GLY C C 77 174.520 174.520 174.918 -0.398 25061 7539 1 11 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.438 0.369 25061 7540 1 11 . 1 1 77 77 GLY H H 77 7.763 7.763 7.582 0.181 25061 7541 1 11 . 1 1 78 78 LEU N N 78 120.179 120.179 119.025 1.154 25061 7542 1 11 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.334 0.054 25061 7543 1 11 . 1 1 78 78 LEU C C 78 175.914 175.914 176.653 -0.739 25061 7544 1 11 . 1 1 78 78 LEU CA C 78 53.472 53.472 54.456 -0.984 25061 7545 1 11 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.657 -0.769 25061 7546 1 11 . 1 1 78 78 LEU H H 78 7.930 7.930 7.879 0.051 25061 7547 1 11 . 1 1 79 79 ARG N N 79 122.207 122.207 122.862 -0.655 25061 7548 1 11 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.234 0.163 25061 7549 1 11 . 1 1 79 79 ARG C C 79 174.960 174.960 174.734 0.226 25061 7550 1 11 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.247 0.401 25061 7551 1 11 . 1 1 79 79 ARG CB C 79 30.476 30.476 30.477 -0.001 25061 7552 1 11 . 1 1 79 79 ARG H H 79 8.241 8.241 8.234 0.007 25061 7553 1 11 . 1 1 80 80 VAL N N 80 123.333 123.333 126.040 -2.707 25061 7554 1 11 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.347 0.948 25061 7555 1 11 . 1 1 80 80 VAL C C 80 174.048 174.048 174.338 -0.290 25061 7556 1 11 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.980 -1.939 25061 7557 1 11 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.608 1.697 25061 7558 1 11 . 1 1 80 80 VAL H H 80 8.359 8.359 8.470 -0.111 25061 7559 1 11 . 1 1 81 81 LEU N N 81 128.719 128.719 129.713 -0.994 25061 7560 1 11 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.413 -0.309 25061 7561 1 11 . 1 1 81 81 LEU C C 81 174.484 174.484 174.653 -0.169 25061 7562 1 11 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.843 0.277 25061 7563 1 11 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.964 -1.009 25061 7564 1 11 . 1 1 81 81 LEU H H 81 8.650 8.650 8.876 -0.226 25061 7565 1 11 . 1 1 82 82 VAL N N 82 122.487 122.487 127.938 -5.451 25061 7566 1 11 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.410 0.687 25061 7567 1 11 . 1 1 82 82 VAL C C 82 174.525 174.525 174.572 -0.047 25061 7568 1 11 . 1 1 82 82 VAL CA C 82 60.285 60.285 61.368 -1.083 25061 7569 1 11 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.026 2.763 25061 7570 1 11 . 1 1 82 82 VAL H H 82 8.781 8.781 8.261 0.520 25061 7571 1 11 . 1 1 83 83 ILE N N 83 128.082 128.082 129.521 -1.439 25061 7572 1 11 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.813 0.117 25061 7573 1 11 . 1 1 83 83 ILE C C 83 172.925 172.925 174.965 -2.040 25061 7574 1 11 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.423 -0.482 25061 7575 1 11 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.259 1.927 25061 7576 1 11 . 1 1 83 83 ILE H H 83 9.527 9.527 8.719 0.808 25061 7577 1 11 . 1 1 84 84 LYS N N 84 128.493 128.493 126.927 1.566 25061 7578 1 11 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.378 -0.330 25061 7579 1 11 . 1 1 84 84 LYS C C 84 174.027 174.027 175.647 -1.620 25061 7580 1 11 . 1 1 84 84 LYS CA C 84 53.253 53.253 53.844 -0.591 25061 7581 1 11 . 1 1 84 84 LYS CB C 84 34.652 34.652 36.036 -1.384 25061 7582 1 11 . 1 1 84 84 LYS H H 84 8.721 8.721 8.888 -0.167 25061 7583 1 11 . 1 1 85 85 VAL N N 85 126.729 126.729 123.952 2.777 25061 7584 1 11 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.162 0.574 25061 7585 1 11 . 1 1 85 85 VAL C C 85 175.935 175.935 175.779 0.156 25061 7586 1 11 . 1 1 85 85 VAL CA C 85 60.200 60.200 61.792 -1.592 25061 7587 1 11 . 1 1 85 85 VAL CB C 85 30.847 30.847 30.259 0.588 25061 7588 1 11 . 1 1 85 85 VAL H H 85 8.643 8.643 8.038 0.605 25061 7589 1 11 . 1 1 86 86 ALA N N 86 132.930 132.930 131.049 1.881 25061 7590 1 11 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.624 -0.194 25061 7591 1 11 . 1 1 86 86 ALA C C 86 175.635 175.635 176.481 -0.846 25061 7592 1 11 . 1 1 86 86 ALA CA C 86 51.504 51.504 51.032 0.472 25061 7593 1 11 . 1 1 86 86 ALA CB C 86 20.821 20.821 20.944 -0.123 25061 7594 1 11 . 1 1 86 86 ALA H H 86 8.835 8.835 7.884 0.951 25061 7595 1 11 . 1 1 87 87 GLN N N 87 118.719 118.719 118.100 0.619 25061 7596 1 11 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.378 0.091 25061 7597 1 11 . 1 1 87 87 GLN C C 87 175.949 175.949 174.845 1.104 25061 7598 1 11 . 1 1 87 87 GLN CA C 87 55.260 55.260 55.030 0.230 25061 7599 1 11 . 1 1 87 87 GLN CB C 87 30.432 30.432 29.095 1.337 25061 7600 1 11 . 1 1 87 87 GLN H H 87 8.570 8.570 8.429 0.141 25061 7601 1 11 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.264 0.216 25061 7602 1 11 . 1 1 88 88 ASP CA C 88 55.454 55.454 55.887 -0.433 25061 7603 1 11 . 1 1 88 88 ASP CB C 88 41.204 41.204 40.117 1.087 25061 7604 1 11 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.614 -0.567 25061 7605 1 11 . 1 1 89 89 GLN CA C 89 56.687 56.687 54.450 2.237 25061 7606 1 11 . 1 1 89 89 GLN CB C 89 27.850 27.850 31.078 -3.228 25061 7607 1 11 . 1 1 92 92 LEU N N 92 125.291 125.291 118.856 6.435 25061 7608 1 11 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.015 0.186 25061 7609 1 11 . 1 1 92 92 LEU CA C 92 55.057 55.057 58.008 -2.951 25061 7610 1 11 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.938 0.108 25061 7611 1 11 . 1 1 92 92 LEU H H 92 8.277 8.277 8.694 -0.417 25061 7612 1 11 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.246 0.510 25061 7613 1 11 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.166 -0.117 25061 7614 1 11 . 1 1 94 94 ARG C C 94 178.544 178.544 178.382 0.162 25061 7615 1 11 . 1 1 94 94 ARG CA C 94 58.607 58.607 58.503 0.104 25061 7616 1 11 . 1 1 94 94 ARG CB C 94 29.614 29.614 29.763 -0.149 25061 7617 1 11 . 1 1 95 95 PHE N N 95 117.407 117.407 119.913 -2.506 25061 7618 1 11 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.226 0.149 25061 7619 1 11 . 1 1 95 95 PHE CA C 95 60.231 60.231 61.148 -0.917 25061 7620 1 11 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.201 -1.259 25061 7621 1 11 . 1 1 95 95 PHE H H 95 8.419 8.419 7.624 0.795 25061 7622 1 11 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.932 -0.124 25061 7623 1 11 . 1 1 96 96 TYR C C 96 177.728 177.728 177.268 0.460 25061 7624 1 11 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.303 1.853 25061 7625 1 11 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.392 -0.692 25061 7626 1 11 . 1 1 97 97 GLU N N 97 119.054 119.054 117.711 1.343 25061 7627 1 11 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.545 0.518 25061 7628 1 11 . 1 1 97 97 GLU C C 97 179.071 179.071 178.345 0.726 25061 7629 1 11 . 1 1 97 97 GLU CA C 97 58.760 58.760 58.870 -0.110 25061 7630 1 11 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.319 -0.147 25061 7631 1 11 . 1 1 97 97 GLU H H 97 7.858 7.858 8.074 -0.216 25061 7632 1 11 . 1 1 98 98 GLN N N 98 119.385 119.385 119.487 -0.102 25061 7633 1 11 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.979 -0.078 25061 7634 1 11 . 1 1 98 98 GLN C C 98 177.599 177.599 178.331 -0.732 25061 7635 1 11 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.596 -0.285 25061 7636 1 11 . 1 1 98 98 GLN CB C 98 27.766 27.766 27.838 -0.072 25061 7637 1 11 . 1 1 98 98 GLN H H 98 7.747 7.747 7.294 0.453 25061 7638 1 11 . 1 1 99 99 LEU N N 99 118.348 118.348 119.635 -1.287 25061 7639 1 11 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.832 0.187 25061 7640 1 11 . 1 1 99 99 LEU C C 99 178.669 178.669 179.113 -0.444 25061 7641 1 11 . 1 1 99 99 LEU CA C 99 57.430 57.430 58.184 -0.753 25061 7642 1 11 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.272 0.231 25061 7643 1 11 . 1 1 99 99 LEU H H 99 7.891 7.891 7.339 0.552 25061 7644 1 11 . 1 1 100 100 LYS N N 100 118.332 118.332 119.088 -0.756 25061 7645 1 11 . 1 1 100 100 LYS HA H 100 4.509 4.509 4.044 0.465 25061 7646 1 11 . 1 1 100 100 LYS C C 100 180.846 180.846 178.974 1.872 25061 7647 1 11 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.688 0.400 25061 7648 1 11 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.810 0.459 25061 7649 1 11 . 1 1 100 100 LYS H H 100 7.560 7.560 7.235 0.325 25061 7650 1 11 . 1 1 101 101 LYS N N 101 121.944 121.944 117.941 4.003 25061 7651 1 11 . 1 1 101 101 LYS HA H 101 4.072 4.072 3.995 0.077 25061 7652 1 11 . 1 1 101 101 LYS C C 101 177.707 177.707 178.365 -0.658 25061 7653 1 11 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.520 0.351 25061 7654 1 11 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.308 -0.213 25061 7655 1 11 . 1 1 101 101 LYS H H 101 7.959 7.959 7.805 0.154 25061 7656 1 11 . 1 1 102 102 ASP N N 102 118.788 118.788 116.794 1.994 25061 7657 1 11 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.424 0.270 25061 7658 1 11 . 1 1 102 102 ASP C C 102 176.359 176.359 177.106 -0.747 25061 7659 1 11 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.590 -1.011 25061 7660 1 11 . 1 1 102 102 ASP CB C 102 40.574 40.574 42.061 -1.487 25061 7661 1 11 . 1 1 102 102 ASP H H 102 7.893 7.893 7.794 0.099 25061 7662 1 11 . 1 1 103 103 GLY N N 103 107.024 107.024 105.569 1.455 25061 7663 1 11 . 1 1 103 103 GLY C C 103 174.328 174.328 174.113 0.215 25061 7664 1 11 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.672 0.673 25061 7665 1 11 . 1 1 103 103 GLY H H 103 7.866 7.866 7.896 -0.030 25061 7666 1 11 . 1 1 104 104 VAL N N 104 123.060 123.060 122.616 0.444 25061 7667 1 11 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.796 0.177 25061 7668 1 11 . 1 1 104 104 VAL C C 104 175.023 175.023 175.184 -0.161 25061 7669 1 11 . 1 1 104 104 VAL CA C 104 61.878 61.878 63.274 -1.396 25061 7670 1 11 . 1 1 104 104 VAL CB C 104 32.088 32.088 31.862 0.226 25061 7671 1 11 . 1 1 104 104 VAL H H 104 7.955 7.955 7.699 0.256 25061 7672 1 11 . 1 1 105 105 ASP N N 105 127.987 127.987 129.740 -1.753 25061 7673 1 11 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.588 -0.013 25061 7674 1 11 . 1 1 105 105 ASP C C 105 173.624 173.624 174.853 -1.229 25061 7675 1 11 . 1 1 105 105 ASP CA C 105 54.087 54.087 54.339 -0.252 25061 7676 1 11 . 1 1 105 105 ASP CB C 105 40.660 40.660 40.327 0.333 25061 7677 1 11 . 1 1 105 105 ASP H H 105 8.399 8.399 8.336 0.063 25061 7678 1 11 . 1 1 106 106 VAL N N 106 125.798 125.798 123.410 2.388 25061 7679 1 11 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.717 0.098 25061 7680 1 11 . 1 1 106 106 VAL C C 106 174.902 174.902 175.082 -0.180 25061 7681 1 11 . 1 1 106 106 VAL CA C 106 60.194 60.194 60.317 -0.123 25061 7682 1 11 . 1 1 106 106 VAL CB C 106 34.179 34.179 33.714 0.465 25061 7683 1 11 . 1 1 106 106 VAL H H 106 7.550 7.550 7.610 -0.060 25061 7684 1 11 . 1 1 107 107 ARG N N 107 128.099 128.099 126.345 1.754 25061 7685 1 11 . 1 1 107 107 ARG HA H 107 4.876 4.876 5.072 -0.196 25061 7686 1 11 . 1 1 107 107 ARG C C 107 173.815 173.815 173.929 -0.114 25061 7687 1 11 . 1 1 107 107 ARG CA C 107 53.386 53.386 54.252 -0.866 25061 7688 1 11 . 1 1 107 107 ARG CB C 107 31.195 31.195 33.358 -2.163 25061 7689 1 11 . 1 1 107 107 ARG H H 107 9.132 9.132 9.115 0.017 25061 7690 1 11 . 1 1 108 108 VAL N N 108 123.979 123.979 120.715 3.264 25061 7691 1 11 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.264 -0.322 25061 7692 1 11 . 1 1 108 108 VAL C C 108 175.854 175.854 176.114 -0.260 25061 7693 1 11 . 1 1 108 108 VAL CA C 108 60.017 60.017 59.785 0.232 25061 7694 1 11 . 1 1 108 108 VAL CB C 108 32.844 32.844 34.180 -1.336 25061 7695 1 11 . 1 1 108 108 VAL H H 108 8.561 8.561 8.629 -0.068 25061 7696 1 11 . 1 1 109 109 THR N N 109 120.144 120.144 116.183 3.961 25061 7697 1 11 . 1 1 109 109 THR HA H 109 4.815 4.815 4.247 0.568 25061 7698 1 11 . 1 1 109 109 THR C C 109 171.867 171.867 174.861 -2.994 25061 7699 1 11 . 1 1 109 109 THR CA C 109 59.613 59.613 62.032 -2.418 25061 7700 1 11 . 1 1 109 109 THR CB C 109 69.720 69.720 69.650 0.070 25061 7701 1 11 . 1 1 109 109 THR H H 109 8.803 8.803 8.319 0.484 25061 7702 1 11 . 1 1 110 110 ASP N N 110 123.212 123.212 117.169 6.043 25061 7703 1 11 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.274 0.695 25061 7704 1 11 . 1 1 110 110 ASP C C 110 175.739 175.739 174.122 1.617 25061 7705 1 11 . 1 1 110 110 ASP CA C 110 53.243 53.243 55.928 -2.685 25061 7706 1 11 . 1 1 110 110 ASP CB C 110 41.351 41.351 39.562 1.789 25061 7707 1 11 . 1 1 110 110 ASP H H 110 8.363 8.363 8.751 -0.388 25061 7708 1 11 . 1 1 111 111 ASN N N 111 116.298 116.298 117.194 -0.896 25061 7709 1 11 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.879 -0.003 25061 7710 1 11 . 1 1 111 111 ASN C C 111 174.756 174.756 175.017 -0.261 25061 7711 1 11 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.634 -0.502 25061 7712 1 11 . 1 1 111 111 ASN CB C 111 40.765 40.765 41.014 -0.249 25061 7713 1 11 . 1 1 111 111 ASN H H 111 8.085 8.085 7.371 0.714 25061 7714 1 11 . 1 1 112 112 GLU HA H 112 3.848 3.848 3.925 -0.077 25061 7715 1 11 . 1 1 112 112 GLU C C 112 177.016 177.016 177.400 -0.384 25061 7716 1 11 . 1 1 112 112 GLU CA C 112 59.480 59.480 59.673 -0.193 25061 7717 1 11 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.398 0.276 25061 7718 1 11 . 1 1 113 113 ASP N N 113 121.033 121.033 120.270 0.763 25061 7719 1 11 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.459 -0.046 25061 7720 1 11 . 1 1 113 113 ASP C C 113 178.988 178.988 178.302 0.686 25061 7721 1 11 . 1 1 113 113 ASP CA C 113 57.855 57.855 56.871 0.984 25061 7722 1 11 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.831 -0.330 25061 7723 1 11 . 1 1 113 113 ASP H H 113 8.219 8.219 8.014 0.205 25061 7724 1 11 . 1 1 114 114 GLU N N 114 121.280 121.280 119.640 1.640 25061 7725 1 11 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.080 -0.015 25061 7726 1 11 . 1 1 114 114 GLU C C 114 178.776 178.776 178.800 -0.024 25061 7727 1 11 . 1 1 114 114 GLU CA C 114 58.714 58.714 58.685 0.029 25061 7728 1 11 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.634 -0.421 25061 7729 1 11 . 1 1 114 114 GLU H H 114 8.296 8.296 8.329 -0.033 25061 7730 1 11 . 1 1 115 115 ALA N N 115 120.924 120.924 122.609 -1.685 25061 7731 1 11 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.113 -0.275 25061 7732 1 11 . 1 1 115 115 ALA C C 115 178.502 178.502 178.861 -0.359 25061 7733 1 11 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.020 0.618 25061 7734 1 11 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.340 0.157 25061 7735 1 11 . 1 1 115 115 ALA H H 115 7.853 7.853 7.991 -0.138 25061 7736 1 11 . 1 1 116 116 LYS N N 116 116.616 116.616 119.249 -2.633 25061 7737 1 11 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.884 -0.165 25061 7738 1 11 . 1 1 116 116 LYS C C 116 178.097 178.097 178.668 -0.571 25061 7739 1 11 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.873 0.879 25061 7740 1 11 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.326 0.229 25061 7741 1 11 . 1 1 116 116 LYS H H 116 8.091 8.091 8.054 0.037 25061 7742 1 11 . 1 1 117 117 LYS N N 117 118.990 118.990 115.864 3.126 25061 7743 1 11 . 1 1 117 117 LYS HA H 117 3.911 3.911 4.077 -0.166 25061 7744 1 11 . 1 1 117 117 LYS C C 117 179.186 179.186 178.996 0.190 25061 7745 1 11 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.183 0.388 25061 7746 1 11 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.141 0.379 25061 7747 1 11 . 1 1 117 117 LYS H H 117 7.742 7.742 7.830 -0.088 25061 7748 1 11 . 1 1 118 118 ARG N N 118 117.441 117.441 120.105 -2.664 25061 7749 1 11 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.210 -0.070 25061 7750 1 11 . 1 1 118 118 ARG C C 118 178.921 178.921 178.448 0.473 25061 7751 1 11 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.172 -0.500 25061 7752 1 11 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.861 -0.200 25061 7753 1 11 . 1 1 118 118 ARG H H 118 8.468 8.468 7.446 1.022 25061 7754 1 11 . 1 1 119 119 LEU N N 119 120.100 120.100 120.911 -0.811 25061 7755 1 11 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.875 0.085 25061 7756 1 11 . 1 1 119 119 LEU C C 119 177.554 177.554 178.490 -0.936 25061 7757 1 11 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.402 -0.521 25061 7758 1 11 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.579 0.310 25061 7759 1 11 . 1 1 119 119 LEU H H 119 8.322 8.322 8.312 0.010 25061 7760 1 11 . 1 1 120 120 LYS N N 120 118.238 118.238 118.868 -0.630 25061 7761 1 11 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.899 -0.077 25061 7762 1 11 . 1 1 120 120 LYS C C 120 178.703 178.703 178.776 -0.073 25061 7763 1 11 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.789 0.557 25061 7764 1 11 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.212 0.024 25061 7765 1 11 . 1 1 120 120 LYS H H 120 7.990 7.990 7.550 0.440 25061 7766 1 11 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.055 -0.033 25061 7767 1 11 . 1 1 121 121 GLU C C 121 177.769 177.769 179.247 -1.478 25061 7768 1 11 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.333 -0.411 25061 7769 1 11 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.358 0.096 25061 7770 1 11 . 1 1 122 122 LEU N N 122 119.454 119.454 118.712 0.742 25061 7771 1 11 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.116 0.017 25061 7772 1 11 . 1 1 122 122 LEU C C 122 178.991 178.991 179.446 -0.455 25061 7773 1 11 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.206 0.120 25061 7774 1 11 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.829 -0.150 25061 7775 1 11 . 1 1 122 122 LEU H H 122 7.930 7.930 7.984 -0.054 25061 7776 1 11 . 1 1 123 123 LEU N N 123 117.862 117.862 120.411 -2.549 25061 7777 1 11 . 1 1 123 123 LEU HA H 123 4.067 4.067 4.044 0.023 25061 7778 1 11 . 1 1 123 123 LEU C C 123 179.178 179.178 178.822 0.356 25061 7779 1 11 . 1 1 123 123 LEU CA C 123 56.920 56.920 57.741 -0.821 25061 7780 1 11 . 1 1 123 123 LEU CB C 123 41.210 41.210 42.013 -0.803 25061 7781 1 11 . 1 1 123 123 LEU H H 123 8.095 8.095 8.000 0.095 25061 7782 1 11 . 1 1 124 124 GLU N N 124 118.975 118.975 117.483 1.492 25061 7783 1 11 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.171 -0.042 25061 7784 1 11 . 1 1 124 124 GLU C C 124 177.777 177.777 178.036 -0.259 25061 7785 1 11 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.631 -0.544 25061 7786 1 11 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.579 -0.039 25061 7787 1 11 . 1 1 124 124 GLU H H 124 7.930 7.930 7.935 -0.005 25061 7788 1 11 . 1 1 125 125 LYS N N 125 118.933 118.933 116.977 1.956 25061 7789 1 11 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.380 -0.043 25061 7790 1 11 . 1 1 125 125 LYS C C 125 178.188 178.188 177.753 0.435 25061 7791 1 11 . 1 1 125 125 LYS CA C 125 56.980 56.980 58.447 -1.467 25061 7792 1 11 . 1 1 125 125 LYS CB C 125 32.608 32.608 34.111 -1.503 25061 7793 1 11 . 1 1 125 125 LYS H H 125 7.729 7.729 7.661 0.068 25061 7794 1 11 . 1 1 126 126 VAL N N 126 117.933 117.933 110.223 7.710 25061 7795 1 11 . 1 1 126 126 VAL HA H 126 4.022 4.022 4.432 -0.410 25061 7796 1 11 . 1 1 126 126 VAL C C 126 176.947 176.947 174.410 2.537 25061 7797 1 11 . 1 1 126 126 VAL CA C 126 63.641 63.641 62.689 0.952 25061 7798 1 11 . 1 1 126 126 VAL CB C 126 31.859 31.859 34.243 -2.384 25061 7799 1 11 . 1 1 126 126 VAL H H 126 8.044 8.044 8.197 -0.153 25061 7800 1 11 . 1 1 127 127 GLY N N 127 109.813 109.813 108.153 1.660 25061 7801 1 11 . 1 1 127 127 GLY C C 127 174.264 174.264 172.664 1.600 25061 7802 1 11 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.029 0.250 25061 7803 1 11 . 1 1 127 127 GLY H H 127 8.279 8.279 7.703 0.576 25061 7804 1 11 . 1 1 128 128 SER N N 128 115.185 115.185 116.527 -1.342 25061 7805 1 11 . 1 1 128 128 SER HA H 128 4.462 4.462 4.935 -0.473 25061 7806 1 11 . 1 1 128 128 SER C C 128 174.775 174.775 172.434 2.341 25061 7807 1 11 . 1 1 128 128 SER CA C 128 58.739 58.739 57.225 1.514 25061 7808 1 11 . 1 1 128 128 SER CB C 128 63.850 63.850 66.371 -2.521 25061 7809 1 11 . 1 1 128 128 SER H H 128 8.048 8.048 8.152 -0.104 25061 7810 1 11 . 1 1 129 129 LEU N N 129 123.060 123.060 120.798 2.262 25061 7811 1 11 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.806 -0.508 25061 7812 1 11 . 1 1 129 129 LEU C C 129 177.313 177.313 175.999 1.314 25061 7813 1 11 . 1 1 129 129 LEU CA C 129 55.158 55.158 54.767 0.391 25061 7814 1 11 . 1 1 129 129 LEU CB C 129 41.837 41.837 44.880 -3.043 25061 7815 1 11 . 1 1 129 129 LEU H H 129 8.147 8.147 8.326 -0.179 25061 7816 1 11 . 1 1 130 130 GLU N N 130 120.088 120.088 122.577 -2.489 25061 7817 1 11 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.456 -0.275 25061 7818 1 11 . 1 1 130 130 GLU C C 130 176.148 176.148 175.670 0.478 25061 7819 1 11 . 1 1 130 130 GLU CA C 130 56.726 56.726 56.659 0.067 25061 7820 1 11 . 1 1 130 130 GLU CB C 130 30.026 30.026 29.705 0.321 25061 7821 1 11 . 1 1 130 130 GLU H H 130 8.242 8.242 8.557 -0.315 25061 7822 1 12 . 1 1 2 2 GLY CA C 2 45.319 45.319 45.278 0.041 25061 7823 1 12 . 1 1 3 3 THR HA H 3 4.820 4.820 5.415 -0.595 25061 7824 1 12 . 1 1 3 3 THR C C 3 172.374 172.374 173.422 -1.048 25061 7825 1 12 . 1 1 3 3 THR CA C 3 62.760 62.760 60.905 1.855 25061 7826 1 12 . 1 1 3 3 THR CB C 3 71.441 71.441 72.622 -1.181 25061 7827 1 12 . 1 1 4 4 VAL N N 4 126.881 126.881 125.620 1.261 25061 7828 1 12 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.269 0.299 25061 7829 1 12 . 1 1 4 4 VAL C C 4 173.116 173.116 174.651 -1.535 25061 7830 1 12 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.663 -1.208 25061 7831 1 12 . 1 1 4 4 VAL CB C 4 33.800 33.800 32.576 1.224 25061 7832 1 12 . 1 1 4 4 VAL H H 4 9.097 9.097 8.773 0.324 25061 7833 1 12 . 1 1 5 5 VAL N N 5 127.172 127.172 125.445 1.727 25061 7834 1 12 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.320 -0.433 25061 7835 1 12 . 1 1 5 5 VAL C C 5 174.091 174.091 175.045 -0.954 25061 7836 1 12 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.873 0.245 25061 7837 1 12 . 1 1 5 5 VAL CB C 5 32.935 32.935 32.757 0.178 25061 7838 1 12 . 1 1 5 5 VAL H H 5 8.811 8.811 8.536 0.275 25061 7839 1 12 . 1 1 6 6 ILE N N 6 127.577 127.577 127.659 -0.082 25061 7840 1 12 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.481 0.139 25061 7841 1 12 . 1 1 6 6 ILE C C 6 173.328 173.328 175.616 -2.288 25061 7842 1 12 . 1 1 6 6 ILE CA C 6 59.832 59.832 58.499 1.333 25061 7843 1 12 . 1 1 6 6 ILE CB C 6 39.930 39.930 37.355 2.575 25061 7844 1 12 . 1 1 6 6 ILE H H 6 9.210 9.210 8.411 0.799 25061 7845 1 12 . 1 1 7 7 VAL N N 7 129.024 129.024 129.400 -0.376 25061 7846 1 12 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.793 0.012 25061 7847 1 12 . 1 1 7 7 VAL C C 7 173.561 173.561 175.291 -1.730 25061 7848 1 12 . 1 1 7 7 VAL CA C 7 60.849 60.849 61.712 -0.863 25061 7849 1 12 . 1 1 7 7 VAL CB C 7 32.360 32.360 32.073 0.287 25061 7850 1 12 . 1 1 7 7 VAL H H 7 9.294 9.294 8.267 1.027 25061 7851 1 12 . 1 1 8 8 VAL N N 8 125.318 125.318 128.229 -2.911 25061 7852 1 12 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.491 -0.095 25061 7853 1 12 . 1 1 8 8 VAL C C 8 175.723 175.723 174.907 0.816 25061 7854 1 12 . 1 1 8 8 VAL CA C 8 59.617 59.617 60.383 -0.766 25061 7855 1 12 . 1 1 8 8 VAL CB C 8 34.915 34.915 35.534 -0.619 25061 7856 1 12 . 1 1 8 8 VAL H H 8 8.898 8.898 8.476 0.422 25061 7857 1 12 . 1 1 9 9 SER N N 9 116.544 116.544 118.207 -1.663 25061 7858 1 12 . 1 1 9 9 SER HA H 9 4.724 4.724 4.928 -0.204 25061 7859 1 12 . 1 1 9 9 SER C C 9 174.552 174.552 173.835 0.717 25061 7860 1 12 . 1 1 9 9 SER CA C 9 57.419 57.419 56.656 0.763 25061 7861 1 12 . 1 1 9 9 SER CB C 9 64.998 64.998 65.171 -0.173 25061 7862 1 12 . 1 1 9 9 SER H H 9 7.833 7.833 8.143 -0.310 25061 7863 1 12 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.682 0.230 25061 7864 1 12 . 1 1 10 10 ASN C C 10 176.170 176.170 174.666 1.504 25061 7865 1 12 . 1 1 10 10 ASN CA C 10 54.141 54.141 53.709 0.431 25061 7866 1 12 . 1 1 10 10 ASN CB C 10 38.626 38.626 38.510 0.116 25061 7867 1 12 . 1 1 11 11 ASP N N 11 120.164 120.164 119.350 0.814 25061 7868 1 12 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.863 -0.020 25061 7869 1 12 . 1 1 11 11 ASP C C 11 176.148 176.148 175.982 0.166 25061 7870 1 12 . 1 1 11 11 ASP CA C 11 52.620 52.620 53.015 -0.395 25061 7871 1 12 . 1 1 11 11 ASP CB C 11 42.631 42.631 43.622 -0.991 25061 7872 1 12 . 1 1 11 11 ASP H H 11 8.142 8.142 7.516 0.626 25061 7873 1 12 . 1 1 12 12 GLU N N 12 127.184 127.184 124.494 2.690 25061 7874 1 12 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.091 -0.238 25061 7875 1 12 . 1 1 12 12 GLU C C 12 177.853 177.853 178.140 -0.287 25061 7876 1 12 . 1 1 12 12 GLU CA C 12 59.547 59.547 59.463 0.084 25061 7877 1 12 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.901 -0.082 25061 7878 1 12 . 1 1 12 12 GLU H H 12 9.152 9.152 8.816 0.336 25061 7879 1 12 . 1 1 13 13 ARG N N 13 119.026 119.026 119.657 -0.631 25061 7880 1 12 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.130 -0.027 25061 7881 1 12 . 1 1 13 13 ARG C C 13 179.151 179.151 178.801 0.350 25061 7882 1 12 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.908 0.035 25061 7883 1 12 . 1 1 13 13 ARG CB C 13 28.757 28.757 29.929 -1.172 25061 7884 1 12 . 1 1 13 13 ARG H H 13 8.389 8.389 7.660 0.729 25061 7885 1 12 . 1 1 14 14 ILE N N 14 119.238 119.238 120.609 -1.371 25061 7886 1 12 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.858 -0.258 25061 7887 1 12 . 1 1 14 14 ILE C C 14 177.905 177.905 177.801 0.104 25061 7888 1 12 . 1 1 14 14 ILE CA C 14 64.666 64.666 63.433 1.233 25061 7889 1 12 . 1 1 14 14 ILE CB C 14 36.780 36.780 37.067 -0.287 25061 7890 1 12 . 1 1 14 14 ILE H H 14 7.254 7.254 8.153 -0.899 25061 7891 1 12 . 1 1 15 15 LEU N N 15 117.008 117.008 119.388 -2.380 25061 7892 1 12 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.116 -0.195 25061 7893 1 12 . 1 1 15 15 LEU C C 15 178.062 178.062 179.075 -1.013 25061 7894 1 12 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.175 0.236 25061 7895 1 12 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.456 -0.287 25061 7896 1 12 . 1 1 15 15 LEU H H 15 7.412 7.412 7.509 -0.097 25061 7897 1 12 . 1 1 16 16 GLU N N 16 117.637 117.637 119.700 -2.063 25061 7898 1 12 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.811 -0.110 25061 7899 1 12 . 1 1 16 16 GLU C C 16 179.182 179.182 178.717 0.465 25061 7900 1 12 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.539 -0.122 25061 7901 1 12 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.540 -0.081 25061 7902 1 12 . 1 1 16 16 GLU H H 16 7.981 7.981 7.931 0.050 25061 7903 1 12 . 1 1 17 17 GLU N N 17 119.759 119.759 120.580 -0.821 25061 7904 1 12 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.051 -0.035 25061 7905 1 12 . 1 1 17 17 GLU C C 17 179.949 179.949 179.219 0.730 25061 7906 1 12 . 1 1 17 17 GLU CA C 17 59.195 59.195 58.871 0.324 25061 7907 1 12 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.361 0.179 25061 7908 1 12 . 1 1 17 17 GLU H H 17 8.248 8.248 7.984 0.264 25061 7909 1 12 . 1 1 18 18 LEU N N 18 119.764 119.764 119.367 0.397 25061 7910 1 12 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.192 -0.111 25061 7911 1 12 . 1 1 18 18 LEU C C 18 177.620 177.620 178.959 -1.339 25061 7912 1 12 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.598 0.080 25061 7913 1 12 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.655 -0.545 25061 7914 1 12 . 1 1 18 18 LEU H H 18 8.486 8.486 7.945 0.541 25061 7915 1 12 . 1 1 19 19 LEU N N 19 123.102 123.102 120.566 2.536 25061 7916 1 12 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.543 0.119 25061 7917 1 12 . 1 1 19 19 LEU C C 19 178.343 178.343 178.298 0.045 25061 7918 1 12 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.273 0.963 25061 7919 1 12 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.339 -0.688 25061 7920 1 12 . 1 1 19 19 LEU H H 19 7.870 7.870 7.467 0.403 25061 7921 1 12 . 1 1 20 20 GLU N N 20 117.884 117.884 118.461 -0.577 25061 7922 1 12 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.995 -0.091 25061 7923 1 12 . 1 1 20 20 GLU C C 20 177.707 177.707 179.129 -1.422 25061 7924 1 12 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.403 -0.011 25061 7925 1 12 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.447 -0.470 25061 7926 1 12 . 1 1 20 20 GLU H H 20 7.497 7.497 7.614 -0.117 25061 7927 1 12 . 1 1 21 21 VAL N N 21 117.709 117.709 119.646 -1.937 25061 7928 1 12 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.681 -0.057 25061 7929 1 12 . 1 1 21 21 VAL C C 21 178.523 178.523 177.954 0.569 25061 7930 1 12 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.687 -0.490 25061 7931 1 12 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.355 -0.208 25061 7932 1 12 . 1 1 21 21 VAL H H 21 7.514 7.514 7.670 -0.156 25061 7933 1 12 . 1 1 22 22 VAL N N 22 121.233 121.233 119.320 1.913 25061 7934 1 12 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.736 -0.290 25061 7935 1 12 . 1 1 22 22 VAL C C 22 176.868 176.868 177.538 -0.670 25061 7936 1 12 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.683 0.330 25061 7937 1 12 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.722 -0.408 25061 7938 1 12 . 1 1 22 22 VAL H H 22 7.863 7.863 7.370 0.493 25061 7939 1 12 . 1 1 23 23 LEU N N 23 118.101 118.101 119.044 -0.943 25061 7940 1 12 . 1 1 23 23 LEU HA H 23 4.065 4.065 3.941 0.124 25061 7941 1 12 . 1 1 23 23 LEU C C 23 179.701 179.701 178.224 1.477 25061 7942 1 12 . 1 1 23 23 LEU CA C 23 57.296 57.296 58.051 -0.755 25061 7943 1 12 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.777 -0.073 25061 7944 1 12 . 1 1 23 23 LEU H H 23 8.151 8.151 7.928 0.223 25061 7945 1 12 . 1 1 24 24 LYS N N 24 114.622 114.622 114.809 -0.187 25061 7946 1 12 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.111 0.026 25061 7947 1 12 . 1 1 24 24 LYS C C 24 178.062 178.062 178.603 -0.541 25061 7948 1 12 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.068 -0.700 25061 7949 1 12 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.409 0.185 25061 7950 1 12 . 1 1 24 24 LYS H H 24 7.823 7.823 7.997 -0.174 25061 7951 1 12 . 1 1 25 25 SER N N 25 115.474 115.474 116.841 -1.367 25061 7952 1 12 . 1 1 25 25 SER HA H 25 4.377 4.377 4.346 0.031 25061 7953 1 12 . 1 1 25 25 SER C C 25 174.520 174.520 174.488 0.032 25061 7954 1 12 . 1 1 25 25 SER CA C 25 61.049 61.049 60.694 0.354 25061 7955 1 12 . 1 1 25 25 SER CB C 25 63.777 63.777 64.397 -0.619 25061 7956 1 12 . 1 1 25 25 SER H H 25 7.798 7.798 7.788 0.010 25061 7957 1 12 . 1 1 26 26 ASP N N 26 117.424 117.424 117.690 -0.266 25061 7958 1 12 . 1 1 26 26 ASP HA H 26 4.886 4.886 4.999 -0.113 25061 7959 1 12 . 1 1 26 26 ASP C C 26 173.521 173.521 174.353 -0.832 25061 7960 1 12 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.847 -0.799 25061 7961 1 12 . 1 1 26 26 ASP CB C 26 42.202 42.202 43.183 -0.981 25061 7962 1 12 . 1 1 26 26 ASP H H 26 7.990 7.990 7.953 0.037 25061 7963 1 12 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.555 0.090 25061 7964 1 12 . 1 1 27 27 PRO C C 27 177.016 177.016 176.513 0.503 25061 7965 1 12 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.803 -0.202 25061 7966 1 12 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.596 -0.423 25061 7967 1 12 . 1 1 28 28 ASN N N 28 115.839 115.839 116.242 -0.403 25061 7968 1 12 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.545 0.147 25061 7969 1 12 . 1 1 28 28 ASN C C 28 175.701 175.701 175.445 0.256 25061 7970 1 12 . 1 1 28 28 ASN CA C 28 53.472 53.472 54.717 -1.245 25061 7971 1 12 . 1 1 28 28 ASN CB C 28 39.213 39.213 38.536 0.677 25061 7972 1 12 . 1 1 28 28 ASN H H 28 8.608 8.608 8.375 0.233 25061 7973 1 12 . 1 1 29 29 VAL N N 29 120.770 120.770 120.541 0.229 25061 7974 1 12 . 1 1 29 29 VAL HA H 29 3.815 3.815 4.082 -0.267 25061 7975 1 12 . 1 1 29 29 VAL C C 29 175.023 175.023 175.651 -0.628 25061 7976 1 12 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.209 -0.657 25061 7977 1 12 . 1 1 29 29 VAL CB C 29 32.147 32.147 31.287 0.860 25061 7978 1 12 . 1 1 29 29 VAL H H 29 7.428 7.428 7.414 0.014 25061 7979 1 12 . 1 1 30 30 LYS N N 30 127.345 127.345 129.452 -2.107 25061 7980 1 12 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.314 0.165 25061 7981 1 12 . 1 1 30 30 LYS C C 30 174.777 174.777 176.306 -1.529 25061 7982 1 12 . 1 1 30 30 LYS CA C 30 55.204 55.204 55.790 -0.586 25061 7983 1 12 . 1 1 30 30 LYS CB C 30 31.949 31.949 32.893 -0.944 25061 7984 1 12 . 1 1 30 30 LYS H H 30 8.457 8.457 8.122 0.335 25061 7985 1 12 . 1 1 31 31 THR N N 31 113.552 113.552 118.314 -4.762 25061 7986 1 12 . 1 1 31 31 THR HA H 31 5.723 5.723 4.996 0.727 25061 7987 1 12 . 1 1 31 31 THR C C 31 174.593 174.593 174.588 0.005 25061 7988 1 12 . 1 1 31 31 THR CA C 31 59.030 59.030 60.711 -1.681 25061 7989 1 12 . 1 1 31 31 THR CB C 31 72.206 72.206 69.470 2.736 25061 7990 1 12 . 1 1 31 31 THR H H 31 8.164 8.164 8.295 -0.131 25061 7991 1 12 . 1 1 32 32 VAL N N 32 119.206 119.206 128.246 -9.040 25061 7992 1 12 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.447 -0.042 25061 7993 1 12 . 1 1 32 32 VAL C C 32 172.663 172.663 174.265 -1.602 25061 7994 1 12 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.679 -0.607 25061 7995 1 12 . 1 1 32 32 VAL CB C 32 35.051 35.051 34.264 0.787 25061 7996 1 12 . 1 1 32 32 VAL H H 32 8.615 8.615 8.814 -0.199 25061 7997 1 12 . 1 1 33 33 ARG N N 33 130.278 130.278 126.824 3.454 25061 7998 1 12 . 1 1 33 33 ARG HA H 33 5.331 5.331 5.109 0.222 25061 7999 1 12 . 1 1 33 33 ARG C C 33 173.836 173.836 175.746 -1.910 25061 8000 1 12 . 1 1 33 33 ARG CA C 33 54.150 54.150 54.989 -0.839 25061 8001 1 12 . 1 1 33 33 ARG CB C 33 30.028 30.028 30.858 -0.830 25061 8002 1 12 . 1 1 33 33 ARG H H 33 8.996 8.996 8.742 0.254 25061 8003 1 12 . 1 1 34 34 THR N N 34 121.695 121.695 117.561 4.134 25061 8004 1 12 . 1 1 34 34 THR HA H 34 4.483 4.483 4.303 0.180 25061 8005 1 12 . 1 1 34 34 THR C C 34 169.769 169.769 172.823 -3.054 25061 8006 1 12 . 1 1 34 34 THR CA C 34 60.814 60.814 62.393 -1.579 25061 8007 1 12 . 1 1 34 34 THR CB C 34 67.402 67.402 70.285 -2.883 25061 8008 1 12 . 1 1 34 34 THR H H 34 8.126 8.126 8.229 -0.103 25061 8009 1 12 . 1 1 35 35 ASP N N 35 122.198 122.198 127.007 -4.809 25061 8010 1 12 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.628 0.196 25061 8011 1 12 . 1 1 35 35 ASP C C 35 174.790 174.790 175.152 -0.362 25061 8012 1 12 . 1 1 35 35 ASP CA C 35 53.386 53.386 53.942 -0.556 25061 8013 1 12 . 1 1 35 35 ASP CB C 35 41.848 41.848 40.314 1.534 25061 8014 1 12 . 1 1 35 35 ASP H H 35 7.983 7.983 8.425 -0.442 25061 8015 1 12 . 1 1 36 36 ASP N N 36 121.091 121.091 125.652 -4.561 25061 8016 1 12 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.479 0.114 25061 8017 1 12 . 1 1 36 36 ASP C C 36 176.189 176.189 176.310 -0.121 25061 8018 1 12 . 1 1 36 36 ASP CA C 36 53.055 53.055 53.551 -0.496 25061 8019 1 12 . 1 1 36 36 ASP CB C 36 42.159 42.159 41.886 0.273 25061 8020 1 12 . 1 1 36 36 ASP H H 36 8.157 8.157 8.042 0.115 25061 8021 1 12 . 1 1 37 37 LYS N N 37 125.839 125.839 116.902 8.937 25061 8022 1 12 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.684 0.038 25061 8023 1 12 . 1 1 37 37 LYS C C 37 176.870 176.870 177.624 -0.754 25061 8024 1 12 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.623 -0.219 25061 8025 1 12 . 1 1 37 37 LYS CB C 37 32.394 32.394 30.427 1.967 25061 8026 1 12 . 1 1 37 37 LYS H H 37 8.843 8.843 8.387 0.456 25061 8027 1 12 . 1 1 38 38 GLU N N 38 118.369 118.369 119.843 -1.474 25061 8028 1 12 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.844 0.163 25061 8029 1 12 . 1 1 38 38 GLU C C 38 179.502 179.502 178.068 1.434 25061 8030 1 12 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.812 -0.142 25061 8031 1 12 . 1 1 38 38 GLU CB C 38 28.474 28.474 29.230 -0.756 25061 8032 1 12 . 1 1 38 38 GLU H H 38 8.182 8.182 8.202 -0.020 25061 8033 1 12 . 1 1 39 39 LYS N N 39 121.722 121.722 120.313 1.409 25061 8034 1 12 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.224 -0.059 25061 8035 1 12 . 1 1 39 39 LYS C C 39 178.500 178.500 178.366 0.134 25061 8036 1 12 . 1 1 39 39 LYS CA C 39 57.736 57.736 59.059 -1.323 25061 8037 1 12 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.441 -1.304 25061 8038 1 12 . 1 1 39 39 LYS H H 39 7.524 7.524 7.601 -0.077 25061 8039 1 12 . 1 1 40 40 VAL N N 40 117.199 117.199 118.694 -1.495 25061 8040 1 12 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.687 -0.459 25061 8041 1 12 . 1 1 40 40 VAL C C 40 177.362 177.362 178.115 -0.753 25061 8042 1 12 . 1 1 40 40 VAL CA C 40 67.642 67.642 65.908 1.734 25061 8043 1 12 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.149 -0.246 25061 8044 1 12 . 1 1 40 40 VAL H H 40 7.883 7.883 7.579 0.304 25061 8045 1 12 . 1 1 41 41 LYS N N 41 117.677 117.677 118.693 -1.016 25061 8046 1 12 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.556 -0.114 25061 8047 1 12 . 1 1 41 41 LYS C C 41 177.686 177.686 178.483 -0.797 25061 8048 1 12 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.404 1.405 25061 8049 1 12 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.360 0.255 25061 8050 1 12 . 1 1 41 41 LYS H H 41 7.567 7.567 7.406 0.161 25061 8051 1 12 . 1 1 42 42 GLU N N 42 118.369 118.369 118.373 -0.004 25061 8052 1 12 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.270 -0.263 25061 8053 1 12 . 1 1 42 42 GLU C C 42 179.725 179.725 178.851 0.874 25061 8054 1 12 . 1 1 42 42 GLU CA C 42 59.069 59.069 58.794 0.275 25061 8055 1 12 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.155 0.384 25061 8056 1 12 . 1 1 42 42 GLU H H 42 7.634 7.634 7.539 0.095 25061 8057 1 12 . 1 1 43 43 GLU N N 43 117.906 117.906 119.031 -1.125 25061 8058 1 12 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.171 0.012 25061 8059 1 12 . 1 1 43 43 GLU C C 43 179.757 179.757 179.026 0.731 25061 8060 1 12 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.171 0.195 25061 8061 1 12 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.121 -0.280 25061 8062 1 12 . 1 1 43 43 GLU H H 43 8.162 8.162 7.544 0.618 25061 8063 1 12 . 1 1 44 44 ILE N N 44 122.291 122.291 120.449 1.842 25061 8064 1 12 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.716 -0.104 25061 8065 1 12 . 1 1 44 44 ILE C C 44 177.101 177.101 177.688 -0.587 25061 8066 1 12 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.525 0.830 25061 8067 1 12 . 1 1 44 44 ILE CB C 44 37.460 37.460 38.023 -0.563 25061 8068 1 12 . 1 1 44 44 ILE H H 44 8.742 8.742 7.601 1.141 25061 8069 1 12 . 1 1 45 45 GLU N N 45 119.892 119.892 118.972 0.920 25061 8070 1 12 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.100 -0.042 25061 8071 1 12 . 1 1 45 45 GLU C C 45 178.991 178.991 178.807 0.184 25061 8072 1 12 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.147 0.518 25061 8073 1 12 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.160 0.001 25061 8074 1 12 . 1 1 45 45 GLU H H 45 8.171 8.171 7.966 0.205 25061 8075 1 12 . 1 1 46 46 LYS N N 46 118.064 118.064 119.723 -1.659 25061 8076 1 12 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.107 -0.125 25061 8077 1 12 . 1 1 46 46 LYS C C 46 178.837 178.837 178.928 -0.091 25061 8078 1 12 . 1 1 46 46 LYS CA C 46 59.741 59.741 58.826 0.915 25061 8079 1 12 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.261 0.182 25061 8080 1 12 . 1 1 46 46 LYS H H 46 7.785 7.785 7.502 0.283 25061 8081 1 12 . 1 1 47 47 ALA N N 47 121.817 121.817 122.341 -0.524 25061 8082 1 12 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.012 0.019 25061 8083 1 12 . 1 1 47 47 ALA C C 47 179.859 179.859 179.298 0.561 25061 8084 1 12 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.382 -0.087 25061 8085 1 12 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.471 -0.815 25061 8086 1 12 . 1 1 47 47 ALA H H 47 8.123 8.123 7.647 0.476 25061 8087 1 12 . 1 1 48 48 ARG N N 48 119.080 119.080 117.392 1.688 25061 8088 1 12 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.032 0.057 25061 8089 1 12 . 1 1 48 48 ARG C C 48 180.155 180.155 178.585 1.570 25061 8090 1 12 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.928 0.269 25061 8091 1 12 . 1 1 48 48 ARG CB C 48 29.510 29.510 30.065 -0.555 25061 8092 1 12 . 1 1 48 48 ARG H H 48 8.768 8.768 7.793 0.975 25061 8093 1 12 . 1 1 49 49 LYS N N 49 119.951 119.951 118.473 1.478 25061 8094 1 12 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.136 -0.097 25061 8095 1 12 . 1 1 49 49 LYS C C 49 178.288 178.288 178.712 -0.424 25061 8096 1 12 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.321 0.516 25061 8097 1 12 . 1 1 49 49 LYS CB C 49 32.143 32.143 31.672 0.471 25061 8098 1 12 . 1 1 49 49 LYS H H 49 8.037 8.037 7.524 0.513 25061 8099 1 12 . 1 1 50 50 GLN N N 50 115.284 115.284 118.829 -3.545 25061 8100 1 12 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.364 -0.022 25061 8101 1 12 . 1 1 50 50 GLN C C 50 176.180 176.180 176.507 -0.327 25061 8102 1 12 . 1 1 50 50 GLN CA C 50 55.741 55.741 55.342 0.399 25061 8103 1 12 . 1 1 50 50 GLN CB C 50 29.565 29.565 28.954 0.611 25061 8104 1 12 . 1 1 50 50 GLN H H 50 7.740 7.740 7.839 -0.099 25061 8105 1 12 . 1 1 51 51 GLY N N 51 109.725 109.725 107.783 1.942 25061 8106 1 12 . 1 1 51 51 GLY C C 51 174.552 174.552 173.940 0.612 25061 8107 1 12 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.120 1.242 25061 8108 1 12 . 1 1 51 51 GLY H H 51 8.027 8.027 7.595 0.432 25061 8109 1 12 . 1 1 52 52 ARG N N 52 119.064 119.064 119.244 -0.180 25061 8110 1 12 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.940 -0.043 25061 8111 1 12 . 1 1 52 52 ARG C C 52 173.123 173.123 173.643 -0.520 25061 8112 1 12 . 1 1 52 52 ARG CA C 52 52.247 52.247 52.695 -0.448 25061 8113 1 12 . 1 1 52 52 ARG CB C 52 32.366 32.366 30.953 1.413 25061 8114 1 12 . 1 1 52 52 ARG H H 52 7.969 7.969 7.837 0.132 25061 8115 1 12 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.559 0.296 25061 8116 1 12 . 1 1 53 53 PRO C C 53 174.069 174.069 175.588 -1.519 25061 8117 1 12 . 1 1 53 53 PRO CA C 53 61.818 61.818 61.913 -0.095 25061 8118 1 12 . 1 1 53 53 PRO CB C 53 32.060 32.060 33.185 -1.125 25061 8119 1 12 . 1 1 54 54 ILE N N 54 116.301 116.301 117.212 -0.911 25061 8120 1 12 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.708 0.530 25061 8121 1 12 . 1 1 54 54 ILE C C 54 171.709 171.709 173.538 -1.829 25061 8122 1 12 . 1 1 54 54 ILE CA C 54 57.774 57.774 60.016 -2.241 25061 8123 1 12 . 1 1 54 54 ILE CB C 54 41.558 41.558 41.594 -0.037 25061 8124 1 12 . 1 1 54 54 ILE H H 54 7.920 7.920 7.875 0.045 25061 8125 1 12 . 1 1 55 55 VAL N N 55 126.302 126.302 128.209 -1.907 25061 8126 1 12 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.171 -0.247 25061 8127 1 12 . 1 1 55 55 VAL C C 55 173.624 173.624 174.688 -1.064 25061 8128 1 12 . 1 1 55 55 VAL CA C 55 59.795 59.795 59.903 -0.108 25061 8129 1 12 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.705 0.123 25061 8130 1 12 . 1 1 55 55 VAL H H 55 8.652 8.652 8.849 -0.197 25061 8131 1 12 . 1 1 56 56 ILE N N 56 127.503 127.503 127.971 -0.468 25061 8132 1 12 . 1 1 56 56 ILE HA H 56 4.664 4.664 5.061 -0.397 25061 8133 1 12 . 1 1 56 56 ILE C C 56 173.479 173.479 175.147 -1.668 25061 8134 1 12 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.260 0.747 25061 8135 1 12 . 1 1 56 56 ILE CB C 56 40.285 40.285 38.738 1.547 25061 8136 1 12 . 1 1 56 56 ILE H H 56 9.124 9.124 8.115 1.009 25061 8137 1 12 . 1 1 57 57 PHE N N 57 125.302 125.302 127.644 -2.342 25061 8138 1 12 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.412 -0.196 25061 8139 1 12 . 1 1 57 57 PHE C C 57 174.536 174.536 175.211 -0.675 25061 8140 1 12 . 1 1 57 57 PHE CA C 57 56.961 56.961 56.838 0.123 25061 8141 1 12 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.892 0.538 25061 8142 1 12 . 1 1 57 57 PHE H H 57 8.971 8.971 8.670 0.301 25061 8143 1 12 . 1 1 58 58 ILE N N 58 126.472 126.472 122.934 3.538 25061 8144 1 12 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.576 -0.061 25061 8145 1 12 . 1 1 58 58 ILE C C 58 173.391 173.391 175.189 -1.798 25061 8146 1 12 . 1 1 58 58 ILE CA C 58 59.090 59.090 58.762 0.328 25061 8147 1 12 . 1 1 58 58 ILE CB C 58 41.742 41.742 41.669 0.073 25061 8148 1 12 . 1 1 58 58 ILE H H 58 9.248 9.248 8.884 0.364 25061 8149 1 12 . 1 1 59 59 ARG N N 59 124.681 124.681 124.151 0.530 25061 8150 1 12 . 1 1 59 59 ARG HA H 59 4.929 4.929 4.940 -0.011 25061 8151 1 12 . 1 1 59 59 ARG C C 59 178.521 178.521 177.973 0.548 25061 8152 1 12 . 1 1 59 59 ARG CA C 59 55.742 55.742 55.886 -0.145 25061 8153 1 12 . 1 1 59 59 ARG CB C 59 30.918 30.918 32.699 -1.781 25061 8154 1 12 . 1 1 59 59 ARG H H 59 8.587 8.587 8.799 -0.212 25061 8155 1 12 . 1 1 60 60 GLY N N 60 108.848 108.848 110.394 -1.546 25061 8156 1 12 . 1 1 60 60 GLY C C 60 174.775 174.775 174.450 0.325 25061 8157 1 12 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.170 -0.203 25061 8158 1 12 . 1 1 60 60 GLY H H 60 7.732 7.732 8.551 -0.819 25061 8159 1 12 . 1 1 61 61 ALA N N 61 120.877 120.877 122.869 -1.992 25061 8160 1 12 . 1 1 61 61 ALA HA H 61 4.144 4.144 4.180 -0.036 25061 8161 1 12 . 1 1 61 61 ALA C C 61 177.769 177.769 179.639 -1.870 25061 8162 1 12 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.682 -0.233 25061 8163 1 12 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.428 -0.057 25061 8164 1 12 . 1 1 61 61 ALA H H 61 7.852 7.852 7.949 -0.097 25061 8165 1 12 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.263 0.537 25061 8166 1 12 . 1 1 62 62 TYR CA C 62 63.039 63.039 58.726 4.313 25061 8167 1 12 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.721 -0.281 25061 8168 1 12 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.834 -0.149 25061 8169 1 12 . 1 1 63 63 GLU C C 63 176.251 176.251 178.240 -1.989 25061 8170 1 12 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.523 -0.265 25061 8171 1 12 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.151 0.261 25061 8172 1 12 . 1 1 64 64 GLU N N 64 119.209 119.209 118.892 0.317 25061 8173 1 12 . 1 1 64 64 GLU HA H 64 3.901 3.901 2.868 1.033 25061 8174 1 12 . 1 1 64 64 GLU C C 64 178.251 178.251 178.502 -0.251 25061 8175 1 12 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.210 1.002 25061 8176 1 12 . 1 1 64 64 GLU CB C 64 28.645 28.645 28.433 0.212 25061 8177 1 12 . 1 1 64 64 GLU H H 64 8.878 8.878 7.823 1.055 25061 8178 1 12 . 1 1 65 65 VAL N N 65 116.728 116.728 119.525 -2.797 25061 8179 1 12 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.768 0.214 25061 8180 1 12 . 1 1 65 65 VAL C C 65 176.915 176.915 177.588 -0.673 25061 8181 1 12 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.555 -0.946 25061 8182 1 12 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.660 0.235 25061 8183 1 12 . 1 1 65 65 VAL H H 65 7.652 7.652 8.013 -0.361 25061 8184 1 12 . 1 1 66 66 VAL N N 66 119.462 119.462 119.462 0.000 25061 8185 1 12 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.717 -0.403 25061 8186 1 12 . 1 1 66 66 VAL C C 66 177.142 177.142 177.774 -0.632 25061 8187 1 12 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.330 1.005 25061 8188 1 12 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.155 0.275 25061 8189 1 12 . 1 1 66 66 VAL H H 66 7.896 7.896 7.910 -0.014 25061 8190 1 12 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.077 -0.449 25061 8191 1 12 . 1 1 67 67 ARG C C 67 177.841 177.841 178.236 -0.395 25061 8192 1 12 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.793 0.259 25061 8193 1 12 . 1 1 67 67 ARG CB C 67 29.393 29.393 29.980 -0.587 25061 8194 1 12 . 1 1 68 68 ASP N N 68 118.316 118.316 120.233 -1.917 25061 8195 1 12 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.527 -0.166 25061 8196 1 12 . 1 1 68 68 ASP C C 68 178.945 178.945 178.532 0.413 25061 8197 1 12 . 1 1 68 68 ASP CA C 68 57.311 57.311 57.244 0.067 25061 8198 1 12 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.706 0.808 25061 8199 1 12 . 1 1 68 68 ASP H H 68 7.625 7.625 7.979 -0.354 25061 8200 1 12 . 1 1 69 69 ILE N N 69 119.231 119.231 120.245 -1.014 25061 8201 1 12 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.660 -0.030 25061 8202 1 12 . 1 1 69 69 ILE C C 69 177.138 177.138 178.079 -0.941 25061 8203 1 12 . 1 1 69 69 ILE CA C 69 64.540 64.540 65.439 -0.899 25061 8204 1 12 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.986 -0.936 25061 8205 1 12 . 1 1 69 69 ILE H H 69 8.113 8.113 7.587 0.526 25061 8206 1 12 . 1 1 70 70 VAL N N 70 120.164 120.164 119.645 0.519 25061 8207 1 12 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.594 -0.177 25061 8208 1 12 . 1 1 70 70 VAL C C 70 177.079 177.079 177.670 -0.591 25061 8209 1 12 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.368 -0.094 25061 8210 1 12 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.474 -0.216 25061 8211 1 12 . 1 1 70 70 VAL H H 70 8.478 8.478 8.288 0.190 25061 8212 1 12 . 1 1 71 71 GLU N N 71 118.293 118.293 120.257 -1.964 25061 8213 1 12 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.900 0.154 25061 8214 1 12 . 1 1 71 71 GLU C C 71 179.009 179.009 178.456 0.553 25061 8215 1 12 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.746 -0.330 25061 8216 1 12 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.667 -0.845 25061 8217 1 12 . 1 1 71 71 GLU H H 71 8.152 8.152 8.034 0.118 25061 8218 1 12 . 1 1 72 72 TYR N N 72 120.091 120.091 120.535 -0.444 25061 8219 1 12 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.067 0.095 25061 8220 1 12 . 1 1 72 72 TYR C C 72 176.404 176.404 177.295 -0.891 25061 8221 1 12 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.839 -0.707 25061 8222 1 12 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.380 -0.243 25061 8223 1 12 . 1 1 72 72 TYR H H 72 7.959 7.959 7.799 0.160 25061 8224 1 12 . 1 1 73 73 ALA N N 73 120.133 120.133 119.787 0.346 25061 8225 1 12 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.875 -0.245 25061 8226 1 12 . 1 1 73 73 ALA C C 73 179.182 179.182 179.163 0.019 25061 8227 1 12 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.191 -0.079 25061 8228 1 12 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.224 -0.033 25061 8229 1 12 . 1 1 73 73 ALA H H 73 8.604 8.604 7.937 0.667 25061 8230 1 12 . 1 1 74 74 GLN N N 74 115.553 115.553 117.741 -2.188 25061 8231 1 12 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.373 -0.235 25061 8232 1 12 . 1 1 74 74 GLN C C 74 180.595 180.595 178.288 2.307 25061 8233 1 12 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.361 0.734 25061 8234 1 12 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.955 -0.380 25061 8235 1 12 . 1 1 74 74 GLN H H 74 8.619 8.619 8.180 0.439 25061 8236 1 12 . 1 1 75 75 LYS N N 75 122.396 122.396 118.116 4.280 25061 8237 1 12 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.109 -0.081 25061 8238 1 12 . 1 1 75 75 LYS C C 75 178.521 178.521 178.629 -0.108 25061 8239 1 12 . 1 1 75 75 LYS CA C 75 59.058 59.058 57.467 1.591 25061 8240 1 12 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.909 -0.310 25061 8241 1 12 . 1 1 75 75 LYS H H 75 8.123 8.123 7.753 0.370 25061 8242 1 12 . 1 1 76 76 GLU N N 76 116.294 116.294 116.362 -0.068 25061 8243 1 12 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.192 -0.093 25061 8244 1 12 . 1 1 76 76 GLU C C 76 175.957 175.957 176.630 -0.673 25061 8245 1 12 . 1 1 76 76 GLU CA C 76 55.605 55.605 56.181 -0.576 25061 8246 1 12 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.132 0.692 25061 8247 1 12 . 1 1 76 76 GLU H H 76 7.450 7.450 7.628 -0.178 25061 8248 1 12 . 1 1 77 77 GLY N N 77 107.446 107.446 106.616 0.830 25061 8249 1 12 . 1 1 77 77 GLY C C 77 174.520 174.520 174.127 0.393 25061 8250 1 12 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.479 0.328 25061 8251 1 12 . 1 1 77 77 GLY H H 77 7.763 7.763 7.444 0.319 25061 8252 1 12 . 1 1 78 78 LEU N N 78 120.179 120.179 119.617 0.562 25061 8253 1 12 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.531 -0.143 25061 8254 1 12 . 1 1 78 78 LEU C C 78 175.914 175.914 176.033 -0.119 25061 8255 1 12 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.641 -0.168 25061 8256 1 12 . 1 1 78 78 LEU CB C 78 41.889 41.889 43.893 -2.004 25061 8257 1 12 . 1 1 78 78 LEU H H 78 7.930 7.930 7.765 0.165 25061 8258 1 12 . 1 1 79 79 ARG N N 79 122.207 122.207 124.173 -1.966 25061 8259 1 12 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.329 0.068 25061 8260 1 12 . 1 1 79 79 ARG C C 79 174.960 174.960 174.232 0.728 25061 8261 1 12 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.469 0.178 25061 8262 1 12 . 1 1 79 79 ARG CB C 79 30.476 30.476 30.943 -0.467 25061 8263 1 12 . 1 1 79 79 ARG H H 79 8.241 8.241 8.064 0.177 25061 8264 1 12 . 1 1 80 80 VAL N N 80 123.333 123.333 125.029 -1.696 25061 8265 1 12 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.665 0.630 25061 8266 1 12 . 1 1 80 80 VAL C C 80 174.048 174.048 174.220 -0.172 25061 8267 1 12 . 1 1 80 80 VAL CA C 80 60.041 60.041 60.756 -0.715 25061 8268 1 12 . 1 1 80 80 VAL CB C 80 34.305 34.305 33.310 0.995 25061 8269 1 12 . 1 1 80 80 VAL H H 80 8.359 8.359 8.459 -0.100 25061 8270 1 12 . 1 1 81 81 LEU N N 81 128.719 128.719 129.186 -0.467 25061 8271 1 12 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.164 -0.060 25061 8272 1 12 . 1 1 81 81 LEU C C 81 174.484 174.484 174.550 -0.066 25061 8273 1 12 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.540 0.580 25061 8274 1 12 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.402 -0.447 25061 8275 1 12 . 1 1 81 81 LEU H H 81 8.650 8.650 8.958 -0.308 25061 8276 1 12 . 1 1 82 82 VAL N N 82 122.487 122.487 124.607 -2.120 25061 8277 1 12 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.758 0.339 25061 8278 1 12 . 1 1 82 82 VAL C C 82 174.525 174.525 174.587 -0.062 25061 8279 1 12 . 1 1 82 82 VAL CA C 82 60.285 60.285 60.527 -0.242 25061 8280 1 12 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.298 2.491 25061 8281 1 12 . 1 1 82 82 VAL H H 82 8.781 8.781 8.409 0.372 25061 8282 1 12 . 1 1 83 83 ILE N N 83 128.082 128.082 129.348 -1.266 25061 8283 1 12 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.810 0.120 25061 8284 1 12 . 1 1 83 83 ILE C C 83 172.925 172.925 175.105 -2.180 25061 8285 1 12 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.598 -0.657 25061 8286 1 12 . 1 1 83 83 ILE CB C 83 40.186 40.186 37.672 2.514 25061 8287 1 12 . 1 1 83 83 ILE H H 83 9.527 9.527 8.369 1.158 25061 8288 1 12 . 1 1 84 84 LYS N N 84 128.493 128.493 127.119 1.374 25061 8289 1 12 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.372 -0.324 25061 8290 1 12 . 1 1 84 84 LYS C C 84 174.027 174.027 175.762 -1.735 25061 8291 1 12 . 1 1 84 84 LYS CA C 84 53.253 53.253 54.102 -0.849 25061 8292 1 12 . 1 1 84 84 LYS CB C 84 34.652 34.652 35.324 -0.672 25061 8293 1 12 . 1 1 84 84 LYS H H 84 8.721 8.721 8.895 -0.174 25061 8294 1 12 . 1 1 85 85 VAL N N 85 126.729 126.729 124.400 2.329 25061 8295 1 12 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.345 0.391 25061 8296 1 12 . 1 1 85 85 VAL C C 85 175.935 175.935 176.952 -1.017 25061 8297 1 12 . 1 1 85 85 VAL CA C 85 60.200 60.200 61.856 -1.656 25061 8298 1 12 . 1 1 85 85 VAL CB C 85 30.847 30.847 32.636 -1.789 25061 8299 1 12 . 1 1 85 85 VAL H H 85 8.643 8.643 8.280 0.363 25061 8300 1 12 . 1 1 86 86 ALA N N 86 132.930 132.930 131.444 1.486 25061 8301 1 12 . 1 1 86 86 ALA HA H 86 4.430 4.430 3.996 0.434 25061 8302 1 12 . 1 1 86 86 ALA C C 86 175.635 175.635 178.515 -2.880 25061 8303 1 12 . 1 1 86 86 ALA CA C 86 51.504 51.504 54.533 -3.029 25061 8304 1 12 . 1 1 86 86 ALA CB C 86 20.821 20.821 18.841 1.980 25061 8305 1 12 . 1 1 86 86 ALA H H 86 8.835 8.835 8.571 0.264 25061 8306 1 12 . 1 1 87 87 GLN N N 87 118.719 118.719 116.391 2.328 25061 8307 1 12 . 1 1 87 87 GLN HA H 87 4.469 4.469 3.831 0.638 25061 8308 1 12 . 1 1 87 87 GLN C C 87 175.949 175.949 177.468 -1.519 25061 8309 1 12 . 1 1 87 87 GLN CA C 87 55.260 55.260 58.361 -3.101 25061 8310 1 12 . 1 1 87 87 GLN CB C 87 30.432 30.432 26.311 4.120 25061 8311 1 12 . 1 1 87 87 GLN H H 87 8.570 8.570 8.360 0.210 25061 8312 1 12 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.408 0.072 25061 8313 1 12 . 1 1 88 88 ASP CA C 88 55.454 55.454 56.059 -0.605 25061 8314 1 12 . 1 1 88 88 ASP CB C 88 41.204 41.204 41.289 -0.085 25061 8315 1 12 . 1 1 89 89 GLN HA H 89 4.047 4.047 3.765 0.282 25061 8316 1 12 . 1 1 89 89 GLN CA C 89 56.687 56.687 58.388 -1.701 25061 8317 1 12 . 1 1 89 89 GLN CB C 89 27.850 27.850 26.979 0.871 25061 8318 1 12 . 1 1 92 92 LEU N N 92 125.291 125.291 120.923 4.368 25061 8319 1 12 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.061 0.140 25061 8320 1 12 . 1 1 92 92 LEU CA C 92 55.057 55.057 58.223 -3.166 25061 8321 1 12 . 1 1 92 92 LEU CB C 92 42.046 42.046 42.211 -0.165 25061 8322 1 12 . 1 1 92 92 LEU H H 92 8.277 8.277 8.432 -0.155 25061 8323 1 12 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.151 0.605 25061 8324 1 12 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.062 -0.013 25061 8325 1 12 . 1 1 94 94 ARG C C 94 178.544 178.544 178.607 -0.063 25061 8326 1 12 . 1 1 94 94 ARG CA C 94 58.607 58.607 59.871 -1.264 25061 8327 1 12 . 1 1 94 94 ARG CB C 94 29.614 29.614 30.079 -0.465 25061 8328 1 12 . 1 1 95 95 PHE N N 95 117.407 117.407 118.274 -0.867 25061 8329 1 12 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.366 0.009 25061 8330 1 12 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.171 0.060 25061 8331 1 12 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.278 -1.336 25061 8332 1 12 . 1 1 95 95 PHE H H 95 8.419 8.419 7.715 0.704 25061 8333 1 12 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.905 -0.097 25061 8334 1 12 . 1 1 96 96 TYR C C 96 177.728 177.728 177.035 0.693 25061 8335 1 12 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.539 1.617 25061 8336 1 12 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.230 -0.530 25061 8337 1 12 . 1 1 97 97 GLU N N 97 119.054 119.054 117.979 1.075 25061 8338 1 12 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.531 0.532 25061 8339 1 12 . 1 1 97 97 GLU C C 97 179.071 179.071 178.688 0.383 25061 8340 1 12 . 1 1 97 97 GLU CA C 97 58.760 58.760 59.176 -0.416 25061 8341 1 12 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.312 -0.140 25061 8342 1 12 . 1 1 97 97 GLU H H 97 7.858 7.858 8.190 -0.332 25061 8343 1 12 . 1 1 98 98 GLN N N 98 119.385 119.385 119.103 0.282 25061 8344 1 12 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.949 -0.048 25061 8345 1 12 . 1 1 98 98 GLN C C 98 177.599 177.599 178.556 -0.957 25061 8346 1 12 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.320 -0.009 25061 8347 1 12 . 1 1 98 98 GLN CB C 98 27.766 27.766 28.111 -0.345 25061 8348 1 12 . 1 1 98 98 GLN H H 98 7.747 7.747 7.549 0.198 25061 8349 1 12 . 1 1 99 99 LEU N N 99 118.348 118.348 119.960 -1.612 25061 8350 1 12 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.693 0.326 25061 8351 1 12 . 1 1 99 99 LEU C C 99 178.669 178.669 178.975 -0.306 25061 8352 1 12 . 1 1 99 99 LEU CA C 99 57.430 57.430 57.865 -0.435 25061 8353 1 12 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.378 0.125 25061 8354 1 12 . 1 1 99 99 LEU H H 99 7.891 7.891 7.663 0.228 25061 8355 1 12 . 1 1 100 100 LYS N N 100 118.332 118.332 117.352 0.980 25061 8356 1 12 . 1 1 100 100 LYS HA H 100 4.509 4.509 4.210 0.299 25061 8357 1 12 . 1 1 100 100 LYS C C 100 180.846 180.846 178.878 1.968 25061 8358 1 12 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.638 0.450 25061 8359 1 12 . 1 1 100 100 LYS CB C 100 32.269 32.269 32.098 0.171 25061 8360 1 12 . 1 1 100 100 LYS H H 100 7.560 7.560 7.274 0.286 25061 8361 1 12 . 1 1 101 101 LYS N N 101 121.944 121.944 119.446 2.498 25061 8362 1 12 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.105 -0.033 25061 8363 1 12 . 1 1 101 101 LYS C C 101 177.707 177.707 177.953 -0.246 25061 8364 1 12 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.296 0.575 25061 8365 1 12 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.421 -0.326 25061 8366 1 12 . 1 1 101 101 LYS H H 101 7.959 7.959 7.674 0.285 25061 8367 1 12 . 1 1 102 102 ASP N N 102 118.788 118.788 117.637 1.151 25061 8368 1 12 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.627 0.067 25061 8369 1 12 . 1 1 102 102 ASP C C 102 176.359 176.359 175.971 0.388 25061 8370 1 12 . 1 1 102 102 ASP CA C 102 54.579 54.579 54.313 0.266 25061 8371 1 12 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.206 -0.632 25061 8372 1 12 . 1 1 102 102 ASP H H 102 7.893 7.893 7.700 0.193 25061 8373 1 12 . 1 1 103 103 GLY N N 103 107.024 107.024 106.979 0.045 25061 8374 1 12 . 1 1 103 103 GLY C C 103 174.328 174.328 174.219 0.109 25061 8375 1 12 . 1 1 103 103 GLY CA C 103 45.345 45.345 45.108 0.237 25061 8376 1 12 . 1 1 103 103 GLY H H 103 7.866 7.866 7.413 0.453 25061 8377 1 12 . 1 1 104 104 VAL N N 104 123.060 123.060 118.260 4.800 25061 8378 1 12 . 1 1 104 104 VAL HA H 104 3.973 3.973 4.179 -0.206 25061 8379 1 12 . 1 1 104 104 VAL C C 104 175.023 175.023 174.357 0.666 25061 8380 1 12 . 1 1 104 104 VAL CA C 104 61.878 61.878 60.430 1.448 25061 8381 1 12 . 1 1 104 104 VAL CB C 104 32.088 32.088 33.965 -1.877 25061 8382 1 12 . 1 1 104 104 VAL H H 104 7.955 7.955 7.508 0.447 25061 8383 1 12 . 1 1 105 105 ASP N N 105 127.987 127.987 125.058 2.929 25061 8384 1 12 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.801 -0.226 25061 8385 1 12 . 1 1 105 105 ASP C C 105 173.624 173.624 174.658 -1.034 25061 8386 1 12 . 1 1 105 105 ASP CA C 105 54.087 54.087 54.265 -0.178 25061 8387 1 12 . 1 1 105 105 ASP CB C 105 40.660 40.660 42.818 -2.158 25061 8388 1 12 . 1 1 105 105 ASP H H 105 8.399 8.399 8.126 0.273 25061 8389 1 12 . 1 1 106 106 VAL N N 106 125.798 125.798 117.749 8.049 25061 8390 1 12 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.876 -0.061 25061 8391 1 12 . 1 1 106 106 VAL C C 106 174.902 174.902 174.321 0.581 25061 8392 1 12 . 1 1 106 106 VAL CA C 106 60.194 60.194 59.141 1.054 25061 8393 1 12 . 1 1 106 106 VAL CB C 106 34.179 34.179 35.183 -1.004 25061 8394 1 12 . 1 1 106 106 VAL H H 106 7.550 7.550 8.130 -0.580 25061 8395 1 12 . 1 1 107 107 ARG N N 107 128.099 128.099 125.785 2.314 25061 8396 1 12 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.819 0.057 25061 8397 1 12 . 1 1 107 107 ARG C C 107 173.815 173.815 175.143 -1.328 25061 8398 1 12 . 1 1 107 107 ARG CA C 107 53.386 53.386 54.736 -1.350 25061 8399 1 12 . 1 1 107 107 ARG CB C 107 31.195 31.195 32.412 -1.217 25061 8400 1 12 . 1 1 107 107 ARG H H 107 9.132 9.132 8.838 0.294 25061 8401 1 12 . 1 1 108 108 VAL N N 108 123.979 123.979 123.535 0.444 25061 8402 1 12 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.005 -0.063 25061 8403 1 12 . 1 1 108 108 VAL C C 108 175.854 175.854 176.492 -0.638 25061 8404 1 12 . 1 1 108 108 VAL CA C 108 60.017 60.017 61.377 -1.361 25061 8405 1 12 . 1 1 108 108 VAL CB C 108 32.844 32.844 32.444 0.400 25061 8406 1 12 . 1 1 108 108 VAL H H 108 8.561 8.561 8.775 -0.214 25061 8407 1 12 . 1 1 109 109 THR N N 109 120.144 120.144 115.003 5.141 25061 8408 1 12 . 1 1 109 109 THR HA H 109 4.815 4.815 4.501 0.314 25061 8409 1 12 . 1 1 109 109 THR C C 109 171.867 171.867 175.485 -3.618 25061 8410 1 12 . 1 1 109 109 THR CA C 109 59.613 59.613 62.222 -2.609 25061 8411 1 12 . 1 1 109 109 THR CB C 109 69.720 69.720 70.925 -1.205 25061 8412 1 12 . 1 1 109 109 THR H H 109 8.803 8.803 8.345 0.458 25061 8413 1 12 . 1 1 110 110 ASP N N 110 123.212 123.212 121.889 1.323 25061 8414 1 12 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.236 0.733 25061 8415 1 12 . 1 1 110 110 ASP C C 110 175.739 175.739 175.955 -0.216 25061 8416 1 12 . 1 1 110 110 ASP CA C 110 53.243 53.243 56.577 -3.334 25061 8417 1 12 . 1 1 110 110 ASP CB C 110 41.351 41.351 39.761 1.590 25061 8418 1 12 . 1 1 110 110 ASP H H 110 8.363 8.363 8.587 -0.224 25061 8419 1 12 . 1 1 111 111 ASN N N 111 116.298 116.298 120.621 -4.323 25061 8420 1 12 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.615 0.261 25061 8421 1 12 . 1 1 111 111 ASN C C 111 174.756 174.756 176.532 -1.776 25061 8422 1 12 . 1 1 111 111 ASN CA C 111 52.132 52.132 53.231 -1.099 25061 8423 1 12 . 1 1 111 111 ASN CB C 111 40.765 40.765 39.122 1.643 25061 8424 1 12 . 1 1 111 111 ASN H H 111 8.085 8.085 8.085 -0.000 25061 8425 1 12 . 1 1 112 112 GLU HA H 112 3.848 3.848 4.062 -0.214 25061 8426 1 12 . 1 1 112 112 GLU C C 112 177.016 177.016 177.688 -0.672 25061 8427 1 12 . 1 1 112 112 GLU CA C 112 59.480 59.480 59.360 0.120 25061 8428 1 12 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.094 0.580 25061 8429 1 12 . 1 1 113 113 ASP N N 113 121.033 121.033 120.243 0.790 25061 8430 1 12 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.367 0.046 25061 8431 1 12 . 1 1 113 113 ASP C C 113 178.988 178.988 178.325 0.663 25061 8432 1 12 . 1 1 113 113 ASP CA C 113 57.855 57.855 57.947 -0.092 25061 8433 1 12 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.862 -0.360 25061 8434 1 12 . 1 1 113 113 ASP H H 113 8.219 8.219 7.991 0.228 25061 8435 1 12 . 1 1 114 114 GLU N N 114 121.280 121.280 118.771 2.509 25061 8436 1 12 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.044 0.021 25061 8437 1 12 . 1 1 114 114 GLU C C 114 178.776 178.776 178.693 0.083 25061 8438 1 12 . 1 1 114 114 GLU CA C 114 58.714 58.714 59.252 -0.538 25061 8439 1 12 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.125 0.088 25061 8440 1 12 . 1 1 114 114 GLU H H 114 8.296 8.296 7.917 0.379 25061 8441 1 12 . 1 1 115 115 ALA N N 115 120.924 120.924 121.451 -0.527 25061 8442 1 12 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.028 -0.190 25061 8443 1 12 . 1 1 115 115 ALA C C 115 178.502 178.502 179.142 -0.640 25061 8444 1 12 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.113 0.525 25061 8445 1 12 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.271 0.226 25061 8446 1 12 . 1 1 115 115 ALA H H 115 7.853 7.853 7.618 0.235 25061 8447 1 12 . 1 1 116 116 LYS N N 116 116.616 116.616 119.015 -2.399 25061 8448 1 12 . 1 1 116 116 LYS HA H 116 3.719 3.719 4.042 -0.323 25061 8449 1 12 . 1 1 116 116 LYS C C 116 178.097 178.097 178.588 -0.491 25061 8450 1 12 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.507 1.245 25061 8451 1 12 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.560 -0.005 25061 8452 1 12 . 1 1 116 116 LYS H H 116 8.091 8.091 7.928 0.163 25061 8453 1 12 . 1 1 117 117 LYS N N 117 118.990 118.990 117.473 1.517 25061 8454 1 12 . 1 1 117 117 LYS HA H 117 3.911 3.911 4.071 -0.160 25061 8455 1 12 . 1 1 117 117 LYS C C 117 179.186 179.186 179.050 0.136 25061 8456 1 12 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.039 0.532 25061 8457 1 12 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.080 0.440 25061 8458 1 12 . 1 1 117 117 LYS H H 117 7.742 7.742 8.170 -0.428 25061 8459 1 12 . 1 1 118 118 ARG N N 118 117.441 117.441 120.042 -2.601 25061 8460 1 12 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.099 0.041 25061 8461 1 12 . 1 1 118 118 ARG C C 118 178.921 178.921 178.437 0.484 25061 8462 1 12 . 1 1 118 118 ARG CA C 118 57.671 57.671 59.167 -1.496 25061 8463 1 12 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.748 -0.087 25061 8464 1 12 . 1 1 118 118 ARG H H 118 8.468 8.468 7.774 0.694 25061 8465 1 12 . 1 1 119 119 LEU N N 119 120.100 120.100 119.173 0.927 25061 8466 1 12 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.951 0.009 25061 8467 1 12 . 1 1 119 119 LEU C C 119 177.554 177.554 178.552 -0.998 25061 8468 1 12 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.084 -0.203 25061 8469 1 12 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.555 0.334 25061 8470 1 12 . 1 1 119 119 LEU H H 119 8.322 8.322 7.734 0.588 25061 8471 1 12 . 1 1 120 120 LYS N N 120 118.238 118.238 119.330 -1.092 25061 8472 1 12 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.923 -0.101 25061 8473 1 12 . 1 1 120 120 LYS C C 120 178.703 178.703 178.897 -0.194 25061 8474 1 12 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.470 0.876 25061 8475 1 12 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.219 0.017 25061 8476 1 12 . 1 1 120 120 LYS H H 120 7.990 7.990 7.644 0.346 25061 8477 1 12 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.356 -0.334 25061 8478 1 12 . 1 1 121 121 GLU C C 121 177.769 177.769 179.138 -1.369 25061 8479 1 12 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.173 -0.251 25061 8480 1 12 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.678 -0.224 25061 8481 1 12 . 1 1 122 122 LEU N N 122 119.454 119.454 119.510 -0.056 25061 8482 1 12 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.052 0.081 25061 8483 1 12 . 1 1 122 122 LEU C C 122 178.991 178.991 179.484 -0.493 25061 8484 1 12 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.301 0.025 25061 8485 1 12 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.832 -0.153 25061 8486 1 12 . 1 1 122 122 LEU H H 122 7.930 7.930 8.192 -0.262 25061 8487 1 12 . 1 1 123 123 LEU N N 123 117.862 117.862 118.464 -0.602 25061 8488 1 12 . 1 1 123 123 LEU HA H 123 4.067 4.067 4.010 0.057 25061 8489 1 12 . 1 1 123 123 LEU C C 123 179.178 179.178 178.633 0.545 25061 8490 1 12 . 1 1 123 123 LEU CA C 123 56.920 56.920 57.788 -0.868 25061 8491 1 12 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.230 -0.020 25061 8492 1 12 . 1 1 123 123 LEU H H 123 8.095 8.095 8.364 -0.269 25061 8493 1 12 . 1 1 124 124 GLU N N 124 118.975 118.975 118.658 0.317 25061 8494 1 12 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.052 0.077 25061 8495 1 12 . 1 1 124 124 GLU C C 124 177.777 177.777 178.141 -0.364 25061 8496 1 12 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.758 -0.671 25061 8497 1 12 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.525 0.015 25061 8498 1 12 . 1 1 124 124 GLU H H 124 7.930 7.930 7.690 0.240 25061 8499 1 12 . 1 1 125 125 LYS N N 125 118.933 118.933 116.414 2.519 25061 8500 1 12 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.341 -0.004 25061 8501 1 12 . 1 1 125 125 LYS C C 125 178.188 178.188 176.749 1.439 25061 8502 1 12 . 1 1 125 125 LYS CA C 125 56.980 56.980 56.059 0.921 25061 8503 1 12 . 1 1 125 125 LYS CB C 125 32.608 32.608 32.827 -0.219 25061 8504 1 12 . 1 1 125 125 LYS H H 125 7.729 7.729 7.459 0.270 25061 8505 1 12 . 1 1 126 126 VAL N N 126 117.933 117.933 118.052 -0.119 25061 8506 1 12 . 1 1 126 126 VAL HA H 126 4.022 4.022 3.626 0.396 25061 8507 1 12 . 1 1 126 126 VAL C C 126 176.947 176.947 175.844 1.103 25061 8508 1 12 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.107 0.534 25061 8509 1 12 . 1 1 126 126 VAL CB C 126 31.859 31.859 29.546 2.313 25061 8510 1 12 . 1 1 126 126 VAL H H 126 8.044 8.044 7.735 0.309 25061 8511 1 12 . 1 1 127 127 GLY N N 127 109.813 109.813 112.815 -3.002 25061 8512 1 12 . 1 1 127 127 GLY C C 127 174.264 174.264 173.534 0.730 25061 8513 1 12 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.563 -0.284 25061 8514 1 12 . 1 1 127 127 GLY H H 127 8.279 8.279 8.668 -0.389 25061 8515 1 12 . 1 1 128 128 SER N N 128 115.185 115.185 115.460 -0.275 25061 8516 1 12 . 1 1 128 128 SER HA H 128 4.462 4.462 4.412 0.050 25061 8517 1 12 . 1 1 128 128 SER C C 128 174.775 174.775 174.134 0.641 25061 8518 1 12 . 1 1 128 128 SER CA C 128 58.739 58.739 58.642 0.096 25061 8519 1 12 . 1 1 128 128 SER CB C 128 63.850 63.850 64.171 -0.321 25061 8520 1 12 . 1 1 128 128 SER H H 128 8.048 8.048 7.690 0.358 25061 8521 1 12 . 1 1 129 129 LEU N N 129 123.060 123.060 123.593 -0.533 25061 8522 1 12 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.079 0.219 25061 8523 1 12 . 1 1 129 129 LEU C C 129 177.313 177.313 175.368 1.945 25061 8524 1 12 . 1 1 129 129 LEU CA C 129 55.158 55.158 55.970 -0.812 25061 8525 1 12 . 1 1 129 129 LEU CB C 129 41.837 41.837 41.136 0.701 25061 8526 1 12 . 1 1 129 129 LEU H H 129 8.147 8.147 8.498 -0.351 25061 8527 1 12 . 1 1 130 130 GLU N N 130 120.088 120.088 116.601 3.487 25061 8528 1 12 . 1 1 130 130 GLU HA H 130 4.181 4.181 3.917 0.264 25061 8529 1 12 . 1 1 130 130 GLU C C 130 176.148 176.148 176.426 -0.278 25061 8530 1 12 . 1 1 130 130 GLU CA C 130 56.726 56.726 57.366 -0.640 25061 8531 1 12 . 1 1 130 130 GLU CB C 130 30.026 30.026 27.317 2.709 25061 8532 1 12 . 1 1 130 130 GLU H H 130 8.242 8.242 8.699 -0.457 25061 8533 1 13 . 1 1 2 2 GLY CA C 2 45.319 45.319 45.228 0.091 25061 8534 1 13 . 1 1 3 3 THR HA H 3 4.820 4.820 4.309 0.511 25061 8535 1 13 . 1 1 3 3 THR C C 3 172.374 172.374 174.543 -2.169 25061 8536 1 13 . 1 1 3 3 THR CA C 3 62.760 62.760 63.714 -0.954 25061 8537 1 13 . 1 1 3 3 THR CB C 3 71.441 71.441 69.663 1.778 25061 8538 1 13 . 1 1 4 4 VAL N N 4 126.881 126.881 127.740 -0.859 25061 8539 1 13 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.486 0.082 25061 8540 1 13 . 1 1 4 4 VAL C C 4 173.116 173.116 174.857 -1.741 25061 8541 1 13 . 1 1 4 4 VAL CA C 4 60.455 60.455 62.170 -1.715 25061 8542 1 13 . 1 1 4 4 VAL CB C 4 33.800 33.800 31.741 2.059 25061 8543 1 13 . 1 1 4 4 VAL H H 4 9.097 9.097 8.723 0.374 25061 8544 1 13 . 1 1 5 5 VAL N N 5 127.172 127.172 125.152 2.020 25061 8545 1 13 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.308 -0.421 25061 8546 1 13 . 1 1 5 5 VAL C C 5 174.091 174.091 175.027 -0.936 25061 8547 1 13 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.765 0.353 25061 8548 1 13 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.042 -0.107 25061 8549 1 13 . 1 1 5 5 VAL H H 5 8.811 8.811 8.716 0.095 25061 8550 1 13 . 1 1 6 6 ILE N N 6 127.577 127.577 129.205 -1.628 25061 8551 1 13 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.475 0.145 25061 8552 1 13 . 1 1 6 6 ILE C C 6 173.328 173.328 175.156 -1.828 25061 8553 1 13 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.863 -0.031 25061 8554 1 13 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.476 1.454 25061 8555 1 13 . 1 1 6 6 ILE H H 6 9.210 9.210 8.521 0.689 25061 8556 1 13 . 1 1 7 7 VAL N N 7 129.024 129.024 129.130 -0.106 25061 8557 1 13 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.607 0.198 25061 8558 1 13 . 1 1 7 7 VAL C C 7 173.561 173.561 175.023 -1.462 25061 8559 1 13 . 1 1 7 7 VAL CA C 7 60.849 60.849 61.831 -0.982 25061 8560 1 13 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.407 0.953 25061 8561 1 13 . 1 1 7 7 VAL H H 7 9.294 9.294 7.992 1.302 25061 8562 1 13 . 1 1 8 8 VAL N N 8 125.318 125.318 127.784 -2.466 25061 8563 1 13 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.416 -0.020 25061 8564 1 13 . 1 1 8 8 VAL C C 8 175.723 175.723 175.048 0.675 25061 8565 1 13 . 1 1 8 8 VAL CA C 8 59.617 59.617 59.638 -0.021 25061 8566 1 13 . 1 1 8 8 VAL CB C 8 34.915 34.915 35.365 -0.450 25061 8567 1 13 . 1 1 8 8 VAL H H 8 8.898 8.898 8.673 0.225 25061 8568 1 13 . 1 1 9 9 SER N N 9 116.544 116.544 116.869 -0.325 25061 8569 1 13 . 1 1 9 9 SER HA H 9 4.724 4.724 4.941 -0.217 25061 8570 1 13 . 1 1 9 9 SER C C 9 174.552 174.552 173.255 1.297 25061 8571 1 13 . 1 1 9 9 SER CA C 9 57.419 57.419 56.623 0.796 25061 8572 1 13 . 1 1 9 9 SER CB C 9 64.998 64.998 65.657 -0.659 25061 8573 1 13 . 1 1 9 9 SER H H 9 7.833 7.833 8.060 -0.227 25061 8574 1 13 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.734 0.178 25061 8575 1 13 . 1 1 10 10 ASN C C 10 176.170 176.170 174.707 1.463 25061 8576 1 13 . 1 1 10 10 ASN CA C 10 54.141 54.141 52.951 1.190 25061 8577 1 13 . 1 1 10 10 ASN CB C 10 38.626 38.626 38.586 0.040 25061 8578 1 13 . 1 1 11 11 ASP N N 11 120.164 120.164 118.256 1.908 25061 8579 1 13 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.834 0.009 25061 8580 1 13 . 1 1 11 11 ASP C C 11 176.148 176.148 175.242 0.906 25061 8581 1 13 . 1 1 11 11 ASP CA C 11 52.620 52.620 53.342 -0.722 25061 8582 1 13 . 1 1 11 11 ASP CB C 11 42.631 42.631 43.611 -0.980 25061 8583 1 13 . 1 1 11 11 ASP H H 11 8.142 8.142 7.509 0.633 25061 8584 1 13 . 1 1 12 12 GLU N N 12 127.184 127.184 122.946 4.238 25061 8585 1 13 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.341 -0.488 25061 8586 1 13 . 1 1 12 12 GLU C C 12 177.853 177.853 178.566 -0.713 25061 8587 1 13 . 1 1 12 12 GLU CA C 12 59.547 59.547 59.192 0.355 25061 8588 1 13 . 1 1 12 12 GLU CB C 12 29.819 29.819 30.010 -0.191 25061 8589 1 13 . 1 1 12 12 GLU H H 12 9.152 9.152 8.928 0.224 25061 8590 1 13 . 1 1 13 13 ARG N N 13 119.026 119.026 119.941 -0.915 25061 8591 1 13 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.162 -0.059 25061 8592 1 13 . 1 1 13 13 ARG C C 13 179.151 179.151 178.617 0.534 25061 8593 1 13 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.959 -0.016 25061 8594 1 13 . 1 1 13 13 ARG CB C 13 28.757 28.757 30.156 -1.399 25061 8595 1 13 . 1 1 13 13 ARG H H 13 8.389 8.389 8.005 0.384 25061 8596 1 13 . 1 1 14 14 ILE N N 14 119.238 119.238 120.583 -1.345 25061 8597 1 13 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.964 -0.363 25061 8598 1 13 . 1 1 14 14 ILE C C 14 177.905 177.905 177.698 0.207 25061 8599 1 13 . 1 1 14 14 ILE CA C 14 64.666 64.666 62.021 2.645 25061 8600 1 13 . 1 1 14 14 ILE CB C 14 36.780 36.780 36.897 -0.117 25061 8601 1 13 . 1 1 14 14 ILE H H 14 7.254 7.254 7.715 -0.461 25061 8602 1 13 . 1 1 15 15 LEU N N 15 117.008 117.008 120.263 -3.255 25061 8603 1 13 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.131 -0.210 25061 8604 1 13 . 1 1 15 15 LEU C C 15 178.062 178.062 179.369 -1.307 25061 8605 1 13 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.582 -0.171 25061 8606 1 13 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.584 -0.415 25061 8607 1 13 . 1 1 15 15 LEU H H 15 7.412 7.412 7.993 -0.581 25061 8608 1 13 . 1 1 16 16 GLU N N 16 117.637 117.637 118.983 -1.346 25061 8609 1 13 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.950 -0.249 25061 8610 1 13 . 1 1 16 16 GLU C C 16 179.182 179.182 178.718 0.464 25061 8611 1 13 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.347 0.070 25061 8612 1 13 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.270 0.188 25061 8613 1 13 . 1 1 16 16 GLU H H 16 7.981 7.981 8.018 -0.037 25061 8614 1 13 . 1 1 17 17 GLU N N 17 119.759 119.759 120.815 -1.056 25061 8615 1 13 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.088 -0.072 25061 8616 1 13 . 1 1 17 17 GLU C C 17 179.949 179.949 178.934 1.015 25061 8617 1 13 . 1 1 17 17 GLU CA C 17 59.195 59.195 59.178 0.016 25061 8618 1 13 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.230 0.310 25061 8619 1 13 . 1 1 17 17 GLU H H 17 8.248 8.248 8.037 0.211 25061 8620 1 13 . 1 1 18 18 LEU N N 18 119.764 119.764 119.455 0.309 25061 8621 1 13 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.240 -0.159 25061 8622 1 13 . 1 1 18 18 LEU C C 18 177.620 177.620 179.379 -1.759 25061 8623 1 13 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.627 0.051 25061 8624 1 13 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.747 -0.637 25061 8625 1 13 . 1 1 18 18 LEU H H 18 8.486 8.486 8.047 0.439 25061 8626 1 13 . 1 1 19 19 LEU N N 19 123.102 123.102 121.143 1.959 25061 8627 1 13 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.585 0.077 25061 8628 1 13 . 1 1 19 19 LEU C C 19 178.343 178.343 178.338 0.005 25061 8629 1 13 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.203 1.033 25061 8630 1 13 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.169 -0.518 25061 8631 1 13 . 1 1 19 19 LEU H H 19 7.870 7.870 7.861 0.009 25061 8632 1 13 . 1 1 20 20 GLU N N 20 117.884 117.884 118.611 -0.727 25061 8633 1 13 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.944 -0.040 25061 8634 1 13 . 1 1 20 20 GLU C C 20 177.707 177.707 179.079 -1.372 25061 8635 1 13 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.361 0.031 25061 8636 1 13 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.469 -0.492 25061 8637 1 13 . 1 1 20 20 GLU H H 20 7.497 7.497 7.994 -0.497 25061 8638 1 13 . 1 1 21 21 VAL N N 21 117.709 117.709 120.085 -2.376 25061 8639 1 13 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.784 -0.160 25061 8640 1 13 . 1 1 21 21 VAL C C 21 178.523 178.523 178.243 0.280 25061 8641 1 13 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.265 -0.068 25061 8642 1 13 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.124 0.023 25061 8643 1 13 . 1 1 21 21 VAL H H 21 7.514 7.514 7.637 -0.123 25061 8644 1 13 . 1 1 22 22 VAL N N 22 121.233 121.233 119.340 1.893 25061 8645 1 13 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.625 -0.179 25061 8646 1 13 . 1 1 22 22 VAL C C 22 176.868 176.868 178.151 -1.283 25061 8647 1 13 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.529 0.484 25061 8648 1 13 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.627 -0.313 25061 8649 1 13 . 1 1 22 22 VAL H H 22 7.863 7.863 7.433 0.430 25061 8650 1 13 . 1 1 23 23 LEU N N 23 118.101 118.101 118.209 -0.108 25061 8651 1 13 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.035 0.030 25061 8652 1 13 . 1 1 23 23 LEU C C 23 179.701 179.701 178.038 1.663 25061 8653 1 13 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.558 -0.262 25061 8654 1 13 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.879 -0.175 25061 8655 1 13 . 1 1 23 23 LEU H H 23 8.151 8.151 8.212 -0.061 25061 8656 1 13 . 1 1 24 24 LYS N N 24 114.622 114.622 115.580 -0.958 25061 8657 1 13 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.096 0.041 25061 8658 1 13 . 1 1 24 24 LYS C C 24 178.062 178.062 178.321 -0.259 25061 8659 1 13 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.162 -0.794 25061 8660 1 13 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.432 0.162 25061 8661 1 13 . 1 1 24 24 LYS H H 24 7.823 7.823 7.936 -0.113 25061 8662 1 13 . 1 1 25 25 SER N N 25 115.474 115.474 116.185 -0.711 25061 8663 1 13 . 1 1 25 25 SER HA H 25 4.377 4.377 4.381 -0.004 25061 8664 1 13 . 1 1 25 25 SER C C 25 174.520 174.520 174.195 0.325 25061 8665 1 13 . 1 1 25 25 SER CA C 25 61.049 61.049 60.551 0.498 25061 8666 1 13 . 1 1 25 25 SER CB C 25 63.777 63.777 64.467 -0.690 25061 8667 1 13 . 1 1 25 25 SER H H 25 7.798 7.798 7.735 0.063 25061 8668 1 13 . 1 1 26 26 ASP N N 26 117.424 117.424 119.952 -2.528 25061 8669 1 13 . 1 1 26 26 ASP HA H 26 4.886 4.886 5.098 -0.212 25061 8670 1 13 . 1 1 26 26 ASP C C 26 173.521 173.521 174.880 -1.359 25061 8671 1 13 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.443 -0.395 25061 8672 1 13 . 1 1 26 26 ASP CB C 26 42.202 42.202 43.392 -1.190 25061 8673 1 13 . 1 1 26 26 ASP H H 26 7.990 7.990 8.038 -0.048 25061 8674 1 13 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.375 0.270 25061 8675 1 13 . 1 1 27 27 PRO C C 27 177.016 177.016 177.306 -0.290 25061 8676 1 13 . 1 1 27 27 PRO CA C 27 63.601 63.601 64.214 -0.613 25061 8677 1 13 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.239 -0.066 25061 8678 1 13 . 1 1 28 28 ASN N N 28 115.839 115.839 116.232 -0.393 25061 8679 1 13 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.568 0.124 25061 8680 1 13 . 1 1 28 28 ASN C C 28 175.701 175.701 175.176 0.525 25061 8681 1 13 . 1 1 28 28 ASN CA C 28 53.472 53.472 54.137 -0.665 25061 8682 1 13 . 1 1 28 28 ASN CB C 28 39.213 39.213 38.484 0.729 25061 8683 1 13 . 1 1 28 28 ASN H H 28 8.608 8.608 8.538 0.070 25061 8684 1 13 . 1 1 29 29 VAL N N 29 120.770 120.770 120.735 0.035 25061 8685 1 13 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.953 -0.138 25061 8686 1 13 . 1 1 29 29 VAL C C 29 175.023 175.023 176.256 -1.233 25061 8687 1 13 . 1 1 29 29 VAL CA C 29 62.552 62.552 62.860 -0.308 25061 8688 1 13 . 1 1 29 29 VAL CB C 29 32.147 32.147 32.119 0.028 25061 8689 1 13 . 1 1 29 29 VAL H H 29 7.428 7.428 7.359 0.069 25061 8690 1 13 . 1 1 30 30 LYS N N 30 127.345 127.345 128.659 -1.314 25061 8691 1 13 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.238 0.241 25061 8692 1 13 . 1 1 30 30 LYS C C 30 174.777 174.777 176.267 -1.490 25061 8693 1 13 . 1 1 30 30 LYS CA C 30 55.204 55.204 55.756 -0.552 25061 8694 1 13 . 1 1 30 30 LYS CB C 30 31.949 31.949 30.416 1.533 25061 8695 1 13 . 1 1 30 30 LYS H H 30 8.457 8.457 8.437 0.020 25061 8696 1 13 . 1 1 31 31 THR N N 31 113.552 113.552 116.236 -2.684 25061 8697 1 13 . 1 1 31 31 THR HA H 31 5.723 5.723 4.461 1.262 25061 8698 1 13 . 1 1 31 31 THR C C 31 174.593 174.593 174.183 0.410 25061 8699 1 13 . 1 1 31 31 THR CA C 31 59.030 59.030 61.717 -2.687 25061 8700 1 13 . 1 1 31 31 THR CB C 31 72.206 72.206 69.164 3.042 25061 8701 1 13 . 1 1 31 31 THR H H 31 8.164 8.164 8.189 -0.025 25061 8702 1 13 . 1 1 32 32 VAL N N 32 119.206 119.206 126.785 -7.579 25061 8703 1 13 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.392 0.013 25061 8704 1 13 . 1 1 32 32 VAL C C 32 172.663 172.663 174.580 -1.917 25061 8705 1 13 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.069 0.003 25061 8706 1 13 . 1 1 32 32 VAL CB C 32 35.051 35.051 34.507 0.544 25061 8707 1 13 . 1 1 32 32 VAL H H 32 8.615 8.615 8.945 -0.330 25061 8708 1 13 . 1 1 33 33 ARG N N 33 130.278 130.278 127.988 2.290 25061 8709 1 13 . 1 1 33 33 ARG HA H 33 5.331 5.331 5.012 0.319 25061 8710 1 13 . 1 1 33 33 ARG C C 33 173.836 173.836 175.261 -1.425 25061 8711 1 13 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.300 -1.150 25061 8712 1 13 . 1 1 33 33 ARG CB C 33 30.028 30.028 30.965 -0.937 25061 8713 1 13 . 1 1 33 33 ARG H H 33 8.996 8.996 8.842 0.154 25061 8714 1 13 . 1 1 34 34 THR N N 34 121.695 121.695 120.297 1.398 25061 8715 1 13 . 1 1 34 34 THR HA H 34 4.483 4.483 4.628 -0.145 25061 8716 1 13 . 1 1 34 34 THR C C 34 169.769 169.769 173.402 -3.633 25061 8717 1 13 . 1 1 34 34 THR CA C 34 60.814 60.814 62.090 -1.276 25061 8718 1 13 . 1 1 34 34 THR CB C 34 67.402 67.402 71.293 -3.891 25061 8719 1 13 . 1 1 34 34 THR H H 34 8.126 8.126 7.770 0.356 25061 8720 1 13 . 1 1 35 35 ASP N N 35 122.198 122.198 122.154 0.044 25061 8721 1 13 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.577 0.247 25061 8722 1 13 . 1 1 35 35 ASP C C 35 174.790 174.790 175.239 -0.449 25061 8723 1 13 . 1 1 35 35 ASP CA C 35 53.386 53.386 53.395 -0.009 25061 8724 1 13 . 1 1 35 35 ASP CB C 35 41.848 41.848 40.867 0.981 25061 8725 1 13 . 1 1 35 35 ASP H H 35 7.983 7.983 8.281 -0.298 25061 8726 1 13 . 1 1 36 36 ASP N N 36 121.091 121.091 120.320 0.771 25061 8727 1 13 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.398 0.195 25061 8728 1 13 . 1 1 36 36 ASP C C 36 176.189 176.189 176.877 -0.688 25061 8729 1 13 . 1 1 36 36 ASP CA C 36 53.055 53.055 55.381 -2.326 25061 8730 1 13 . 1 1 36 36 ASP CB C 36 42.159 42.159 40.534 1.625 25061 8731 1 13 . 1 1 36 36 ASP H H 36 8.157 8.157 8.213 -0.056 25061 8732 1 13 . 1 1 37 37 LYS N N 37 125.839 125.839 115.508 10.331 25061 8733 1 13 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.686 0.036 25061 8734 1 13 . 1 1 37 37 LYS C C 37 176.870 176.870 177.559 -0.689 25061 8735 1 13 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.688 -0.284 25061 8736 1 13 . 1 1 37 37 LYS CB C 37 32.394 32.394 30.552 1.842 25061 8737 1 13 . 1 1 37 37 LYS H H 37 8.843 8.843 8.120 0.723 25061 8738 1 13 . 1 1 38 38 GLU N N 38 118.369 118.369 119.377 -1.008 25061 8739 1 13 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.850 0.157 25061 8740 1 13 . 1 1 38 38 GLU C C 38 179.502 179.502 178.009 1.493 25061 8741 1 13 . 1 1 38 38 GLU CA C 38 58.670 58.670 59.028 -0.358 25061 8742 1 13 . 1 1 38 38 GLU CB C 38 28.474 28.474 29.257 -0.783 25061 8743 1 13 . 1 1 38 38 GLU H H 38 8.182 8.182 8.276 -0.094 25061 8744 1 13 . 1 1 39 39 LYS N N 39 121.722 121.722 119.643 2.079 25061 8745 1 13 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.055 0.110 25061 8746 1 13 . 1 1 39 39 LYS C C 39 178.500 178.500 178.390 0.110 25061 8747 1 13 . 1 1 39 39 LYS CA C 39 57.736 57.736 59.212 -1.476 25061 8748 1 13 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.359 -1.221 25061 8749 1 13 . 1 1 39 39 LYS H H 39 7.524 7.524 7.549 -0.025 25061 8750 1 13 . 1 1 40 40 VAL N N 40 117.199 117.199 119.435 -2.236 25061 8751 1 13 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.620 -0.392 25061 8752 1 13 . 1 1 40 40 VAL C C 40 177.362 177.362 178.051 -0.689 25061 8753 1 13 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.275 1.367 25061 8754 1 13 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.203 -0.300 25061 8755 1 13 . 1 1 40 40 VAL H H 40 7.883 7.883 7.490 0.393 25061 8756 1 13 . 1 1 41 41 LYS N N 41 117.677 117.677 118.202 -0.525 25061 8757 1 13 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.421 0.020 25061 8758 1 13 . 1 1 41 41 LYS C C 41 177.686 177.686 178.651 -0.965 25061 8759 1 13 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.345 1.464 25061 8760 1 13 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.406 0.209 25061 8761 1 13 . 1 1 41 41 LYS H H 41 7.567 7.567 7.254 0.313 25061 8762 1 13 . 1 1 42 42 GLU N N 42 118.369 118.369 119.442 -1.073 25061 8763 1 13 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.004 0.003 25061 8764 1 13 . 1 1 42 42 GLU C C 42 179.725 179.725 179.063 0.662 25061 8765 1 13 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.173 -0.104 25061 8766 1 13 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.606 -0.067 25061 8767 1 13 . 1 1 42 42 GLU H H 42 7.634 7.634 7.702 -0.068 25061 8768 1 13 . 1 1 43 43 GLU N N 43 117.906 117.906 118.028 -0.122 25061 8769 1 13 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.229 -0.046 25061 8770 1 13 . 1 1 43 43 GLU C C 43 179.757 179.757 179.167 0.590 25061 8771 1 13 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.445 -0.079 25061 8772 1 13 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.217 -0.376 25061 8773 1 13 . 1 1 43 43 GLU H H 43 8.162 8.162 7.911 0.251 25061 8774 1 13 . 1 1 44 44 ILE N N 44 122.291 122.291 121.538 0.753 25061 8775 1 13 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.579 0.033 25061 8776 1 13 . 1 1 44 44 ILE C C 44 177.101 177.101 177.497 -0.396 25061 8777 1 13 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.838 0.517 25061 8778 1 13 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.943 -0.483 25061 8779 1 13 . 1 1 44 44 ILE H H 44 8.742 8.742 8.068 0.674 25061 8780 1 13 . 1 1 45 45 GLU N N 45 119.892 119.892 120.358 -0.466 25061 8781 1 13 . 1 1 45 45 GLU HA H 45 4.058 4.058 3.947 0.111 25061 8782 1 13 . 1 1 45 45 GLU C C 45 178.991 178.991 178.607 0.384 25061 8783 1 13 . 1 1 45 45 GLU CA C 45 59.665 59.665 60.099 -0.433 25061 8784 1 13 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.402 -0.241 25061 8785 1 13 . 1 1 45 45 GLU H H 45 8.171 8.171 7.973 0.198 25061 8786 1 13 . 1 1 46 46 LYS N N 46 118.064 118.064 118.475 -0.411 25061 8787 1 13 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.053 -0.071 25061 8788 1 13 . 1 1 46 46 LYS C C 46 178.837 178.837 178.861 -0.024 25061 8789 1 13 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.125 0.616 25061 8790 1 13 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.149 0.294 25061 8791 1 13 . 1 1 46 46 LYS H H 46 7.785 7.785 7.439 0.346 25061 8792 1 13 . 1 1 47 47 ALA N N 47 121.817 121.817 122.176 -0.359 25061 8793 1 13 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.042 -0.011 25061 8794 1 13 . 1 1 47 47 ALA C C 47 179.859 179.859 179.164 0.695 25061 8795 1 13 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.297 -0.002 25061 8796 1 13 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.659 -1.003 25061 8797 1 13 . 1 1 47 47 ALA H H 47 8.123 8.123 7.538 0.585 25061 8798 1 13 . 1 1 48 48 ARG N N 48 119.080 119.080 117.742 1.338 25061 8799 1 13 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.112 -0.023 25061 8800 1 13 . 1 1 48 48 ARG C C 48 180.155 180.155 178.660 1.495 25061 8801 1 13 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.551 0.646 25061 8802 1 13 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.910 -0.400 25061 8803 1 13 . 1 1 48 48 ARG H H 48 8.768 8.768 8.194 0.574 25061 8804 1 13 . 1 1 49 49 LYS N N 49 119.951 119.951 120.171 -0.220 25061 8805 1 13 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.079 -0.040 25061 8806 1 13 . 1 1 49 49 LYS C C 49 178.288 178.288 178.431 -0.143 25061 8807 1 13 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.843 -0.006 25061 8808 1 13 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.306 -0.163 25061 8809 1 13 . 1 1 49 49 LYS H H 49 8.037 8.037 7.972 0.065 25061 8810 1 13 . 1 1 50 50 GLN N N 50 115.284 115.284 115.461 -0.177 25061 8811 1 13 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.305 0.037 25061 8812 1 13 . 1 1 50 50 GLN C C 50 176.180 176.180 177.184 -1.004 25061 8813 1 13 . 1 1 50 50 GLN CA C 50 55.741 55.741 56.056 -0.315 25061 8814 1 13 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.389 0.176 25061 8815 1 13 . 1 1 50 50 GLN H H 50 7.740 7.740 7.708 0.032 25061 8816 1 13 . 1 1 51 51 GLY N N 51 109.725 109.725 108.544 1.181 25061 8817 1 13 . 1 1 51 51 GLY C C 51 174.552 174.552 173.804 0.748 25061 8818 1 13 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.195 1.168 25061 8819 1 13 . 1 1 51 51 GLY H H 51 8.027 8.027 8.012 0.015 25061 8820 1 13 . 1 1 52 52 ARG N N 52 119.064 119.064 120.793 -1.729 25061 8821 1 13 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.592 0.305 25061 8822 1 13 . 1 1 52 52 ARG C C 52 173.123 173.123 174.521 -1.398 25061 8823 1 13 . 1 1 52 52 ARG CA C 52 52.247 52.247 52.847 -0.600 25061 8824 1 13 . 1 1 52 52 ARG CB C 52 32.366 32.366 30.598 1.768 25061 8825 1 13 . 1 1 52 52 ARG H H 52 7.969 7.969 7.826 0.143 25061 8826 1 13 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.536 0.319 25061 8827 1 13 . 1 1 53 53 PRO C C 53 174.069 174.069 175.547 -1.478 25061 8828 1 13 . 1 1 53 53 PRO CA C 53 61.818 61.818 63.296 -1.478 25061 8829 1 13 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.427 -0.367 25061 8830 1 13 . 1 1 54 54 ILE N N 54 116.301 116.301 121.347 -5.046 25061 8831 1 13 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.739 0.499 25061 8832 1 13 . 1 1 54 54 ILE C C 54 171.709 171.709 174.073 -2.364 25061 8833 1 13 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.537 -1.763 25061 8834 1 13 . 1 1 54 54 ILE CB C 54 41.558 41.558 41.145 0.413 25061 8835 1 13 . 1 1 54 54 ILE H H 54 7.920 7.920 8.222 -0.302 25061 8836 1 13 . 1 1 55 55 VAL N N 55 126.302 126.302 130.023 -3.721 25061 8837 1 13 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.154 -0.230 25061 8838 1 13 . 1 1 55 55 VAL C C 55 173.624 173.624 175.302 -1.678 25061 8839 1 13 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.539 -0.744 25061 8840 1 13 . 1 1 55 55 VAL CB C 55 32.828 32.828 33.226 -0.398 25061 8841 1 13 . 1 1 55 55 VAL H H 55 8.652 8.652 8.709 -0.057 25061 8842 1 13 . 1 1 56 56 ILE N N 56 127.503 127.503 126.657 0.846 25061 8843 1 13 . 1 1 56 56 ILE HA H 56 4.664 4.664 4.592 0.072 25061 8844 1 13 . 1 1 56 56 ILE C C 56 173.479 173.479 174.885 -1.406 25061 8845 1 13 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.313 0.694 25061 8846 1 13 . 1 1 56 56 ILE CB C 56 40.285 40.285 37.883 2.402 25061 8847 1 13 . 1 1 56 56 ILE H H 56 9.124 9.124 8.216 0.908 25061 8848 1 13 . 1 1 57 57 PHE N N 57 125.302 125.302 128.189 -2.887 25061 8849 1 13 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.428 -0.212 25061 8850 1 13 . 1 1 57 57 PHE C C 57 174.536 174.536 175.809 -1.273 25061 8851 1 13 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.071 -0.110 25061 8852 1 13 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.807 0.622 25061 8853 1 13 . 1 1 57 57 PHE H H 57 8.971 8.971 8.923 0.048 25061 8854 1 13 . 1 1 58 58 ILE N N 58 126.472 126.472 116.629 9.843 25061 8855 1 13 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.785 -0.270 25061 8856 1 13 . 1 1 58 58 ILE C C 58 173.391 173.391 174.035 -0.644 25061 8857 1 13 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.383 -0.293 25061 8858 1 13 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.075 -0.334 25061 8859 1 13 . 1 1 58 58 ILE H H 58 9.248 9.248 8.557 0.691 25061 8860 1 13 . 1 1 59 59 ARG N N 59 124.681 124.681 120.959 3.722 25061 8861 1 13 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.230 -0.301 25061 8862 1 13 . 1 1 59 59 ARG C C 59 178.521 178.521 177.944 0.577 25061 8863 1 13 . 1 1 59 59 ARG CA C 59 55.742 55.742 55.606 0.136 25061 8864 1 13 . 1 1 59 59 ARG CB C 59 30.918 30.918 32.901 -1.984 25061 8865 1 13 . 1 1 59 59 ARG H H 59 8.587 8.587 8.894 -0.307 25061 8866 1 13 . 1 1 60 60 GLY N N 60 108.848 108.848 108.736 0.112 25061 8867 1 13 . 1 1 60 60 GLY C C 60 174.775 174.775 174.567 0.208 25061 8868 1 13 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.286 -0.319 25061 8869 1 13 . 1 1 60 60 GLY H H 60 7.732 7.732 8.415 -0.683 25061 8870 1 13 . 1 1 61 61 ALA N N 61 120.877 120.877 122.526 -1.649 25061 8871 1 13 . 1 1 61 61 ALA HA H 61 4.144 4.144 3.940 0.204 25061 8872 1 13 . 1 1 61 61 ALA C C 61 177.769 177.769 178.844 -1.075 25061 8873 1 13 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.862 -0.413 25061 8874 1 13 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.412 -0.041 25061 8875 1 13 . 1 1 61 61 ALA H H 61 7.852 7.852 7.910 -0.058 25061 8876 1 13 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.189 0.611 25061 8877 1 13 . 1 1 62 62 TYR CA C 62 63.039 63.039 59.333 3.706 25061 8878 1 13 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.024 0.416 25061 8879 1 13 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.774 -0.089 25061 8880 1 13 . 1 1 63 63 GLU C C 63 176.251 176.251 178.469 -2.218 25061 8881 1 13 . 1 1 63 63 GLU CA C 63 59.258 59.258 58.973 0.285 25061 8882 1 13 . 1 1 63 63 GLU CB C 63 29.412 29.412 28.899 0.513 25061 8883 1 13 . 1 1 64 64 GLU N N 64 119.209 119.209 119.539 -0.330 25061 8884 1 13 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.906 -0.005 25061 8885 1 13 . 1 1 64 64 GLU C C 64 178.251 178.251 179.014 -0.763 25061 8886 1 13 . 1 1 64 64 GLU CA C 64 59.212 59.212 59.112 0.100 25061 8887 1 13 . 1 1 64 64 GLU CB C 64 28.645 28.645 29.412 -0.766 25061 8888 1 13 . 1 1 64 64 GLU H H 64 8.878 8.878 7.533 1.345 25061 8889 1 13 . 1 1 65 65 VAL N N 65 116.728 116.728 119.299 -2.571 25061 8890 1 13 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.756 0.226 25061 8891 1 13 . 1 1 65 65 VAL C C 65 176.915 176.915 177.788 -0.873 25061 8892 1 13 . 1 1 65 65 VAL CA C 65 64.609 64.609 66.011 -1.402 25061 8893 1 13 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.604 0.291 25061 8894 1 13 . 1 1 65 65 VAL H H 65 7.652 7.652 7.663 -0.011 25061 8895 1 13 . 1 1 66 66 VAL N N 66 119.462 119.462 119.915 -0.453 25061 8896 1 13 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.668 -0.354 25061 8897 1 13 . 1 1 66 66 VAL C C 66 177.142 177.142 177.803 -0.661 25061 8898 1 13 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.820 0.514 25061 8899 1 13 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.452 -0.022 25061 8900 1 13 . 1 1 66 66 VAL H H 66 7.896 7.896 7.695 0.201 25061 8901 1 13 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.044 -0.416 25061 8902 1 13 . 1 1 67 67 ARG C C 67 177.841 177.841 178.448 -0.607 25061 8903 1 13 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.183 0.869 25061 8904 1 13 . 1 1 67 67 ARG CB C 67 29.393 29.393 29.560 -0.167 25061 8905 1 13 . 1 1 68 68 ASP N N 68 118.316 118.316 119.703 -1.387 25061 8906 1 13 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.553 -0.192 25061 8907 1 13 . 1 1 68 68 ASP C C 68 178.945 178.945 178.786 0.159 25061 8908 1 13 . 1 1 68 68 ASP CA C 68 57.311 57.311 57.036 0.275 25061 8909 1 13 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.629 0.885 25061 8910 1 13 . 1 1 68 68 ASP H H 68 7.625 7.625 7.913 -0.288 25061 8911 1 13 . 1 1 69 69 ILE N N 69 119.231 119.231 119.833 -0.602 25061 8912 1 13 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.810 -0.180 25061 8913 1 13 . 1 1 69 69 ILE C C 69 177.138 177.138 177.995 -0.857 25061 8914 1 13 . 1 1 69 69 ILE CA C 69 64.540 64.540 63.151 1.389 25061 8915 1 13 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.026 0.024 25061 8916 1 13 . 1 1 69 69 ILE H H 69 8.113 8.113 7.681 0.432 25061 8917 1 13 . 1 1 70 70 VAL N N 70 120.164 120.164 120.823 -0.659 25061 8918 1 13 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.577 -0.160 25061 8919 1 13 . 1 1 70 70 VAL C C 70 177.079 177.079 177.613 -0.534 25061 8920 1 13 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.433 -0.159 25061 8921 1 13 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.441 -0.183 25061 8922 1 13 . 1 1 70 70 VAL H H 70 8.478 8.478 8.438 0.040 25061 8923 1 13 . 1 1 71 71 GLU N N 71 118.293 118.293 120.103 -1.810 25061 8924 1 13 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.929 0.125 25061 8925 1 13 . 1 1 71 71 GLU C C 71 179.009 179.009 178.630 0.379 25061 8926 1 13 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.592 -0.176 25061 8927 1 13 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.575 -0.753 25061 8928 1 13 . 1 1 71 71 GLU H H 71 8.152 8.152 8.014 0.138 25061 8929 1 13 . 1 1 72 72 TYR N N 72 120.091 120.091 120.209 -0.118 25061 8930 1 13 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.148 0.014 25061 8931 1 13 . 1 1 72 72 TYR C C 72 176.404 176.404 177.083 -0.679 25061 8932 1 13 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.473 -0.341 25061 8933 1 13 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.542 -0.405 25061 8934 1 13 . 1 1 72 72 TYR H H 72 7.959 7.959 7.663 0.296 25061 8935 1 13 . 1 1 73 73 ALA N N 73 120.133 120.133 119.994 0.139 25061 8936 1 13 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.876 -0.246 25061 8937 1 13 . 1 1 73 73 ALA C C 73 179.182 179.182 179.727 -0.545 25061 8938 1 13 . 1 1 73 73 ALA CA C 73 55.112 55.112 54.875 0.237 25061 8939 1 13 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.104 0.087 25061 8940 1 13 . 1 1 73 73 ALA H H 73 8.604 8.604 8.082 0.522 25061 8941 1 13 . 1 1 74 74 GLN N N 74 115.553 115.553 116.838 -1.285 25061 8942 1 13 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.975 0.163 25061 8943 1 13 . 1 1 74 74 GLN C C 74 180.595 180.595 178.023 2.572 25061 8944 1 13 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.569 0.526 25061 8945 1 13 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.944 -0.369 25061 8946 1 13 . 1 1 74 74 GLN H H 74 8.619 8.619 8.421 0.198 25061 8947 1 13 . 1 1 75 75 LYS N N 75 122.396 122.396 116.553 5.843 25061 8948 1 13 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.136 -0.108 25061 8949 1 13 . 1 1 75 75 LYS C C 75 178.521 178.521 178.450 0.071 25061 8950 1 13 . 1 1 75 75 LYS CA C 75 59.058 59.058 57.844 1.214 25061 8951 1 13 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.544 0.055 25061 8952 1 13 . 1 1 75 75 LYS H H 75 8.123 8.123 7.511 0.612 25061 8953 1 13 . 1 1 76 76 GLU N N 76 116.294 116.294 117.818 -1.524 25061 8954 1 13 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.110 -0.011 25061 8955 1 13 . 1 1 76 76 GLU C C 76 175.957 175.957 177.109 -1.152 25061 8956 1 13 . 1 1 76 76 GLU CA C 76 55.605 55.605 56.858 -1.253 25061 8957 1 13 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.698 0.126 25061 8958 1 13 . 1 1 76 76 GLU H H 76 7.450 7.450 7.508 -0.058 25061 8959 1 13 . 1 1 77 77 GLY N N 77 107.446 107.446 106.476 0.970 25061 8960 1 13 . 1 1 77 77 GLY C C 77 174.520 174.520 174.682 -0.162 25061 8961 1 13 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.275 0.532 25061 8962 1 13 . 1 1 77 77 GLY H H 77 7.763 7.763 7.559 0.204 25061 8963 1 13 . 1 1 78 78 LEU N N 78 120.179 120.179 119.811 0.368 25061 8964 1 13 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.403 -0.015 25061 8965 1 13 . 1 1 78 78 LEU C C 78 175.914 175.914 176.708 -0.794 25061 8966 1 13 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.876 -0.404 25061 8967 1 13 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.699 -0.810 25061 8968 1 13 . 1 1 78 78 LEU H H 78 7.930 7.930 7.843 0.087 25061 8969 1 13 . 1 1 79 79 ARG N N 79 122.207 122.207 122.343 -0.136 25061 8970 1 13 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.372 0.025 25061 8971 1 13 . 1 1 79 79 ARG C C 79 174.960 174.960 174.667 0.293 25061 8972 1 13 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.373 0.275 25061 8973 1 13 . 1 1 79 79 ARG CB C 79 30.476 30.476 30.759 -0.283 25061 8974 1 13 . 1 1 79 79 ARG H H 79 8.241 8.241 8.471 -0.230 25061 8975 1 13 . 1 1 80 80 VAL N N 80 123.333 123.333 123.976 -0.643 25061 8976 1 13 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.972 0.323 25061 8977 1 13 . 1 1 80 80 VAL C C 80 174.048 174.048 174.178 -0.130 25061 8978 1 13 . 1 1 80 80 VAL CA C 80 60.041 60.041 60.694 -0.653 25061 8979 1 13 . 1 1 80 80 VAL CB C 80 34.305 34.305 33.984 0.321 25061 8980 1 13 . 1 1 80 80 VAL H H 80 8.359 8.359 8.455 -0.096 25061 8981 1 13 . 1 1 81 81 LEU N N 81 128.719 128.719 128.053 0.666 25061 8982 1 13 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.233 -0.129 25061 8983 1 13 . 1 1 81 81 LEU C C 81 174.484 174.484 174.889 -0.405 25061 8984 1 13 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.934 0.186 25061 8985 1 13 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.472 -0.517 25061 8986 1 13 . 1 1 81 81 LEU H H 81 8.650 8.650 9.006 -0.356 25061 8987 1 13 . 1 1 82 82 VAL N N 82 122.487 122.487 127.758 -5.271 25061 8988 1 13 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.287 0.810 25061 8989 1 13 . 1 1 82 82 VAL C C 82 174.525 174.525 175.145 -0.620 25061 8990 1 13 . 1 1 82 82 VAL CA C 82 60.285 60.285 62.010 -1.725 25061 8991 1 13 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.288 2.501 25061 8992 1 13 . 1 1 82 82 VAL H H 82 8.781 8.781 8.194 0.587 25061 8993 1 13 . 1 1 83 83 ILE N N 83 128.082 128.082 130.851 -2.769 25061 8994 1 13 . 1 1 83 83 ILE HA H 83 4.930 4.930 5.056 -0.126 25061 8995 1 13 . 1 1 83 83 ILE C C 83 172.925 172.925 174.916 -1.991 25061 8996 1 13 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.314 -0.373 25061 8997 1 13 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.261 1.925 25061 8998 1 13 . 1 1 83 83 ILE H H 83 9.527 9.527 8.796 0.731 25061 8999 1 13 . 1 1 84 84 LYS N N 84 128.493 128.493 127.330 1.163 25061 9000 1 13 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.267 -0.219 25061 9001 1 13 . 1 1 84 84 LYS C C 84 174.027 174.027 175.099 -1.072 25061 9002 1 13 . 1 1 84 84 LYS CA C 84 53.253 53.253 53.400 -0.147 25061 9003 1 13 . 1 1 84 84 LYS CB C 84 34.652 34.652 36.012 -1.360 25061 9004 1 13 . 1 1 84 84 LYS H H 84 8.721 8.721 8.381 0.340 25061 9005 1 13 . 1 1 85 85 VAL N N 85 126.729 126.729 124.424 2.305 25061 9006 1 13 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.170 0.566 25061 9007 1 13 . 1 1 85 85 VAL C C 85 175.935 175.935 176.772 -0.837 25061 9008 1 13 . 1 1 85 85 VAL CA C 85 60.200 60.200 61.747 -1.547 25061 9009 1 13 . 1 1 85 85 VAL CB C 85 30.847 30.847 30.603 0.244 25061 9010 1 13 . 1 1 85 85 VAL H H 85 8.643 8.643 8.093 0.550 25061 9011 1 13 . 1 1 86 86 ALA N N 86 132.930 132.930 132.218 0.712 25061 9012 1 13 . 1 1 86 86 ALA HA H 86 4.430 4.430 3.987 0.443 25061 9013 1 13 . 1 1 86 86 ALA C C 86 175.635 175.635 178.659 -3.024 25061 9014 1 13 . 1 1 86 86 ALA CA C 86 51.504 51.504 54.206 -2.702 25061 9015 1 13 . 1 1 86 86 ALA CB C 86 20.821 20.821 19.034 1.787 25061 9016 1 13 . 1 1 86 86 ALA H H 86 8.835 8.835 8.810 0.025 25061 9017 1 13 . 1 1 87 87 GLN N N 87 118.719 118.719 116.438 2.281 25061 9018 1 13 . 1 1 87 87 GLN HA H 87 4.469 4.469 3.949 0.520 25061 9019 1 13 . 1 1 87 87 GLN C C 87 175.949 175.949 175.865 0.084 25061 9020 1 13 . 1 1 87 87 GLN CA C 87 55.260 55.260 58.228 -2.968 25061 9021 1 13 . 1 1 87 87 GLN CB C 87 30.432 30.432 27.635 2.797 25061 9022 1 13 . 1 1 87 87 GLN H H 87 8.570 8.570 8.134 0.436 25061 9023 1 13 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.678 -0.198 25061 9024 1 13 . 1 1 88 88 ASP CA C 88 55.454 55.454 54.284 1.170 25061 9025 1 13 . 1 1 88 88 ASP CB C 88 41.204 41.204 41.419 -0.215 25061 9026 1 13 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.648 -0.601 25061 9027 1 13 . 1 1 89 89 GLN CA C 89 56.687 56.687 54.700 1.987 25061 9028 1 13 . 1 1 89 89 GLN CB C 89 27.850 27.850 30.914 -3.064 25061 9029 1 13 . 1 1 92 92 LEU N N 92 125.291 125.291 120.100 5.191 25061 9030 1 13 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.053 0.148 25061 9031 1 13 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.934 -2.877 25061 9032 1 13 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.693 0.353 25061 9033 1 13 . 1 1 92 92 LEU H H 92 8.277 8.277 7.945 0.332 25061 9034 1 13 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.184 0.572 25061 9035 1 13 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.197 -0.148 25061 9036 1 13 . 1 1 94 94 ARG C C 94 178.544 178.544 178.215 0.329 25061 9037 1 13 . 1 1 94 94 ARG CA C 94 58.607 58.607 58.836 -0.229 25061 9038 1 13 . 1 1 94 94 ARG CB C 94 29.614 29.614 29.700 -0.086 25061 9039 1 13 . 1 1 95 95 PHE N N 95 117.407 117.407 122.009 -4.602 25061 9040 1 13 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.235 0.140 25061 9041 1 13 . 1 1 95 95 PHE CA C 95 60.231 60.231 61.157 -0.926 25061 9042 1 13 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.447 -1.505 25061 9043 1 13 . 1 1 95 95 PHE H H 95 8.419 8.419 7.587 0.832 25061 9044 1 13 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.965 -0.157 25061 9045 1 13 . 1 1 96 96 TYR C C 96 177.728 177.728 177.489 0.239 25061 9046 1 13 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.603 1.553 25061 9047 1 13 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.500 -0.800 25061 9048 1 13 . 1 1 97 97 GLU N N 97 119.054 119.054 117.470 1.584 25061 9049 1 13 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.730 0.333 25061 9050 1 13 . 1 1 97 97 GLU C C 97 179.071 179.071 178.792 0.279 25061 9051 1 13 . 1 1 97 97 GLU CA C 97 58.760 58.760 58.917 -0.158 25061 9052 1 13 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.417 -0.245 25061 9053 1 13 . 1 1 97 97 GLU H H 97 7.858 7.858 7.968 -0.110 25061 9054 1 13 . 1 1 98 98 GLN N N 98 119.385 119.385 119.794 -0.409 25061 9055 1 13 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.983 -0.082 25061 9056 1 13 . 1 1 98 98 GLN C C 98 177.599 177.599 178.392 -0.793 25061 9057 1 13 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.293 0.018 25061 9058 1 13 . 1 1 98 98 GLN CB C 98 27.766 27.766 27.990 -0.224 25061 9059 1 13 . 1 1 98 98 GLN H H 98 7.747 7.747 7.452 0.295 25061 9060 1 13 . 1 1 99 99 LEU N N 99 118.348 118.348 118.240 0.108 25061 9061 1 13 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.982 0.037 25061 9062 1 13 . 1 1 99 99 LEU C C 99 178.669 178.669 178.694 -0.025 25061 9063 1 13 . 1 1 99 99 LEU CA C 99 57.430 57.430 57.554 -0.124 25061 9064 1 13 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.159 0.344 25061 9065 1 13 . 1 1 99 99 LEU H H 99 7.891 7.891 7.363 0.528 25061 9066 1 13 . 1 1 100 100 LYS N N 100 118.332 118.332 117.380 0.952 25061 9067 1 13 . 1 1 100 100 LYS HA H 100 4.509 4.509 3.938 0.571 25061 9068 1 13 . 1 1 100 100 LYS C C 100 180.846 180.846 178.834 2.012 25061 9069 1 13 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.591 0.497 25061 9070 1 13 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.628 0.641 25061 9071 1 13 . 1 1 100 100 LYS H H 100 7.560 7.560 7.548 0.012 25061 9072 1 13 . 1 1 101 101 LYS N N 101 121.944 121.944 119.365 2.579 25061 9073 1 13 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.049 0.023 25061 9074 1 13 . 1 1 101 101 LYS C C 101 177.707 177.707 178.385 -0.678 25061 9075 1 13 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.574 0.297 25061 9076 1 13 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.113 -0.018 25061 9077 1 13 . 1 1 101 101 LYS H H 101 7.959 7.959 7.309 0.650 25061 9078 1 13 . 1 1 102 102 ASP N N 102 118.788 118.788 116.623 2.165 25061 9079 1 13 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.483 0.211 25061 9080 1 13 . 1 1 102 102 ASP C C 102 176.359 176.359 177.390 -1.031 25061 9081 1 13 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.306 -0.727 25061 9082 1 13 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.352 -0.778 25061 9083 1 13 . 1 1 102 102 ASP H H 102 7.893 7.893 7.530 0.363 25061 9084 1 13 . 1 1 103 103 GLY N N 103 107.024 107.024 107.279 -0.255 25061 9085 1 13 . 1 1 103 103 GLY C C 103 174.328 174.328 174.498 -0.170 25061 9086 1 13 . 1 1 103 103 GLY CA C 103 45.345 45.345 45.055 0.290 25061 9087 1 13 . 1 1 103 103 GLY H H 103 7.866 7.866 7.657 0.209 25061 9088 1 13 . 1 1 104 104 VAL N N 104 123.060 123.060 121.333 1.727 25061 9089 1 13 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.936 0.037 25061 9090 1 13 . 1 1 104 104 VAL C C 104 175.023 175.023 175.587 -0.564 25061 9091 1 13 . 1 1 104 104 VAL CA C 104 61.878 61.878 62.608 -0.730 25061 9092 1 13 . 1 1 104 104 VAL CB C 104 32.088 32.088 32.041 0.047 25061 9093 1 13 . 1 1 104 104 VAL H H 104 7.955 7.955 7.818 0.137 25061 9094 1 13 . 1 1 105 105 ASP N N 105 127.987 127.987 128.429 -0.442 25061 9095 1 13 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.735 -0.160 25061 9096 1 13 . 1 1 105 105 ASP C C 105 173.624 173.624 175.176 -1.552 25061 9097 1 13 . 1 1 105 105 ASP CA C 105 54.087 54.087 55.191 -1.104 25061 9098 1 13 . 1 1 105 105 ASP CB C 105 40.660 40.660 41.905 -1.245 25061 9099 1 13 . 1 1 105 105 ASP H H 105 8.399 8.399 8.391 0.008 25061 9100 1 13 . 1 1 106 106 VAL N N 106 125.798 125.798 117.236 8.562 25061 9101 1 13 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.548 0.267 25061 9102 1 13 . 1 1 106 106 VAL C C 106 174.902 174.902 175.002 -0.100 25061 9103 1 13 . 1 1 106 106 VAL CA C 106 60.194 60.194 59.981 0.213 25061 9104 1 13 . 1 1 106 106 VAL CB C 106 34.179 34.179 34.760 -0.581 25061 9105 1 13 . 1 1 106 106 VAL H H 106 7.550 7.550 8.231 -0.681 25061 9106 1 13 . 1 1 107 107 ARG N N 107 128.099 128.099 126.473 1.626 25061 9107 1 13 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.684 0.192 25061 9108 1 13 . 1 1 107 107 ARG C C 107 173.815 173.815 175.261 -1.446 25061 9109 1 13 . 1 1 107 107 ARG CA C 107 53.386 53.386 53.751 -0.365 25061 9110 1 13 . 1 1 107 107 ARG CB C 107 31.195 31.195 30.120 1.075 25061 9111 1 13 . 1 1 107 107 ARG H H 107 9.132 9.132 8.302 0.830 25061 9112 1 13 . 1 1 108 108 VAL N N 108 123.979 123.979 122.580 1.399 25061 9113 1 13 . 1 1 108 108 VAL HA H 108 4.942 4.942 4.807 0.135 25061 9114 1 13 . 1 1 108 108 VAL C C 108 175.854 175.854 176.881 -1.027 25061 9115 1 13 . 1 1 108 108 VAL CA C 108 60.017 60.017 61.260 -1.243 25061 9116 1 13 . 1 1 108 108 VAL CB C 108 32.844 32.844 32.292 0.552 25061 9117 1 13 . 1 1 108 108 VAL H H 108 8.561 8.561 8.549 0.012 25061 9118 1 13 . 1 1 109 109 THR N N 109 120.144 120.144 118.284 1.860 25061 9119 1 13 . 1 1 109 109 THR HA H 109 4.815 4.815 4.473 0.342 25061 9120 1 13 . 1 1 109 109 THR C C 109 171.867 171.867 175.474 -3.607 25061 9121 1 13 . 1 1 109 109 THR CA C 109 59.613 59.613 61.837 -2.224 25061 9122 1 13 . 1 1 109 109 THR CB C 109 69.720 69.720 70.156 -0.436 25061 9123 1 13 . 1 1 109 109 THR H H 109 8.803 8.803 8.305 0.498 25061 9124 1 13 . 1 1 110 110 ASP N N 110 123.212 123.212 119.293 3.919 25061 9125 1 13 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.132 0.837 25061 9126 1 13 . 1 1 110 110 ASP C C 110 175.739 175.739 175.569 0.170 25061 9127 1 13 . 1 1 110 110 ASP CA C 110 53.243 53.243 57.546 -4.303 25061 9128 1 13 . 1 1 110 110 ASP CB C 110 41.351 41.351 39.234 2.117 25061 9129 1 13 . 1 1 110 110 ASP H H 110 8.363 8.363 8.482 -0.119 25061 9130 1 13 . 1 1 111 111 ASN N N 111 116.298 116.298 121.397 -5.099 25061 9131 1 13 . 1 1 111 111 ASN HA H 111 4.876 4.876 5.128 -0.252 25061 9132 1 13 . 1 1 111 111 ASN C C 111 174.756 174.756 176.883 -2.127 25061 9133 1 13 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.695 -0.563 25061 9134 1 13 . 1 1 111 111 ASN CB C 111 40.765 40.765 39.885 0.880 25061 9135 1 13 . 1 1 111 111 ASN H H 111 8.085 8.085 7.995 0.090 25061 9136 1 13 . 1 1 112 112 GLU HA H 112 3.848 3.848 3.940 -0.092 25061 9137 1 13 . 1 1 112 112 GLU C C 112 177.016 177.016 178.087 -1.071 25061 9138 1 13 . 1 1 112 112 GLU CA C 112 59.480 59.480 59.534 -0.054 25061 9139 1 13 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.431 0.243 25061 9140 1 13 . 1 1 113 113 ASP N N 113 121.033 121.033 119.646 1.387 25061 9141 1 13 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.344 0.069 25061 9142 1 13 . 1 1 113 113 ASP C C 113 178.988 178.988 178.065 0.923 25061 9143 1 13 . 1 1 113 113 ASP CA C 113 57.855 57.855 57.333 0.522 25061 9144 1 13 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.757 -0.255 25061 9145 1 13 . 1 1 113 113 ASP H H 113 8.219 8.219 8.431 -0.212 25061 9146 1 13 . 1 1 114 114 GLU N N 114 121.280 121.280 120.105 1.175 25061 9147 1 13 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.120 -0.055 25061 9148 1 13 . 1 1 114 114 GLU C C 114 178.776 178.776 177.824 0.952 25061 9149 1 13 . 1 1 114 114 GLU CA C 114 58.714 58.714 58.975 -0.261 25061 9150 1 13 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.222 -0.009 25061 9151 1 13 . 1 1 114 114 GLU H H 114 8.296 8.296 8.117 0.179 25061 9152 1 13 . 1 1 115 115 ALA N N 115 120.924 120.924 121.833 -0.909 25061 9153 1 13 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.038 -0.200 25061 9154 1 13 . 1 1 115 115 ALA C C 115 178.502 178.502 179.317 -0.815 25061 9155 1 13 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.157 0.481 25061 9156 1 13 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.152 0.345 25061 9157 1 13 . 1 1 115 115 ALA H H 115 7.853 7.853 7.600 0.253 25061 9158 1 13 . 1 1 116 116 LYS N N 116 116.616 116.616 117.852 -1.236 25061 9159 1 13 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.896 -0.177 25061 9160 1 13 . 1 1 116 116 LYS C C 116 178.097 178.097 178.525 -0.428 25061 9161 1 13 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.986 0.766 25061 9162 1 13 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.223 0.332 25061 9163 1 13 . 1 1 116 116 LYS H H 116 8.091 8.091 7.746 0.345 25061 9164 1 13 . 1 1 117 117 LYS N N 117 118.990 118.990 118.055 0.935 25061 9165 1 13 . 1 1 117 117 LYS HA H 117 3.911 3.911 4.084 -0.173 25061 9166 1 13 . 1 1 117 117 LYS C C 117 179.186 179.186 179.618 -0.432 25061 9167 1 13 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.217 0.354 25061 9168 1 13 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.316 0.204 25061 9169 1 13 . 1 1 117 117 LYS H H 117 7.742 7.742 7.524 0.218 25061 9170 1 13 . 1 1 118 118 ARG N N 118 117.441 117.441 119.802 -2.361 25061 9171 1 13 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.442 -0.302 25061 9172 1 13 . 1 1 118 118 ARG C C 118 178.921 178.921 178.990 -0.069 25061 9173 1 13 . 1 1 118 118 ARG CA C 118 57.671 57.671 57.963 -0.292 25061 9174 1 13 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.585 0.076 25061 9175 1 13 . 1 1 118 118 ARG H H 118 8.468 8.468 7.508 0.960 25061 9176 1 13 . 1 1 119 119 LEU N N 119 120.100 120.100 120.703 -0.603 25061 9177 1 13 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.893 0.067 25061 9178 1 13 . 1 1 119 119 LEU C C 119 177.554 177.554 178.563 -1.009 25061 9179 1 13 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.264 -0.383 25061 9180 1 13 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.458 0.431 25061 9181 1 13 . 1 1 119 119 LEU H H 119 8.322 8.322 8.190 0.132 25061 9182 1 13 . 1 1 120 120 LYS N N 120 118.238 118.238 119.340 -1.102 25061 9183 1 13 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.898 -0.076 25061 9184 1 13 . 1 1 120 120 LYS C C 120 178.703 178.703 178.903 -0.200 25061 9185 1 13 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.950 0.397 25061 9186 1 13 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.286 -0.050 25061 9187 1 13 . 1 1 120 120 LYS H H 120 7.990 7.990 7.625 0.364 25061 9188 1 13 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.287 -0.265 25061 9189 1 13 . 1 1 121 121 GLU C C 121 177.769 177.769 179.398 -1.629 25061 9190 1 13 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.045 -0.123 25061 9191 1 13 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.519 -0.065 25061 9192 1 13 . 1 1 122 122 LEU N N 122 119.454 119.454 119.685 -0.231 25061 9193 1 13 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.072 0.061 25061 9194 1 13 . 1 1 122 122 LEU C C 122 178.991 178.991 178.903 0.088 25061 9195 1 13 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.579 -0.253 25061 9196 1 13 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.799 -0.120 25061 9197 1 13 . 1 1 122 122 LEU H H 122 7.930 7.930 7.737 0.193 25061 9198 1 13 . 1 1 123 123 LEU N N 123 117.862 117.862 118.462 -0.600 25061 9199 1 13 . 1 1 123 123 LEU HA H 123 4.067 4.067 4.125 -0.058 25061 9200 1 13 . 1 1 123 123 LEU C C 123 179.178 179.178 178.545 0.633 25061 9201 1 13 . 1 1 123 123 LEU CA C 123 56.920 56.920 57.402 -0.482 25061 9202 1 13 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.772 -0.562 25061 9203 1 13 . 1 1 123 123 LEU H H 123 8.095 8.095 7.786 0.309 25061 9204 1 13 . 1 1 124 124 GLU N N 124 118.975 118.975 116.958 2.017 25061 9205 1 13 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.162 -0.033 25061 9206 1 13 . 1 1 124 124 GLU C C 124 177.777 177.777 177.223 0.554 25061 9207 1 13 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.224 -0.136 25061 9208 1 13 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.958 -0.418 25061 9209 1 13 . 1 1 124 124 GLU H H 124 7.930 7.930 7.941 -0.011 25061 9210 1 13 . 1 1 125 125 LYS N N 125 118.933 118.933 118.664 0.269 25061 9211 1 13 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.462 -0.125 25061 9212 1 13 . 1 1 125 125 LYS C C 125 178.188 178.188 175.848 2.340 25061 9213 1 13 . 1 1 125 125 LYS CA C 125 56.980 56.980 55.178 1.802 25061 9214 1 13 . 1 1 125 125 LYS CB C 125 32.608 32.608 34.120 -1.512 25061 9215 1 13 . 1 1 125 125 LYS H H 125 7.729 7.729 7.588 0.141 25061 9216 1 13 . 1 1 126 126 VAL N N 126 117.933 117.933 118.768 -0.835 25061 9217 1 13 . 1 1 126 126 VAL HA H 126 4.022 4.022 4.173 -0.151 25061 9218 1 13 . 1 1 126 126 VAL C C 126 176.947 176.947 175.977 0.970 25061 9219 1 13 . 1 1 126 126 VAL CA C 126 63.641 63.641 61.623 2.018 25061 9220 1 13 . 1 1 126 126 VAL CB C 126 31.859 31.859 30.517 1.342 25061 9221 1 13 . 1 1 126 126 VAL H H 126 8.044 8.044 8.186 -0.142 25061 9222 1 13 . 1 1 127 127 GLY N N 127 109.813 109.813 109.792 0.021 25061 9223 1 13 . 1 1 127 127 GLY C C 127 174.264 174.264 173.814 0.450 25061 9224 1 13 . 1 1 127 127 GLY CA C 127 45.279 45.279 46.587 -1.308 25061 9225 1 13 . 1 1 127 127 GLY H H 127 8.279 8.279 8.369 -0.090 25061 9226 1 13 . 1 1 128 128 SER N N 128 115.185 115.185 114.811 0.374 25061 9227 1 13 . 1 1 128 128 SER HA H 128 4.462 4.462 4.443 0.019 25061 9228 1 13 . 1 1 128 128 SER C C 128 174.775 174.775 173.865 0.910 25061 9229 1 13 . 1 1 128 128 SER CA C 128 58.739 58.739 57.770 0.969 25061 9230 1 13 . 1 1 128 128 SER CB C 128 63.850 63.850 64.077 -0.227 25061 9231 1 13 . 1 1 128 128 SER H H 128 8.048 8.048 8.054 -0.006 25061 9232 1 13 . 1 1 129 129 LEU N N 129 123.060 123.060 118.642 4.418 25061 9233 1 13 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.053 0.245 25061 9234 1 13 . 1 1 129 129 LEU C C 129 177.313 177.313 175.150 2.163 25061 9235 1 13 . 1 1 129 129 LEU CA C 129 55.158 55.158 55.737 -0.579 25061 9236 1 13 . 1 1 129 129 LEU CB C 129 41.837 41.837 42.605 -0.767 25061 9237 1 13 . 1 1 129 129 LEU H H 129 8.147 8.147 8.106 0.041 25061 9238 1 13 . 1 1 130 130 GLU N N 130 120.088 120.088 120.058 0.030 25061 9239 1 13 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.501 -0.320 25061 9240 1 13 . 1 1 130 130 GLU C C 130 176.148 176.148 176.741 -0.593 25061 9241 1 13 . 1 1 130 130 GLU CA C 130 56.726 56.726 55.738 0.988 25061 9242 1 13 . 1 1 130 130 GLU CB C 130 30.026 30.026 30.324 -0.298 25061 9243 1 13 . 1 1 130 130 GLU H H 130 8.242 8.242 8.307 -0.065 25061 9244 1 14 . 1 1 2 2 GLY CA C 2 45.319 45.319 45.407 -0.088 25061 9245 1 14 . 1 1 3 3 THR HA H 3 4.820 4.820 4.790 0.030 25061 9246 1 14 . 1 1 3 3 THR C C 3 172.374 172.374 173.630 -1.256 25061 9247 1 14 . 1 1 3 3 THR CA C 3 62.760 62.760 60.357 2.403 25061 9248 1 14 . 1 1 3 3 THR CB C 3 71.441 71.441 70.588 0.853 25061 9249 1 14 . 1 1 4 4 VAL N N 4 126.881 126.881 122.629 4.252 25061 9250 1 14 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.807 -0.239 25061 9251 1 14 . 1 1 4 4 VAL C C 4 173.116 173.116 174.451 -1.335 25061 9252 1 14 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.509 -1.054 25061 9253 1 14 . 1 1 4 4 VAL CB C 4 33.800 33.800 33.532 0.268 25061 9254 1 14 . 1 1 4 4 VAL H H 4 9.097 9.097 8.700 0.397 25061 9255 1 14 . 1 1 5 5 VAL N N 5 127.172 127.172 124.075 3.097 25061 9256 1 14 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.412 -0.525 25061 9257 1 14 . 1 1 5 5 VAL C C 5 174.091 174.091 174.625 -0.534 25061 9258 1 14 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.072 1.046 25061 9259 1 14 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.205 -0.270 25061 9260 1 14 . 1 1 5 5 VAL H H 5 8.811 8.811 8.869 -0.058 25061 9261 1 14 . 1 1 6 6 ILE N N 6 127.577 127.577 129.079 -1.502 25061 9262 1 14 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.406 0.214 25061 9263 1 14 . 1 1 6 6 ILE C C 6 173.328 173.328 175.259 -1.931 25061 9264 1 14 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.792 0.040 25061 9265 1 14 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.351 1.579 25061 9266 1 14 . 1 1 6 6 ILE H H 6 9.210 9.210 8.503 0.707 25061 9267 1 14 . 1 1 7 7 VAL N N 7 129.024 129.024 130.005 -0.981 25061 9268 1 14 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.256 0.549 25061 9269 1 14 . 1 1 7 7 VAL C C 7 173.561 173.561 174.972 -1.411 25061 9270 1 14 . 1 1 7 7 VAL CA C 7 60.849 60.849 62.315 -1.466 25061 9271 1 14 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.129 1.231 25061 9272 1 14 . 1 1 7 7 VAL H H 7 9.294 9.294 8.185 1.109 25061 9273 1 14 . 1 1 8 8 VAL N N 8 125.318 125.318 129.742 -4.424 25061 9274 1 14 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.294 0.102 25061 9275 1 14 . 1 1 8 8 VAL C C 8 175.723 175.723 175.468 0.255 25061 9276 1 14 . 1 1 8 8 VAL CA C 8 59.617 59.617 60.135 -0.518 25061 9277 1 14 . 1 1 8 8 VAL CB C 8 34.915 34.915 33.580 1.335 25061 9278 1 14 . 1 1 8 8 VAL H H 8 8.898 8.898 9.027 -0.129 25061 9279 1 14 . 1 1 9 9 SER N N 9 116.544 116.544 119.971 -3.427 25061 9280 1 14 . 1 1 9 9 SER HA H 9 4.724 4.724 5.046 -0.322 25061 9281 1 14 . 1 1 9 9 SER C C 9 174.552 174.552 173.999 0.553 25061 9282 1 14 . 1 1 9 9 SER CA C 9 57.419 57.419 57.533 -0.114 25061 9283 1 14 . 1 1 9 9 SER CB C 9 64.998 64.998 65.567 -0.569 25061 9284 1 14 . 1 1 9 9 SER H H 9 7.833 7.833 8.300 -0.467 25061 9285 1 14 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.447 0.465 25061 9286 1 14 . 1 1 10 10 ASN C C 10 176.170 176.170 173.981 2.189 25061 9287 1 14 . 1 1 10 10 ASN CA C 10 54.141 54.141 56.057 -1.916 25061 9288 1 14 . 1 1 10 10 ASN CB C 10 38.626 38.626 39.121 -0.495 25061 9289 1 14 . 1 1 11 11 ASP N N 11 120.164 120.164 117.497 2.667 25061 9290 1 14 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.742 0.101 25061 9291 1 14 . 1 1 11 11 ASP C C 11 176.148 176.148 176.566 -0.418 25061 9292 1 14 . 1 1 11 11 ASP CA C 11 52.620 52.620 53.233 -0.613 25061 9293 1 14 . 1 1 11 11 ASP CB C 11 42.631 42.631 42.718 -0.087 25061 9294 1 14 . 1 1 11 11 ASP H H 11 8.142 8.142 7.820 0.322 25061 9295 1 14 . 1 1 12 12 GLU N N 12 127.184 127.184 124.551 2.633 25061 9296 1 14 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.021 -0.168 25061 9297 1 14 . 1 1 12 12 GLU C C 12 177.853 177.853 178.108 -0.255 25061 9298 1 14 . 1 1 12 12 GLU CA C 12 59.547 59.547 59.921 -0.374 25061 9299 1 14 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.982 -0.163 25061 9300 1 14 . 1 1 12 12 GLU H H 12 9.152 9.152 8.944 0.208 25061 9301 1 14 . 1 1 13 13 ARG N N 13 119.026 119.026 117.396 1.630 25061 9302 1 14 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.394 -0.291 25061 9303 1 14 . 1 1 13 13 ARG C C 13 179.151 179.151 178.883 0.268 25061 9304 1 14 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.545 0.398 25061 9305 1 14 . 1 1 13 13 ARG CB C 13 28.757 28.757 29.734 -0.977 25061 9306 1 14 . 1 1 13 13 ARG H H 13 8.389 8.389 8.798 -0.409 25061 9307 1 14 . 1 1 14 14 ILE N N 14 119.238 119.238 121.105 -1.867 25061 9308 1 14 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.686 -0.085 25061 9309 1 14 . 1 1 14 14 ILE C C 14 177.905 177.905 177.486 0.419 25061 9310 1 14 . 1 1 14 14 ILE CA C 14 64.666 64.666 65.257 -0.591 25061 9311 1 14 . 1 1 14 14 ILE CB C 14 36.780 36.780 37.700 -0.920 25061 9312 1 14 . 1 1 14 14 ILE H H 14 7.254 7.254 7.931 -0.677 25061 9313 1 14 . 1 1 15 15 LEU N N 15 117.008 117.008 119.504 -2.496 25061 9314 1 14 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.093 -0.172 25061 9315 1 14 . 1 1 15 15 LEU C C 15 178.062 178.062 179.393 -1.331 25061 9316 1 14 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.287 0.124 25061 9317 1 14 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.421 -0.252 25061 9318 1 14 . 1 1 15 15 LEU H H 15 7.412 7.412 7.588 -0.176 25061 9319 1 14 . 1 1 16 16 GLU N N 16 117.637 117.637 118.499 -0.862 25061 9320 1 14 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.904 -0.203 25061 9321 1 14 . 1 1 16 16 GLU C C 16 179.182 179.182 178.965 0.217 25061 9322 1 14 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.434 -0.017 25061 9323 1 14 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.346 0.113 25061 9324 1 14 . 1 1 16 16 GLU H H 16 7.981 7.981 7.875 0.105 25061 9325 1 14 . 1 1 17 17 GLU N N 17 119.759 119.759 121.143 -1.384 25061 9326 1 14 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.081 -0.065 25061 9327 1 14 . 1 1 17 17 GLU C C 17 179.949 179.949 179.112 0.837 25061 9328 1 14 . 1 1 17 17 GLU CA C 17 59.195 59.195 58.980 0.215 25061 9329 1 14 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.404 0.136 25061 9330 1 14 . 1 1 17 17 GLU H H 17 8.248 8.248 8.094 0.154 25061 9331 1 14 . 1 1 18 18 LEU N N 18 119.764 119.764 119.284 0.480 25061 9332 1 14 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.184 -0.103 25061 9333 1 14 . 1 1 18 18 LEU C C 18 177.620 177.620 179.198 -1.578 25061 9334 1 14 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.691 -0.013 25061 9335 1 14 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.599 -0.488 25061 9336 1 14 . 1 1 18 18 LEU H H 18 8.486 8.486 8.196 0.290 25061 9337 1 14 . 1 1 19 19 LEU N N 19 123.102 123.102 120.993 2.109 25061 9338 1 14 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.738 -0.076 25061 9339 1 14 . 1 1 19 19 LEU C C 19 178.343 178.343 178.354 -0.011 25061 9340 1 14 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.547 0.689 25061 9341 1 14 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.360 -0.709 25061 9342 1 14 . 1 1 19 19 LEU H H 19 7.870 7.870 7.917 -0.047 25061 9343 1 14 . 1 1 20 20 GLU N N 20 117.884 117.884 118.235 -0.351 25061 9344 1 14 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.921 -0.017 25061 9345 1 14 . 1 1 20 20 GLU C C 20 177.707 177.707 179.091 -1.384 25061 9346 1 14 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.554 -0.162 25061 9347 1 14 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.569 -0.592 25061 9348 1 14 . 1 1 20 20 GLU H H 20 7.497 7.497 7.682 -0.185 25061 9349 1 14 . 1 1 21 21 VAL N N 21 117.709 117.709 120.131 -2.422 25061 9350 1 14 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.743 -0.119 25061 9351 1 14 . 1 1 21 21 VAL C C 21 178.523 178.523 177.757 0.766 25061 9352 1 14 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.638 -0.441 25061 9353 1 14 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.420 -0.273 25061 9354 1 14 . 1 1 21 21 VAL H H 21 7.514 7.514 7.543 -0.029 25061 9355 1 14 . 1 1 22 22 VAL N N 22 121.233 121.233 120.244 0.989 25061 9356 1 14 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.596 -0.150 25061 9357 1 14 . 1 1 22 22 VAL C C 22 176.868 176.868 178.180 -1.312 25061 9358 1 14 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.715 0.298 25061 9359 1 14 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.739 -0.425 25061 9360 1 14 . 1 1 22 22 VAL H H 22 7.863 7.863 7.521 0.342 25061 9361 1 14 . 1 1 23 23 LEU N N 23 118.101 118.101 118.965 -0.864 25061 9362 1 14 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.197 -0.132 25061 9363 1 14 . 1 1 23 23 LEU C C 23 179.701 179.701 179.081 0.620 25061 9364 1 14 . 1 1 23 23 LEU CA C 23 57.296 57.296 58.023 -0.727 25061 9365 1 14 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.228 0.475 25061 9366 1 14 . 1 1 23 23 LEU H H 23 8.151 8.151 8.163 -0.012 25061 9367 1 14 . 1 1 24 24 LYS N N 24 114.622 114.622 118.479 -3.857 25061 9368 1 14 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.064 0.073 25061 9369 1 14 . 1 1 24 24 LYS C C 24 178.062 178.062 178.844 -0.782 25061 9370 1 14 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.971 -1.603 25061 9371 1 14 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.469 0.125 25061 9372 1 14 . 1 1 24 24 LYS H H 24 7.823 7.823 7.806 0.017 25061 9373 1 14 . 1 1 25 25 SER N N 25 115.474 115.474 113.790 1.684 25061 9374 1 14 . 1 1 25 25 SER HA H 25 4.377 4.377 4.278 0.099 25061 9375 1 14 . 1 1 25 25 SER C C 25 174.520 174.520 174.682 -0.162 25061 9376 1 14 . 1 1 25 25 SER CA C 25 61.049 61.049 60.170 0.879 25061 9377 1 14 . 1 1 25 25 SER CB C 25 63.777 63.777 64.085 -0.308 25061 9378 1 14 . 1 1 25 25 SER H H 25 7.798 7.798 8.127 -0.329 25061 9379 1 14 . 1 1 26 26 ASP N N 26 117.424 117.424 116.908 0.516 25061 9380 1 14 . 1 1 26 26 ASP HA H 26 4.886 4.886 4.963 -0.077 25061 9381 1 14 . 1 1 26 26 ASP C C 26 173.521 173.521 173.883 -0.362 25061 9382 1 14 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.738 -0.690 25061 9383 1 14 . 1 1 26 26 ASP CB C 26 42.202 42.202 42.883 -0.681 25061 9384 1 14 . 1 1 26 26 ASP H H 26 7.990 7.990 7.799 0.191 25061 9385 1 14 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.576 0.069 25061 9386 1 14 . 1 1 27 27 PRO C C 27 177.016 177.016 176.683 0.333 25061 9387 1 14 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.916 -0.315 25061 9388 1 14 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.674 -0.501 25061 9389 1 14 . 1 1 28 28 ASN N N 28 115.839 115.839 115.971 -0.132 25061 9390 1 14 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.742 -0.050 25061 9391 1 14 . 1 1 28 28 ASN C C 28 175.701 175.701 175.433 0.268 25061 9392 1 14 . 1 1 28 28 ASN CA C 28 53.472 53.472 52.582 0.890 25061 9393 1 14 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.618 -0.405 25061 9394 1 14 . 1 1 28 28 ASN H H 28 8.608 8.608 8.253 0.355 25061 9395 1 14 . 1 1 29 29 VAL N N 29 120.770 120.770 122.500 -1.730 25061 9396 1 14 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.944 -0.129 25061 9397 1 14 . 1 1 29 29 VAL C C 29 175.023 175.023 175.241 -0.218 25061 9398 1 14 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.465 -0.914 25061 9399 1 14 . 1 1 29 29 VAL CB C 29 32.147 32.147 32.035 0.112 25061 9400 1 14 . 1 1 29 29 VAL H H 29 7.428 7.428 7.592 -0.164 25061 9401 1 14 . 1 1 30 30 LYS N N 30 127.345 127.345 129.704 -2.359 25061 9402 1 14 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.334 0.145 25061 9403 1 14 . 1 1 30 30 LYS C C 30 174.777 174.777 175.778 -1.001 25061 9404 1 14 . 1 1 30 30 LYS CA C 30 55.204 55.204 55.464 -0.260 25061 9405 1 14 . 1 1 30 30 LYS CB C 30 31.949 31.949 32.328 -0.379 25061 9406 1 14 . 1 1 30 30 LYS H H 30 8.457 8.457 8.217 0.240 25061 9407 1 14 . 1 1 31 31 THR N N 31 113.552 113.552 119.209 -5.657 25061 9408 1 14 . 1 1 31 31 THR HA H 31 5.723 5.723 5.288 0.435 25061 9409 1 14 . 1 1 31 31 THR C C 31 174.593 174.593 174.299 0.294 25061 9410 1 14 . 1 1 31 31 THR CA C 31 59.030 59.030 60.448 -1.418 25061 9411 1 14 . 1 1 31 31 THR CB C 31 72.206 72.206 69.493 2.713 25061 9412 1 14 . 1 1 31 31 THR H H 31 8.164 8.164 8.312 -0.148 25061 9413 1 14 . 1 1 32 32 VAL N N 32 119.206 119.206 126.889 -7.683 25061 9414 1 14 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.462 -0.057 25061 9415 1 14 . 1 1 32 32 VAL C C 32 172.663 172.663 175.094 -2.431 25061 9416 1 14 . 1 1 32 32 VAL CA C 32 61.072 61.072 60.789 0.283 25061 9417 1 14 . 1 1 32 32 VAL CB C 32 35.051 35.051 34.823 0.228 25061 9418 1 14 . 1 1 32 32 VAL H H 32 8.615 8.615 8.818 -0.203 25061 9419 1 14 . 1 1 33 33 ARG N N 33 130.278 130.278 127.562 2.716 25061 9420 1 14 . 1 1 33 33 ARG HA H 33 5.331 5.331 5.068 0.263 25061 9421 1 14 . 1 1 33 33 ARG C C 33 173.836 173.836 175.385 -1.549 25061 9422 1 14 . 1 1 33 33 ARG CA C 33 54.150 54.150 54.529 -0.379 25061 9423 1 14 . 1 1 33 33 ARG CB C 33 30.028 30.028 29.405 0.622 25061 9424 1 14 . 1 1 33 33 ARG H H 33 8.996 8.996 8.637 0.359 25061 9425 1 14 . 1 1 34 34 THR N N 34 121.695 121.695 118.547 3.148 25061 9426 1 14 . 1 1 34 34 THR HA H 34 4.483 4.483 4.531 -0.048 25061 9427 1 14 . 1 1 34 34 THR C C 34 169.769 169.769 174.022 -4.253 25061 9428 1 14 . 1 1 34 34 THR CA C 34 60.814 60.814 61.466 -0.652 25061 9429 1 14 . 1 1 34 34 THR CB C 34 67.402 67.402 71.741 -4.339 25061 9430 1 14 . 1 1 34 34 THR H H 34 8.126 8.126 7.870 0.257 25061 9431 1 14 . 1 1 35 35 ASP N N 35 122.198 122.198 122.359 -0.161 25061 9432 1 14 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.542 0.282 25061 9433 1 14 . 1 1 35 35 ASP C C 35 174.790 174.790 175.481 -0.691 25061 9434 1 14 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.322 -0.936 25061 9435 1 14 . 1 1 35 35 ASP CB C 35 41.848 41.848 41.140 0.708 25061 9436 1 14 . 1 1 35 35 ASP H H 35 7.983 7.983 8.333 -0.350 25061 9437 1 14 . 1 1 36 36 ASP N N 36 121.091 121.091 122.523 -1.432 25061 9438 1 14 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.415 0.178 25061 9439 1 14 . 1 1 36 36 ASP C C 36 176.189 176.189 177.323 -1.134 25061 9440 1 14 . 1 1 36 36 ASP CA C 36 53.055 53.055 54.963 -1.908 25061 9441 1 14 . 1 1 36 36 ASP CB C 36 42.159 42.159 40.567 1.592 25061 9442 1 14 . 1 1 36 36 ASP H H 36 8.157 8.157 8.249 -0.092 25061 9443 1 14 . 1 1 37 37 LYS N N 37 125.839 125.839 126.117 -0.278 25061 9444 1 14 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.886 -0.164 25061 9445 1 14 . 1 1 37 37 LYS C C 37 176.870 176.870 178.000 -1.130 25061 9446 1 14 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.470 -0.066 25061 9447 1 14 . 1 1 37 37 LYS CB C 37 32.394 32.394 32.129 0.265 25061 9448 1 14 . 1 1 37 37 LYS H H 37 8.843 8.843 8.578 0.265 25061 9449 1 14 . 1 1 38 38 GLU N N 38 118.369 118.369 118.871 -0.502 25061 9450 1 14 . 1 1 38 38 GLU HA H 38 4.007 4.007 4.008 -0.001 25061 9451 1 14 . 1 1 38 38 GLU C C 38 179.502 179.502 178.515 0.987 25061 9452 1 14 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.927 -0.257 25061 9453 1 14 . 1 1 38 38 GLU CB C 38 28.474 28.474 28.775 -0.301 25061 9454 1 14 . 1 1 38 38 GLU H H 38 8.182 8.182 8.798 -0.616 25061 9455 1 14 . 1 1 39 39 LYS N N 39 121.722 121.722 120.518 1.204 25061 9456 1 14 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.363 -0.198 25061 9457 1 14 . 1 1 39 39 LYS C C 39 178.500 178.500 178.806 -0.306 25061 9458 1 14 . 1 1 39 39 LYS CA C 39 57.736 57.736 58.431 -0.695 25061 9459 1 14 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.692 -1.554 25061 9460 1 14 . 1 1 39 39 LYS H H 39 7.524 7.524 7.519 0.005 25061 9461 1 14 . 1 1 40 40 VAL N N 40 117.199 117.199 119.810 -2.611 25061 9462 1 14 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.572 -0.344 25061 9463 1 14 . 1 1 40 40 VAL C C 40 177.362 177.362 177.695 -0.333 25061 9464 1 14 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.795 0.847 25061 9465 1 14 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.422 -0.518 25061 9466 1 14 . 1 1 40 40 VAL H H 40 7.883 7.883 8.249 -0.366 25061 9467 1 14 . 1 1 41 41 LYS N N 41 117.677 117.677 119.488 -1.811 25061 9468 1 14 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.870 -0.428 25061 9469 1 14 . 1 1 41 41 LYS C C 41 177.686 177.686 178.930 -1.244 25061 9470 1 14 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.931 0.878 25061 9471 1 14 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.727 -0.112 25061 9472 1 14 . 1 1 41 41 LYS H H 41 7.567 7.567 7.460 0.107 25061 9473 1 14 . 1 1 42 42 GLU N N 42 118.369 118.369 118.900 -0.531 25061 9474 1 14 . 1 1 42 42 GLU HA H 42 4.007 4.007 3.985 0.022 25061 9475 1 14 . 1 1 42 42 GLU C C 42 179.725 179.725 178.910 0.815 25061 9476 1 14 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.472 -0.403 25061 9477 1 14 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.373 0.165 25061 9478 1 14 . 1 1 42 42 GLU H H 42 7.634 7.634 7.616 0.018 25061 9479 1 14 . 1 1 43 43 GLU N N 43 117.906 117.906 119.203 -1.297 25061 9480 1 14 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.163 0.020 25061 9481 1 14 . 1 1 43 43 GLU C C 43 179.757 179.757 179.217 0.540 25061 9482 1 14 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.536 -0.170 25061 9483 1 14 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.186 -0.345 25061 9484 1 14 . 1 1 43 43 GLU H H 43 8.162 8.162 8.043 0.119 25061 9485 1 14 . 1 1 44 44 ILE N N 44 122.291 122.291 120.450 1.841 25061 9486 1 14 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.675 -0.063 25061 9487 1 14 . 1 1 44 44 ILE C C 44 177.101 177.101 177.775 -0.674 25061 9488 1 14 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.921 0.434 25061 9489 1 14 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.829 -0.369 25061 9490 1 14 . 1 1 44 44 ILE H H 44 8.742 8.742 8.370 0.372 25061 9491 1 14 . 1 1 45 45 GLU N N 45 119.892 119.892 119.741 0.151 25061 9492 1 14 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.149 -0.091 25061 9493 1 14 . 1 1 45 45 GLU C C 45 178.991 178.991 178.205 0.786 25061 9494 1 14 . 1 1 45 45 GLU CA C 45 59.665 59.665 58.917 0.748 25061 9495 1 14 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.338 -0.177 25061 9496 1 14 . 1 1 45 45 GLU H H 45 8.171 8.171 8.068 0.103 25061 9497 1 14 . 1 1 46 46 LYS N N 46 118.064 118.064 118.718 -0.654 25061 9498 1 14 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.130 -0.148 25061 9499 1 14 . 1 1 46 46 LYS C C 46 178.837 178.837 178.916 -0.079 25061 9500 1 14 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.063 0.678 25061 9501 1 14 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.452 -0.009 25061 9502 1 14 . 1 1 46 46 LYS H H 46 7.785 7.785 7.576 0.209 25061 9503 1 14 . 1 1 47 47 ALA N N 47 121.817 121.817 121.713 0.104 25061 9504 1 14 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.049 -0.018 25061 9505 1 14 . 1 1 47 47 ALA C C 47 179.859 179.859 179.545 0.314 25061 9506 1 14 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.007 0.288 25061 9507 1 14 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.534 -0.878 25061 9508 1 14 . 1 1 47 47 ALA H H 47 8.123 8.123 7.873 0.250 25061 9509 1 14 . 1 1 48 48 ARG N N 48 119.080 119.080 116.498 2.582 25061 9510 1 14 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.058 0.031 25061 9511 1 14 . 1 1 48 48 ARG C C 48 180.155 180.155 178.390 1.765 25061 9512 1 14 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.801 0.396 25061 9513 1 14 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.833 -0.323 25061 9514 1 14 . 1 1 48 48 ARG H H 48 8.768 8.768 8.076 0.692 25061 9515 1 14 . 1 1 49 49 LYS N N 49 119.951 119.951 117.429 2.522 25061 9516 1 14 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.246 -0.207 25061 9517 1 14 . 1 1 49 49 LYS C C 49 178.288 178.288 178.359 -0.071 25061 9518 1 14 . 1 1 49 49 LYS CA C 49 58.837 58.837 57.879 0.959 25061 9519 1 14 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.429 -0.286 25061 9520 1 14 . 1 1 49 49 LYS H H 49 8.037 8.037 7.719 0.318 25061 9521 1 14 . 1 1 50 50 GLN N N 50 115.284 115.284 118.221 -2.937 25061 9522 1 14 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.162 0.180 25061 9523 1 14 . 1 1 50 50 GLN C C 50 176.180 176.180 176.796 -0.616 25061 9524 1 14 . 1 1 50 50 GLN CA C 50 55.741 55.741 56.263 -0.522 25061 9525 1 14 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.709 -0.144 25061 9526 1 14 . 1 1 50 50 GLN H H 50 7.740 7.740 7.845 -0.105 25061 9527 1 14 . 1 1 51 51 GLY N N 51 109.725 109.725 108.389 1.336 25061 9528 1 14 . 1 1 51 51 GLY C C 51 174.552 174.552 173.529 1.023 25061 9529 1 14 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.240 1.123 25061 9530 1 14 . 1 1 51 51 GLY H H 51 8.027 8.027 7.840 0.187 25061 9531 1 14 . 1 1 52 52 ARG N N 52 119.064 119.064 119.006 0.058 25061 9532 1 14 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.837 0.060 25061 9533 1 14 . 1 1 52 52 ARG C C 52 173.123 173.123 173.443 -0.320 25061 9534 1 14 . 1 1 52 52 ARG CA C 52 52.247 52.247 52.995 -0.747 25061 9535 1 14 . 1 1 52 52 ARG CB C 52 32.366 32.366 31.182 1.184 25061 9536 1 14 . 1 1 52 52 ARG H H 52 7.969 7.969 7.765 0.204 25061 9537 1 14 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.842 0.013 25061 9538 1 14 . 1 1 53 53 PRO C C 53 174.069 174.069 175.694 -1.625 25061 9539 1 14 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.755 -0.937 25061 9540 1 14 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.383 -0.323 25061 9541 1 14 . 1 1 54 54 ILE N N 54 116.301 116.301 122.628 -6.327 25061 9542 1 14 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.885 0.353 25061 9543 1 14 . 1 1 54 54 ILE C C 54 171.709 171.709 173.663 -1.954 25061 9544 1 14 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.098 -1.324 25061 9545 1 14 . 1 1 54 54 ILE CB C 54 41.558 41.558 42.059 -0.500 25061 9546 1 14 . 1 1 54 54 ILE H H 54 7.920 7.920 8.302 -0.382 25061 9547 1 14 . 1 1 55 55 VAL N N 55 126.302 126.302 128.835 -2.533 25061 9548 1 14 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.122 -0.198 25061 9549 1 14 . 1 1 55 55 VAL C C 55 173.624 173.624 174.779 -1.155 25061 9550 1 14 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.517 -0.722 25061 9551 1 14 . 1 1 55 55 VAL CB C 55 32.828 32.828 33.511 -0.683 25061 9552 1 14 . 1 1 55 55 VAL H H 55 8.652 8.652 8.934 -0.281 25061 9553 1 14 . 1 1 56 56 ILE N N 56 127.503 127.503 127.904 -0.401 25061 9554 1 14 . 1 1 56 56 ILE HA H 56 4.664 4.664 5.109 -0.445 25061 9555 1 14 . 1 1 56 56 ILE C C 56 173.479 173.479 175.609 -2.130 25061 9556 1 14 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.422 0.585 25061 9557 1 14 . 1 1 56 56 ILE CB C 56 40.285 40.285 37.696 2.589 25061 9558 1 14 . 1 1 56 56 ILE H H 56 9.124 9.124 7.970 1.154 25061 9559 1 14 . 1 1 57 57 PHE N N 57 125.302 125.302 128.647 -3.345 25061 9560 1 14 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.190 0.026 25061 9561 1 14 . 1 1 57 57 PHE C C 57 174.536 174.536 176.030 -1.494 25061 9562 1 14 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.545 -0.584 25061 9563 1 14 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.843 0.586 25061 9564 1 14 . 1 1 57 57 PHE H H 57 8.971 8.971 8.573 0.398 25061 9565 1 14 . 1 1 58 58 ILE N N 58 126.472 126.472 117.993 8.479 25061 9566 1 14 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.736 -0.221 25061 9567 1 14 . 1 1 58 58 ILE C C 58 173.391 173.391 174.170 -0.779 25061 9568 1 14 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.128 -0.038 25061 9569 1 14 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.269 -0.527 25061 9570 1 14 . 1 1 58 58 ILE H H 58 9.248 9.248 9.160 0.088 25061 9571 1 14 . 1 1 59 59 ARG N N 59 124.681 124.681 121.678 3.003 25061 9572 1 14 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.139 -0.210 25061 9573 1 14 . 1 1 59 59 ARG C C 59 178.521 178.521 178.220 0.301 25061 9574 1 14 . 1 1 59 59 ARG CA C 59 55.742 55.742 55.947 -0.205 25061 9575 1 14 . 1 1 59 59 ARG CB C 59 30.918 30.918 32.092 -1.173 25061 9576 1 14 . 1 1 59 59 ARG H H 59 8.587 8.587 8.869 -0.282 25061 9577 1 14 . 1 1 60 60 GLY N N 60 108.848 108.848 110.815 -1.967 25061 9578 1 14 . 1 1 60 60 GLY C C 60 174.775 174.775 174.342 0.433 25061 9579 1 14 . 1 1 60 60 GLY CA C 60 46.967 46.967 46.993 -0.026 25061 9580 1 14 . 1 1 60 60 GLY H H 60 7.732 7.732 8.428 -0.696 25061 9581 1 14 . 1 1 61 61 ALA N N 61 120.877 120.877 122.982 -2.105 25061 9582 1 14 . 1 1 61 61 ALA HA H 61 4.144 4.144 3.977 0.167 25061 9583 1 14 . 1 1 61 61 ALA C C 61 177.769 177.769 179.042 -1.273 25061 9584 1 14 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.610 -0.161 25061 9585 1 14 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.470 -0.099 25061 9586 1 14 . 1 1 61 61 ALA H H 61 7.852 7.852 7.933 -0.081 25061 9587 1 14 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.253 0.547 25061 9588 1 14 . 1 1 62 62 TYR CA C 62 63.039 63.039 59.768 3.271 25061 9589 1 14 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.896 -0.456 25061 9590 1 14 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.959 -0.274 25061 9591 1 14 . 1 1 63 63 GLU C C 63 176.251 176.251 178.518 -2.267 25061 9592 1 14 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.273 -0.015 25061 9593 1 14 . 1 1 63 63 GLU CB C 63 29.412 29.412 28.603 0.809 25061 9594 1 14 . 1 1 64 64 GLU N N 64 119.209 119.209 119.843 -0.634 25061 9595 1 14 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.548 0.353 25061 9596 1 14 . 1 1 64 64 GLU C C 64 178.251 178.251 178.900 -0.649 25061 9597 1 14 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.487 0.725 25061 9598 1 14 . 1 1 64 64 GLU CB C 64 28.645 28.645 28.903 -0.258 25061 9599 1 14 . 1 1 64 64 GLU H H 64 8.878 8.878 7.850 1.028 25061 9600 1 14 . 1 1 65 65 VAL N N 65 116.728 116.728 119.904 -3.176 25061 9601 1 14 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.884 0.098 25061 9602 1 14 . 1 1 65 65 VAL C C 65 176.915 176.915 177.645 -0.730 25061 9603 1 14 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.337 -0.728 25061 9604 1 14 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.053 0.842 25061 9605 1 14 . 1 1 65 65 VAL H H 65 7.652 7.652 7.975 -0.323 25061 9606 1 14 . 1 1 66 66 VAL N N 66 119.462 119.462 119.949 -0.487 25061 9607 1 14 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.744 -0.430 25061 9608 1 14 . 1 1 66 66 VAL C C 66 177.142 177.142 177.712 -0.570 25061 9609 1 14 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.144 1.191 25061 9610 1 14 . 1 1 66 66 VAL CB C 66 31.430 31.430 30.924 0.506 25061 9611 1 14 . 1 1 66 66 VAL H H 66 7.896 7.896 7.768 0.128 25061 9612 1 14 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.026 -0.398 25061 9613 1 14 . 1 1 67 67 ARG C C 67 177.841 177.841 177.898 -0.057 25061 9614 1 14 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.711 0.341 25061 9615 1 14 . 1 1 67 67 ARG CB C 67 29.393 29.393 29.842 -0.449 25061 9616 1 14 . 1 1 68 68 ASP N N 68 118.316 118.316 118.473 -0.157 25061 9617 1 14 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.549 -0.188 25061 9618 1 14 . 1 1 68 68 ASP C C 68 178.945 178.945 178.736 0.209 25061 9619 1 14 . 1 1 68 68 ASP CA C 68 57.311 57.311 56.796 0.515 25061 9620 1 14 . 1 1 68 68 ASP CB C 68 41.514 41.514 41.399 0.115 25061 9621 1 14 . 1 1 68 68 ASP H H 68 7.625 7.625 7.705 -0.080 25061 9622 1 14 . 1 1 69 69 ILE N N 69 119.231 119.231 121.064 -1.833 25061 9623 1 14 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.791 -0.161 25061 9624 1 14 . 1 1 69 69 ILE C C 69 177.138 177.138 178.384 -1.246 25061 9625 1 14 . 1 1 69 69 ILE CA C 69 64.540 64.540 64.703 -0.163 25061 9626 1 14 . 1 1 69 69 ILE CB C 69 37.050 37.050 38.018 -0.968 25061 9627 1 14 . 1 1 69 69 ILE H H 69 8.113 8.113 7.755 0.358 25061 9628 1 14 . 1 1 70 70 VAL N N 70 120.164 120.164 120.080 0.084 25061 9629 1 14 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.647 -0.230 25061 9630 1 14 . 1 1 70 70 VAL C C 70 177.079 177.079 176.767 0.312 25061 9631 1 14 . 1 1 70 70 VAL CA C 70 67.274 67.274 66.350 0.924 25061 9632 1 14 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.725 -0.467 25061 9633 1 14 . 1 1 70 70 VAL H H 70 8.478 8.478 8.344 0.134 25061 9634 1 14 . 1 1 71 71 GLU N N 71 118.293 118.293 119.634 -1.341 25061 9635 1 14 . 1 1 71 71 GLU HA H 71 4.054 4.054 4.235 -0.181 25061 9636 1 14 . 1 1 71 71 GLU C C 71 179.009 179.009 178.461 0.548 25061 9637 1 14 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.219 0.197 25061 9638 1 14 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.356 -0.534 25061 9639 1 14 . 1 1 71 71 GLU H H 71 8.152 8.152 7.931 0.221 25061 9640 1 14 . 1 1 72 72 TYR N N 72 120.091 120.091 119.755 0.336 25061 9641 1 14 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.166 -0.004 25061 9642 1 14 . 1 1 72 72 TYR C C 72 176.404 176.404 176.938 -0.534 25061 9643 1 14 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.430 -0.298 25061 9644 1 14 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.356 -0.219 25061 9645 1 14 . 1 1 72 72 TYR H H 72 7.959 7.959 8.073 -0.114 25061 9646 1 14 . 1 1 73 73 ALA N N 73 120.133 120.133 120.280 -0.147 25061 9647 1 14 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.880 -0.250 25061 9648 1 14 . 1 1 73 73 ALA C C 73 179.182 179.182 179.524 -0.342 25061 9649 1 14 . 1 1 73 73 ALA CA C 73 55.112 55.112 54.640 0.472 25061 9650 1 14 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.198 -0.007 25061 9651 1 14 . 1 1 73 73 ALA H H 73 8.604 8.604 7.629 0.975 25061 9652 1 14 . 1 1 74 74 GLN N N 74 115.553 115.553 117.890 -2.337 25061 9653 1 14 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.939 0.199 25061 9654 1 14 . 1 1 74 74 GLN C C 74 180.595 180.595 178.361 2.234 25061 9655 1 14 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.580 0.515 25061 9656 1 14 . 1 1 74 74 GLN CB C 74 28.575 28.575 29.046 -0.471 25061 9657 1 14 . 1 1 74 74 GLN H H 74 8.619 8.619 7.924 0.695 25061 9658 1 14 . 1 1 75 75 LYS N N 75 122.396 122.396 117.008 5.388 25061 9659 1 14 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.116 -0.088 25061 9660 1 14 . 1 1 75 75 LYS C C 75 178.521 178.521 178.186 0.335 25061 9661 1 14 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.255 0.803 25061 9662 1 14 . 1 1 75 75 LYS CB C 75 31.599 31.599 32.071 -0.472 25061 9663 1 14 . 1 1 75 75 LYS H H 75 8.123 8.123 7.690 0.433 25061 9664 1 14 . 1 1 76 76 GLU N N 76 116.294 116.294 117.510 -1.216 25061 9665 1 14 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.229 -0.130 25061 9666 1 14 . 1 1 76 76 GLU C C 76 175.957 175.957 176.952 -0.995 25061 9667 1 14 . 1 1 76 76 GLU CA C 76 55.605 55.605 55.497 0.108 25061 9668 1 14 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.346 0.478 25061 9669 1 14 . 1 1 76 76 GLU H H 76 7.450 7.450 7.430 0.020 25061 9670 1 14 . 1 1 77 77 GLY N N 77 107.446 107.446 107.676 -0.230 25061 9671 1 14 . 1 1 77 77 GLY C C 77 174.520 174.520 174.851 -0.331 25061 9672 1 14 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.554 0.252 25061 9673 1 14 . 1 1 77 77 GLY H H 77 7.763 7.763 7.636 0.127 25061 9674 1 14 . 1 1 78 78 LEU N N 78 120.179 120.179 119.477 0.702 25061 9675 1 14 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.269 0.119 25061 9676 1 14 . 1 1 78 78 LEU C C 78 175.914 175.914 176.647 -0.733 25061 9677 1 14 . 1 1 78 78 LEU CA C 78 53.472 53.472 54.253 -0.781 25061 9678 1 14 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.481 -0.592 25061 9679 1 14 . 1 1 78 78 LEU H H 78 7.930 7.930 7.836 0.094 25061 9680 1 14 . 1 1 79 79 ARG N N 79 122.207 122.207 124.920 -2.713 25061 9681 1 14 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.297 0.100 25061 9682 1 14 . 1 1 79 79 ARG C C 79 174.960 174.960 174.918 0.042 25061 9683 1 14 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.386 0.262 25061 9684 1 14 . 1 1 79 79 ARG CB C 79 30.476 30.476 29.859 0.617 25061 9685 1 14 . 1 1 79 79 ARG H H 79 8.241 8.241 8.133 0.108 25061 9686 1 14 . 1 1 80 80 VAL N N 80 123.333 123.333 123.038 0.295 25061 9687 1 14 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.575 0.720 25061 9688 1 14 . 1 1 80 80 VAL C C 80 174.048 174.048 173.651 0.397 25061 9689 1 14 . 1 1 80 80 VAL CA C 80 60.041 60.041 59.776 0.265 25061 9690 1 14 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.276 2.029 25061 9691 1 14 . 1 1 80 80 VAL H H 80 8.359 8.359 8.358 0.001 25061 9692 1 14 . 1 1 81 81 LEU N N 81 128.719 128.719 129.327 -0.608 25061 9693 1 14 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.341 -0.237 25061 9694 1 14 . 1 1 81 81 LEU C C 81 174.484 174.484 174.581 -0.097 25061 9695 1 14 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.677 0.443 25061 9696 1 14 . 1 1 81 81 LEU CB C 81 44.955 44.955 46.067 -1.112 25061 9697 1 14 . 1 1 81 81 LEU H H 81 8.650 8.650 8.579 0.071 25061 9698 1 14 . 1 1 82 82 VAL N N 82 122.487 122.487 123.693 -1.206 25061 9699 1 14 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.649 0.448 25061 9700 1 14 . 1 1 82 82 VAL C C 82 174.525 174.525 174.494 0.031 25061 9701 1 14 . 1 1 82 82 VAL CA C 82 60.285 60.285 60.340 -0.055 25061 9702 1 14 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.945 1.844 25061 9703 1 14 . 1 1 82 82 VAL H H 82 8.781 8.781 8.452 0.329 25061 9704 1 14 . 1 1 83 83 ILE N N 83 128.082 128.082 128.513 -0.431 25061 9705 1 14 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.887 0.043 25061 9706 1 14 . 1 1 83 83 ILE C C 83 172.925 172.925 175.100 -2.175 25061 9707 1 14 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.477 -0.536 25061 9708 1 14 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.249 1.937 25061 9709 1 14 . 1 1 83 83 ILE H H 83 9.527 9.527 8.741 0.786 25061 9710 1 14 . 1 1 84 84 LYS N N 84 128.493 128.493 127.041 1.452 25061 9711 1 14 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.103 -0.055 25061 9712 1 14 . 1 1 84 84 LYS C C 84 174.027 174.027 175.570 -1.543 25061 9713 1 14 . 1 1 84 84 LYS CA C 84 53.253 53.253 54.029 -0.776 25061 9714 1 14 . 1 1 84 84 LYS CB C 84 34.652 34.652 34.703 -0.051 25061 9715 1 14 . 1 1 84 84 LYS H H 84 8.721 8.721 8.876 -0.155 25061 9716 1 14 . 1 1 85 85 VAL N N 85 126.729 126.729 126.299 0.430 25061 9717 1 14 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.894 -0.158 25061 9718 1 14 . 1 1 85 85 VAL C C 85 175.935 175.935 175.047 0.888 25061 9719 1 14 . 1 1 85 85 VAL CA C 85 60.200 60.200 61.805 -1.605 25061 9720 1 14 . 1 1 85 85 VAL CB C 85 30.847 30.847 31.690 -0.843 25061 9721 1 14 . 1 1 85 85 VAL H H 85 8.643 8.643 8.468 0.175 25061 9722 1 14 . 1 1 86 86 ALA N N 86 132.930 132.930 130.796 2.134 25061 9723 1 14 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.601 -0.171 25061 9724 1 14 . 1 1 86 86 ALA C C 86 175.635 175.635 174.791 0.844 25061 9725 1 14 . 1 1 86 86 ALA CA C 86 51.504 51.504 52.274 -0.770 25061 9726 1 14 . 1 1 86 86 ALA CB C 86 20.821 20.821 21.736 -0.915 25061 9727 1 14 . 1 1 86 86 ALA H H 86 8.835 8.835 7.998 0.837 25061 9728 1 14 . 1 1 87 87 GLN N N 87 118.719 118.719 120.688 -1.969 25061 9729 1 14 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.451 0.018 25061 9730 1 14 . 1 1 87 87 GLN C C 87 175.949 175.949 174.652 1.297 25061 9731 1 14 . 1 1 87 87 GLN CA C 87 55.260 55.260 55.284 -0.024 25061 9732 1 14 . 1 1 87 87 GLN CB C 87 30.432 30.432 31.110 -0.678 25061 9733 1 14 . 1 1 87 87 GLN H H 87 8.570 8.570 8.474 0.096 25061 9734 1 14 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.263 0.217 25061 9735 1 14 . 1 1 88 88 ASP CA C 88 55.454 55.454 55.263 0.191 25061 9736 1 14 . 1 1 88 88 ASP CB C 88 41.204 41.204 40.882 0.322 25061 9737 1 14 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.495 -0.448 25061 9738 1 14 . 1 1 89 89 GLN CA C 89 56.687 56.687 55.102 1.585 25061 9739 1 14 . 1 1 89 89 GLN CB C 89 27.850 27.850 31.039 -3.189 25061 9740 1 14 . 1 1 92 92 LEU N N 92 125.291 125.291 120.085 5.206 25061 9741 1 14 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.018 0.183 25061 9742 1 14 . 1 1 92 92 LEU CA C 92 55.057 55.057 58.211 -3.154 25061 9743 1 14 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.611 0.435 25061 9744 1 14 . 1 1 92 92 LEU H H 92 8.277 8.277 8.010 0.267 25061 9745 1 14 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.092 0.664 25061 9746 1 14 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.171 -0.122 25061 9747 1 14 . 1 1 94 94 ARG C C 94 178.544 178.544 178.554 -0.010 25061 9748 1 14 . 1 1 94 94 ARG CA C 94 58.607 58.607 59.051 -0.444 25061 9749 1 14 . 1 1 94 94 ARG CB C 94 29.614 29.614 30.094 -0.480 25061 9750 1 14 . 1 1 95 95 PHE N N 95 117.407 117.407 120.145 -2.738 25061 9751 1 14 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.211 0.164 25061 9752 1 14 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.780 -0.549 25061 9753 1 14 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.150 -1.208 25061 9754 1 14 . 1 1 95 95 PHE H H 95 8.419 8.419 7.735 0.684 25061 9755 1 14 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.851 -0.043 25061 9756 1 14 . 1 1 96 96 TYR C C 96 177.728 177.728 177.342 0.386 25061 9757 1 14 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.430 1.726 25061 9758 1 14 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.430 -0.730 25061 9759 1 14 . 1 1 97 97 GLU N N 97 119.054 119.054 117.872 1.182 25061 9760 1 14 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.690 0.373 25061 9761 1 14 . 1 1 97 97 GLU C C 97 179.071 179.071 178.593 0.478 25061 9762 1 14 . 1 1 97 97 GLU CA C 97 58.760 58.760 59.507 -0.747 25061 9763 1 14 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.241 -0.069 25061 9764 1 14 . 1 1 97 97 GLU H H 97 7.858 7.858 7.986 -0.128 25061 9765 1 14 . 1 1 98 98 GLN N N 98 119.385 119.385 118.593 0.792 25061 9766 1 14 . 1 1 98 98 GLN HA H 98 3.901 3.901 4.021 -0.120 25061 9767 1 14 . 1 1 98 98 GLN C C 98 177.599 177.599 178.076 -0.477 25061 9768 1 14 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.549 -0.238 25061 9769 1 14 . 1 1 98 98 GLN CB C 98 27.766 27.766 27.796 -0.030 25061 9770 1 14 . 1 1 98 98 GLN H H 98 7.747 7.747 7.493 0.254 25061 9771 1 14 . 1 1 99 99 LEU N N 99 118.348 118.348 119.083 -0.735 25061 9772 1 14 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.951 0.068 25061 9773 1 14 . 1 1 99 99 LEU C C 99 178.669 178.669 178.919 -0.250 25061 9774 1 14 . 1 1 99 99 LEU CA C 99 57.430 57.430 57.651 -0.221 25061 9775 1 14 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.330 0.173 25061 9776 1 14 . 1 1 99 99 LEU H H 99 7.891 7.891 7.329 0.562 25061 9777 1 14 . 1 1 100 100 LYS N N 100 118.332 118.332 118.950 -0.618 25061 9778 1 14 . 1 1 100 100 LYS HA H 100 4.509 4.509 4.019 0.490 25061 9779 1 14 . 1 1 100 100 LYS C C 100 180.846 180.846 178.903 1.943 25061 9780 1 14 . 1 1 100 100 LYS CA C 100 59.088 59.088 57.973 1.115 25061 9781 1 14 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.805 0.465 25061 9782 1 14 . 1 1 100 100 LYS H H 100 7.560 7.560 7.359 0.201 25061 9783 1 14 . 1 1 101 101 LYS N N 101 121.944 121.944 119.381 2.563 25061 9784 1 14 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.078 -0.006 25061 9785 1 14 . 1 1 101 101 LYS C C 101 177.707 177.707 177.622 0.085 25061 9786 1 14 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.595 0.276 25061 9787 1 14 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.444 -0.349 25061 9788 1 14 . 1 1 101 101 LYS H H 101 7.959 7.959 7.577 0.382 25061 9789 1 14 . 1 1 102 102 ASP N N 102 118.788 118.788 117.021 1.767 25061 9790 1 14 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.427 0.267 25061 9791 1 14 . 1 1 102 102 ASP C C 102 176.359 176.359 177.624 -1.265 25061 9792 1 14 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.733 -1.154 25061 9793 1 14 . 1 1 102 102 ASP CB C 102 40.574 40.574 42.369 -1.795 25061 9794 1 14 . 1 1 102 102 ASP H H 102 7.893 7.893 7.857 0.036 25061 9795 1 14 . 1 1 103 103 GLY N N 103 107.024 107.024 106.248 0.776 25061 9796 1 14 . 1 1 103 103 GLY C C 103 174.328 174.328 174.741 -0.413 25061 9797 1 14 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.702 0.643 25061 9798 1 14 . 1 1 103 103 GLY H H 103 7.866 7.866 8.141 -0.275 25061 9799 1 14 . 1 1 104 104 VAL N N 104 123.060 123.060 124.123 -1.063 25061 9800 1 14 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.695 0.278 25061 9801 1 14 . 1 1 104 104 VAL C C 104 175.023 175.023 175.595 -0.572 25061 9802 1 14 . 1 1 104 104 VAL CA C 104 61.878 61.878 63.318 -1.440 25061 9803 1 14 . 1 1 104 104 VAL CB C 104 32.088 32.088 30.703 1.385 25061 9804 1 14 . 1 1 104 104 VAL H H 104 7.955 7.955 7.836 0.119 25061 9805 1 14 . 1 1 105 105 ASP N N 105 127.987 127.987 128.705 -0.718 25061 9806 1 14 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.473 0.102 25061 9807 1 14 . 1 1 105 105 ASP C C 105 173.624 173.624 174.364 -0.740 25061 9808 1 14 . 1 1 105 105 ASP CA C 105 54.087 54.087 54.330 -0.243 25061 9809 1 14 . 1 1 105 105 ASP CB C 105 40.660 40.660 42.504 -1.843 25061 9810 1 14 . 1 1 105 105 ASP H H 105 8.399 8.399 7.849 0.550 25061 9811 1 14 . 1 1 106 106 VAL N N 106 125.798 125.798 122.719 3.079 25061 9812 1 14 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.653 0.162 25061 9813 1 14 . 1 1 106 106 VAL C C 106 174.902 174.902 175.753 -0.851 25061 9814 1 14 . 1 1 106 106 VAL CA C 106 60.194 60.194 61.227 -1.033 25061 9815 1 14 . 1 1 106 106 VAL CB C 106 34.179 34.179 34.538 -0.359 25061 9816 1 14 . 1 1 106 106 VAL H H 106 7.550 7.550 8.306 -0.756 25061 9817 1 14 . 1 1 107 107 ARG N N 107 128.099 128.099 128.350 -0.251 25061 9818 1 14 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.655 0.221 25061 9819 1 14 . 1 1 107 107 ARG C C 107 173.815 173.815 175.112 -1.297 25061 9820 1 14 . 1 1 107 107 ARG CA C 107 53.386 53.386 53.849 -0.463 25061 9821 1 14 . 1 1 107 107 ARG CB C 107 31.195 31.195 29.966 1.229 25061 9822 1 14 . 1 1 107 107 ARG H H 107 9.132 9.132 8.655 0.477 25061 9823 1 14 . 1 1 108 108 VAL N N 108 123.979 123.979 122.589 1.390 25061 9824 1 14 . 1 1 108 108 VAL HA H 108 4.942 4.942 4.708 0.234 25061 9825 1 14 . 1 1 108 108 VAL C C 108 175.854 175.854 176.011 -0.157 25061 9826 1 14 . 1 1 108 108 VAL CA C 108 60.017 60.017 61.245 -1.228 25061 9827 1 14 . 1 1 108 108 VAL CB C 108 32.844 32.844 31.936 0.908 25061 9828 1 14 . 1 1 108 108 VAL H H 108 8.561 8.561 8.529 0.032 25061 9829 1 14 . 1 1 109 109 THR N N 109 120.144 120.144 121.415 -1.271 25061 9830 1 14 . 1 1 109 109 THR HA H 109 4.815 4.815 4.626 0.189 25061 9831 1 14 . 1 1 109 109 THR C C 109 171.867 171.867 174.656 -2.789 25061 9832 1 14 . 1 1 109 109 THR CA C 109 59.613 59.613 60.270 -0.657 25061 9833 1 14 . 1 1 109 109 THR CB C 109 69.720 69.720 69.456 0.264 25061 9834 1 14 . 1 1 109 109 THR H H 109 8.803 8.803 8.504 0.299 25061 9835 1 14 . 1 1 110 110 ASP N N 110 123.212 123.212 127.206 -3.994 25061 9836 1 14 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.804 0.165 25061 9837 1 14 . 1 1 110 110 ASP C C 110 175.739 175.739 175.769 -0.030 25061 9838 1 14 . 1 1 110 110 ASP CA C 110 53.243 53.243 54.155 -0.912 25061 9839 1 14 . 1 1 110 110 ASP CB C 110 41.351 41.351 40.413 0.938 25061 9840 1 14 . 1 1 110 110 ASP H H 110 8.363 8.363 8.900 -0.537 25061 9841 1 14 . 1 1 111 111 ASN N N 111 116.298 116.298 117.795 -1.497 25061 9842 1 14 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.937 -0.061 25061 9843 1 14 . 1 1 111 111 ASN C C 111 174.756 174.756 174.513 0.243 25061 9844 1 14 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.056 0.076 25061 9845 1 14 . 1 1 111 111 ASN CB C 111 40.765 40.765 41.475 -0.710 25061 9846 1 14 . 1 1 111 111 ASN H H 111 8.085 8.085 7.383 0.702 25061 9847 1 14 . 1 1 112 112 GLU HA H 112 3.848 3.848 3.978 -0.130 25061 9848 1 14 . 1 1 112 112 GLU C C 112 177.016 177.016 178.280 -1.264 25061 9849 1 14 . 1 1 112 112 GLU CA C 112 59.480 59.480 60.019 -0.539 25061 9850 1 14 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.844 -0.170 25061 9851 1 14 . 1 1 113 113 ASP N N 113 121.033 121.033 118.954 2.079 25061 9852 1 14 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.503 -0.090 25061 9853 1 14 . 1 1 113 113 ASP C C 113 178.988 178.988 178.177 0.811 25061 9854 1 14 . 1 1 113 113 ASP CA C 113 57.855 57.855 56.680 1.175 25061 9855 1 14 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.634 -0.132 25061 9856 1 14 . 1 1 113 113 ASP H H 113 8.219 8.219 8.236 -0.017 25061 9857 1 14 . 1 1 114 114 GLU N N 114 121.280 121.280 119.551 1.729 25061 9858 1 14 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.116 -0.051 25061 9859 1 14 . 1 1 114 114 GLU C C 114 178.776 178.776 178.036 0.740 25061 9860 1 14 . 1 1 114 114 GLU CA C 114 58.714 58.714 58.994 -0.280 25061 9861 1 14 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.061 0.152 25061 9862 1 14 . 1 1 114 114 GLU H H 114 8.296 8.296 8.665 -0.369 25061 9863 1 14 . 1 1 115 115 ALA N N 115 120.924 120.924 121.551 -0.627 25061 9864 1 14 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.080 -0.242 25061 9865 1 14 . 1 1 115 115 ALA C C 115 178.502 178.502 179.259 -0.757 25061 9866 1 14 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.029 0.609 25061 9867 1 14 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.267 0.230 25061 9868 1 14 . 1 1 115 115 ALA H H 115 7.853 7.853 7.521 0.332 25061 9869 1 14 . 1 1 116 116 LYS N N 116 116.616 116.616 119.314 -2.698 25061 9870 1 14 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.942 -0.223 25061 9871 1 14 . 1 1 116 116 LYS C C 116 178.097 178.097 178.512 -0.415 25061 9872 1 14 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.801 0.951 25061 9873 1 14 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.330 0.225 25061 9874 1 14 . 1 1 116 116 LYS H H 116 8.091 8.091 7.588 0.503 25061 9875 1 14 . 1 1 117 117 LYS N N 117 118.990 118.990 117.127 1.863 25061 9876 1 14 . 1 1 117 117 LYS HA H 117 3.911 3.911 4.083 -0.172 25061 9877 1 14 . 1 1 117 117 LYS C C 117 179.186 179.186 179.246 -0.060 25061 9878 1 14 . 1 1 117 117 LYS CA C 117 59.571 59.571 58.957 0.614 25061 9879 1 14 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.072 0.448 25061 9880 1 14 . 1 1 117 117 LYS H H 117 7.742 7.742 7.720 0.022 25061 9881 1 14 . 1 1 118 118 ARG N N 118 117.441 117.441 120.856 -3.415 25061 9882 1 14 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.105 0.035 25061 9883 1 14 . 1 1 118 118 ARG C C 118 178.921 178.921 178.580 0.341 25061 9884 1 14 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.581 -0.910 25061 9885 1 14 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.527 0.133 25061 9886 1 14 . 1 1 118 118 ARG H H 118 8.468 8.468 7.808 0.660 25061 9887 1 14 . 1 1 119 119 LEU N N 119 120.100 120.100 119.928 0.172 25061 9888 1 14 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.949 0.011 25061 9889 1 14 . 1 1 119 119 LEU C C 119 177.554 177.554 178.612 -1.058 25061 9890 1 14 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.016 -0.135 25061 9891 1 14 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.639 0.250 25061 9892 1 14 . 1 1 119 119 LEU H H 119 8.322 8.322 7.812 0.510 25061 9893 1 14 . 1 1 120 120 LYS N N 120 118.238 118.238 119.595 -1.357 25061 9894 1 14 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.921 -0.099 25061 9895 1 14 . 1 1 120 120 LYS C C 120 178.703 178.703 178.790 -0.087 25061 9896 1 14 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.497 0.849 25061 9897 1 14 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.307 -0.071 25061 9898 1 14 . 1 1 120 120 LYS H H 120 7.990 7.990 7.637 0.353 25061 9899 1 14 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.034 -0.012 25061 9900 1 14 . 1 1 121 121 GLU C C 121 177.769 177.769 178.885 -1.116 25061 9901 1 14 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.277 -0.355 25061 9902 1 14 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.138 0.316 25061 9903 1 14 . 1 1 122 122 LEU N N 122 119.454 119.454 118.968 0.486 25061 9904 1 14 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.051 0.082 25061 9905 1 14 . 1 1 122 122 LEU C C 122 178.991 178.991 179.508 -0.517 25061 9906 1 14 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.551 -0.225 25061 9907 1 14 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.927 -0.248 25061 9908 1 14 . 1 1 122 122 LEU H H 122 7.930 7.930 7.493 0.437 25061 9909 1 14 . 1 1 123 123 LEU N N 123 117.862 117.862 118.790 -0.928 25061 9910 1 14 . 1 1 123 123 LEU HA H 123 4.067 4.067 3.986 0.081 25061 9911 1 14 . 1 1 123 123 LEU C C 123 179.178 179.178 179.813 -0.635 25061 9912 1 14 . 1 1 123 123 LEU CA C 123 56.920 56.920 58.241 -1.321 25061 9913 1 14 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.116 0.094 25061 9914 1 14 . 1 1 123 123 LEU H H 123 8.095 8.095 8.020 0.075 25061 9915 1 14 . 1 1 124 124 GLU N N 124 118.975 118.975 118.552 0.423 25061 9916 1 14 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.189 -0.060 25061 9917 1 14 . 1 1 124 124 GLU C C 124 177.777 177.777 177.589 0.188 25061 9918 1 14 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.555 -0.468 25061 9919 1 14 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.283 0.257 25061 9920 1 14 . 1 1 124 124 GLU H H 124 7.930 7.930 8.229 -0.299 25061 9921 1 14 . 1 1 125 125 LYS N N 125 118.933 118.933 117.134 1.799 25061 9922 1 14 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.552 -0.215 25061 9923 1 14 . 1 1 125 125 LYS C C 125 178.188 178.188 175.780 2.408 25061 9924 1 14 . 1 1 125 125 LYS CA C 125 56.980 56.980 55.507 1.473 25061 9925 1 14 . 1 1 125 125 LYS CB C 125 32.608 32.608 33.516 -0.908 25061 9926 1 14 . 1 1 125 125 LYS H H 125 7.729 7.729 7.645 0.084 25061 9927 1 14 . 1 1 126 126 VAL N N 126 117.933 117.933 115.169 2.764 25061 9928 1 14 . 1 1 126 126 VAL HA H 126 4.022 4.022 3.664 0.358 25061 9929 1 14 . 1 1 126 126 VAL C C 126 176.947 176.947 175.250 1.697 25061 9930 1 14 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.744 -0.103 25061 9931 1 14 . 1 1 126 126 VAL CB C 126 31.859 31.859 30.016 1.843 25061 9932 1 14 . 1 1 126 126 VAL H H 126 8.044 8.044 7.795 0.249 25061 9933 1 14 . 1 1 127 127 GLY N N 127 109.813 109.813 106.634 3.179 25061 9934 1 14 . 1 1 127 127 GLY C C 127 174.264 174.264 172.955 1.309 25061 9935 1 14 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.264 0.015 25061 9936 1 14 . 1 1 127 127 GLY H H 127 8.279 8.279 7.847 0.432 25061 9937 1 14 . 1 1 128 128 SER N N 128 115.185 115.185 115.814 -0.629 25061 9938 1 14 . 1 1 128 128 SER HA H 128 4.462 4.462 4.582 -0.120 25061 9939 1 14 . 1 1 128 128 SER C C 128 174.775 174.775 174.467 0.308 25061 9940 1 14 . 1 1 128 128 SER CA C 128 58.739 58.739 57.705 1.034 25061 9941 1 14 . 1 1 128 128 SER CB C 128 63.850 63.850 61.970 1.880 25061 9942 1 14 . 1 1 128 128 SER H H 128 8.048 8.048 8.515 -0.467 25061 9943 1 14 . 1 1 129 129 LEU N N 129 123.060 123.060 122.860 0.200 25061 9944 1 14 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.298 0.000 25061 9945 1 14 . 1 1 129 129 LEU C C 129 177.313 177.313 177.358 -0.045 25061 9946 1 14 . 1 1 129 129 LEU CA C 129 55.158 55.158 55.113 0.045 25061 9947 1 14 . 1 1 129 129 LEU CB C 129 41.837 41.837 42.479 -0.642 25061 9948 1 14 . 1 1 129 129 LEU H H 129 8.147 8.147 7.434 0.713 25061 9949 1 14 . 1 1 130 130 GLU N N 130 120.088 120.088 116.616 3.472 25061 9950 1 14 . 1 1 130 130 GLU HA H 130 4.181 4.181 3.894 0.287 25061 9951 1 14 . 1 1 130 130 GLU C C 130 176.148 176.148 175.520 0.628 25061 9952 1 14 . 1 1 130 130 GLU CA C 130 56.726 56.726 57.236 -0.510 25061 9953 1 14 . 1 1 130 130 GLU CB C 130 30.026 30.026 27.334 2.692 25061 9954 1 14 . 1 1 130 130 GLU H H 130 8.242 8.242 8.510 -0.268 25061 9955 1 15 . 1 1 2 2 GLY CA C 2 45.319 45.319 44.668 0.651 25061 9956 1 15 . 1 1 3 3 THR HA H 3 4.820 4.820 4.637 0.183 25061 9957 1 15 . 1 1 3 3 THR C C 3 172.374 172.374 173.559 -1.185 25061 9958 1 15 . 1 1 3 3 THR CA C 3 62.760 62.760 63.293 -0.533 25061 9959 1 15 . 1 1 3 3 THR CB C 3 71.441 71.441 70.316 1.125 25061 9960 1 15 . 1 1 4 4 VAL N N 4 126.881 126.881 126.506 0.375 25061 9961 1 15 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.661 -0.093 25061 9962 1 15 . 1 1 4 4 VAL C C 4 173.116 173.116 174.029 -0.913 25061 9963 1 15 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.144 -0.689 25061 9964 1 15 . 1 1 4 4 VAL CB C 4 33.800 33.800 33.339 0.461 25061 9965 1 15 . 1 1 4 4 VAL H H 4 9.097 9.097 8.886 0.211 25061 9966 1 15 . 1 1 5 5 VAL N N 5 127.172 127.172 124.565 2.607 25061 9967 1 15 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.322 -0.435 25061 9968 1 15 . 1 1 5 5 VAL C C 5 174.091 174.091 175.070 -0.979 25061 9969 1 15 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.689 0.429 25061 9970 1 15 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.036 -0.101 25061 9971 1 15 . 1 1 5 5 VAL H H 5 8.811 8.811 8.826 -0.015 25061 9972 1 15 . 1 1 6 6 ILE N N 6 127.577 127.577 128.776 -1.199 25061 9973 1 15 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.500 0.120 25061 9974 1 15 . 1 1 6 6 ILE C C 6 173.328 173.328 175.357 -2.029 25061 9975 1 15 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.690 0.142 25061 9976 1 15 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.545 1.385 25061 9977 1 15 . 1 1 6 6 ILE H H 6 9.210 9.210 8.873 0.337 25061 9978 1 15 . 1 1 7 7 VAL N N 7 129.024 129.024 129.630 -0.606 25061 9979 1 15 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.779 0.026 25061 9980 1 15 . 1 1 7 7 VAL C C 7 173.561 173.561 175.217 -1.656 25061 9981 1 15 . 1 1 7 7 VAL CA C 7 60.849 60.849 61.303 -0.454 25061 9982 1 15 . 1 1 7 7 VAL CB C 7 32.360 32.360 30.856 1.504 25061 9983 1 15 . 1 1 7 7 VAL H H 7 9.294 9.294 8.256 1.038 25061 9984 1 15 . 1 1 8 8 VAL N N 8 125.318 125.318 129.055 -3.737 25061 9985 1 15 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.529 -0.133 25061 9986 1 15 . 1 1 8 8 VAL C C 8 175.723 175.723 175.439 0.284 25061 9987 1 15 . 1 1 8 8 VAL CA C 8 59.617 59.617 59.543 0.074 25061 9988 1 15 . 1 1 8 8 VAL CB C 8 34.915 34.915 35.217 -0.302 25061 9989 1 15 . 1 1 8 8 VAL H H 8 8.898 8.898 8.435 0.463 25061 9990 1 15 . 1 1 9 9 SER N N 9 116.544 116.544 117.229 -0.685 25061 9991 1 15 . 1 1 9 9 SER HA H 9 4.724 4.724 4.840 -0.116 25061 9992 1 15 . 1 1 9 9 SER C C 9 174.552 174.552 174.356 0.196 25061 9993 1 15 . 1 1 9 9 SER CA C 9 57.419 57.419 57.370 0.049 25061 9994 1 15 . 1 1 9 9 SER CB C 9 64.998 64.998 65.952 -0.954 25061 9995 1 15 . 1 1 9 9 SER H H 9 7.833 7.833 8.145 -0.312 25061 9996 1 15 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.608 0.304 25061 9997 1 15 . 1 1 10 10 ASN C C 10 176.170 176.170 174.359 1.811 25061 9998 1 15 . 1 1 10 10 ASN CA C 10 54.141 54.141 56.138 -1.997 25061 9999 1 15 . 1 1 10 10 ASN CB C 10 38.626 38.626 38.861 -0.235 25061 10000 1 15 . 1 1 11 11 ASP N N 11 120.164 120.164 117.939 2.225 25061 10001 1 15 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.862 -0.019 25061 10002 1 15 . 1 1 11 11 ASP C C 11 176.148 176.148 175.700 0.448 25061 10003 1 15 . 1 1 11 11 ASP CA C 11 52.620 52.620 52.360 0.260 25061 10004 1 15 . 1 1 11 11 ASP CB C 11 42.631 42.631 42.891 -0.260 25061 10005 1 15 . 1 1 11 11 ASP H H 11 8.142 8.142 7.657 0.485 25061 10006 1 15 . 1 1 12 12 GLU N N 12 127.184 127.184 124.885 2.299 25061 10007 1 15 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.076 -0.223 25061 10008 1 15 . 1 1 12 12 GLU C C 12 177.853 177.853 177.937 -0.084 25061 10009 1 15 . 1 1 12 12 GLU CA C 12 59.547 59.547 59.433 0.114 25061 10010 1 15 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.980 -0.161 25061 10011 1 15 . 1 1 12 12 GLU H H 12 9.152 9.152 8.883 0.269 25061 10012 1 15 . 1 1 13 13 ARG N N 13 119.026 119.026 118.214 0.812 25061 10013 1 15 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.131 -0.028 25061 10014 1 15 . 1 1 13 13 ARG C C 13 179.151 179.151 178.865 0.286 25061 10015 1 15 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.776 0.168 25061 10016 1 15 . 1 1 13 13 ARG CB C 13 28.757 28.757 30.090 -1.333 25061 10017 1 15 . 1 1 13 13 ARG H H 13 8.389 8.389 7.726 0.663 25061 10018 1 15 . 1 1 14 14 ILE N N 14 119.238 119.238 120.812 -1.574 25061 10019 1 15 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.784 -0.183 25061 10020 1 15 . 1 1 14 14 ILE C C 14 177.905 177.905 178.061 -0.156 25061 10021 1 15 . 1 1 14 14 ILE CA C 14 64.666 64.666 64.909 -0.243 25061 10022 1 15 . 1 1 14 14 ILE CB C 14 36.780 36.780 37.870 -1.090 25061 10023 1 15 . 1 1 14 14 ILE H H 14 7.254 7.254 7.594 -0.340 25061 10024 1 15 . 1 1 15 15 LEU N N 15 117.008 117.008 119.908 -2.900 25061 10025 1 15 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.080 -0.159 25061 10026 1 15 . 1 1 15 15 LEU C C 15 178.062 178.062 179.053 -0.991 25061 10027 1 15 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.381 0.030 25061 10028 1 15 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.527 -0.358 25061 10029 1 15 . 1 1 15 15 LEU H H 15 7.412 7.412 7.570 -0.158 25061 10030 1 15 . 1 1 16 16 GLU N N 16 117.637 117.637 119.143 -1.506 25061 10031 1 15 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.794 -0.093 25061 10032 1 15 . 1 1 16 16 GLU C C 16 179.182 179.182 178.792 0.390 25061 10033 1 15 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.709 -0.292 25061 10034 1 15 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.502 -0.043 25061 10035 1 15 . 1 1 16 16 GLU H H 16 7.981 7.981 8.100 -0.119 25061 10036 1 15 . 1 1 17 17 GLU N N 17 119.759 119.759 120.355 -0.596 25061 10037 1 15 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.219 -0.203 25061 10038 1 15 . 1 1 17 17 GLU C C 17 179.949 179.949 179.260 0.689 25061 10039 1 15 . 1 1 17 17 GLU CA C 17 59.195 59.195 59.059 0.137 25061 10040 1 15 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.384 0.156 25061 10041 1 15 . 1 1 17 17 GLU H H 17 8.248 8.248 8.050 0.198 25061 10042 1 15 . 1 1 18 18 LEU N N 18 119.764 119.764 119.539 0.225 25061 10043 1 15 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.210 -0.129 25061 10044 1 15 . 1 1 18 18 LEU C C 18 177.620 177.620 179.212 -1.592 25061 10045 1 15 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.613 0.065 25061 10046 1 15 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.704 -0.594 25061 10047 1 15 . 1 1 18 18 LEU H H 18 8.486 8.486 7.892 0.594 25061 10048 1 15 . 1 1 19 19 LEU N N 19 123.102 123.102 121.278 1.824 25061 10049 1 15 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.668 -0.006 25061 10050 1 15 . 1 1 19 19 LEU C C 19 178.343 178.343 178.243 0.100 25061 10051 1 15 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.250 0.986 25061 10052 1 15 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.034 -0.383 25061 10053 1 15 . 1 1 19 19 LEU H H 19 7.870 7.870 8.144 -0.274 25061 10054 1 15 . 1 1 20 20 GLU N N 20 117.884 117.884 118.779 -0.895 25061 10055 1 15 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.955 -0.051 25061 10056 1 15 . 1 1 20 20 GLU C C 20 177.707 177.707 179.457 -1.750 25061 10057 1 15 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.521 -0.129 25061 10058 1 15 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.376 -0.399 25061 10059 1 15 . 1 1 20 20 GLU H H 20 7.497 7.497 7.866 -0.369 25061 10060 1 15 . 1 1 21 21 VAL N N 21 117.709 117.709 120.026 -2.317 25061 10061 1 15 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.705 -0.081 25061 10062 1 15 . 1 1 21 21 VAL C C 21 178.523 178.523 178.012 0.511 25061 10063 1 15 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.198 -0.001 25061 10064 1 15 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.786 -0.639 25061 10065 1 15 . 1 1 21 21 VAL H H 21 7.514 7.514 7.273 0.241 25061 10066 1 15 . 1 1 22 22 VAL N N 22 121.233 121.233 119.234 1.999 25061 10067 1 15 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.716 -0.270 25061 10068 1 15 . 1 1 22 22 VAL C C 22 176.868 176.868 178.147 -1.279 25061 10069 1 15 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.186 0.827 25061 10070 1 15 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.147 0.167 25061 10071 1 15 . 1 1 22 22 VAL H H 22 7.863 7.863 7.926 -0.063 25061 10072 1 15 . 1 1 23 23 LEU N N 23 118.101 118.101 119.138 -1.037 25061 10073 1 15 . 1 1 23 23 LEU HA H 23 4.065 4.065 3.999 0.066 25061 10074 1 15 . 1 1 23 23 LEU C C 23 179.701 179.701 178.277 1.424 25061 10075 1 15 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.877 -0.581 25061 10076 1 15 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.914 -0.210 25061 10077 1 15 . 1 1 23 23 LEU H H 23 8.151 8.151 8.525 -0.374 25061 10078 1 15 . 1 1 24 24 LYS N N 24 114.622 114.622 116.355 -1.733 25061 10079 1 15 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.131 0.006 25061 10080 1 15 . 1 1 24 24 LYS C C 24 178.062 178.062 178.967 -0.905 25061 10081 1 15 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.216 -0.848 25061 10082 1 15 . 1 1 24 24 LYS CB C 24 32.594 32.594 31.925 0.669 25061 10083 1 15 . 1 1 24 24 LYS H H 24 7.823 7.823 7.458 0.365 25061 10084 1 15 . 1 1 25 25 SER N N 25 115.474 115.474 116.583 -1.109 25061 10085 1 15 . 1 1 25 25 SER HA H 25 4.377 4.377 4.227 0.150 25061 10086 1 15 . 1 1 25 25 SER C C 25 174.520 174.520 174.656 -0.136 25061 10087 1 15 . 1 1 25 25 SER CA C 25 61.049 61.049 60.855 0.194 25061 10088 1 15 . 1 1 25 25 SER CB C 25 63.777 63.777 63.768 0.009 25061 10089 1 15 . 1 1 25 25 SER H H 25 7.798 7.798 7.755 0.043 25061 10090 1 15 . 1 1 26 26 ASP N N 26 117.424 117.424 117.759 -0.335 25061 10091 1 15 . 1 1 26 26 ASP HA H 26 4.886 4.886 4.970 -0.084 25061 10092 1 15 . 1 1 26 26 ASP C C 26 173.521 173.521 173.917 -0.396 25061 10093 1 15 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.508 -0.460 25061 10094 1 15 . 1 1 26 26 ASP CB C 26 42.202 42.202 42.934 -0.732 25061 10095 1 15 . 1 1 26 26 ASP H H 26 7.990 7.990 7.670 0.320 25061 10096 1 15 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.721 -0.076 25061 10097 1 15 . 1 1 27 27 PRO C C 27 177.016 177.016 176.891 0.125 25061 10098 1 15 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.850 -0.249 25061 10099 1 15 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.652 -0.479 25061 10100 1 15 . 1 1 28 28 ASN N N 28 115.839 115.839 115.916 -0.077 25061 10101 1 15 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.753 -0.061 25061 10102 1 15 . 1 1 28 28 ASN C C 28 175.701 175.701 175.543 0.158 25061 10103 1 15 . 1 1 28 28 ASN CA C 28 53.472 53.472 53.117 0.355 25061 10104 1 15 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.221 -0.008 25061 10105 1 15 . 1 1 28 28 ASN H H 28 8.608 8.608 8.073 0.535 25061 10106 1 15 . 1 1 29 29 VAL N N 29 120.770 120.770 121.188 -0.418 25061 10107 1 15 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.741 0.074 25061 10108 1 15 . 1 1 29 29 VAL C C 29 175.023 175.023 176.029 -1.006 25061 10109 1 15 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.991 -1.439 25061 10110 1 15 . 1 1 29 29 VAL CB C 29 32.147 32.147 32.222 -0.075 25061 10111 1 15 . 1 1 29 29 VAL H H 29 7.428 7.428 8.134 -0.706 25061 10112 1 15 . 1 1 30 30 LYS N N 30 127.345 127.345 129.852 -2.507 25061 10113 1 15 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.322 0.157 25061 10114 1 15 . 1 1 30 30 LYS C C 30 174.777 174.777 175.619 -0.842 25061 10115 1 15 . 1 1 30 30 LYS CA C 30 55.204 55.204 54.956 0.248 25061 10116 1 15 . 1 1 30 30 LYS CB C 30 31.949 31.949 30.833 1.116 25061 10117 1 15 . 1 1 30 30 LYS H H 30 8.457 8.457 8.185 0.272 25061 10118 1 15 . 1 1 31 31 THR N N 31 113.552 113.552 116.246 -2.694 25061 10119 1 15 . 1 1 31 31 THR HA H 31 5.723 5.723 4.795 0.928 25061 10120 1 15 . 1 1 31 31 THR C C 31 174.593 174.593 174.647 -0.054 25061 10121 1 15 . 1 1 31 31 THR CA C 31 59.030 59.030 61.459 -2.429 25061 10122 1 15 . 1 1 31 31 THR CB C 31 72.206 72.206 69.228 2.978 25061 10123 1 15 . 1 1 31 31 THR H H 31 8.164 8.164 8.141 0.023 25061 10124 1 15 . 1 1 32 32 VAL N N 32 119.206 119.206 127.109 -7.903 25061 10125 1 15 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.384 0.021 25061 10126 1 15 . 1 1 32 32 VAL C C 32 172.663 172.663 174.331 -1.668 25061 10127 1 15 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.846 -0.774 25061 10128 1 15 . 1 1 32 32 VAL CB C 32 35.051 35.051 35.259 -0.208 25061 10129 1 15 . 1 1 32 32 VAL H H 32 8.615 8.615 9.146 -0.531 25061 10130 1 15 . 1 1 33 33 ARG N N 33 130.278 130.278 128.882 1.396 25061 10131 1 15 . 1 1 33 33 ARG HA H 33 5.331 5.331 4.797 0.534 25061 10132 1 15 . 1 1 33 33 ARG C C 33 173.836 173.836 175.531 -1.695 25061 10133 1 15 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.778 -1.628 25061 10134 1 15 . 1 1 33 33 ARG CB C 33 30.028 30.028 30.511 -0.483 25061 10135 1 15 . 1 1 33 33 ARG H H 33 8.996 8.996 8.932 0.064 25061 10136 1 15 . 1 1 34 34 THR N N 34 121.695 121.695 120.344 1.351 25061 10137 1 15 . 1 1 34 34 THR HA H 34 4.483 4.483 4.444 0.039 25061 10138 1 15 . 1 1 34 34 THR C C 34 169.769 169.769 174.616 -4.847 25061 10139 1 15 . 1 1 34 34 THR CA C 34 60.814 60.814 61.898 -1.083 25061 10140 1 15 . 1 1 34 34 THR CB C 34 67.402 67.402 69.530 -2.128 25061 10141 1 15 . 1 1 34 34 THR H H 34 8.126 8.126 8.912 -0.786 25061 10142 1 15 . 1 1 35 35 ASP N N 35 122.198 122.198 120.212 1.986 25061 10143 1 15 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.349 0.475 25061 10144 1 15 . 1 1 35 35 ASP C C 35 174.790 174.790 174.458 0.332 25061 10145 1 15 . 1 1 35 35 ASP CA C 35 53.386 53.386 55.623 -2.237 25061 10146 1 15 . 1 1 35 35 ASP CB C 35 41.848 41.848 39.896 1.952 25061 10147 1 15 . 1 1 35 35 ASP H H 35 7.983 7.983 8.114 -0.131 25061 10148 1 15 . 1 1 36 36 ASP N N 36 121.091 121.091 118.136 2.955 25061 10149 1 15 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.708 -0.116 25061 10150 1 15 . 1 1 36 36 ASP C C 36 176.189 176.189 176.652 -0.463 25061 10151 1 15 . 1 1 36 36 ASP CA C 36 53.055 53.055 53.554 -0.499 25061 10152 1 15 . 1 1 36 36 ASP CB C 36 42.159 42.159 42.330 -0.171 25061 10153 1 15 . 1 1 36 36 ASP H H 36 8.157 8.157 7.951 0.206 25061 10154 1 15 . 1 1 37 37 LYS N N 37 125.839 125.839 126.665 -0.826 25061 10155 1 15 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.992 -0.270 25061 10156 1 15 . 1 1 37 37 LYS C C 37 176.870 176.870 178.354 -1.484 25061 10157 1 15 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.598 -0.194 25061 10158 1 15 . 1 1 37 37 LYS CB C 37 32.394 32.394 32.806 -0.412 25061 10159 1 15 . 1 1 37 37 LYS H H 37 8.843 8.843 8.670 0.173 25061 10160 1 15 . 1 1 38 38 GLU N N 38 118.369 118.369 118.016 0.353 25061 10161 1 15 . 1 1 38 38 GLU HA H 38 4.007 4.007 4.034 -0.027 25061 10162 1 15 . 1 1 38 38 GLU C C 38 179.502 179.502 178.500 1.002 25061 10163 1 15 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.815 -0.145 25061 10164 1 15 . 1 1 38 38 GLU CB C 38 28.474 28.474 28.971 -0.497 25061 10165 1 15 . 1 1 38 38 GLU H H 38 8.182 8.182 8.317 -0.135 25061 10166 1 15 . 1 1 39 39 LYS N N 39 121.722 121.722 121.147 0.575 25061 10167 1 15 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.304 -0.139 25061 10168 1 15 . 1 1 39 39 LYS C C 39 178.500 178.500 178.664 -0.164 25061 10169 1 15 . 1 1 39 39 LYS CA C 39 57.736 57.736 58.977 -1.241 25061 10170 1 15 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.535 -1.397 25061 10171 1 15 . 1 1 39 39 LYS H H 39 7.524 7.524 7.616 -0.092 25061 10172 1 15 . 1 1 40 40 VAL N N 40 117.199 117.199 119.059 -1.860 25061 10173 1 15 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.592 -0.364 25061 10174 1 15 . 1 1 40 40 VAL C C 40 177.362 177.362 177.857 -0.495 25061 10175 1 15 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.754 0.888 25061 10176 1 15 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.593 -0.690 25061 10177 1 15 . 1 1 40 40 VAL H H 40 7.883 7.883 7.446 0.437 25061 10178 1 15 . 1 1 41 41 LYS N N 41 117.677 117.677 118.329 -0.652 25061 10179 1 15 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.459 -0.017 25061 10180 1 15 . 1 1 41 41 LYS C C 41 177.686 177.686 178.859 -1.173 25061 10181 1 15 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.566 1.243 25061 10182 1 15 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.344 0.271 25061 10183 1 15 . 1 1 41 41 LYS H H 41 7.567 7.567 7.861 -0.294 25061 10184 1 15 . 1 1 42 42 GLU N N 42 118.369 118.369 118.719 -0.350 25061 10185 1 15 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.001 0.006 25061 10186 1 15 . 1 1 42 42 GLU C C 42 179.725 179.725 178.983 0.742 25061 10187 1 15 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.419 -0.350 25061 10188 1 15 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.516 0.023 25061 10189 1 15 . 1 1 42 42 GLU H H 42 7.634 7.634 7.475 0.159 25061 10190 1 15 . 1 1 43 43 GLU N N 43 117.906 117.906 119.384 -1.478 25061 10191 1 15 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.157 0.026 25061 10192 1 15 . 1 1 43 43 GLU C C 43 179.757 179.757 179.290 0.467 25061 10193 1 15 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.654 -0.287 25061 10194 1 15 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.651 -0.810 25061 10195 1 15 . 1 1 43 43 GLU H H 43 8.162 8.162 7.668 0.494 25061 10196 1 15 . 1 1 44 44 ILE N N 44 122.291 122.291 121.009 1.282 25061 10197 1 15 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.601 0.011 25061 10198 1 15 . 1 1 44 44 ILE C C 44 177.101 177.101 177.594 -0.493 25061 10199 1 15 . 1 1 44 44 ILE CA C 44 66.355 66.355 66.072 0.283 25061 10200 1 15 . 1 1 44 44 ILE CB C 44 37.460 37.460 38.004 -0.544 25061 10201 1 15 . 1 1 44 44 ILE H H 44 8.742 8.742 8.487 0.255 25061 10202 1 15 . 1 1 45 45 GLU N N 45 119.892 119.892 120.233 -0.341 25061 10203 1 15 . 1 1 45 45 GLU HA H 45 4.058 4.058 3.960 0.098 25061 10204 1 15 . 1 1 45 45 GLU C C 45 178.991 178.991 178.819 0.172 25061 10205 1 15 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.997 -0.332 25061 10206 1 15 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.364 -0.203 25061 10207 1 15 . 1 1 45 45 GLU H H 45 8.171 8.171 7.837 0.334 25061 10208 1 15 . 1 1 46 46 LYS N N 46 118.064 118.064 118.557 -0.493 25061 10209 1 15 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.081 -0.099 25061 10210 1 15 . 1 1 46 46 LYS C C 46 178.837 178.837 179.123 -0.286 25061 10211 1 15 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.014 0.727 25061 10212 1 15 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.260 0.183 25061 10213 1 15 . 1 1 46 46 LYS H H 46 7.785 7.785 7.557 0.228 25061 10214 1 15 . 1 1 47 47 ALA N N 47 121.817 121.817 121.566 0.251 25061 10215 1 15 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.047 -0.016 25061 10216 1 15 . 1 1 47 47 ALA C C 47 179.859 179.859 179.396 0.463 25061 10217 1 15 . 1 1 47 47 ALA CA C 47 55.295 55.295 54.933 0.362 25061 10218 1 15 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.402 -0.746 25061 10219 1 15 . 1 1 47 47 ALA H H 47 8.123 8.123 7.930 0.193 25061 10220 1 15 . 1 1 48 48 ARG N N 48 119.080 119.080 117.946 1.134 25061 10221 1 15 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.165 -0.076 25061 10222 1 15 . 1 1 48 48 ARG C C 48 180.155 180.155 179.233 0.922 25061 10223 1 15 . 1 1 48 48 ARG CA C 48 59.197 59.197 57.910 1.287 25061 10224 1 15 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.828 -0.318 25061 10225 1 15 . 1 1 48 48 ARG H H 48 8.768 8.768 7.949 0.819 25061 10226 1 15 . 1 1 49 49 LYS N N 49 119.951 119.951 119.260 0.691 25061 10227 1 15 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.122 -0.083 25061 10228 1 15 . 1 1 49 49 LYS C C 49 178.288 178.288 178.667 -0.379 25061 10229 1 15 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.468 0.369 25061 10230 1 15 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.130 0.013 25061 10231 1 15 . 1 1 49 49 LYS H H 49 8.037 8.037 7.895 0.142 25061 10232 1 15 . 1 1 50 50 GLN N N 50 115.284 115.284 117.998 -2.714 25061 10233 1 15 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.294 0.048 25061 10234 1 15 . 1 1 50 50 GLN C C 50 176.180 176.180 176.578 -0.398 25061 10235 1 15 . 1 1 50 50 GLN CA C 50 55.741 55.741 56.037 -0.296 25061 10236 1 15 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.347 0.218 25061 10237 1 15 . 1 1 50 50 GLN H H 50 7.740 7.740 7.755 -0.015 25061 10238 1 15 . 1 1 51 51 GLY N N 51 109.725 109.725 107.526 2.199 25061 10239 1 15 . 1 1 51 51 GLY C C 51 174.552 174.552 173.547 1.005 25061 10240 1 15 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.037 1.326 25061 10241 1 15 . 1 1 51 51 GLY H H 51 8.027 8.027 7.736 0.291 25061 10242 1 15 . 1 1 52 52 ARG N N 52 119.064 119.064 117.138 1.926 25061 10243 1 15 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.900 -0.003 25061 10244 1 15 . 1 1 52 52 ARG C C 52 173.123 173.123 173.191 -0.068 25061 10245 1 15 . 1 1 52 52 ARG CA C 52 52.247 52.247 52.408 -0.161 25061 10246 1 15 . 1 1 52 52 ARG CB C 52 32.366 32.366 31.235 1.131 25061 10247 1 15 . 1 1 52 52 ARG H H 52 7.969 7.969 7.986 -0.017 25061 10248 1 15 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.775 0.080 25061 10249 1 15 . 1 1 53 53 PRO C C 53 174.069 174.069 175.770 -1.701 25061 10250 1 15 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.830 -1.012 25061 10251 1 15 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.665 -0.605 25061 10252 1 15 . 1 1 54 54 ILE N N 54 116.301 116.301 121.073 -4.772 25061 10253 1 15 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.655 0.583 25061 10254 1 15 . 1 1 54 54 ILE C C 54 171.709 171.709 173.806 -2.097 25061 10255 1 15 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.419 -1.645 25061 10256 1 15 . 1 1 54 54 ILE CB C 54 41.558 41.558 41.373 0.185 25061 10257 1 15 . 1 1 54 54 ILE H H 54 7.920 7.920 7.876 0.044 25061 10258 1 15 . 1 1 55 55 VAL N N 55 126.302 126.302 129.516 -3.214 25061 10259 1 15 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.157 -0.233 25061 10260 1 15 . 1 1 55 55 VAL C C 55 173.624 173.624 174.865 -1.241 25061 10261 1 15 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.849 -1.054 25061 10262 1 15 . 1 1 55 55 VAL CB C 55 32.828 32.828 33.069 -0.241 25061 10263 1 15 . 1 1 55 55 VAL H H 55 8.652 8.652 8.493 0.159 25061 10264 1 15 . 1 1 56 56 ILE N N 56 127.503 127.503 126.892 0.611 25061 10265 1 15 . 1 1 56 56 ILE HA H 56 4.664 4.664 4.812 -0.148 25061 10266 1 15 . 1 1 56 56 ILE C C 56 173.479 173.479 174.849 -1.370 25061 10267 1 15 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.715 0.292 25061 10268 1 15 . 1 1 56 56 ILE CB C 56 40.285 40.285 39.038 1.247 25061 10269 1 15 . 1 1 56 56 ILE H H 56 9.124 9.124 8.442 0.682 25061 10270 1 15 . 1 1 57 57 PHE N N 57 125.302 125.302 127.538 -2.236 25061 10271 1 15 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.293 -0.077 25061 10272 1 15 . 1 1 57 57 PHE C C 57 174.536 174.536 175.601 -1.065 25061 10273 1 15 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.024 -0.063 25061 10274 1 15 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.755 0.674 25061 10275 1 15 . 1 1 57 57 PHE H H 57 8.971 8.971 9.069 -0.098 25061 10276 1 15 . 1 1 58 58 ILE N N 58 126.472 126.472 123.314 3.158 25061 10277 1 15 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.642 -0.127 25061 10278 1 15 . 1 1 58 58 ILE C C 58 173.391 173.391 174.592 -1.201 25061 10279 1 15 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.867 -0.777 25061 10280 1 15 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.400 -0.658 25061 10281 1 15 . 1 1 58 58 ILE H H 58 9.248 9.248 8.921 0.327 25061 10282 1 15 . 1 1 59 59 ARG N N 59 124.681 124.681 124.583 0.098 25061 10283 1 15 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.304 -0.375 25061 10284 1 15 . 1 1 59 59 ARG C C 59 178.521 178.521 177.703 0.818 25061 10285 1 15 . 1 1 59 59 ARG CA C 59 55.742 55.742 54.418 1.324 25061 10286 1 15 . 1 1 59 59 ARG CB C 59 30.918 30.918 33.346 -2.428 25061 10287 1 15 . 1 1 59 59 ARG H H 59 8.587 8.587 8.570 0.017 25061 10288 1 15 . 1 1 60 60 GLY N N 60 108.848 108.848 108.307 0.541 25061 10289 1 15 . 1 1 60 60 GLY C C 60 174.775 174.775 174.680 0.095 25061 10290 1 15 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.299 -0.332 25061 10291 1 15 . 1 1 60 60 GLY H H 60 7.732 7.732 8.408 -0.676 25061 10292 1 15 . 1 1 61 61 ALA N N 61 120.877 120.877 122.508 -1.631 25061 10293 1 15 . 1 1 61 61 ALA HA H 61 4.144 4.144 4.027 0.117 25061 10294 1 15 . 1 1 61 61 ALA C C 61 177.769 177.769 178.865 -1.096 25061 10295 1 15 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.603 -0.154 25061 10296 1 15 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.530 -0.159 25061 10297 1 15 . 1 1 61 61 ALA H H 61 7.852 7.852 8.327 -0.475 25061 10298 1 15 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.297 0.503 25061 10299 1 15 . 1 1 62 62 TYR CA C 62 63.039 63.039 60.172 2.868 25061 10300 1 15 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.905 -0.465 25061 10301 1 15 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.783 -0.098 25061 10302 1 15 . 1 1 63 63 GLU C C 63 176.251 176.251 178.396 -2.145 25061 10303 1 15 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.511 -0.253 25061 10304 1 15 . 1 1 63 63 GLU CB C 63 29.412 29.412 28.884 0.528 25061 10305 1 15 . 1 1 64 64 GLU N N 64 119.209 119.209 120.129 -0.920 25061 10306 1 15 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.936 -0.035 25061 10307 1 15 . 1 1 64 64 GLU C C 64 178.251 178.251 178.966 -0.715 25061 10308 1 15 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.800 0.412 25061 10309 1 15 . 1 1 64 64 GLU CB C 64 28.645 28.645 28.797 -0.152 25061 10310 1 15 . 1 1 64 64 GLU H H 64 8.878 8.878 8.054 0.824 25061 10311 1 15 . 1 1 65 65 VAL N N 65 116.728 116.728 119.505 -2.777 25061 10312 1 15 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.750 0.232 25061 10313 1 15 . 1 1 65 65 VAL C C 65 176.915 176.915 177.914 -0.999 25061 10314 1 15 . 1 1 65 65 VAL CA C 65 64.609 64.609 66.287 -1.678 25061 10315 1 15 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.263 0.632 25061 10316 1 15 . 1 1 65 65 VAL H H 65 7.652 7.652 8.263 -0.611 25061 10317 1 15 . 1 1 66 66 VAL N N 66 119.462 119.462 119.064 0.398 25061 10318 1 15 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.670 -0.356 25061 10319 1 15 . 1 1 66 66 VAL C C 66 177.142 177.142 177.836 -0.694 25061 10320 1 15 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.130 1.204 25061 10321 1 15 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.427 0.003 25061 10322 1 15 . 1 1 66 66 VAL H H 66 7.896 7.896 7.688 0.208 25061 10323 1 15 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.038 -0.410 25061 10324 1 15 . 1 1 67 67 ARG C C 67 177.841 177.841 178.176 -0.335 25061 10325 1 15 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.204 0.848 25061 10326 1 15 . 1 1 67 67 ARG CB C 67 29.393 29.393 29.713 -0.320 25061 10327 1 15 . 1 1 68 68 ASP N N 68 118.316 118.316 119.401 -1.085 25061 10328 1 15 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.546 -0.185 25061 10329 1 15 . 1 1 68 68 ASP C C 68 178.945 178.945 178.576 0.369 25061 10330 1 15 . 1 1 68 68 ASP CA C 68 57.311 57.311 58.030 -0.719 25061 10331 1 15 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.888 0.626 25061 10332 1 15 . 1 1 68 68 ASP H H 68 7.625 7.625 7.740 -0.115 25061 10333 1 15 . 1 1 69 69 ILE N N 69 119.231 119.231 120.675 -1.444 25061 10334 1 15 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.654 -0.024 25061 10335 1 15 . 1 1 69 69 ILE C C 69 177.138 177.138 177.912 -0.774 25061 10336 1 15 . 1 1 69 69 ILE CA C 69 64.540 64.540 65.487 -0.947 25061 10337 1 15 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.842 -0.792 25061 10338 1 15 . 1 1 69 69 ILE H H 69 8.113 8.113 7.487 0.626 25061 10339 1 15 . 1 1 70 70 VAL N N 70 120.164 120.164 119.703 0.461 25061 10340 1 15 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.503 -0.086 25061 10341 1 15 . 1 1 70 70 VAL C C 70 177.079 177.079 177.908 -0.829 25061 10342 1 15 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.830 -0.556 25061 10343 1 15 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.329 -0.071 25061 10344 1 15 . 1 1 70 70 VAL H H 70 8.478 8.478 8.226 0.252 25061 10345 1 15 . 1 1 71 71 GLU N N 71 118.293 118.293 118.919 -0.626 25061 10346 1 15 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.956 0.098 25061 10347 1 15 . 1 1 71 71 GLU C C 71 179.009 179.009 179.034 -0.025 25061 10348 1 15 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.700 -0.284 25061 10349 1 15 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.317 -0.494 25061 10350 1 15 . 1 1 71 71 GLU H H 71 8.152 8.152 8.010 0.142 25061 10351 1 15 . 1 1 72 72 TYR N N 72 120.091 120.091 120.746 -0.655 25061 10352 1 15 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.085 0.077 25061 10353 1 15 . 1 1 72 72 TYR C C 72 176.404 176.404 177.142 -0.738 25061 10354 1 15 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.636 -0.504 25061 10355 1 15 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.482 -0.345 25061 10356 1 15 . 1 1 72 72 TYR H H 72 7.959 7.959 7.723 0.236 25061 10357 1 15 . 1 1 73 73 ALA N N 73 120.133 120.133 119.273 0.860 25061 10358 1 15 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.875 -0.245 25061 10359 1 15 . 1 1 73 73 ALA C C 73 179.182 179.182 179.824 -0.642 25061 10360 1 15 . 1 1 73 73 ALA CA C 73 55.112 55.112 54.996 0.116 25061 10361 1 15 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.276 -0.085 25061 10362 1 15 . 1 1 73 73 ALA H H 73 8.604 8.604 8.390 0.214 25061 10363 1 15 . 1 1 74 74 GLN N N 74 115.553 115.553 116.566 -1.013 25061 10364 1 15 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.108 0.030 25061 10365 1 15 . 1 1 74 74 GLN C C 74 180.595 180.595 178.547 2.048 25061 10366 1 15 . 1 1 74 74 GLN CA C 74 59.095 59.095 57.895 1.200 25061 10367 1 15 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.405 0.170 25061 10368 1 15 . 1 1 74 74 GLN H H 74 8.619 8.619 7.991 0.628 25061 10369 1 15 . 1 1 75 75 LYS N N 75 122.396 122.396 119.017 3.379 25061 10370 1 15 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.085 -0.057 25061 10371 1 15 . 1 1 75 75 LYS C C 75 178.521 178.521 178.478 0.043 25061 10372 1 15 . 1 1 75 75 LYS CA C 75 59.058 59.058 57.804 1.254 25061 10373 1 15 . 1 1 75 75 LYS CB C 75 31.599 31.599 32.018 -0.419 25061 10374 1 15 . 1 1 75 75 LYS H H 75 8.123 8.123 7.540 0.583 25061 10375 1 15 . 1 1 76 76 GLU N N 76 116.294 116.294 116.369 -0.075 25061 10376 1 15 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.207 -0.108 25061 10377 1 15 . 1 1 76 76 GLU C C 76 175.957 175.957 177.024 -1.067 25061 10378 1 15 . 1 1 76 76 GLU CA C 76 55.605 55.605 55.904 -0.299 25061 10379 1 15 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.535 0.289 25061 10380 1 15 . 1 1 76 76 GLU H H 76 7.450 7.450 7.617 -0.167 25061 10381 1 15 . 1 1 77 77 GLY N N 77 107.446 107.446 107.841 -0.395 25061 10382 1 15 . 1 1 77 77 GLY C C 77 174.520 174.520 174.536 -0.016 25061 10383 1 15 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.786 0.021 25061 10384 1 15 . 1 1 77 77 GLY H H 77 7.763 7.763 7.400 0.363 25061 10385 1 15 . 1 1 78 78 LEU N N 78 120.179 120.179 118.453 1.726 25061 10386 1 15 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.404 -0.016 25061 10387 1 15 . 1 1 78 78 LEU C C 78 175.914 175.914 176.105 -0.191 25061 10388 1 15 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.546 -0.074 25061 10389 1 15 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.990 -1.101 25061 10390 1 15 . 1 1 78 78 LEU H H 78 7.930 7.930 7.918 0.012 25061 10391 1 15 . 1 1 79 79 ARG N N 79 122.207 122.207 123.104 -0.897 25061 10392 1 15 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.235 0.162 25061 10393 1 15 . 1 1 79 79 ARG C C 79 174.960 174.960 174.542 0.418 25061 10394 1 15 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.282 0.366 25061 10395 1 15 . 1 1 79 79 ARG CB C 79 30.476 30.476 29.383 1.093 25061 10396 1 15 . 1 1 79 79 ARG H H 79 8.241 8.241 8.095 0.146 25061 10397 1 15 . 1 1 80 80 VAL N N 80 123.333 123.333 126.359 -3.026 25061 10398 1 15 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.453 0.842 25061 10399 1 15 . 1 1 80 80 VAL C C 80 174.048 174.048 174.110 -0.062 25061 10400 1 15 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.093 -1.052 25061 10401 1 15 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.343 1.962 25061 10402 1 15 . 1 1 80 80 VAL H H 80 8.359 8.359 8.452 -0.093 25061 10403 1 15 . 1 1 81 81 LEU N N 81 128.719 128.719 130.517 -1.798 25061 10404 1 15 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.177 -0.073 25061 10405 1 15 . 1 1 81 81 LEU C C 81 174.484 174.484 174.180 0.304 25061 10406 1 15 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.955 0.165 25061 10407 1 15 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.473 -0.518 25061 10408 1 15 . 1 1 81 81 LEU H H 81 8.650 8.650 8.843 -0.193 25061 10409 1 15 . 1 1 82 82 VAL N N 82 122.487 122.487 128.168 -5.681 25061 10410 1 15 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.699 0.398 25061 10411 1 15 . 1 1 82 82 VAL C C 82 174.525 174.525 173.986 0.539 25061 10412 1 15 . 1 1 82 82 VAL CA C 82 60.285 60.285 60.164 0.121 25061 10413 1 15 . 1 1 82 82 VAL CB C 82 34.789 34.789 33.101 1.688 25061 10414 1 15 . 1 1 82 82 VAL H H 82 8.781 8.781 8.840 -0.059 25061 10415 1 15 . 1 1 83 83 ILE N N 83 128.082 128.082 130.550 -2.468 25061 10416 1 15 . 1 1 83 83 ILE HA H 83 4.930 4.930 5.009 -0.079 25061 10417 1 15 . 1 1 83 83 ILE C C 83 172.925 172.925 174.529 -1.604 25061 10418 1 15 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.178 -0.237 25061 10419 1 15 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.022 2.164 25061 10420 1 15 . 1 1 83 83 ILE H H 83 9.527 9.527 8.571 0.956 25061 10421 1 15 . 1 1 84 84 LYS N N 84 128.493 128.493 126.437 2.056 25061 10422 1 15 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.382 -0.334 25061 10423 1 15 . 1 1 84 84 LYS C C 84 174.027 174.027 175.278 -1.251 25061 10424 1 15 . 1 1 84 84 LYS CA C 84 53.253 53.253 54.082 -0.829 25061 10425 1 15 . 1 1 84 84 LYS CB C 84 34.652 34.652 36.491 -1.839 25061 10426 1 15 . 1 1 84 84 LYS H H 84 8.721 8.721 8.856 -0.135 25061 10427 1 15 . 1 1 85 85 VAL N N 85 126.729 126.729 122.613 4.116 25061 10428 1 15 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.159 0.577 25061 10429 1 15 . 1 1 85 85 VAL C C 85 175.935 175.935 174.883 1.052 25061 10430 1 15 . 1 1 85 85 VAL CA C 85 60.200 60.200 62.202 -2.002 25061 10431 1 15 . 1 1 85 85 VAL CB C 85 30.847 30.847 32.590 -1.743 25061 10432 1 15 . 1 1 85 85 VAL H H 85 8.643 8.643 7.844 0.799 25061 10433 1 15 . 1 1 86 86 ALA N N 86 132.930 132.930 128.815 4.115 25061 10434 1 15 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.658 -0.228 25061 10435 1 15 . 1 1 86 86 ALA C C 86 175.635 175.635 176.915 -1.280 25061 10436 1 15 . 1 1 86 86 ALA CA C 86 51.504 51.504 52.014 -0.510 25061 10437 1 15 . 1 1 86 86 ALA CB C 86 20.821 20.821 20.781 0.040 25061 10438 1 15 . 1 1 86 86 ALA H H 86 8.835 8.835 8.128 0.707 25061 10439 1 15 . 1 1 87 87 GLN N N 87 118.719 118.719 121.780 -3.061 25061 10440 1 15 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.785 -0.316 25061 10441 1 15 . 1 1 87 87 GLN C C 87 175.949 175.949 175.879 0.070 25061 10442 1 15 . 1 1 87 87 GLN CA C 87 55.260 55.260 56.602 -1.342 25061 10443 1 15 . 1 1 87 87 GLN CB C 87 30.432 30.432 29.990 0.442 25061 10444 1 15 . 1 1 87 87 GLN H H 87 8.570 8.570 8.680 -0.110 25061 10445 1 15 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.691 -0.211 25061 10446 1 15 . 1 1 88 88 ASP CA C 88 55.454 55.454 54.131 1.323 25061 10447 1 15 . 1 1 88 88 ASP CB C 88 41.204 41.204 41.565 -0.361 25061 10448 1 15 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.563 -0.516 25061 10449 1 15 . 1 1 89 89 GLN CA C 89 56.687 56.687 55.720 0.967 25061 10450 1 15 . 1 1 89 89 GLN CB C 89 27.850 27.850 30.880 -3.030 25061 10451 1 15 . 1 1 92 92 LEU N N 92 125.291 125.291 120.959 4.332 25061 10452 1 15 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.401 -0.200 25061 10453 1 15 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.509 -2.452 25061 10454 1 15 . 1 1 92 92 LEU CB C 92 42.046 42.046 42.017 0.028 25061 10455 1 15 . 1 1 92 92 LEU H H 92 8.277 8.277 8.003 0.274 25061 10456 1 15 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.354 0.402 25061 10457 1 15 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.151 -0.102 25061 10458 1 15 . 1 1 94 94 ARG C C 94 178.544 178.544 178.233 0.311 25061 10459 1 15 . 1 1 94 94 ARG CA C 94 58.607 58.607 58.687 -0.080 25061 10460 1 15 . 1 1 94 94 ARG CB C 94 29.614 29.614 29.836 -0.222 25061 10461 1 15 . 1 1 95 95 PHE N N 95 117.407 117.407 119.864 -2.457 25061 10462 1 15 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.202 0.173 25061 10463 1 15 . 1 1 95 95 PHE CA C 95 60.231 60.231 61.477 -1.246 25061 10464 1 15 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.257 -1.315 25061 10465 1 15 . 1 1 95 95 PHE H H 95 8.419 8.419 7.670 0.749 25061 10466 1 15 . 1 1 96 96 TYR HA H 96 3.808 3.808 4.004 -0.196 25061 10467 1 15 . 1 1 96 96 TYR C C 96 177.728 177.728 177.405 0.323 25061 10468 1 15 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.767 1.389 25061 10469 1 15 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.457 -0.757 25061 10470 1 15 . 1 1 97 97 GLU N N 97 119.054 119.054 118.065 0.989 25061 10471 1 15 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.729 0.334 25061 10472 1 15 . 1 1 97 97 GLU C C 97 179.071 179.071 178.785 0.286 25061 10473 1 15 . 1 1 97 97 GLU CA C 97 58.760 58.760 59.817 -1.057 25061 10474 1 15 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.329 -0.157 25061 10475 1 15 . 1 1 97 97 GLU H H 97 7.858 7.858 7.924 -0.066 25061 10476 1 15 . 1 1 98 98 GLN N N 98 119.385 119.385 118.689 0.696 25061 10477 1 15 . 1 1 98 98 GLN HA H 98 3.901 3.901 4.039 -0.138 25061 10478 1 15 . 1 1 98 98 GLN C C 98 177.599 177.599 178.367 -0.768 25061 10479 1 15 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.151 0.160 25061 10480 1 15 . 1 1 98 98 GLN CB C 98 27.766 27.766 27.791 -0.025 25061 10481 1 15 . 1 1 98 98 GLN H H 98 7.747 7.747 7.791 -0.044 25061 10482 1 15 . 1 1 99 99 LEU N N 99 118.348 118.348 119.211 -0.863 25061 10483 1 15 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.790 0.229 25061 10484 1 15 . 1 1 99 99 LEU C C 99 178.669 178.669 178.577 0.092 25061 10485 1 15 . 1 1 99 99 LEU CA C 99 57.430 57.430 58.082 -0.652 25061 10486 1 15 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.266 0.237 25061 10487 1 15 . 1 1 99 99 LEU H H 99 7.891 7.891 7.529 0.362 25061 10488 1 15 . 1 1 100 100 LYS N N 100 118.332 118.332 118.826 -0.494 25061 10489 1 15 . 1 1 100 100 LYS HA H 100 4.509 4.509 4.131 0.378 25061 10490 1 15 . 1 1 100 100 LYS C C 100 180.846 180.846 178.939 1.907 25061 10491 1 15 . 1 1 100 100 LYS CA C 100 59.088 59.088 59.016 0.072 25061 10492 1 15 . 1 1 100 100 LYS CB C 100 32.269 32.269 32.207 0.062 25061 10493 1 15 . 1 1 100 100 LYS H H 100 7.560 7.560 7.296 0.264 25061 10494 1 15 . 1 1 101 101 LYS N N 101 121.944 121.944 117.955 3.989 25061 10495 1 15 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.048 0.024 25061 10496 1 15 . 1 1 101 101 LYS C C 101 177.707 177.707 178.185 -0.478 25061 10497 1 15 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.430 0.441 25061 10498 1 15 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.219 -0.124 25061 10499 1 15 . 1 1 101 101 LYS H H 101 7.959 7.959 7.579 0.380 25061 10500 1 15 . 1 1 102 102 ASP N N 102 118.788 118.788 117.905 0.883 25061 10501 1 15 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.451 0.243 25061 10502 1 15 . 1 1 102 102 ASP C C 102 176.359 176.359 177.468 -1.109 25061 10503 1 15 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.553 -0.974 25061 10504 1 15 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.638 -1.064 25061 10505 1 15 . 1 1 102 102 ASP H H 102 7.893 7.893 7.709 0.184 25061 10506 1 15 . 1 1 103 103 GLY N N 103 107.024 107.024 105.101 1.923 25061 10507 1 15 . 1 1 103 103 GLY C C 103 174.328 174.328 174.257 0.071 25061 10508 1 15 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.694 0.652 25061 10509 1 15 . 1 1 103 103 GLY H H 103 7.866 7.866 7.869 -0.003 25061 10510 1 15 . 1 1 104 104 VAL N N 104 123.060 123.060 122.652 0.408 25061 10511 1 15 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.844 0.129 25061 10512 1 15 . 1 1 104 104 VAL C C 104 175.023 175.023 175.080 -0.057 25061 10513 1 15 . 1 1 104 104 VAL CA C 104 61.878 61.878 62.798 -0.920 25061 10514 1 15 . 1 1 104 104 VAL CB C 104 32.088 32.088 31.237 0.851 25061 10515 1 15 . 1 1 104 104 VAL H H 104 7.955 7.955 7.753 0.202 25061 10516 1 15 . 1 1 105 105 ASP N N 105 127.987 127.987 128.385 -0.398 25061 10517 1 15 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.607 -0.032 25061 10518 1 15 . 1 1 105 105 ASP C C 105 173.624 173.624 174.508 -0.884 25061 10519 1 15 . 1 1 105 105 ASP CA C 105 54.087 54.087 54.264 -0.177 25061 10520 1 15 . 1 1 105 105 ASP CB C 105 40.660 40.660 42.747 -2.087 25061 10521 1 15 . 1 1 105 105 ASP H H 105 8.399 8.399 8.121 0.278 25061 10522 1 15 . 1 1 106 106 VAL N N 106 125.798 125.798 118.368 7.430 25061 10523 1 15 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.971 -0.156 25061 10524 1 15 . 1 1 106 106 VAL C C 106 174.902 174.902 175.162 -0.260 25061 10525 1 15 . 1 1 106 106 VAL CA C 106 60.194 60.194 60.038 0.156 25061 10526 1 15 . 1 1 106 106 VAL CB C 106 34.179 34.179 33.276 0.903 25061 10527 1 15 . 1 1 106 106 VAL H H 106 7.550 7.550 7.986 -0.436 25061 10528 1 15 . 1 1 107 107 ARG N N 107 128.099 128.099 128.431 -0.332 25061 10529 1 15 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.767 0.109 25061 10530 1 15 . 1 1 107 107 ARG C C 107 173.815 173.815 175.071 -1.256 25061 10531 1 15 . 1 1 107 107 ARG CA C 107 53.386 53.386 54.509 -1.123 25061 10532 1 15 . 1 1 107 107 ARG CB C 107 31.195 31.195 31.241 -0.046 25061 10533 1 15 . 1 1 107 107 ARG H H 107 9.132 9.132 8.730 0.402 25061 10534 1 15 . 1 1 108 108 VAL N N 108 123.979 123.979 121.627 2.352 25061 10535 1 15 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.165 -0.223 25061 10536 1 15 . 1 1 108 108 VAL C C 108 175.854 175.854 176.466 -0.612 25061 10537 1 15 . 1 1 108 108 VAL CA C 108 60.017 60.017 60.530 -0.513 25061 10538 1 15 . 1 1 108 108 VAL CB C 108 32.844 32.844 32.817 0.027 25061 10539 1 15 . 1 1 108 108 VAL H H 108 8.561 8.561 8.633 -0.072 25061 10540 1 15 . 1 1 109 109 THR N N 109 120.144 120.144 115.309 4.835 25061 10541 1 15 . 1 1 109 109 THR HA H 109 4.815 4.815 4.397 0.418 25061 10542 1 15 . 1 1 109 109 THR C C 109 171.867 171.867 175.719 -3.852 25061 10543 1 15 . 1 1 109 109 THR CA C 109 59.613 59.613 62.762 -3.149 25061 10544 1 15 . 1 1 109 109 THR CB C 109 69.720 69.720 69.742 -0.022 25061 10545 1 15 . 1 1 109 109 THR H H 109 8.803 8.803 8.521 0.282 25061 10546 1 15 . 1 1 110 110 ASP N N 110 123.212 123.212 121.548 1.664 25061 10547 1 15 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.372 0.597 25061 10548 1 15 . 1 1 110 110 ASP C C 110 175.739 175.739 175.052 0.687 25061 10549 1 15 . 1 1 110 110 ASP CA C 110 53.243 53.243 56.784 -3.541 25061 10550 1 15 . 1 1 110 110 ASP CB C 110 41.351 41.351 39.523 1.827 25061 10551 1 15 . 1 1 110 110 ASP H H 110 8.363 8.363 8.732 -0.369 25061 10552 1 15 . 1 1 111 111 ASN N N 111 116.298 116.298 119.968 -3.670 25061 10553 1 15 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.724 0.152 25061 10554 1 15 . 1 1 111 111 ASN C C 111 174.756 174.756 176.180 -1.424 25061 10555 1 15 . 1 1 111 111 ASN CA C 111 52.132 52.132 53.256 -1.124 25061 10556 1 15 . 1 1 111 111 ASN CB C 111 40.765 40.765 39.190 1.575 25061 10557 1 15 . 1 1 111 111 ASN H H 111 8.085 8.085 8.102 -0.017 25061 10558 1 15 . 1 1 112 112 GLU HA H 112 3.848 3.848 3.967 -0.119 25061 10559 1 15 . 1 1 112 112 GLU C C 112 177.016 177.016 177.767 -0.751 25061 10560 1 15 . 1 1 112 112 GLU CA C 112 59.480 59.480 60.265 -0.785 25061 10561 1 15 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.522 0.152 25061 10562 1 15 . 1 1 113 113 ASP N N 113 121.033 121.033 119.288 1.745 25061 10563 1 15 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.500 -0.087 25061 10564 1 15 . 1 1 113 113 ASP C C 113 178.988 178.988 178.571 0.417 25061 10565 1 15 . 1 1 113 113 ASP CA C 113 57.855 57.855 57.278 0.577 25061 10566 1 15 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.255 0.247 25061 10567 1 15 . 1 1 113 113 ASP H H 113 8.219 8.219 8.670 -0.451 25061 10568 1 15 . 1 1 114 114 GLU N N 114 121.280 121.280 119.293 1.987 25061 10569 1 15 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.174 -0.109 25061 10570 1 15 . 1 1 114 114 GLU C C 114 178.776 178.776 178.195 0.581 25061 10571 1 15 . 1 1 114 114 GLU CA C 114 58.714 58.714 58.482 0.232 25061 10572 1 15 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.000 0.212 25061 10573 1 15 . 1 1 114 114 GLU H H 114 8.296 8.296 8.631 -0.335 25061 10574 1 15 . 1 1 115 115 ALA N N 115 120.924 120.924 122.527 -1.603 25061 10575 1 15 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.100 -0.262 25061 10576 1 15 . 1 1 115 115 ALA C C 115 178.502 178.502 179.337 -0.835 25061 10577 1 15 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.338 0.300 25061 10578 1 15 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.417 0.080 25061 10579 1 15 . 1 1 115 115 ALA H H 115 7.853 7.853 7.483 0.370 25061 10580 1 15 . 1 1 116 116 LYS N N 116 116.616 116.616 117.824 -1.208 25061 10581 1 15 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.983 -0.264 25061 10582 1 15 . 1 1 116 116 LYS C C 116 178.097 178.097 178.494 -0.397 25061 10583 1 15 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.203 1.550 25061 10584 1 15 . 1 1 116 116 LYS CB C 116 32.555 32.555 31.883 0.672 25061 10585 1 15 . 1 1 116 116 LYS H H 116 8.091 8.091 7.963 0.128 25061 10586 1 15 . 1 1 117 117 LYS N N 117 118.990 118.990 120.519 -1.529 25061 10587 1 15 . 1 1 117 117 LYS HA H 117 3.911 3.911 3.981 -0.070 25061 10588 1 15 . 1 1 117 117 LYS C C 117 179.186 179.186 179.049 0.137 25061 10589 1 15 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.334 0.237 25061 10590 1 15 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.383 0.137 25061 10591 1 15 . 1 1 117 117 LYS H H 117 7.742 7.742 7.546 0.196 25061 10592 1 15 . 1 1 118 118 ARG N N 118 117.441 117.441 119.149 -1.708 25061 10593 1 15 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.283 -0.143 25061 10594 1 15 . 1 1 118 118 ARG C C 118 178.921 178.921 179.149 -0.228 25061 10595 1 15 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.526 -0.855 25061 10596 1 15 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.697 -0.036 25061 10597 1 15 . 1 1 118 118 ARG H H 118 8.468 8.468 7.559 0.909 25061 10598 1 15 . 1 1 119 119 LEU N N 119 120.100 120.100 120.180 -0.080 25061 10599 1 15 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.855 0.105 25061 10600 1 15 . 1 1 119 119 LEU C C 119 177.554 177.554 178.724 -1.170 25061 10601 1 15 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.235 -0.354 25061 10602 1 15 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.514 0.375 25061 10603 1 15 . 1 1 119 119 LEU H H 119 8.322 8.322 8.201 0.120 25061 10604 1 15 . 1 1 120 120 LYS N N 120 118.238 118.238 119.101 -0.863 25061 10605 1 15 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.968 -0.146 25061 10606 1 15 . 1 1 120 120 LYS C C 120 178.703 178.703 179.109 -0.406 25061 10607 1 15 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.383 0.963 25061 10608 1 15 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.345 -0.109 25061 10609 1 15 . 1 1 120 120 LYS H H 120 7.990 7.990 7.590 0.400 25061 10610 1 15 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.338 -0.316 25061 10611 1 15 . 1 1 121 121 GLU C C 121 177.769 177.769 179.216 -1.447 25061 10612 1 15 . 1 1 121 121 GLU CA C 121 58.922 58.922 58.873 0.049 25061 10613 1 15 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.624 -0.170 25061 10614 1 15 . 1 1 122 122 LEU N N 122 119.454 119.454 119.539 -0.085 25061 10615 1 15 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.030 0.103 25061 10616 1 15 . 1 1 122 122 LEU C C 122 178.991 178.991 178.346 0.645 25061 10617 1 15 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.366 -0.040 25061 10618 1 15 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.818 -0.139 25061 10619 1 15 . 1 1 122 122 LEU H H 122 7.930 7.930 7.960 -0.030 25061 10620 1 15 . 1 1 123 123 LEU N N 123 117.862 117.862 117.193 0.669 25061 10621 1 15 . 1 1 123 123 LEU HA H 123 4.067 4.067 4.106 -0.039 25061 10622 1 15 . 1 1 123 123 LEU C C 123 179.178 179.178 178.984 0.194 25061 10623 1 15 . 1 1 123 123 LEU CA C 123 56.920 56.920 57.318 -0.398 25061 10624 1 15 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.907 -0.698 25061 10625 1 15 . 1 1 123 123 LEU H H 123 8.095 8.095 7.609 0.486 25061 10626 1 15 . 1 1 124 124 GLU N N 124 118.975 118.975 117.349 1.626 25061 10627 1 15 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.072 0.057 25061 10628 1 15 . 1 1 124 124 GLU C C 124 177.777 177.777 177.139 0.638 25061 10629 1 15 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.572 -0.485 25061 10630 1 15 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.875 -0.335 25061 10631 1 15 . 1 1 124 124 GLU H H 124 7.930 7.930 8.117 -0.187 25061 10632 1 15 . 1 1 125 125 LYS N N 125 118.933 118.933 116.101 2.832 25061 10633 1 15 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.321 0.016 25061 10634 1 15 . 1 1 125 125 LYS C C 125 178.188 178.188 176.224 1.964 25061 10635 1 15 . 1 1 125 125 LYS CA C 125 56.980 56.980 56.756 0.224 25061 10636 1 15 . 1 1 125 125 LYS CB C 125 32.608 32.608 34.068 -1.460 25061 10637 1 15 . 1 1 125 125 LYS H H 125 7.729 7.729 7.418 0.311 25061 10638 1 15 . 1 1 126 126 VAL N N 126 117.933 117.933 114.010 3.923 25061 10639 1 15 . 1 1 126 126 VAL HA H 126 4.022 4.022 4.202 -0.180 25061 10640 1 15 . 1 1 126 126 VAL C C 126 176.947 176.947 175.280 1.667 25061 10641 1 15 . 1 1 126 126 VAL CA C 126 63.641 63.641 62.602 1.039 25061 10642 1 15 . 1 1 126 126 VAL CB C 126 31.859 31.859 33.363 -1.504 25061 10643 1 15 . 1 1 126 126 VAL H H 126 8.044 8.044 8.061 -0.017 25061 10644 1 15 . 1 1 127 127 GLY N N 127 109.813 109.813 107.264 2.549 25061 10645 1 15 . 1 1 127 127 GLY C C 127 174.264 174.264 174.171 0.093 25061 10646 1 15 . 1 1 127 127 GLY CA C 127 45.279 45.279 44.873 0.405 25061 10647 1 15 . 1 1 127 127 GLY H H 127 8.279 8.279 7.785 0.494 25061 10648 1 15 . 1 1 128 128 SER N N 128 115.185 115.185 115.733 -0.548 25061 10649 1 15 . 1 1 128 128 SER HA H 128 4.462 4.462 4.680 -0.218 25061 10650 1 15 . 1 1 128 128 SER C C 128 174.775 174.775 173.743 1.032 25061 10651 1 15 . 1 1 128 128 SER CA C 128 58.739 58.739 57.888 0.851 25061 10652 1 15 . 1 1 128 128 SER CB C 128 63.850 63.850 64.738 -0.888 25061 10653 1 15 . 1 1 128 128 SER H H 128 8.048 8.048 7.904 0.144 25061 10654 1 15 . 1 1 129 129 LEU N N 129 123.060 123.060 122.369 0.691 25061 10655 1 15 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.188 0.110 25061 10656 1 15 . 1 1 129 129 LEU C C 129 177.313 177.313 176.092 1.221 25061 10657 1 15 . 1 1 129 129 LEU CA C 129 55.158 55.158 55.284 -0.126 25061 10658 1 15 . 1 1 129 129 LEU CB C 129 41.837 41.837 42.207 -0.370 25061 10659 1 15 . 1 1 129 129 LEU H H 129 8.147 8.147 8.198 -0.051 25061 10660 1 15 . 1 1 130 130 GLU N N 130 120.088 120.088 125.991 -5.903 25061 10661 1 15 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.347 -0.166 25061 10662 1 15 . 1 1 130 130 GLU C C 130 176.148 176.148 175.923 0.225 25061 10663 1 15 . 1 1 130 130 GLU CA C 130 56.726 56.726 57.668 -0.942 25061 10664 1 15 . 1 1 130 130 GLU CB C 130 30.026 30.026 29.007 1.019 25061 10665 1 15 . 1 1 130 130 GLU H H 130 8.242 8.242 8.701 -0.459 25061 10666 1 16 . 1 1 2 2 GLY CA C 2 45.319 45.319 44.538 0.781 25061 10667 1 16 . 1 1 3 3 THR HA H 3 4.820 4.820 4.632 0.188 25061 10668 1 16 . 1 1 3 3 THR C C 3 172.374 172.374 174.075 -1.701 25061 10669 1 16 . 1 1 3 3 THR CA C 3 62.760 62.760 62.647 0.113 25061 10670 1 16 . 1 1 3 3 THR CB C 3 71.441 71.441 69.125 2.316 25061 10671 1 16 . 1 1 4 4 VAL N N 4 126.881 126.881 129.855 -2.974 25061 10672 1 16 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.505 0.063 25061 10673 1 16 . 1 1 4 4 VAL C C 4 173.116 173.116 174.526 -1.410 25061 10674 1 16 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.730 -1.275 25061 10675 1 16 . 1 1 4 4 VAL CB C 4 33.800 33.800 32.152 1.648 25061 10676 1 16 . 1 1 4 4 VAL H H 4 9.097 9.097 8.981 0.116 25061 10677 1 16 . 1 1 5 5 VAL N N 5 127.172 127.172 125.079 2.093 25061 10678 1 16 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.457 -0.570 25061 10679 1 16 . 1 1 5 5 VAL C C 5 174.091 174.091 174.947 -0.856 25061 10680 1 16 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.493 0.625 25061 10681 1 16 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.228 -0.293 25061 10682 1 16 . 1 1 5 5 VAL H H 5 8.811 8.811 8.927 -0.116 25061 10683 1 16 . 1 1 6 6 ILE N N 6 127.577 127.577 128.410 -0.833 25061 10684 1 16 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.521 0.099 25061 10685 1 16 . 1 1 6 6 ILE C C 6 173.328 173.328 175.567 -2.239 25061 10686 1 16 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.607 0.225 25061 10687 1 16 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.640 1.290 25061 10688 1 16 . 1 1 6 6 ILE H H 6 9.210 9.210 8.684 0.526 25061 10689 1 16 . 1 1 7 7 VAL N N 7 129.024 129.024 129.203 -0.179 25061 10690 1 16 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.647 0.158 25061 10691 1 16 . 1 1 7 7 VAL C C 7 173.561 173.561 175.389 -1.828 25061 10692 1 16 . 1 1 7 7 VAL CA C 7 60.849 60.849 61.535 -0.686 25061 10693 1 16 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.211 1.149 25061 10694 1 16 . 1 1 7 7 VAL H H 7 9.294 9.294 8.108 1.186 25061 10695 1 16 . 1 1 8 8 VAL N N 8 125.318 125.318 128.053 -2.735 25061 10696 1 16 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.470 -0.074 25061 10697 1 16 . 1 1 8 8 VAL C C 8 175.723 175.723 175.253 0.470 25061 10698 1 16 . 1 1 8 8 VAL CA C 8 59.617 59.617 59.680 -0.063 25061 10699 1 16 . 1 1 8 8 VAL CB C 8 34.915 34.915 34.851 0.064 25061 10700 1 16 . 1 1 8 8 VAL H H 8 8.898 8.898 7.909 0.989 25061 10701 1 16 . 1 1 9 9 SER N N 9 116.544 116.544 116.372 0.172 25061 10702 1 16 . 1 1 9 9 SER HA H 9 4.724 4.724 5.113 -0.389 25061 10703 1 16 . 1 1 9 9 SER C C 9 174.552 174.552 174.422 0.130 25061 10704 1 16 . 1 1 9 9 SER CA C 9 57.419 57.419 56.414 1.004 25061 10705 1 16 . 1 1 9 9 SER CB C 9 64.998 64.998 65.535 -0.537 25061 10706 1 16 . 1 1 9 9 SER H H 9 7.833 7.833 8.015 -0.182 25061 10707 1 16 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.489 0.423 25061 10708 1 16 . 1 1 10 10 ASN C C 10 176.170 176.170 175.347 0.823 25061 10709 1 16 . 1 1 10 10 ASN CA C 10 54.141 54.141 54.421 -0.280 25061 10710 1 16 . 1 1 10 10 ASN CB C 10 38.626 38.626 38.645 -0.019 25061 10711 1 16 . 1 1 11 11 ASP N N 11 120.164 120.164 119.402 0.762 25061 10712 1 16 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.865 -0.022 25061 10713 1 16 . 1 1 11 11 ASP C C 11 176.148 176.148 176.258 -0.110 25061 10714 1 16 . 1 1 11 11 ASP CA C 11 52.620 52.620 51.960 0.660 25061 10715 1 16 . 1 1 11 11 ASP CB C 11 42.631 42.631 43.897 -1.266 25061 10716 1 16 . 1 1 11 11 ASP H H 11 8.142 8.142 7.466 0.676 25061 10717 1 16 . 1 1 12 12 GLU N N 12 127.184 127.184 122.276 4.908 25061 10718 1 16 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.176 -0.323 25061 10719 1 16 . 1 1 12 12 GLU C C 12 177.853 177.853 178.485 -0.632 25061 10720 1 16 . 1 1 12 12 GLU CA C 12 59.547 59.547 58.891 0.656 25061 10721 1 16 . 1 1 12 12 GLU CB C 12 29.819 29.819 30.099 -0.280 25061 10722 1 16 . 1 1 12 12 GLU H H 12 9.152 9.152 8.734 0.418 25061 10723 1 16 . 1 1 13 13 ARG N N 13 119.026 119.026 119.768 -0.742 25061 10724 1 16 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.294 -0.191 25061 10725 1 16 . 1 1 13 13 ARG C C 13 179.151 179.151 178.979 0.172 25061 10726 1 16 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.785 0.158 25061 10727 1 16 . 1 1 13 13 ARG CB C 13 28.757 28.757 30.048 -1.291 25061 10728 1 16 . 1 1 13 13 ARG H H 13 8.389 8.389 7.819 0.570 25061 10729 1 16 . 1 1 14 14 ILE N N 14 119.238 119.238 121.057 -1.819 25061 10730 1 16 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.838 -0.237 25061 10731 1 16 . 1 1 14 14 ILE C C 14 177.905 177.905 177.905 0.000 25061 10732 1 16 . 1 1 14 14 ILE CA C 14 64.666 64.666 64.128 0.538 25061 10733 1 16 . 1 1 14 14 ILE CB C 14 36.780 36.780 36.899 -0.119 25061 10734 1 16 . 1 1 14 14 ILE H H 14 7.254 7.254 8.174 -0.920 25061 10735 1 16 . 1 1 15 15 LEU N N 15 117.008 117.008 119.386 -2.378 25061 10736 1 16 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.177 -0.256 25061 10737 1 16 . 1 1 15 15 LEU C C 15 178.062 178.062 179.354 -1.292 25061 10738 1 16 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.120 0.291 25061 10739 1 16 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.568 -0.399 25061 10740 1 16 . 1 1 15 15 LEU H H 15 7.412 7.412 7.435 -0.023 25061 10741 1 16 . 1 1 16 16 GLU N N 16 117.637 117.637 119.039 -1.402 25061 10742 1 16 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.882 -0.181 25061 10743 1 16 . 1 1 16 16 GLU C C 16 179.182 179.182 178.972 0.210 25061 10744 1 16 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.452 -0.035 25061 10745 1 16 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.320 0.139 25061 10746 1 16 . 1 1 16 16 GLU H H 16 7.981 7.981 7.990 -0.009 25061 10747 1 16 . 1 1 17 17 GLU N N 17 119.759 119.759 120.987 -1.228 25061 10748 1 16 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.101 -0.085 25061 10749 1 16 . 1 1 17 17 GLU C C 17 179.949 179.949 178.972 0.977 25061 10750 1 16 . 1 1 17 17 GLU CA C 17 59.195 59.195 58.746 0.449 25061 10751 1 16 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.390 0.151 25061 10752 1 16 . 1 1 17 17 GLU H H 17 8.248 8.248 8.050 0.198 25061 10753 1 16 . 1 1 18 18 LEU N N 18 119.764 119.764 119.594 0.170 25061 10754 1 16 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.199 -0.118 25061 10755 1 16 . 1 1 18 18 LEU C C 18 177.620 177.620 179.354 -1.734 25061 10756 1 16 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.529 0.149 25061 10757 1 16 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.737 -0.627 25061 10758 1 16 . 1 1 18 18 LEU H H 18 8.486 8.486 8.051 0.435 25061 10759 1 16 . 1 1 19 19 LEU N N 19 123.102 123.102 120.952 2.150 25061 10760 1 16 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.701 -0.039 25061 10761 1 16 . 1 1 19 19 LEU C C 19 178.343 178.343 178.225 0.118 25061 10762 1 16 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.490 0.745 25061 10763 1 16 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.395 -0.744 25061 10764 1 16 . 1 1 19 19 LEU H H 19 7.870 7.870 7.874 -0.004 25061 10765 1 16 . 1 1 20 20 GLU N N 20 117.884 117.884 118.233 -0.349 25061 10766 1 16 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.911 -0.007 25061 10767 1 16 . 1 1 20 20 GLU C C 20 177.707 177.707 179.133 -1.426 25061 10768 1 16 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.470 -0.078 25061 10769 1 16 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.479 -0.502 25061 10770 1 16 . 1 1 20 20 GLU H H 20 7.497 7.497 7.590 -0.093 25061 10771 1 16 . 1 1 21 21 VAL N N 21 117.709 117.709 119.158 -1.449 25061 10772 1 16 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.693 -0.069 25061 10773 1 16 . 1 1 21 21 VAL C C 21 178.523 178.523 177.894 0.629 25061 10774 1 16 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.201 -0.004 25061 10775 1 16 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.521 -0.374 25061 10776 1 16 . 1 1 21 21 VAL H H 21 7.514 7.514 7.505 0.009 25061 10777 1 16 . 1 1 22 22 VAL N N 22 121.233 121.233 120.052 1.181 25061 10778 1 16 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.708 -0.262 25061 10779 1 16 . 1 1 22 22 VAL C C 22 176.868 176.868 177.878 -1.010 25061 10780 1 16 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.506 0.507 25061 10781 1 16 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.570 -0.256 25061 10782 1 16 . 1 1 22 22 VAL H H 22 7.863 7.863 7.392 0.471 25061 10783 1 16 . 1 1 23 23 LEU N N 23 118.101 118.101 118.907 -0.806 25061 10784 1 16 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.013 0.052 25061 10785 1 16 . 1 1 23 23 LEU C C 23 179.701 179.701 178.924 0.777 25061 10786 1 16 . 1 1 23 23 LEU CA C 23 57.296 57.296 58.166 -0.870 25061 10787 1 16 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.322 0.382 25061 10788 1 16 . 1 1 23 23 LEU H H 23 8.151 8.151 7.839 0.312 25061 10789 1 16 . 1 1 24 24 LYS N N 24 114.622 114.622 117.539 -2.917 25061 10790 1 16 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.081 0.056 25061 10791 1 16 . 1 1 24 24 LYS C C 24 178.062 178.062 178.988 -0.926 25061 10792 1 16 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.854 -1.486 25061 10793 1 16 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.623 -0.029 25061 10794 1 16 . 1 1 24 24 LYS H H 24 7.823 7.823 7.857 -0.034 25061 10795 1 16 . 1 1 25 25 SER N N 25 115.474 115.474 113.928 1.546 25061 10796 1 16 . 1 1 25 25 SER HA H 25 4.377 4.377 4.253 0.124 25061 10797 1 16 . 1 1 25 25 SER C C 25 174.520 174.520 174.751 -0.231 25061 10798 1 16 . 1 1 25 25 SER CA C 25 61.049 61.049 60.286 0.763 25061 10799 1 16 . 1 1 25 25 SER CB C 25 63.777 63.777 64.032 -0.255 25061 10800 1 16 . 1 1 25 25 SER H H 25 7.798 7.798 7.999 -0.201 25061 10801 1 16 . 1 1 26 26 ASP N N 26 117.424 117.424 117.633 -0.209 25061 10802 1 16 . 1 1 26 26 ASP HA H 26 4.886 4.886 4.952 -0.066 25061 10803 1 16 . 1 1 26 26 ASP C C 26 173.521 173.521 173.830 -0.309 25061 10804 1 16 . 1 1 26 26 ASP CA C 26 52.048 52.048 53.092 -1.044 25061 10805 1 16 . 1 1 26 26 ASP CB C 26 42.202 42.202 42.371 -0.169 25061 10806 1 16 . 1 1 26 26 ASP H H 26 7.990 7.990 7.918 0.072 25061 10807 1 16 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.641 0.004 25061 10808 1 16 . 1 1 27 27 PRO C C 27 177.016 177.016 176.624 0.392 25061 10809 1 16 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.599 0.002 25061 10810 1 16 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.302 -0.129 25061 10811 1 16 . 1 1 28 28 ASN N N 28 115.839 115.839 116.185 -0.346 25061 10812 1 16 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.774 -0.082 25061 10813 1 16 . 1 1 28 28 ASN C C 28 175.701 175.701 175.631 0.070 25061 10814 1 16 . 1 1 28 28 ASN CA C 28 53.472 53.472 53.442 0.030 25061 10815 1 16 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.373 -0.160 25061 10816 1 16 . 1 1 28 28 ASN H H 28 8.608 8.608 8.159 0.449 25061 10817 1 16 . 1 1 29 29 VAL N N 29 120.770 120.770 122.171 -1.401 25061 10818 1 16 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.896 -0.081 25061 10819 1 16 . 1 1 29 29 VAL C C 29 175.023 175.023 175.178 -0.155 25061 10820 1 16 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.289 -0.738 25061 10821 1 16 . 1 1 29 29 VAL CB C 29 32.147 32.147 31.595 0.552 25061 10822 1 16 . 1 1 29 29 VAL H H 29 7.428 7.428 7.565 -0.137 25061 10823 1 16 . 1 1 30 30 LYS N N 30 127.345 127.345 129.716 -2.371 25061 10824 1 16 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.434 0.045 25061 10825 1 16 . 1 1 30 30 LYS C C 30 174.777 174.777 175.983 -1.206 25061 10826 1 16 . 1 1 30 30 LYS CA C 30 55.204 55.204 55.175 0.029 25061 10827 1 16 . 1 1 30 30 LYS CB C 30 31.949 31.949 33.113 -1.164 25061 10828 1 16 . 1 1 30 30 LYS H H 30 8.457 8.457 8.315 0.142 25061 10829 1 16 . 1 1 31 31 THR N N 31 113.552 113.552 117.461 -3.909 25061 10830 1 16 . 1 1 31 31 THR HA H 31 5.723 5.723 5.272 0.451 25061 10831 1 16 . 1 1 31 31 THR C C 31 174.593 174.593 174.501 0.092 25061 10832 1 16 . 1 1 31 31 THR CA C 31 59.030 59.030 60.495 -1.464 25061 10833 1 16 . 1 1 31 31 THR CB C 31 72.206 72.206 70.364 1.842 25061 10834 1 16 . 1 1 31 31 THR H H 31 8.164 8.164 8.366 -0.202 25061 10835 1 16 . 1 1 32 32 VAL N N 32 119.206 119.206 124.484 -5.278 25061 10836 1 16 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.413 -0.008 25061 10837 1 16 . 1 1 32 32 VAL C C 32 172.663 172.663 174.790 -2.127 25061 10838 1 16 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.842 -0.770 25061 10839 1 16 . 1 1 32 32 VAL CB C 32 35.051 35.051 35.322 -0.271 25061 10840 1 16 . 1 1 32 32 VAL H H 32 8.615 8.615 9.075 -0.460 25061 10841 1 16 . 1 1 33 33 ARG N N 33 130.278 130.278 128.374 1.904 25061 10842 1 16 . 1 1 33 33 ARG HA H 33 5.331 5.331 4.967 0.364 25061 10843 1 16 . 1 1 33 33 ARG C C 33 173.836 173.836 175.981 -2.145 25061 10844 1 16 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.965 -1.815 25061 10845 1 16 . 1 1 33 33 ARG CB C 33 30.028 30.028 30.384 -0.356 25061 10846 1 16 . 1 1 33 33 ARG H H 33 8.996 8.996 8.721 0.275 25061 10847 1 16 . 1 1 34 34 THR N N 34 121.695 121.695 117.460 4.235 25061 10848 1 16 . 1 1 34 34 THR HA H 34 4.483 4.483 4.360 0.123 25061 10849 1 16 . 1 1 34 34 THR C C 34 169.769 169.769 173.499 -3.730 25061 10850 1 16 . 1 1 34 34 THR CA C 34 60.814 60.814 61.315 -0.501 25061 10851 1 16 . 1 1 34 34 THR CB C 34 67.402 67.402 70.457 -3.055 25061 10852 1 16 . 1 1 34 34 THR H H 34 8.126 8.126 8.297 -0.171 25061 10853 1 16 . 1 1 35 35 ASP N N 35 122.198 122.198 122.422 -0.224 25061 10854 1 16 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.487 0.337 25061 10855 1 16 . 1 1 35 35 ASP C C 35 174.790 174.790 175.732 -0.942 25061 10856 1 16 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.145 -0.759 25061 10857 1 16 . 1 1 35 35 ASP CB C 35 41.848 41.848 40.898 0.951 25061 10858 1 16 . 1 1 35 35 ASP H H 35 7.983 7.983 8.366 -0.383 25061 10859 1 16 . 1 1 36 36 ASP N N 36 121.091 121.091 123.556 -2.465 25061 10860 1 16 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.562 0.031 25061 10861 1 16 . 1 1 36 36 ASP C C 36 176.189 176.189 177.064 -0.875 25061 10862 1 16 . 1 1 36 36 ASP CA C 36 53.055 53.055 55.289 -2.234 25061 10863 1 16 . 1 1 36 36 ASP CB C 36 42.159 42.159 39.627 2.532 25061 10864 1 16 . 1 1 36 36 ASP H H 36 8.157 8.157 7.811 0.346 25061 10865 1 16 . 1 1 37 37 LYS N N 37 125.839 125.839 124.057 1.782 25061 10866 1 16 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.795 -0.073 25061 10867 1 16 . 1 1 37 37 LYS C C 37 176.870 176.870 177.998 -1.128 25061 10868 1 16 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.698 -0.294 25061 10869 1 16 . 1 1 37 37 LYS CB C 37 32.394 32.394 31.931 0.463 25061 10870 1 16 . 1 1 37 37 LYS H H 37 8.843 8.843 8.002 0.841 25061 10871 1 16 . 1 1 38 38 GLU N N 38 118.369 118.369 118.471 -0.102 25061 10872 1 16 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.956 0.051 25061 10873 1 16 . 1 1 38 38 GLU C C 38 179.502 179.502 178.166 1.336 25061 10874 1 16 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.852 -0.182 25061 10875 1 16 . 1 1 38 38 GLU CB C 38 28.474 28.474 28.261 0.213 25061 10876 1 16 . 1 1 38 38 GLU H H 38 8.182 8.182 8.670 -0.488 25061 10877 1 16 . 1 1 39 39 LYS N N 39 121.722 121.722 120.559 1.163 25061 10878 1 16 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.092 0.073 25061 10879 1 16 . 1 1 39 39 LYS C C 39 178.500 178.500 178.885 -0.385 25061 10880 1 16 . 1 1 39 39 LYS CA C 39 57.736 57.736 58.809 -1.073 25061 10881 1 16 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.660 -1.522 25061 10882 1 16 . 1 1 39 39 LYS H H 39 7.524 7.524 7.441 0.083 25061 10883 1 16 . 1 1 40 40 VAL N N 40 117.199 117.199 119.951 -2.752 25061 10884 1 16 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.480 -0.252 25061 10885 1 16 . 1 1 40 40 VAL C C 40 177.362 177.362 177.847 -0.485 25061 10886 1 16 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.433 1.209 25061 10887 1 16 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.486 -0.583 25061 10888 1 16 . 1 1 40 40 VAL H H 40 7.883 7.883 8.104 -0.221 25061 10889 1 16 . 1 1 41 41 LYS N N 41 117.677 117.677 118.398 -0.721 25061 10890 1 16 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.570 -0.128 25061 10891 1 16 . 1 1 41 41 LYS C C 41 177.686 177.686 178.689 -1.003 25061 10892 1 16 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.701 1.108 25061 10893 1 16 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.425 0.190 25061 10894 1 16 . 1 1 41 41 LYS H H 41 7.567 7.567 7.756 -0.189 25061 10895 1 16 . 1 1 42 42 GLU N N 42 118.369 118.369 118.067 0.302 25061 10896 1 16 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.105 -0.098 25061 10897 1 16 . 1 1 42 42 GLU C C 42 179.725 179.725 178.910 0.815 25061 10898 1 16 . 1 1 42 42 GLU CA C 42 59.069 59.069 58.403 0.666 25061 10899 1 16 . 1 1 42 42 GLU CB C 42 29.539 29.539 28.930 0.609 25061 10900 1 16 . 1 1 42 42 GLU H H 42 7.634 7.634 7.560 0.074 25061 10901 1 16 . 1 1 43 43 GLU N N 43 117.906 117.906 119.966 -2.060 25061 10902 1 16 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.086 0.097 25061 10903 1 16 . 1 1 43 43 GLU C C 43 179.757 179.757 179.213 0.544 25061 10904 1 16 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.742 -0.376 25061 10905 1 16 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.177 -0.336 25061 10906 1 16 . 1 1 43 43 GLU H H 43 8.162 8.162 7.903 0.259 25061 10907 1 16 . 1 1 44 44 ILE N N 44 122.291 122.291 119.817 2.474 25061 10908 1 16 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.649 -0.037 25061 10909 1 16 . 1 1 44 44 ILE C C 44 177.101 177.101 178.070 -0.969 25061 10910 1 16 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.811 0.544 25061 10911 1 16 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.883 -0.423 25061 10912 1 16 . 1 1 44 44 ILE H H 44 8.742 8.742 8.266 0.476 25061 10913 1 16 . 1 1 45 45 GLU N N 45 119.892 119.892 119.402 0.490 25061 10914 1 16 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.114 -0.056 25061 10915 1 16 . 1 1 45 45 GLU C C 45 178.991 178.991 178.915 0.076 25061 10916 1 16 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.235 0.430 25061 10917 1 16 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.185 -0.024 25061 10918 1 16 . 1 1 45 45 GLU H H 45 8.171 8.171 7.770 0.401 25061 10919 1 16 . 1 1 46 46 LYS N N 46 118.064 118.064 119.307 -1.243 25061 10920 1 16 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.050 -0.068 25061 10921 1 16 . 1 1 46 46 LYS C C 46 178.837 178.837 178.763 0.074 25061 10922 1 16 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.404 0.337 25061 10923 1 16 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.352 0.091 25061 10924 1 16 . 1 1 46 46 LYS H H 46 7.785 7.785 7.701 0.084 25061 10925 1 16 . 1 1 47 47 ALA N N 47 121.817 121.817 122.435 -0.618 25061 10926 1 16 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.041 -0.010 25061 10927 1 16 . 1 1 47 47 ALA C C 47 179.859 179.859 179.331 0.528 25061 10928 1 16 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.055 0.240 25061 10929 1 16 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.437 -0.781 25061 10930 1 16 . 1 1 47 47 ALA H H 47 8.123 8.123 7.644 0.479 25061 10931 1 16 . 1 1 48 48 ARG N N 48 119.080 119.080 117.617 1.463 25061 10932 1 16 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.018 0.071 25061 10933 1 16 . 1 1 48 48 ARG C C 48 180.155 180.155 178.927 1.228 25061 10934 1 16 . 1 1 48 48 ARG CA C 48 59.197 59.197 59.057 0.140 25061 10935 1 16 . 1 1 48 48 ARG CB C 48 29.510 29.510 30.221 -0.712 25061 10936 1 16 . 1 1 48 48 ARG H H 48 8.768 8.768 8.191 0.577 25061 10937 1 16 . 1 1 49 49 LYS N N 49 119.951 119.951 119.536 0.415 25061 10938 1 16 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.122 -0.083 25061 10939 1 16 . 1 1 49 49 LYS C C 49 178.288 178.288 178.688 -0.400 25061 10940 1 16 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.426 0.411 25061 10941 1 16 . 1 1 49 49 LYS CB C 49 32.143 32.143 31.963 0.180 25061 10942 1 16 . 1 1 49 49 LYS H H 49 8.037 8.037 7.623 0.414 25061 10943 1 16 . 1 1 50 50 GLN N N 50 115.284 115.284 114.841 0.443 25061 10944 1 16 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.289 0.053 25061 10945 1 16 . 1 1 50 50 GLN C C 50 176.180 176.180 177.163 -0.983 25061 10946 1 16 . 1 1 50 50 GLN CA C 50 55.741 55.741 55.939 -0.198 25061 10947 1 16 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.398 0.167 25061 10948 1 16 . 1 1 50 50 GLN H H 50 7.740 7.740 7.715 0.025 25061 10949 1 16 . 1 1 51 51 GLY N N 51 109.725 109.725 106.802 2.923 25061 10950 1 16 . 1 1 51 51 GLY C C 51 174.552 174.552 174.082 0.470 25061 10951 1 16 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.421 0.942 25061 10952 1 16 . 1 1 51 51 GLY H H 51 8.027 8.027 7.681 0.346 25061 10953 1 16 . 1 1 52 52 ARG N N 52 119.064 119.064 120.052 -0.988 25061 10954 1 16 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.848 0.049 25061 10955 1 16 . 1 1 52 52 ARG C C 52 173.123 173.123 174.218 -1.095 25061 10956 1 16 . 1 1 52 52 ARG CA C 52 52.247 52.247 52.798 -0.551 25061 10957 1 16 . 1 1 52 52 ARG CB C 52 32.366 32.366 31.303 1.062 25061 10958 1 16 . 1 1 52 52 ARG H H 52 7.969 7.969 8.171 -0.202 25061 10959 1 16 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.507 0.348 25061 10960 1 16 . 1 1 53 53 PRO C C 53 174.069 174.069 175.516 -1.447 25061 10961 1 16 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.875 -1.057 25061 10962 1 16 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.644 -0.584 25061 10963 1 16 . 1 1 54 54 ILE N N 54 116.301 116.301 120.133 -3.832 25061 10964 1 16 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.919 0.319 25061 10965 1 16 . 1 1 54 54 ILE C C 54 171.709 171.709 173.834 -2.125 25061 10966 1 16 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.222 -1.448 25061 10967 1 16 . 1 1 54 54 ILE CB C 54 41.558 41.558 41.963 -0.405 25061 10968 1 16 . 1 1 54 54 ILE H H 54 7.920 7.920 8.002 -0.082 25061 10969 1 16 . 1 1 55 55 VAL N N 55 126.302 126.302 129.505 -3.203 25061 10970 1 16 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.014 -0.090 25061 10971 1 16 . 1 1 55 55 VAL C C 55 173.624 173.624 174.971 -1.347 25061 10972 1 16 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.732 -0.937 25061 10973 1 16 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.386 0.442 25061 10974 1 16 . 1 1 55 55 VAL H H 55 8.652 8.652 8.788 -0.136 25061 10975 1 16 . 1 1 56 56 ILE N N 56 127.503 127.503 128.173 -0.670 25061 10976 1 16 . 1 1 56 56 ILE HA H 56 4.664 4.664 4.766 -0.102 25061 10977 1 16 . 1 1 56 56 ILE C C 56 173.479 173.479 175.260 -1.781 25061 10978 1 16 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.488 0.519 25061 10979 1 16 . 1 1 56 56 ILE CB C 56 40.285 40.285 37.480 2.804 25061 10980 1 16 . 1 1 56 56 ILE H H 56 9.124 9.124 8.270 0.854 25061 10981 1 16 . 1 1 57 57 PHE N N 57 125.302 125.302 128.106 -2.804 25061 10982 1 16 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.213 0.003 25061 10983 1 16 . 1 1 57 57 PHE C C 57 174.536 174.536 175.648 -1.112 25061 10984 1 16 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.279 -0.318 25061 10985 1 16 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.739 0.690 25061 10986 1 16 . 1 1 57 57 PHE H H 57 8.971 8.971 8.882 0.089 25061 10987 1 16 . 1 1 58 58 ILE N N 58 126.472 126.472 124.233 2.239 25061 10988 1 16 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.588 -0.073 25061 10989 1 16 . 1 1 58 58 ILE C C 58 173.391 173.391 175.027 -1.636 25061 10990 1 16 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.080 0.010 25061 10991 1 16 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.087 -0.346 25061 10992 1 16 . 1 1 58 58 ILE H H 58 9.248 9.248 8.898 0.350 25061 10993 1 16 . 1 1 59 59 ARG N N 59 124.681 124.681 123.117 1.564 25061 10994 1 16 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.260 -0.331 25061 10995 1 16 . 1 1 59 59 ARG C C 59 178.521 178.521 177.761 0.760 25061 10996 1 16 . 1 1 59 59 ARG CA C 59 55.742 55.742 54.622 1.120 25061 10997 1 16 . 1 1 59 59 ARG CB C 59 30.918 30.918 33.992 -3.074 25061 10998 1 16 . 1 1 59 59 ARG H H 59 8.587 8.587 8.793 -0.206 25061 10999 1 16 . 1 1 60 60 GLY N N 60 108.848 108.848 108.920 -0.072 25061 11000 1 16 . 1 1 60 60 GLY C C 60 174.775 174.775 174.565 0.210 25061 11001 1 16 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.322 -0.355 25061 11002 1 16 . 1 1 60 60 GLY H H 60 7.732 7.732 8.403 -0.671 25061 11003 1 16 . 1 1 61 61 ALA N N 61 120.877 120.877 122.911 -2.034 25061 11004 1 16 . 1 1 61 61 ALA HA H 61 4.144 4.144 4.132 0.012 25061 11005 1 16 . 1 1 61 61 ALA C C 61 177.769 177.769 179.426 -1.657 25061 11006 1 16 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.674 -0.225 25061 11007 1 16 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.293 0.079 25061 11008 1 16 . 1 1 61 61 ALA H H 61 7.852 7.852 7.926 -0.074 25061 11009 1 16 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.308 0.492 25061 11010 1 16 . 1 1 62 62 TYR CA C 62 63.039 63.039 58.288 4.752 25061 11011 1 16 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.521 -0.081 25061 11012 1 16 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.730 -0.045 25061 11013 1 16 . 1 1 63 63 GLU C C 63 176.251 176.251 178.331 -2.080 25061 11014 1 16 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.607 -0.349 25061 11015 1 16 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.066 0.346 25061 11016 1 16 . 1 1 64 64 GLU N N 64 119.209 119.209 118.678 0.531 25061 11017 1 16 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.998 -0.097 25061 11018 1 16 . 1 1 64 64 GLU C C 64 178.251 178.251 178.894 -0.643 25061 11019 1 16 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.672 0.540 25061 11020 1 16 . 1 1 64 64 GLU CB C 64 28.645 28.645 28.822 -0.177 25061 11021 1 16 . 1 1 64 64 GLU H H 64 8.878 8.878 8.105 0.772 25061 11022 1 16 . 1 1 65 65 VAL N N 65 116.728 116.728 120.353 -3.625 25061 11023 1 16 . 1 1 65 65 VAL HA H 65 3.982 3.982 4.016 -0.034 25061 11024 1 16 . 1 1 65 65 VAL C C 65 176.915 176.915 177.826 -0.911 25061 11025 1 16 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.543 -0.934 25061 11026 1 16 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.642 0.253 25061 11027 1 16 . 1 1 65 65 VAL H H 65 7.652 7.652 7.930 -0.278 25061 11028 1 16 . 1 1 66 66 VAL N N 66 119.462 119.462 119.407 0.055 25061 11029 1 16 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.633 -0.319 25061 11030 1 16 . 1 1 66 66 VAL C C 66 177.142 177.142 177.525 -0.383 25061 11031 1 16 . 1 1 66 66 VAL CA C 66 67.335 67.335 65.943 1.392 25061 11032 1 16 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.001 0.429 25061 11033 1 16 . 1 1 66 66 VAL H H 66 7.896 7.896 7.540 0.356 25061 11034 1 16 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.004 -0.376 25061 11035 1 16 . 1 1 67 67 ARG C C 67 177.841 177.841 178.062 -0.221 25061 11036 1 16 . 1 1 67 67 ARG CA C 67 60.052 60.052 60.155 -0.103 25061 11037 1 16 . 1 1 67 67 ARG CB C 67 29.393 29.393 30.164 -0.771 25061 11038 1 16 . 1 1 68 68 ASP N N 68 118.316 118.316 119.098 -0.782 25061 11039 1 16 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.736 -0.375 25061 11040 1 16 . 1 1 68 68 ASP C C 68 178.945 178.945 178.689 0.256 25061 11041 1 16 . 1 1 68 68 ASP CA C 68 57.311 57.311 57.932 -0.621 25061 11042 1 16 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.568 0.946 25061 11043 1 16 . 1 1 68 68 ASP H H 68 7.625 7.625 7.841 -0.216 25061 11044 1 16 . 1 1 69 69 ILE N N 69 119.231 119.231 120.291 -1.060 25061 11045 1 16 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.727 -0.097 25061 11046 1 16 . 1 1 69 69 ILE C C 69 177.138 177.138 177.873 -0.735 25061 11047 1 16 . 1 1 69 69 ILE CA C 69 64.540 64.540 65.132 -0.592 25061 11048 1 16 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.812 -0.762 25061 11049 1 16 . 1 1 69 69 ILE H H 69 8.113 8.113 7.301 0.812 25061 11050 1 16 . 1 1 70 70 VAL N N 70 120.164 120.164 119.718 0.446 25061 11051 1 16 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.678 -0.261 25061 11052 1 16 . 1 1 70 70 VAL C C 70 177.079 177.079 178.202 -1.123 25061 11053 1 16 . 1 1 70 70 VAL CA C 70 67.274 67.274 66.425 0.849 25061 11054 1 16 . 1 1 70 70 VAL CB C 70 31.258 31.258 30.677 0.581 25061 11055 1 16 . 1 1 70 70 VAL H H 70 8.478 8.478 8.280 0.198 25061 11056 1 16 . 1 1 71 71 GLU N N 71 118.293 118.293 120.682 -2.389 25061 11057 1 16 . 1 1 71 71 GLU HA H 71 4.054 4.054 4.232 -0.178 25061 11058 1 16 . 1 1 71 71 GLU C C 71 179.009 179.009 179.229 -0.220 25061 11059 1 16 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.475 -0.059 25061 11060 1 16 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.379 -0.557 25061 11061 1 16 . 1 1 71 71 GLU H H 71 8.152 8.152 7.925 0.227 25061 11062 1 16 . 1 1 72 72 TYR N N 72 120.091 120.091 120.239 -0.148 25061 11063 1 16 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.126 0.036 25061 11064 1 16 . 1 1 72 72 TYR C C 72 176.404 176.404 177.027 -0.623 25061 11065 1 16 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.492 -0.360 25061 11066 1 16 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.506 -0.369 25061 11067 1 16 . 1 1 72 72 TYR H H 72 7.959 7.959 7.688 0.271 25061 11068 1 16 . 1 1 73 73 ALA N N 73 120.133 120.133 120.389 -0.256 25061 11069 1 16 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.941 -0.311 25061 11070 1 16 . 1 1 73 73 ALA C C 73 179.182 179.182 179.647 -0.465 25061 11071 1 16 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.094 0.018 25061 11072 1 16 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.079 0.112 25061 11073 1 16 . 1 1 73 73 ALA H H 73 8.604 8.604 7.969 0.635 25061 11074 1 16 . 1 1 74 74 GLN N N 74 115.553 115.553 117.043 -1.490 25061 11075 1 16 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.966 0.172 25061 11076 1 16 . 1 1 74 74 GLN C C 74 180.595 180.595 178.672 1.923 25061 11077 1 16 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.476 0.619 25061 11078 1 16 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.719 -0.144 25061 11079 1 16 . 1 1 74 74 GLN H H 74 8.619 8.619 8.113 0.506 25061 11080 1 16 . 1 1 75 75 LYS N N 75 122.396 122.396 119.053 3.343 25061 11081 1 16 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.029 -0.001 25061 11082 1 16 . 1 1 75 75 LYS C C 75 178.521 178.521 178.628 -0.107 25061 11083 1 16 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.212 0.846 25061 11084 1 16 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.962 -0.363 25061 11085 1 16 . 1 1 75 75 LYS H H 75 8.123 8.123 7.341 0.782 25061 11086 1 16 . 1 1 76 76 GLU N N 76 116.294 116.294 114.950 1.344 25061 11087 1 16 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.302 -0.203 25061 11088 1 16 . 1 1 76 76 GLU C C 76 175.957 175.957 176.766 -0.809 25061 11089 1 16 . 1 1 76 76 GLU CA C 76 55.605 55.605 55.390 0.215 25061 11090 1 16 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.019 0.805 25061 11091 1 16 . 1 1 76 76 GLU H H 76 7.450 7.450 7.571 -0.121 25061 11092 1 16 . 1 1 77 77 GLY N N 77 107.446 107.446 108.305 -0.859 25061 11093 1 16 . 1 1 77 77 GLY C C 77 174.520 174.520 174.844 -0.324 25061 11094 1 16 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.909 -0.102 25061 11095 1 16 . 1 1 77 77 GLY H H 77 7.763 7.763 7.408 0.355 25061 11096 1 16 . 1 1 78 78 LEU N N 78 120.179 120.179 118.481 1.698 25061 11097 1 16 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.348 0.040 25061 11098 1 16 . 1 1 78 78 LEU C C 78 175.914 175.914 176.537 -0.623 25061 11099 1 16 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.985 -0.513 25061 11100 1 16 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.634 -0.745 25061 11101 1 16 . 1 1 78 78 LEU H H 78 7.930 7.930 7.904 0.026 25061 11102 1 16 . 1 1 79 79 ARG N N 79 122.207 122.207 123.667 -1.460 25061 11103 1 16 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.370 0.027 25061 11104 1 16 . 1 1 79 79 ARG C C 79 174.960 174.960 174.533 0.427 25061 11105 1 16 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.160 0.488 25061 11106 1 16 . 1 1 79 79 ARG CB C 79 30.476 30.476 29.134 1.342 25061 11107 1 16 . 1 1 79 79 ARG H H 79 8.241 8.241 8.118 0.123 25061 11108 1 16 . 1 1 80 80 VAL N N 80 123.333 123.333 126.015 -2.682 25061 11109 1 16 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.488 0.807 25061 11110 1 16 . 1 1 80 80 VAL C C 80 174.048 174.048 174.043 0.005 25061 11111 1 16 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.070 -1.029 25061 11112 1 16 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.334 1.971 25061 11113 1 16 . 1 1 80 80 VAL H H 80 8.359 8.359 8.391 -0.032 25061 11114 1 16 . 1 1 81 81 LEU N N 81 128.719 128.719 129.994 -1.275 25061 11115 1 16 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.295 -0.191 25061 11116 1 16 . 1 1 81 81 LEU C C 81 174.484 174.484 174.565 -0.081 25061 11117 1 16 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.631 0.489 25061 11118 1 16 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.420 -0.465 25061 11119 1 16 . 1 1 81 81 LEU H H 81 8.650 8.650 8.968 -0.318 25061 11120 1 16 . 1 1 82 82 VAL N N 82 122.487 122.487 128.374 -5.887 25061 11121 1 16 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.429 0.668 25061 11122 1 16 . 1 1 82 82 VAL C C 82 174.525 174.525 174.509 0.016 25061 11123 1 16 . 1 1 82 82 VAL CA C 82 60.285 60.285 61.461 -1.176 25061 11124 1 16 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.054 2.735 25061 11125 1 16 . 1 1 82 82 VAL H H 82 8.781 8.781 8.616 0.165 25061 11126 1 16 . 1 1 83 83 ILE N N 83 128.082 128.082 129.762 -1.680 25061 11127 1 16 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.535 0.395 25061 11128 1 16 . 1 1 83 83 ILE C C 83 172.925 172.925 174.401 -1.476 25061 11129 1 16 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.604 -0.663 25061 11130 1 16 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.386 1.800 25061 11131 1 16 . 1 1 83 83 ILE H H 83 9.527 9.527 8.450 1.077 25061 11132 1 16 . 1 1 84 84 LYS N N 84 128.493 128.493 126.505 1.988 25061 11133 1 16 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.233 -0.185 25061 11134 1 16 . 1 1 84 84 LYS C C 84 174.027 174.027 175.468 -1.441 25061 11135 1 16 . 1 1 84 84 LYS CA C 84 53.253 53.253 53.974 -0.721 25061 11136 1 16 . 1 1 84 84 LYS CB C 84 34.652 34.652 36.323 -1.671 25061 11137 1 16 . 1 1 84 84 LYS H H 84 8.721 8.721 8.603 0.118 25061 11138 1 16 . 1 1 85 85 VAL N N 85 126.729 126.729 124.021 2.708 25061 11139 1 16 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.400 0.336 25061 11140 1 16 . 1 1 85 85 VAL C C 85 175.935 175.935 175.765 0.170 25061 11141 1 16 . 1 1 85 85 VAL CA C 85 60.200 60.200 61.010 -0.810 25061 11142 1 16 . 1 1 85 85 VAL CB C 85 30.847 30.847 30.710 0.137 25061 11143 1 16 . 1 1 85 85 VAL H H 85 8.643 8.643 8.623 0.020 25061 11144 1 16 . 1 1 86 86 ALA N N 86 132.930 132.930 131.919 1.011 25061 11145 1 16 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.604 -0.174 25061 11146 1 16 . 1 1 86 86 ALA C C 86 175.635 175.635 177.896 -2.261 25061 11147 1 16 . 1 1 86 86 ALA CA C 86 51.504 51.504 51.150 0.354 25061 11148 1 16 . 1 1 86 86 ALA CB C 86 20.821 20.821 18.484 2.337 25061 11149 1 16 . 1 1 86 86 ALA H H 86 8.835 8.835 8.576 0.259 25061 11150 1 16 . 1 1 87 87 GLN N N 87 118.719 118.719 123.622 -4.903 25061 11151 1 16 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.216 0.253 25061 11152 1 16 . 1 1 87 87 GLN C C 87 175.949 175.949 176.455 -0.506 25061 11153 1 16 . 1 1 87 87 GLN CA C 87 55.260 55.260 57.890 -2.630 25061 11154 1 16 . 1 1 87 87 GLN CB C 87 30.432 30.432 29.508 0.924 25061 11155 1 16 . 1 1 87 87 GLN H H 87 8.570 8.570 8.350 0.220 25061 11156 1 16 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.751 -0.271 25061 11157 1 16 . 1 1 88 88 ASP CA C 88 55.454 55.454 54.605 0.849 25061 11158 1 16 . 1 1 88 88 ASP CB C 88 41.204 41.204 41.384 -0.180 25061 11159 1 16 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.556 -0.509 25061 11160 1 16 . 1 1 89 89 GLN CA C 89 56.687 56.687 55.320 1.367 25061 11161 1 16 . 1 1 89 89 GLN CB C 89 27.850 27.850 30.462 -2.612 25061 11162 1 16 . 1 1 92 92 LEU N N 92 125.291 125.291 119.050 6.241 25061 11163 1 16 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.277 -0.076 25061 11164 1 16 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.329 -2.272 25061 11165 1 16 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.618 0.428 25061 11166 1 16 . 1 1 92 92 LEU H H 92 8.277 8.277 8.083 0.194 25061 11167 1 16 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.128 0.628 25061 11168 1 16 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.116 -0.067 25061 11169 1 16 . 1 1 94 94 ARG C C 94 178.544 178.544 178.536 0.008 25061 11170 1 16 . 1 1 94 94 ARG CA C 94 58.607 58.607 59.092 -0.485 25061 11171 1 16 . 1 1 94 94 ARG CB C 94 29.614 29.614 30.186 -0.572 25061 11172 1 16 . 1 1 95 95 PHE N N 95 117.407 117.407 119.924 -2.517 25061 11173 1 16 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.173 0.202 25061 11174 1 16 . 1 1 95 95 PHE CA C 95 60.231 60.231 61.428 -1.196 25061 11175 1 16 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.125 -1.183 25061 11176 1 16 . 1 1 95 95 PHE H H 95 8.419 8.419 7.635 0.784 25061 11177 1 16 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.970 -0.162 25061 11178 1 16 . 1 1 96 96 TYR C C 96 177.728 177.728 177.324 0.404 25061 11179 1 16 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.541 1.615 25061 11180 1 16 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.488 -0.788 25061 11181 1 16 . 1 1 97 97 GLU N N 97 119.054 119.054 117.943 1.111 25061 11182 1 16 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.680 0.383 25061 11183 1 16 . 1 1 97 97 GLU C C 97 179.071 179.071 178.809 0.262 25061 11184 1 16 . 1 1 97 97 GLU CA C 97 58.760 58.760 59.123 -0.363 25061 11185 1 16 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.367 -0.195 25061 11186 1 16 . 1 1 97 97 GLU H H 97 7.858 7.858 8.187 -0.329 25061 11187 1 16 . 1 1 98 98 GLN N N 98 119.385 119.385 119.719 -0.334 25061 11188 1 16 . 1 1 98 98 GLN HA H 98 3.901 3.901 4.005 -0.104 25061 11189 1 16 . 1 1 98 98 GLN C C 98 177.599 177.599 178.300 -0.701 25061 11190 1 16 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.338 -0.027 25061 11191 1 16 . 1 1 98 98 GLN CB C 98 27.766 27.766 28.073 -0.307 25061 11192 1 16 . 1 1 98 98 GLN H H 98 7.747 7.747 7.503 0.244 25061 11193 1 16 . 1 1 99 99 LEU N N 99 118.348 118.348 119.647 -1.299 25061 11194 1 16 . 1 1 99 99 LEU HA H 99 4.019 4.019 4.146 -0.127 25061 11195 1 16 . 1 1 99 99 LEU C C 99 178.669 178.669 179.371 -0.702 25061 11196 1 16 . 1 1 99 99 LEU CA C 99 57.430 57.430 57.675 -0.245 25061 11197 1 16 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.169 0.334 25061 11198 1 16 . 1 1 99 99 LEU H H 99 7.891 7.891 7.440 0.451 25061 11199 1 16 . 1 1 100 100 LYS N N 100 118.332 118.332 118.031 0.301 25061 11200 1 16 . 1 1 100 100 LYS HA H 100 4.509 4.509 3.909 0.600 25061 11201 1 16 . 1 1 100 100 LYS C C 100 180.846 180.846 178.794 2.052 25061 11202 1 16 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.201 0.887 25061 11203 1 16 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.809 0.460 25061 11204 1 16 . 1 1 100 100 LYS H H 100 7.560 7.560 7.515 0.045 25061 11205 1 16 . 1 1 101 101 LYS N N 101 121.944 121.944 118.585 3.359 25061 11206 1 16 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.065 0.007 25061 11207 1 16 . 1 1 101 101 LYS C C 101 177.707 177.707 177.776 -0.069 25061 11208 1 16 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.367 0.504 25061 11209 1 16 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.234 -0.139 25061 11210 1 16 . 1 1 101 101 LYS H H 101 7.959 7.959 7.174 0.785 25061 11211 1 16 . 1 1 102 102 ASP N N 102 118.788 118.788 117.079 1.709 25061 11212 1 16 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.425 0.269 25061 11213 1 16 . 1 1 102 102 ASP C C 102 176.359 176.359 177.332 -0.973 25061 11214 1 16 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.995 -1.417 25061 11215 1 16 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.689 -1.115 25061 11216 1 16 . 1 1 102 102 ASP H H 102 7.893 7.893 7.845 0.048 25061 11217 1 16 . 1 1 103 103 GLY N N 103 107.024 107.024 105.725 1.299 25061 11218 1 16 . 1 1 103 103 GLY C C 103 174.328 174.328 174.649 -0.321 25061 11219 1 16 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.731 0.614 25061 11220 1 16 . 1 1 103 103 GLY H H 103 7.866 7.866 7.917 -0.051 25061 11221 1 16 . 1 1 104 104 VAL N N 104 123.060 123.060 121.785 1.275 25061 11222 1 16 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.819 0.154 25061 11223 1 16 . 1 1 104 104 VAL C C 104 175.023 175.023 175.378 -0.355 25061 11224 1 16 . 1 1 104 104 VAL CA C 104 61.878 61.878 63.373 -1.494 25061 11225 1 16 . 1 1 104 104 VAL CB C 104 32.088 32.088 31.878 0.210 25061 11226 1 16 . 1 1 104 104 VAL H H 104 7.955 7.955 7.484 0.471 25061 11227 1 16 . 1 1 105 105 ASP N N 105 127.987 127.987 128.642 -0.655 25061 11228 1 16 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.572 0.003 25061 11229 1 16 . 1 1 105 105 ASP C C 105 173.624 173.624 174.468 -0.844 25061 11230 1 16 . 1 1 105 105 ASP CA C 105 54.087 54.087 54.440 -0.353 25061 11231 1 16 . 1 1 105 105 ASP CB C 105 40.660 40.660 41.670 -1.010 25061 11232 1 16 . 1 1 105 105 ASP H H 105 8.399 8.399 8.223 0.176 25061 11233 1 16 . 1 1 106 106 VAL N N 106 125.798 125.798 123.379 2.419 25061 11234 1 16 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.772 0.043 25061 11235 1 16 . 1 1 106 106 VAL C C 106 174.902 174.902 174.290 0.612 25061 11236 1 16 . 1 1 106 106 VAL CA C 106 60.194 60.194 59.368 0.826 25061 11237 1 16 . 1 1 106 106 VAL CB C 106 34.179 34.179 34.628 -0.449 25061 11238 1 16 . 1 1 106 106 VAL H H 106 7.550 7.550 8.078 -0.528 25061 11239 1 16 . 1 1 107 107 ARG N N 107 128.099 128.099 128.154 -0.055 25061 11240 1 16 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.845 0.031 25061 11241 1 16 . 1 1 107 107 ARG C C 107 173.815 173.815 174.472 -0.657 25061 11242 1 16 . 1 1 107 107 ARG CA C 107 53.386 53.386 54.265 -0.879 25061 11243 1 16 . 1 1 107 107 ARG CB C 107 31.195 31.195 34.081 -2.886 25061 11244 1 16 . 1 1 107 107 ARG H H 107 9.132 9.132 8.847 0.285 25061 11245 1 16 . 1 1 108 108 VAL N N 108 123.979 123.979 121.425 2.554 25061 11246 1 16 . 1 1 108 108 VAL HA H 108 4.942 4.942 4.997 -0.055 25061 11247 1 16 . 1 1 108 108 VAL C C 108 175.854 175.854 176.567 -0.713 25061 11248 1 16 . 1 1 108 108 VAL CA C 108 60.017 60.017 59.896 0.121 25061 11249 1 16 . 1 1 108 108 VAL CB C 108 32.844 32.844 32.129 0.715 25061 11250 1 16 . 1 1 108 108 VAL H H 108 8.561 8.561 8.440 0.121 25061 11251 1 16 . 1 1 109 109 THR N N 109 120.144 120.144 119.257 0.887 25061 11252 1 16 . 1 1 109 109 THR HA H 109 4.815 4.815 4.549 0.266 25061 11253 1 16 . 1 1 109 109 THR C C 109 171.867 171.867 175.003 -3.136 25061 11254 1 16 . 1 1 109 109 THR CA C 109 59.613 59.613 60.485 -0.872 25061 11255 1 16 . 1 1 109 109 THR CB C 109 69.720 69.720 68.356 1.364 25061 11256 1 16 . 1 1 109 109 THR H H 109 8.803 8.803 8.475 0.328 25061 11257 1 16 . 1 1 110 110 ASP N N 110 123.212 123.212 123.210 0.002 25061 11258 1 16 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.429 0.540 25061 11259 1 16 . 1 1 110 110 ASP C C 110 175.739 175.739 175.920 -0.181 25061 11260 1 16 . 1 1 110 110 ASP CA C 110 53.243 53.243 56.682 -3.439 25061 11261 1 16 . 1 1 110 110 ASP CB C 110 41.351 41.351 40.294 1.056 25061 11262 1 16 . 1 1 110 110 ASP H H 110 8.363 8.363 8.075 0.288 25061 11263 1 16 . 1 1 111 111 ASN N N 111 116.298 116.298 119.897 -3.599 25061 11264 1 16 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.698 0.178 25061 11265 1 16 . 1 1 111 111 ASN C C 111 174.756 174.756 175.915 -1.159 25061 11266 1 16 . 1 1 111 111 ASN CA C 111 52.132 52.132 53.236 -1.104 25061 11267 1 16 . 1 1 111 111 ASN CB C 111 40.765 40.765 37.850 2.915 25061 11268 1 16 . 1 1 111 111 ASN H H 111 8.085 8.085 8.162 -0.077 25061 11269 1 16 . 1 1 112 112 GLU HA H 112 3.848 3.848 3.892 -0.044 25061 11270 1 16 . 1 1 112 112 GLU C C 112 177.016 177.016 177.583 -0.567 25061 11271 1 16 . 1 1 112 112 GLU CA C 112 59.480 59.480 59.520 -0.040 25061 11272 1 16 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.679 -0.005 25061 11273 1 16 . 1 1 113 113 ASP N N 113 121.033 121.033 120.312 0.721 25061 11274 1 16 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.351 0.062 25061 11275 1 16 . 1 1 113 113 ASP C C 113 178.988 178.988 178.460 0.528 25061 11276 1 16 . 1 1 113 113 ASP CA C 113 57.855 57.855 57.414 0.441 25061 11277 1 16 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.437 0.065 25061 11278 1 16 . 1 1 113 113 ASP H H 113 8.219 8.219 8.483 -0.264 25061 11279 1 16 . 1 1 114 114 GLU N N 114 121.280 121.280 119.092 2.188 25061 11280 1 16 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.063 0.002 25061 11281 1 16 . 1 1 114 114 GLU C C 114 178.776 178.776 178.237 0.539 25061 11282 1 16 . 1 1 114 114 GLU CA C 114 58.714 58.714 59.035 -0.321 25061 11283 1 16 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.480 -0.268 25061 11284 1 16 . 1 1 114 114 GLU H H 114 8.296 8.296 8.449 -0.153 25061 11285 1 16 . 1 1 115 115 ALA N N 115 120.924 120.924 122.487 -1.563 25061 11286 1 16 . 1 1 115 115 ALA HA H 115 3.838 3.838 3.986 -0.148 25061 11287 1 16 . 1 1 115 115 ALA C C 115 178.502 178.502 179.511 -1.009 25061 11288 1 16 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.445 0.193 25061 11289 1 16 . 1 1 115 115 ALA CB C 115 18.497 18.497 17.965 0.532 25061 11290 1 16 . 1 1 115 115 ALA H H 115 7.853 7.853 7.977 -0.124 25061 11291 1 16 . 1 1 116 116 LYS N N 116 116.616 116.616 118.116 -1.500 25061 11292 1 16 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.973 -0.254 25061 11293 1 16 . 1 1 116 116 LYS C C 116 178.097 178.097 178.877 -0.780 25061 11294 1 16 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.240 1.512 25061 11295 1 16 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.049 0.506 25061 11296 1 16 . 1 1 116 116 LYS H H 116 8.091 8.091 7.657 0.434 25061 11297 1 16 . 1 1 117 117 LYS N N 117 118.990 118.990 118.824 0.166 25061 11298 1 16 . 1 1 117 117 LYS HA H 117 3.911 3.911 4.030 -0.119 25061 11299 1 16 . 1 1 117 117 LYS C C 117 179.186 179.186 179.422 -0.236 25061 11300 1 16 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.578 -0.007 25061 11301 1 16 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.333 0.188 25061 11302 1 16 . 1 1 117 117 LYS H H 117 7.742 7.742 7.622 0.120 25061 11303 1 16 . 1 1 118 118 ARG N N 118 117.441 117.441 119.244 -1.803 25061 11304 1 16 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.116 0.024 25061 11305 1 16 . 1 1 118 118 ARG C C 118 178.921 178.921 178.787 0.134 25061 11306 1 16 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.094 -0.423 25061 11307 1 16 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.568 0.093 25061 11308 1 16 . 1 1 118 118 ARG H H 118 8.468 8.468 8.207 0.261 25061 11309 1 16 . 1 1 119 119 LEU N N 119 120.100 120.100 120.322 -0.222 25061 11310 1 16 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.937 0.023 25061 11311 1 16 . 1 1 119 119 LEU C C 119 177.554 177.554 178.636 -1.082 25061 11312 1 16 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.181 -0.300 25061 11313 1 16 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.293 0.596 25061 11314 1 16 . 1 1 119 119 LEU H H 119 8.322 8.322 7.825 0.496 25061 11315 1 16 . 1 1 120 120 LYS N N 120 118.238 118.238 119.624 -1.386 25061 11316 1 16 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.935 -0.113 25061 11317 1 16 . 1 1 120 120 LYS C C 120 178.703 178.703 178.758 -0.055 25061 11318 1 16 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.465 0.881 25061 11319 1 16 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.289 -0.053 25061 11320 1 16 . 1 1 120 120 LYS H H 120 7.990 7.990 7.645 0.345 25061 11321 1 16 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.088 -0.066 25061 11322 1 16 . 1 1 121 121 GLU C C 121 177.769 177.769 179.094 -1.325 25061 11323 1 16 . 1 1 121 121 GLU CA C 121 58.922 58.922 58.907 0.015 25061 11324 1 16 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.204 0.250 25061 11325 1 16 . 1 1 122 122 LEU N N 122 119.454 119.454 118.863 0.591 25061 11326 1 16 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.029 0.104 25061 11327 1 16 . 1 1 122 122 LEU C C 122 178.991 178.991 179.204 -0.213 25061 11328 1 16 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.515 -0.189 25061 11329 1 16 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.974 -0.295 25061 11330 1 16 . 1 1 122 122 LEU H H 122 7.930 7.930 7.788 0.142 25061 11331 1 16 . 1 1 123 123 LEU N N 123 117.862 117.862 118.711 -0.849 25061 11332 1 16 . 1 1 123 123 LEU HA H 123 4.067 4.067 3.954 0.113 25061 11333 1 16 . 1 1 123 123 LEU C C 123 179.178 179.178 179.537 -0.359 25061 11334 1 16 . 1 1 123 123 LEU CA C 123 56.920 56.920 57.948 -1.028 25061 11335 1 16 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.379 -0.169 25061 11336 1 16 . 1 1 123 123 LEU H H 123 8.095 8.095 7.632 0.463 25061 11337 1 16 . 1 1 124 124 GLU N N 124 118.975 118.975 116.524 2.451 25061 11338 1 16 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.125 0.004 25061 11339 1 16 . 1 1 124 124 GLU C C 124 177.777 177.777 177.620 0.157 25061 11340 1 16 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.553 -0.466 25061 11341 1 16 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.578 -0.038 25061 11342 1 16 . 1 1 124 124 GLU H H 124 7.930 7.930 8.128 -0.198 25061 11343 1 16 . 1 1 125 125 LYS N N 125 118.933 118.933 117.482 1.451 25061 11344 1 16 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.402 -0.065 25061 11345 1 16 . 1 1 125 125 LYS C C 125 178.188 178.188 177.021 1.167 25061 11346 1 16 . 1 1 125 125 LYS CA C 125 56.980 56.980 55.996 0.984 25061 11347 1 16 . 1 1 125 125 LYS CB C 125 32.608 32.608 33.794 -1.186 25061 11348 1 16 . 1 1 125 125 LYS H H 125 7.729 7.729 7.526 0.203 25061 11349 1 16 . 1 1 126 126 VAL N N 126 117.933 117.933 115.241 2.692 25061 11350 1 16 . 1 1 126 126 VAL HA H 126 4.022 4.022 3.714 0.308 25061 11351 1 16 . 1 1 126 126 VAL C C 126 176.947 176.947 174.026 2.921 25061 11352 1 16 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.514 0.127 25061 11353 1 16 . 1 1 126 126 VAL CB C 126 31.859 31.859 31.011 0.848 25061 11354 1 16 . 1 1 126 126 VAL H H 126 8.044 8.044 7.920 0.124 25061 11355 1 16 . 1 1 127 127 GLY N N 127 109.813 109.813 104.454 5.359 25061 11356 1 16 . 1 1 127 127 GLY C C 127 174.264 174.264 172.390 1.874 25061 11357 1 16 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.151 0.128 25061 11358 1 16 . 1 1 127 127 GLY H H 127 8.279 8.279 7.440 0.839 25061 11359 1 16 . 1 1 128 128 SER N N 128 115.185 115.185 115.367 -0.182 25061 11360 1 16 . 1 1 128 128 SER HA H 128 4.462 4.462 4.711 -0.249 25061 11361 1 16 . 1 1 128 128 SER C C 128 174.775 174.775 172.795 1.980 25061 11362 1 16 . 1 1 128 128 SER CA C 128 58.739 58.739 57.553 1.187 25061 11363 1 16 . 1 1 128 128 SER CB C 128 63.850 63.850 65.083 -1.233 25061 11364 1 16 . 1 1 128 128 SER H H 128 8.048 8.048 8.291 -0.243 25061 11365 1 16 . 1 1 129 129 LEU N N 129 123.060 123.060 118.786 4.274 25061 11366 1 16 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.782 -0.484 25061 11367 1 16 . 1 1 129 129 LEU C C 129 177.313 177.313 175.091 2.222 25061 11368 1 16 . 1 1 129 129 LEU CA C 129 55.158 55.158 54.767 0.391 25061 11369 1 16 . 1 1 129 129 LEU CB C 129 41.837 41.837 43.680 -1.843 25061 11370 1 16 . 1 1 129 129 LEU H H 129 8.147 8.147 8.219 -0.072 25061 11371 1 16 . 1 1 130 130 GLU N N 130 120.088 120.088 119.805 0.283 25061 11372 1 16 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.654 -0.473 25061 11373 1 16 . 1 1 130 130 GLU C C 130 176.148 176.148 175.021 1.127 25061 11374 1 16 . 1 1 130 130 GLU CA C 130 56.726 56.726 55.812 0.915 25061 11375 1 16 . 1 1 130 130 GLU CB C 130 30.026 30.026 31.974 -1.948 25061 11376 1 16 . 1 1 130 130 GLU H H 130 8.242 8.242 8.445 -0.203 25061 11377 1 17 . 1 1 2 2 GLY CA C 2 45.319 45.319 44.513 0.806 25061 11378 1 17 . 1 1 3 3 THR HA H 3 4.820 4.820 5.247 -0.427 25061 11379 1 17 . 1 1 3 3 THR C C 3 172.374 172.374 173.519 -1.145 25061 11380 1 17 . 1 1 3 3 THR CA C 3 62.760 62.760 60.164 2.596 25061 11381 1 17 . 1 1 3 3 THR CB C 3 71.441 71.441 70.789 0.652 25061 11382 1 17 . 1 1 4 4 VAL N N 4 126.881 126.881 124.109 2.772 25061 11383 1 17 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.686 -0.118 25061 11384 1 17 . 1 1 4 4 VAL C C 4 173.116 173.116 174.415 -1.299 25061 11385 1 17 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.137 -0.682 25061 11386 1 17 . 1 1 4 4 VAL CB C 4 33.800 33.800 33.167 0.633 25061 11387 1 17 . 1 1 4 4 VAL H H 4 9.097 9.097 8.860 0.237 25061 11388 1 17 . 1 1 5 5 VAL N N 5 127.172 127.172 123.259 3.913 25061 11389 1 17 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.458 -0.571 25061 11390 1 17 . 1 1 5 5 VAL C C 5 174.091 174.091 175.228 -1.137 25061 11391 1 17 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.117 1.001 25061 11392 1 17 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.949 -1.014 25061 11393 1 17 . 1 1 5 5 VAL H H 5 8.811 8.811 8.874 -0.063 25061 11394 1 17 . 1 1 6 6 ILE N N 6 127.577 127.577 127.303 0.274 25061 11395 1 17 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.585 0.035 25061 11396 1 17 . 1 1 6 6 ILE C C 6 173.328 173.328 175.414 -2.086 25061 11397 1 17 . 1 1 6 6 ILE CA C 6 59.832 59.832 58.064 1.768 25061 11398 1 17 . 1 1 6 6 ILE CB C 6 39.930 39.930 37.708 2.222 25061 11399 1 17 . 1 1 6 6 ILE H H 6 9.210 9.210 7.994 1.216 25061 11400 1 17 . 1 1 7 7 VAL N N 7 129.024 129.024 129.607 -0.583 25061 11401 1 17 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.103 0.702 25061 11402 1 17 . 1 1 7 7 VAL C C 7 173.561 173.561 174.732 -1.171 25061 11403 1 17 . 1 1 7 7 VAL CA C 7 60.849 60.849 62.267 -1.418 25061 11404 1 17 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.047 1.313 25061 11405 1 17 . 1 1 7 7 VAL H H 7 9.294 9.294 8.363 0.931 25061 11406 1 17 . 1 1 8 8 VAL N N 8 125.318 125.318 128.398 -3.080 25061 11407 1 17 . 1 1 8 8 VAL HA H 8 5.396 5.396 4.780 0.616 25061 11408 1 17 . 1 1 8 8 VAL C C 8 175.723 175.723 175.046 0.677 25061 11409 1 17 . 1 1 8 8 VAL CA C 8 59.617 59.617 60.929 -1.312 25061 11410 1 17 . 1 1 8 8 VAL CB C 8 34.915 34.915 33.663 1.252 25061 11411 1 17 . 1 1 8 8 VAL H H 8 8.898 8.898 8.718 0.180 25061 11412 1 17 . 1 1 9 9 SER N N 9 116.544 116.544 119.840 -3.296 25061 11413 1 17 . 1 1 9 9 SER HA H 9 4.724 4.724 4.741 -0.017 25061 11414 1 17 . 1 1 9 9 SER C C 9 174.552 174.552 173.003 1.549 25061 11415 1 17 . 1 1 9 9 SER CA C 9 57.419 57.419 57.528 -0.109 25061 11416 1 17 . 1 1 9 9 SER CB C 9 64.998 64.998 64.653 0.345 25061 11417 1 17 . 1 1 9 9 SER H H 9 7.833 7.833 8.027 -0.194 25061 11418 1 17 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.862 0.050 25061 11419 1 17 . 1 1 10 10 ASN C C 10 176.170 176.170 174.306 1.864 25061 11420 1 17 . 1 1 10 10 ASN CA C 10 54.141 54.141 53.103 1.038 25061 11421 1 17 . 1 1 10 10 ASN CB C 10 38.626 38.626 38.846 -0.220 25061 11422 1 17 . 1 1 11 11 ASP N N 11 120.164 120.164 121.475 -1.311 25061 11423 1 17 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.853 -0.010 25061 11424 1 17 . 1 1 11 11 ASP C C 11 176.148 176.148 176.203 -0.055 25061 11425 1 17 . 1 1 11 11 ASP CA C 11 52.620 52.620 53.698 -1.078 25061 11426 1 17 . 1 1 11 11 ASP CB C 11 42.631 42.631 42.526 0.105 25061 11427 1 17 . 1 1 11 11 ASP H H 11 8.142 8.142 7.640 0.502 25061 11428 1 17 . 1 1 12 12 GLU N N 12 127.184 127.184 124.422 2.762 25061 11429 1 17 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.051 -0.198 25061 11430 1 17 . 1 1 12 12 GLU C C 12 177.853 177.853 178.370 -0.517 25061 11431 1 17 . 1 1 12 12 GLU CA C 12 59.547 59.547 59.808 -0.261 25061 11432 1 17 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.680 0.139 25061 11433 1 17 . 1 1 12 12 GLU H H 12 9.152 9.152 9.008 0.144 25061 11434 1 17 . 1 1 13 13 ARG N N 13 119.026 119.026 117.522 1.504 25061 11435 1 17 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.291 -0.188 25061 11436 1 17 . 1 1 13 13 ARG C C 13 179.151 179.151 178.483 0.668 25061 11437 1 17 . 1 1 13 13 ARG CA C 13 58.943 58.943 59.065 -0.121 25061 11438 1 17 . 1 1 13 13 ARG CB C 13 28.757 28.757 29.867 -1.110 25061 11439 1 17 . 1 1 13 13 ARG H H 13 8.389 8.389 8.400 -0.011 25061 11440 1 17 . 1 1 14 14 ILE N N 14 119.238 119.238 119.625 -0.387 25061 11441 1 17 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.997 -0.396 25061 11442 1 17 . 1 1 14 14 ILE C C 14 177.905 177.905 177.738 0.167 25061 11443 1 17 . 1 1 14 14 ILE CA C 14 64.666 64.666 62.252 2.414 25061 11444 1 17 . 1 1 14 14 ILE CB C 14 36.780 36.780 36.656 0.124 25061 11445 1 17 . 1 1 14 14 ILE H H 14 7.254 7.254 7.979 -0.725 25061 11446 1 17 . 1 1 15 15 LEU N N 15 117.008 117.008 120.499 -3.491 25061 11447 1 17 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.167 -0.246 25061 11448 1 17 . 1 1 15 15 LEU C C 15 178.062 178.062 179.372 -1.310 25061 11449 1 17 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.541 -0.130 25061 11450 1 17 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.593 -0.423 25061 11451 1 17 . 1 1 15 15 LEU H H 15 7.412 7.412 7.742 -0.330 25061 11452 1 17 . 1 1 16 16 GLU N N 16 117.637 117.637 118.802 -1.165 25061 11453 1 17 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.909 -0.208 25061 11454 1 17 . 1 1 16 16 GLU C C 16 179.182 179.182 178.939 0.243 25061 11455 1 17 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.486 -0.069 25061 11456 1 17 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.392 0.067 25061 11457 1 17 . 1 1 16 16 GLU H H 16 7.981 7.981 8.207 -0.226 25061 11458 1 17 . 1 1 17 17 GLU N N 17 119.759 119.759 121.039 -1.280 25061 11459 1 17 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.266 -0.250 25061 11460 1 17 . 1 1 17 17 GLU C C 17 179.949 179.949 179.073 0.876 25061 11461 1 17 . 1 1 17 17 GLU CA C 17 59.195 59.195 58.845 0.350 25061 11462 1 17 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.380 0.160 25061 11463 1 17 . 1 1 17 17 GLU H H 17 8.248 8.248 8.107 0.141 25061 11464 1 17 . 1 1 18 18 LEU N N 18 119.764 119.764 119.194 0.570 25061 11465 1 17 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.194 -0.113 25061 11466 1 17 . 1 1 18 18 LEU C C 18 177.620 177.620 179.163 -1.543 25061 11467 1 17 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.632 0.046 25061 11468 1 17 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.633 -0.523 25061 11469 1 17 . 1 1 18 18 LEU H H 18 8.486 8.486 8.139 0.347 25061 11470 1 17 . 1 1 19 19 LEU N N 19 123.102 123.102 121.003 2.099 25061 11471 1 17 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.686 -0.024 25061 11472 1 17 . 1 1 19 19 LEU C C 19 178.343 178.343 178.317 0.026 25061 11473 1 17 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.341 0.895 25061 11474 1 17 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.329 -0.678 25061 11475 1 17 . 1 1 19 19 LEU H H 19 7.870 7.870 7.723 0.147 25061 11476 1 17 . 1 1 20 20 GLU N N 20 117.884 117.884 118.738 -0.854 25061 11477 1 17 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.938 -0.034 25061 11478 1 17 . 1 1 20 20 GLU C C 20 177.707 177.707 179.257 -1.550 25061 11479 1 17 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.625 -0.233 25061 11480 1 17 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.427 -0.450 25061 11481 1 17 . 1 1 20 20 GLU H H 20 7.497 7.497 7.797 -0.300 25061 11482 1 17 . 1 1 21 21 VAL N N 21 117.709 117.709 119.198 -1.489 25061 11483 1 17 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.784 -0.160 25061 11484 1 17 . 1 1 21 21 VAL C C 21 178.523 178.523 177.948 0.575 25061 11485 1 17 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.531 -0.334 25061 11486 1 17 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.439 -0.292 25061 11487 1 17 . 1 1 21 21 VAL H H 21 7.514 7.514 7.660 -0.146 25061 11488 1 17 . 1 1 22 22 VAL N N 22 121.233 121.233 119.539 1.694 25061 11489 1 17 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.762 -0.316 25061 11490 1 17 . 1 1 22 22 VAL C C 22 176.868 176.868 177.946 -1.078 25061 11491 1 17 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.621 0.392 25061 11492 1 17 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.656 -0.342 25061 11493 1 17 . 1 1 22 22 VAL H H 22 7.863 7.863 7.273 0.590 25061 11494 1 17 . 1 1 23 23 LEU N N 23 118.101 118.101 119.021 -0.920 25061 11495 1 17 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.063 0.002 25061 11496 1 17 . 1 1 23 23 LEU C C 23 179.701 179.701 178.140 1.561 25061 11497 1 17 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.864 -0.568 25061 11498 1 17 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.720 -0.016 25061 11499 1 17 . 1 1 23 23 LEU H H 23 8.151 8.151 8.181 -0.031 25061 11500 1 17 . 1 1 24 24 LYS N N 24 114.622 114.622 115.632 -1.010 25061 11501 1 17 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.141 -0.004 25061 11502 1 17 . 1 1 24 24 LYS C C 24 178.062 178.062 178.684 -0.622 25061 11503 1 17 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.021 -0.653 25061 11504 1 17 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.010 0.584 25061 11505 1 17 . 1 1 24 24 LYS H H 24 7.823 7.823 7.856 -0.033 25061 11506 1 17 . 1 1 25 25 SER N N 25 115.474 115.474 116.106 -0.632 25061 11507 1 17 . 1 1 25 25 SER HA H 25 4.377 4.377 4.294 0.083 25061 11508 1 17 . 1 1 25 25 SER C C 25 174.520 174.520 174.888 -0.368 25061 11509 1 17 . 1 1 25 25 SER CA C 25 61.049 61.049 60.786 0.263 25061 11510 1 17 . 1 1 25 25 SER CB C 25 63.777 63.777 64.248 -0.471 25061 11511 1 17 . 1 1 25 25 SER H H 25 7.798 7.798 7.747 0.051 25061 11512 1 17 . 1 1 26 26 ASP N N 26 117.424 117.424 118.314 -0.890 25061 11513 1 17 . 1 1 26 26 ASP HA H 26 4.886 4.886 4.937 -0.051 25061 11514 1 17 . 1 1 26 26 ASP C C 26 173.521 173.521 174.130 -0.609 25061 11515 1 17 . 1 1 26 26 ASP CA C 26 52.048 52.048 53.313 -1.266 25061 11516 1 17 . 1 1 26 26 ASP CB C 26 42.202 42.202 42.418 -0.216 25061 11517 1 17 . 1 1 26 26 ASP H H 26 7.990 7.990 8.059 -0.069 25061 11518 1 17 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.430 0.215 25061 11519 1 17 . 1 1 27 27 PRO C C 27 177.016 177.016 176.878 0.138 25061 11520 1 17 . 1 1 27 27 PRO CA C 27 63.601 63.601 64.498 -0.897 25061 11521 1 17 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.430 -0.257 25061 11522 1 17 . 1 1 28 28 ASN N N 28 115.839 115.839 116.123 -0.284 25061 11523 1 17 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.656 0.036 25061 11524 1 17 . 1 1 28 28 ASN C C 28 175.701 175.701 175.978 -0.277 25061 11525 1 17 . 1 1 28 28 ASN CA C 28 53.472 53.472 53.189 0.283 25061 11526 1 17 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.031 0.182 25061 11527 1 17 . 1 1 28 28 ASN H H 28 8.608 8.608 7.902 0.706 25061 11528 1 17 . 1 1 29 29 VAL N N 29 120.770 120.770 122.035 -1.265 25061 11529 1 17 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.884 -0.069 25061 11530 1 17 . 1 1 29 29 VAL C C 29 175.023 175.023 175.305 -0.282 25061 11531 1 17 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.142 -0.590 25061 11532 1 17 . 1 1 29 29 VAL CB C 29 32.147 32.147 32.185 -0.038 25061 11533 1 17 . 1 1 29 29 VAL H H 29 7.428 7.428 7.621 -0.193 25061 11534 1 17 . 1 1 30 30 LYS N N 30 127.345 127.345 129.670 -2.325 25061 11535 1 17 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.284 0.195 25061 11536 1 17 . 1 1 30 30 LYS C C 30 174.777 174.777 176.122 -1.345 25061 11537 1 17 . 1 1 30 30 LYS CA C 30 55.204 55.204 55.807 -0.603 25061 11538 1 17 . 1 1 30 30 LYS CB C 30 31.949 31.949 31.512 0.437 25061 11539 1 17 . 1 1 30 30 LYS H H 30 8.457 8.457 8.523 -0.066 25061 11540 1 17 . 1 1 31 31 THR N N 31 113.552 113.552 119.265 -5.713 25061 11541 1 17 . 1 1 31 31 THR HA H 31 5.723 5.723 5.401 0.322 25061 11542 1 17 . 1 1 31 31 THR C C 31 174.593 174.593 174.586 0.007 25061 11543 1 17 . 1 1 31 31 THR CA C 31 59.030 59.030 60.408 -1.378 25061 11544 1 17 . 1 1 31 31 THR CB C 31 72.206 72.206 69.217 2.989 25061 11545 1 17 . 1 1 31 31 THR H H 31 8.164 8.164 8.011 0.153 25061 11546 1 17 . 1 1 32 32 VAL N N 32 119.206 119.206 127.386 -8.180 25061 11547 1 17 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.333 0.072 25061 11548 1 17 . 1 1 32 32 VAL C C 32 172.663 172.663 174.219 -1.556 25061 11549 1 17 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.519 -0.447 25061 11550 1 17 . 1 1 32 32 VAL CB C 32 35.051 35.051 34.377 0.674 25061 11551 1 17 . 1 1 32 32 VAL H H 32 8.615 8.615 8.808 -0.193 25061 11552 1 17 . 1 1 33 33 ARG N N 33 130.278 130.278 129.069 1.209 25061 11553 1 17 . 1 1 33 33 ARG HA H 33 5.331 5.331 5.232 0.099 25061 11554 1 17 . 1 1 33 33 ARG C C 33 173.836 173.836 175.706 -1.870 25061 11555 1 17 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.699 -1.549 25061 11556 1 17 . 1 1 33 33 ARG CB C 33 30.028 30.028 31.016 -0.988 25061 11557 1 17 . 1 1 33 33 ARG H H 33 8.996 8.996 8.752 0.244 25061 11558 1 17 . 1 1 34 34 THR N N 34 121.695 121.695 121.222 0.473 25061 11559 1 17 . 1 1 34 34 THR HA H 34 4.483 4.483 4.380 0.103 25061 11560 1 17 . 1 1 34 34 THR C C 34 169.769 169.769 172.689 -2.920 25061 11561 1 17 . 1 1 34 34 THR CA C 34 60.814 60.814 61.098 -0.284 25061 11562 1 17 . 1 1 34 34 THR CB C 34 67.402 67.402 70.260 -2.858 25061 11563 1 17 . 1 1 34 34 THR H H 34 8.126 8.126 8.303 -0.177 25061 11564 1 17 . 1 1 35 35 ASP N N 35 122.198 122.198 120.551 1.647 25061 11565 1 17 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.693 0.131 25061 11566 1 17 . 1 1 35 35 ASP C C 35 174.790 174.790 175.635 -0.845 25061 11567 1 17 . 1 1 35 35 ASP CA C 35 53.386 53.386 53.707 -0.321 25061 11568 1 17 . 1 1 35 35 ASP CB C 35 41.848 41.848 41.185 0.663 25061 11569 1 17 . 1 1 35 35 ASP H H 35 7.983 7.983 8.343 -0.360 25061 11570 1 17 . 1 1 36 36 ASP N N 36 121.091 121.091 121.764 -0.673 25061 11571 1 17 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.371 0.222 25061 11572 1 17 . 1 1 36 36 ASP C C 36 176.189 176.189 176.729 -0.540 25061 11573 1 17 . 1 1 36 36 ASP CA C 36 53.055 53.055 55.709 -2.654 25061 11574 1 17 . 1 1 36 36 ASP CB C 36 42.159 42.159 41.502 0.657 25061 11575 1 17 . 1 1 36 36 ASP H H 36 8.157 8.157 7.907 0.250 25061 11576 1 17 . 1 1 37 37 LYS N N 37 125.839 125.839 117.266 8.573 25061 11577 1 17 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.749 -0.027 25061 11578 1 17 . 1 1 37 37 LYS C C 37 176.870 176.870 176.908 -0.038 25061 11579 1 17 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.464 -0.060 25061 11580 1 17 . 1 1 37 37 LYS CB C 37 32.394 32.394 31.016 1.378 25061 11581 1 17 . 1 1 37 37 LYS H H 37 8.843 8.843 8.214 0.629 25061 11582 1 17 . 1 1 38 38 GLU N N 38 118.369 118.369 119.007 -0.638 25061 11583 1 17 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.915 0.092 25061 11584 1 17 . 1 1 38 38 GLU C C 38 179.502 179.502 178.343 1.159 25061 11585 1 17 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.819 -0.149 25061 11586 1 17 . 1 1 38 38 GLU CB C 38 28.474 28.474 29.214 -0.740 25061 11587 1 17 . 1 1 38 38 GLU H H 38 8.182 8.182 8.195 -0.013 25061 11588 1 17 . 1 1 39 39 LYS N N 39 121.722 121.722 120.633 1.089 25061 11589 1 17 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.193 -0.028 25061 11590 1 17 . 1 1 39 39 LYS C C 39 178.500 178.500 178.559 -0.059 25061 11591 1 17 . 1 1 39 39 LYS CA C 39 57.736 57.736 58.829 -1.093 25061 11592 1 17 . 1 1 39 39 LYS CB C 39 31.138 31.138 31.921 -0.783 25061 11593 1 17 . 1 1 39 39 LYS H H 39 7.524 7.524 7.786 -0.262 25061 11594 1 17 . 1 1 40 40 VAL N N 40 117.199 117.199 118.094 -0.895 25061 11595 1 17 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.633 -0.405 25061 11596 1 17 . 1 1 40 40 VAL C C 40 177.362 177.362 177.983 -0.621 25061 11597 1 17 . 1 1 40 40 VAL CA C 40 67.642 67.642 65.915 1.727 25061 11598 1 17 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.556 -0.653 25061 11599 1 17 . 1 1 40 40 VAL H H 40 7.883 7.883 7.309 0.574 25061 11600 1 17 . 1 1 41 41 LYS N N 41 117.677 117.677 119.594 -1.917 25061 11601 1 17 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.809 -0.367 25061 11602 1 17 . 1 1 41 41 LYS C C 41 177.686 177.686 178.667 -0.981 25061 11603 1 17 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.942 0.867 25061 11604 1 17 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.755 -0.140 25061 11605 1 17 . 1 1 41 41 LYS H H 41 7.567 7.567 7.678 -0.111 25061 11606 1 17 . 1 1 42 42 GLU N N 42 118.369 118.369 118.117 0.252 25061 11607 1 17 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.063 -0.056 25061 11608 1 17 . 1 1 42 42 GLU C C 42 179.725 179.725 179.218 0.507 25061 11609 1 17 . 1 1 42 42 GLU CA C 42 59.069 59.069 58.766 0.303 25061 11610 1 17 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.051 0.488 25061 11611 1 17 . 1 1 42 42 GLU H H 42 7.634 7.634 7.882 -0.248 25061 11612 1 17 . 1 1 43 43 GLU N N 43 117.906 117.906 120.142 -2.236 25061 11613 1 17 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.133 0.050 25061 11614 1 17 . 1 1 43 43 GLU C C 43 179.757 179.757 178.903 0.854 25061 11615 1 17 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.413 -0.047 25061 11616 1 17 . 1 1 43 43 GLU CB C 43 28.841 28.841 28.994 -0.153 25061 11617 1 17 . 1 1 43 43 GLU H H 43 8.162 8.162 7.693 0.469 25061 11618 1 17 . 1 1 44 44 ILE N N 44 122.291 122.291 120.545 1.746 25061 11619 1 17 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.647 -0.035 25061 11620 1 17 . 1 1 44 44 ILE C C 44 177.101 177.101 177.740 -0.639 25061 11621 1 17 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.803 0.552 25061 11622 1 17 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.849 -0.389 25061 11623 1 17 . 1 1 44 44 ILE H H 44 8.742 8.742 8.259 0.483 25061 11624 1 17 . 1 1 45 45 GLU N N 45 119.892 119.892 121.250 -1.358 25061 11625 1 17 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.318 -0.260 25061 11626 1 17 . 1 1 45 45 GLU C C 45 178.991 178.991 179.081 -0.090 25061 11627 1 17 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.689 -0.024 25061 11628 1 17 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.629 -0.468 25061 11629 1 17 . 1 1 45 45 GLU H H 45 8.171 8.171 8.169 0.002 25061 11630 1 17 . 1 1 46 46 LYS N N 46 118.064 118.064 118.618 -0.554 25061 11631 1 17 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.049 -0.067 25061 11632 1 17 . 1 1 46 46 LYS C C 46 178.837 178.837 178.870 -0.033 25061 11633 1 17 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.284 0.457 25061 11634 1 17 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.310 0.133 25061 11635 1 17 . 1 1 46 46 LYS H H 46 7.785 7.785 7.771 0.014 25061 11636 1 17 . 1 1 47 47 ALA N N 47 121.817 121.817 121.696 0.121 25061 11637 1 17 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.295 -0.264 25061 11638 1 17 . 1 1 47 47 ALA C C 47 179.859 179.859 179.780 0.079 25061 11639 1 17 . 1 1 47 47 ALA CA C 47 55.295 55.295 54.681 0.614 25061 11640 1 17 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.744 -1.088 25061 11641 1 17 . 1 1 47 47 ALA H H 47 8.123 8.123 8.014 0.109 25061 11642 1 17 . 1 1 48 48 ARG N N 48 119.080 119.080 117.390 1.690 25061 11643 1 17 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.176 -0.087 25061 11644 1 17 . 1 1 48 48 ARG C C 48 180.155 180.155 178.162 1.993 25061 11645 1 17 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.182 1.015 25061 11646 1 17 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.645 -0.136 25061 11647 1 17 . 1 1 48 48 ARG H H 48 8.768 8.768 8.116 0.652 25061 11648 1 17 . 1 1 49 49 LYS N N 49 119.951 119.951 118.919 1.032 25061 11649 1 17 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.176 -0.137 25061 11650 1 17 . 1 1 49 49 LYS C C 49 178.288 178.288 178.069 0.219 25061 11651 1 17 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.412 0.425 25061 11652 1 17 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.812 -0.669 25061 11653 1 17 . 1 1 49 49 LYS H H 49 8.037 8.037 7.699 0.338 25061 11654 1 17 . 1 1 50 50 GLN N N 50 115.284 115.284 117.055 -1.771 25061 11655 1 17 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.271 0.071 25061 11656 1 17 . 1 1 50 50 GLN C C 50 176.180 176.180 176.338 -0.158 25061 11657 1 17 . 1 1 50 50 GLN CA C 50 55.741 55.741 55.888 -0.147 25061 11658 1 17 . 1 1 50 50 GLN CB C 50 29.565 29.565 30.271 -0.706 25061 11659 1 17 . 1 1 50 50 GLN H H 50 7.740 7.740 8.048 -0.308 25061 11660 1 17 . 1 1 51 51 GLY N N 51 109.725 109.725 106.611 3.114 25061 11661 1 17 . 1 1 51 51 GLY C C 51 174.552 174.552 172.831 1.721 25061 11662 1 17 . 1 1 51 51 GLY CA C 51 46.363 46.363 44.464 1.899 25061 11663 1 17 . 1 1 51 51 GLY H H 51 8.027 8.027 7.961 0.066 25061 11664 1 17 . 1 1 52 52 ARG N N 52 119.064 119.064 116.694 2.370 25061 11665 1 17 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.033 0.864 25061 11666 1 17 . 1 1 52 52 ARG C C 52 173.123 173.123 173.252 -0.129 25061 11667 1 17 . 1 1 52 52 ARG CA C 52 52.247 52.247 56.177 -3.930 25061 11668 1 17 . 1 1 52 52 ARG CB C 52 32.366 32.366 29.375 2.991 25061 11669 1 17 . 1 1 52 52 ARG H H 52 7.969 7.969 8.031 -0.062 25061 11670 1 17 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.739 0.116 25061 11671 1 17 . 1 1 53 53 PRO C C 53 174.069 174.069 176.393 -2.324 25061 11672 1 17 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.617 -0.799 25061 11673 1 17 . 1 1 53 53 PRO CB C 53 32.060 32.060 31.637 0.423 25061 11674 1 17 . 1 1 54 54 ILE N N 54 116.301 116.301 127.138 -10.837 25061 11675 1 17 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.162 1.076 25061 11676 1 17 . 1 1 54 54 ILE C C 54 171.709 171.709 174.462 -2.753 25061 11677 1 17 . 1 1 54 54 ILE CA C 54 57.774 57.774 61.286 -3.512 25061 11678 1 17 . 1 1 54 54 ILE CB C 54 41.558 41.558 39.074 2.484 25061 11679 1 17 . 1 1 54 54 ILE H H 54 7.920 7.920 8.074 -0.154 25061 11680 1 17 . 1 1 55 55 VAL N N 55 126.302 126.302 130.219 -3.917 25061 11681 1 17 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.182 -0.258 25061 11682 1 17 . 1 1 55 55 VAL C C 55 173.624 173.624 175.203 -1.579 25061 11683 1 17 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.303 -0.508 25061 11684 1 17 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.069 0.759 25061 11685 1 17 . 1 1 55 55 VAL H H 55 8.652 8.652 8.615 0.037 25061 11686 1 17 . 1 1 56 56 ILE N N 56 127.503 127.503 128.450 -0.947 25061 11687 1 17 . 1 1 56 56 ILE HA H 56 4.664 4.664 5.019 -0.355 25061 11688 1 17 . 1 1 56 56 ILE C C 56 173.479 173.479 175.406 -1.927 25061 11689 1 17 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.465 0.542 25061 11690 1 17 . 1 1 56 56 ILE CB C 56 40.285 40.285 38.310 1.975 25061 11691 1 17 . 1 1 56 56 ILE H H 56 9.124 9.124 8.083 1.041 25061 11692 1 17 . 1 1 57 57 PHE N N 57 125.302 125.302 128.031 -2.729 25061 11693 1 17 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.260 -0.044 25061 11694 1 17 . 1 1 57 57 PHE C C 57 174.536 174.536 176.099 -1.563 25061 11695 1 17 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.462 -0.501 25061 11696 1 17 . 1 1 57 57 PHE CB C 57 40.429 40.429 40.357 0.072 25061 11697 1 17 . 1 1 57 57 PHE H H 57 8.971 8.971 8.326 0.645 25061 11698 1 17 . 1 1 58 58 ILE N N 58 126.472 126.472 115.733 10.739 25061 11699 1 17 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.803 -0.288 25061 11700 1 17 . 1 1 58 58 ILE C C 58 173.391 173.391 173.959 -0.568 25061 11701 1 17 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.554 -0.464 25061 11702 1 17 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.037 -0.295 25061 11703 1 17 . 1 1 58 58 ILE H H 58 9.248 9.248 8.648 0.600 25061 11704 1 17 . 1 1 59 59 ARG N N 59 124.681 124.681 119.787 4.894 25061 11705 1 17 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.608 -0.679 25061 11706 1 17 . 1 1 59 59 ARG C C 59 178.521 178.521 177.868 0.653 25061 11707 1 17 . 1 1 59 59 ARG CA C 59 55.742 55.742 54.674 1.068 25061 11708 1 17 . 1 1 59 59 ARG CB C 59 30.918 30.918 33.203 -2.284 25061 11709 1 17 . 1 1 59 59 ARG H H 59 8.587 8.587 8.822 -0.235 25061 11710 1 17 . 1 1 60 60 GLY N N 60 108.848 108.848 109.616 -0.768 25061 11711 1 17 . 1 1 60 60 GLY C C 60 174.775 174.775 174.593 0.182 25061 11712 1 17 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.020 -0.053 25061 11713 1 17 . 1 1 60 60 GLY H H 60 7.732 7.732 8.660 -0.928 25061 11714 1 17 . 1 1 61 61 ALA N N 61 120.877 120.877 123.950 -3.073 25061 11715 1 17 . 1 1 61 61 ALA HA H 61 4.144 4.144 3.960 0.184 25061 11716 1 17 . 1 1 61 61 ALA C C 61 177.769 177.769 179.406 -1.637 25061 11717 1 17 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.943 -0.494 25061 11718 1 17 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.379 -0.008 25061 11719 1 17 . 1 1 61 61 ALA H H 61 7.852 7.852 7.731 0.120 25061 11720 1 17 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.247 0.553 25061 11721 1 17 . 1 1 62 62 TYR CA C 62 63.039 63.039 58.550 4.489 25061 11722 1 17 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.335 0.105 25061 11723 1 17 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.830 -0.145 25061 11724 1 17 . 1 1 63 63 GLU C C 63 176.251 176.251 177.824 -1.573 25061 11725 1 17 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.471 -0.213 25061 11726 1 17 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.003 0.409 25061 11727 1 17 . 1 1 64 64 GLU N N 64 119.209 119.209 118.701 0.508 25061 11728 1 17 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.921 -0.020 25061 11729 1 17 . 1 1 64 64 GLU C C 64 178.251 178.251 179.096 -0.845 25061 11730 1 17 . 1 1 64 64 GLU CA C 64 59.212 59.212 59.157 0.055 25061 11731 1 17 . 1 1 64 64 GLU CB C 64 28.645 28.645 29.437 -0.792 25061 11732 1 17 . 1 1 64 64 GLU H H 64 8.878 8.878 7.381 1.497 25061 11733 1 17 . 1 1 65 65 VAL N N 65 116.728 116.728 118.572 -1.844 25061 11734 1 17 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.980 0.002 25061 11735 1 17 . 1 1 65 65 VAL C C 65 176.915 176.915 178.738 -1.823 25061 11736 1 17 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.505 -0.896 25061 11737 1 17 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.327 0.568 25061 11738 1 17 . 1 1 65 65 VAL H H 65 7.652 7.652 7.759 -0.107 25061 11739 1 17 . 1 1 66 66 VAL N N 66 119.462 119.462 118.763 0.699 25061 11740 1 17 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.725 -0.411 25061 11741 1 17 . 1 1 66 66 VAL C C 66 177.142 177.142 177.572 -0.430 25061 11742 1 17 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.561 0.774 25061 11743 1 17 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.317 0.114 25061 11744 1 17 . 1 1 66 66 VAL H H 66 7.896 7.896 7.594 0.302 25061 11745 1 17 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.057 -0.429 25061 11746 1 17 . 1 1 67 67 ARG C C 67 177.841 177.841 178.192 -0.351 25061 11747 1 17 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.734 0.318 25061 11748 1 17 . 1 1 67 67 ARG CB C 67 29.393 29.393 30.006 -0.613 25061 11749 1 17 . 1 1 68 68 ASP N N 68 118.316 118.316 119.223 -0.907 25061 11750 1 17 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.530 -0.169 25061 11751 1 17 . 1 1 68 68 ASP C C 68 178.945 178.945 178.548 0.397 25061 11752 1 17 . 1 1 68 68 ASP CA C 68 57.311 57.311 57.160 0.151 25061 11753 1 17 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.847 0.667 25061 11754 1 17 . 1 1 68 68 ASP H H 68 7.625 7.625 7.807 -0.182 25061 11755 1 17 . 1 1 69 69 ILE N N 69 119.231 119.231 120.414 -1.183 25061 11756 1 17 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.861 -0.231 25061 11757 1 17 . 1 1 69 69 ILE C C 69 177.138 177.138 177.978 -0.840 25061 11758 1 17 . 1 1 69 69 ILE CA C 69 64.540 64.540 64.792 -0.252 25061 11759 1 17 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.860 -0.810 25061 11760 1 17 . 1 1 69 69 ILE H H 69 8.113 8.113 7.421 0.692 25061 11761 1 17 . 1 1 70 70 VAL N N 70 120.164 120.164 120.851 -0.687 25061 11762 1 17 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.626 -0.209 25061 11763 1 17 . 1 1 70 70 VAL C C 70 177.079 177.079 177.678 -0.599 25061 11764 1 17 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.439 -0.165 25061 11765 1 17 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.270 -0.012 25061 11766 1 17 . 1 1 70 70 VAL H H 70 8.478 8.478 8.467 0.011 25061 11767 1 17 . 1 1 71 71 GLU N N 71 118.293 118.293 119.376 -1.083 25061 11768 1 17 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.981 0.073 25061 11769 1 17 . 1 1 71 71 GLU C C 71 179.009 179.009 178.923 0.086 25061 11770 1 17 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.536 -0.120 25061 11771 1 17 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.395 -0.573 25061 11772 1 17 . 1 1 71 71 GLU H H 71 8.152 8.152 7.810 0.342 25061 11773 1 17 . 1 1 72 72 TYR N N 72 120.091 120.091 120.192 -0.101 25061 11774 1 17 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.228 -0.066 25061 11775 1 17 . 1 1 72 72 TYR C C 72 176.404 176.404 177.017 -0.613 25061 11776 1 17 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.246 -0.114 25061 11777 1 17 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.536 -0.399 25061 11778 1 17 . 1 1 72 72 TYR H H 72 7.959 7.959 7.449 0.510 25061 11779 1 17 . 1 1 73 73 ALA N N 73 120.133 120.133 121.056 -0.923 25061 11780 1 17 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.846 -0.216 25061 11781 1 17 . 1 1 73 73 ALA C C 73 179.182 179.182 179.362 -0.180 25061 11782 1 17 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.181 -0.069 25061 11783 1 17 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.228 -0.037 25061 11784 1 17 . 1 1 73 73 ALA H H 73 8.604 8.604 8.089 0.515 25061 11785 1 17 . 1 1 74 74 GLN N N 74 115.553 115.553 115.390 0.163 25061 11786 1 17 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.108 0.030 25061 11787 1 17 . 1 1 74 74 GLN C C 74 180.595 180.595 178.421 2.174 25061 11788 1 17 . 1 1 74 74 GLN CA C 74 59.095 59.095 57.758 1.337 25061 11789 1 17 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.235 0.340 25061 11790 1 17 . 1 1 74 74 GLN H H 74 8.619 8.619 8.224 0.395 25061 11791 1 17 . 1 1 75 75 LYS N N 75 122.396 122.396 119.244 3.152 25061 11792 1 17 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.066 -0.038 25061 11793 1 17 . 1 1 75 75 LYS C C 75 178.521 178.521 178.920 -0.399 25061 11794 1 17 . 1 1 75 75 LYS CA C 75 59.058 59.058 57.812 1.246 25061 11795 1 17 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.788 -0.189 25061 11796 1 17 . 1 1 75 75 LYS H H 75 8.123 8.123 7.450 0.673 25061 11797 1 17 . 1 1 76 76 GLU N N 76 116.294 116.294 116.950 -0.656 25061 11798 1 17 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.066 0.033 25061 11799 1 17 . 1 1 76 76 GLU C C 76 175.957 175.957 177.536 -1.579 25061 11800 1 17 . 1 1 76 76 GLU CA C 76 55.605 55.605 56.999 -1.394 25061 11801 1 17 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.841 -0.017 25061 11802 1 17 . 1 1 76 76 GLU H H 76 7.450 7.450 7.595 -0.145 25061 11803 1 17 . 1 1 77 77 GLY N N 77 107.446 107.446 107.798 -0.352 25061 11804 1 17 . 1 1 77 77 GLY C C 77 174.520 174.520 174.417 0.103 25061 11805 1 17 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.532 0.275 25061 11806 1 17 . 1 1 77 77 GLY H H 77 7.763 7.763 7.693 0.070 25061 11807 1 17 . 1 1 78 78 LEU N N 78 120.179 120.179 119.036 1.143 25061 11808 1 17 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.380 0.008 25061 11809 1 17 . 1 1 78 78 LEU C C 78 175.914 175.914 176.567 -0.653 25061 11810 1 17 . 1 1 78 78 LEU CA C 78 53.472 53.472 54.000 -0.528 25061 11811 1 17 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.754 -0.865 25061 11812 1 17 . 1 1 78 78 LEU H H 78 7.930 7.930 7.536 0.394 25061 11813 1 17 . 1 1 79 79 ARG N N 79 122.207 122.207 123.105 -0.898 25061 11814 1 17 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.340 0.057 25061 11815 1 17 . 1 1 79 79 ARG C C 79 174.960 174.960 174.476 0.484 25061 11816 1 17 . 1 1 79 79 ARG CA C 79 55.648 55.648 54.787 0.861 25061 11817 1 17 . 1 1 79 79 ARG CB C 79 30.476 30.476 29.415 1.061 25061 11818 1 17 . 1 1 79 79 ARG H H 79 8.241 8.241 8.171 0.070 25061 11819 1 17 . 1 1 80 80 VAL N N 80 123.333 123.333 126.417 -3.084 25061 11820 1 17 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.499 0.796 25061 11821 1 17 . 1 1 80 80 VAL C C 80 174.048 174.048 174.040 0.008 25061 11822 1 17 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.246 -1.205 25061 11823 1 17 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.512 1.793 25061 11824 1 17 . 1 1 80 80 VAL H H 80 8.359 8.359 8.370 -0.011 25061 11825 1 17 . 1 1 81 81 LEU N N 81 128.719 128.719 130.795 -2.076 25061 11826 1 17 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.295 -0.191 25061 11827 1 17 . 1 1 81 81 LEU C C 81 174.484 174.484 174.481 0.003 25061 11828 1 17 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.576 0.544 25061 11829 1 17 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.564 -0.609 25061 11830 1 17 . 1 1 81 81 LEU H H 81 8.650 8.650 9.037 -0.387 25061 11831 1 17 . 1 1 82 82 VAL N N 82 122.487 122.487 124.028 -1.541 25061 11832 1 17 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.491 0.606 25061 11833 1 17 . 1 1 82 82 VAL C C 82 174.525 174.525 174.294 0.231 25061 11834 1 17 . 1 1 82 82 VAL CA C 82 60.285 60.285 60.650 -0.365 25061 11835 1 17 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.811 1.978 25061 11836 1 17 . 1 1 82 82 VAL H H 82 8.781 8.781 8.508 0.273 25061 11837 1 17 . 1 1 83 83 ILE N N 83 128.082 128.082 128.569 -0.487 25061 11838 1 17 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.796 0.134 25061 11839 1 17 . 1 1 83 83 ILE C C 83 172.925 172.925 174.861 -1.936 25061 11840 1 17 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.573 -0.632 25061 11841 1 17 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.302 1.884 25061 11842 1 17 . 1 1 83 83 ILE H H 83 9.527 9.527 8.717 0.810 25061 11843 1 17 . 1 1 84 84 LYS N N 84 128.493 128.493 126.616 1.877 25061 11844 1 17 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.110 -0.062 25061 11845 1 17 . 1 1 84 84 LYS C C 84 174.027 174.027 175.503 -1.476 25061 11846 1 17 . 1 1 84 84 LYS CA C 84 53.253 53.253 53.991 -0.738 25061 11847 1 17 . 1 1 84 84 LYS CB C 84 34.652 34.652 35.453 -0.801 25061 11848 1 17 . 1 1 84 84 LYS H H 84 8.721 8.721 8.796 -0.075 25061 11849 1 17 . 1 1 85 85 VAL N N 85 126.729 126.729 124.075 2.654 25061 11850 1 17 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.025 0.711 25061 11851 1 17 . 1 1 85 85 VAL C C 85 175.935 175.935 175.325 0.610 25061 11852 1 17 . 1 1 85 85 VAL CA C 85 60.200 60.200 62.257 -2.057 25061 11853 1 17 . 1 1 85 85 VAL CB C 85 30.847 30.847 31.332 -0.485 25061 11854 1 17 . 1 1 85 85 VAL H H 85 8.643 8.643 7.950 0.693 25061 11855 1 17 . 1 1 86 86 ALA N N 86 132.930 132.930 130.979 1.951 25061 11856 1 17 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.292 0.138 25061 11857 1 17 . 1 1 86 86 ALA C C 86 175.635 175.635 176.986 -1.351 25061 11858 1 17 . 1 1 86 86 ALA CA C 86 51.504 51.504 52.695 -1.191 25061 11859 1 17 . 1 1 86 86 ALA CB C 86 20.821 20.821 19.729 1.092 25061 11860 1 17 . 1 1 86 86 ALA H H 86 8.835 8.835 8.240 0.595 25061 11861 1 17 . 1 1 87 87 GLN N N 87 118.719 118.719 123.272 -4.553 25061 11862 1 17 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.356 0.113 25061 11863 1 17 . 1 1 87 87 GLN C C 87 175.949 175.949 175.074 0.875 25061 11864 1 17 . 1 1 87 87 GLN CA C 87 55.260 55.260 55.235 0.025 25061 11865 1 17 . 1 1 87 87 GLN CB C 87 30.432 30.432 28.741 1.691 25061 11866 1 17 . 1 1 87 87 GLN H H 87 8.570 8.570 8.577 -0.007 25061 11867 1 17 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.198 0.282 25061 11868 1 17 . 1 1 88 88 ASP CA C 88 55.454 55.454 55.303 0.151 25061 11869 1 17 . 1 1 88 88 ASP CB C 88 41.204 41.204 40.513 0.691 25061 11870 1 17 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.422 -0.375 25061 11871 1 17 . 1 1 89 89 GLN CA C 89 56.687 56.687 55.192 1.495 25061 11872 1 17 . 1 1 89 89 GLN CB C 89 27.850 27.850 28.623 -0.773 25061 11873 1 17 . 1 1 92 92 LEU N N 92 125.291 125.291 120.232 5.059 25061 11874 1 17 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.100 0.101 25061 11875 1 17 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.787 -2.730 25061 11876 1 17 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.853 0.193 25061 11877 1 17 . 1 1 92 92 LEU H H 92 8.277 8.277 7.930 0.347 25061 11878 1 17 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.436 0.320 25061 11879 1 17 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.186 -0.137 25061 11880 1 17 . 1 1 94 94 ARG C C 94 178.544 178.544 178.766 -0.222 25061 11881 1 17 . 1 1 94 94 ARG CA C 94 58.607 58.607 59.221 -0.614 25061 11882 1 17 . 1 1 94 94 ARG CB C 94 29.614 29.614 30.410 -0.796 25061 11883 1 17 . 1 1 95 95 PHE N N 95 117.407 117.407 121.290 -3.883 25061 11884 1 17 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.401 -0.026 25061 11885 1 17 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.934 -0.703 25061 11886 1 17 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.089 -1.147 25061 11887 1 17 . 1 1 95 95 PHE H H 95 8.419 8.419 8.155 0.264 25061 11888 1 17 . 1 1 96 96 TYR HA H 96 3.808 3.808 4.004 -0.196 25061 11889 1 17 . 1 1 96 96 TYR C C 96 177.728 177.728 177.201 0.527 25061 11890 1 17 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.416 1.740 25061 11891 1 17 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.266 -0.565 25061 11892 1 17 . 1 1 97 97 GLU N N 97 119.054 119.054 118.094 0.960 25061 11893 1 17 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.739 0.324 25061 11894 1 17 . 1 1 97 97 GLU C C 97 179.071 179.071 178.681 0.390 25061 11895 1 17 . 1 1 97 97 GLU CA C 97 58.760 58.760 59.352 -0.592 25061 11896 1 17 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.412 -0.240 25061 11897 1 17 . 1 1 97 97 GLU H H 97 7.858 7.858 7.700 0.158 25061 11898 1 17 . 1 1 98 98 GLN N N 98 119.385 119.385 118.953 0.432 25061 11899 1 17 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.923 -0.022 25061 11900 1 17 . 1 1 98 98 GLN C C 98 177.599 177.599 178.783 -1.184 25061 11901 1 17 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.584 -0.273 25061 11902 1 17 . 1 1 98 98 GLN CB C 98 27.766 27.766 28.075 -0.309 25061 11903 1 17 . 1 1 98 98 GLN H H 98 7.747 7.747 7.521 0.226 25061 11904 1 17 . 1 1 99 99 LEU N N 99 118.348 118.348 119.179 -0.831 25061 11905 1 17 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.776 0.243 25061 11906 1 17 . 1 1 99 99 LEU C C 99 178.669 178.669 178.774 -0.105 25061 11907 1 17 . 1 1 99 99 LEU CA C 99 57.430 57.430 58.136 -0.706 25061 11908 1 17 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.266 0.237 25061 11909 1 17 . 1 1 99 99 LEU H H 99 7.891 7.891 7.388 0.503 25061 11910 1 17 . 1 1 100 100 LYS N N 100 118.332 118.332 117.028 1.304 25061 11911 1 17 . 1 1 100 100 LYS HA H 100 4.509 4.509 4.298 0.211 25061 11912 1 17 . 1 1 100 100 LYS C C 100 180.846 180.846 179.016 1.830 25061 11913 1 17 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.260 0.829 25061 11914 1 17 . 1 1 100 100 LYS CB C 100 32.269 32.269 32.122 0.147 25061 11915 1 17 . 1 1 100 100 LYS H H 100 7.560 7.560 7.395 0.165 25061 11916 1 17 . 1 1 101 101 LYS N N 101 121.944 121.944 118.892 3.052 25061 11917 1 17 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.120 -0.048 25061 11918 1 17 . 1 1 101 101 LYS C C 101 177.707 177.707 177.588 0.119 25061 11919 1 17 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.017 0.853 25061 11920 1 17 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.320 -0.225 25061 11921 1 17 . 1 1 101 101 LYS H H 101 7.959 7.959 7.779 0.180 25061 11922 1 17 . 1 1 102 102 ASP N N 102 118.788 118.788 117.149 1.639 25061 11923 1 17 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.604 0.090 25061 11924 1 17 . 1 1 102 102 ASP C C 102 176.359 176.359 177.016 -0.657 25061 11925 1 17 . 1 1 102 102 ASP CA C 102 54.579 54.579 54.986 -0.407 25061 11926 1 17 . 1 1 102 102 ASP CB C 102 40.574 40.574 42.427 -1.853 25061 11927 1 17 . 1 1 102 102 ASP H H 102 7.893 7.893 7.772 0.121 25061 11928 1 17 . 1 1 103 103 GLY N N 103 107.024 107.024 107.446 -0.422 25061 11929 1 17 . 1 1 103 103 GLY C C 103 174.328 174.328 173.177 1.151 25061 11930 1 17 . 1 1 103 103 GLY CA C 103 45.345 45.345 45.250 0.095 25061 11931 1 17 . 1 1 103 103 GLY H H 103 7.866 7.866 7.837 0.029 25061 11932 1 17 . 1 1 104 104 VAL N N 104 123.060 123.060 120.441 2.619 25061 11933 1 17 . 1 1 104 104 VAL HA H 104 3.973 3.973 4.326 -0.353 25061 11934 1 17 . 1 1 104 104 VAL C C 104 175.023 175.023 174.031 0.992 25061 11935 1 17 . 1 1 104 104 VAL CA C 104 61.878 61.878 60.576 1.302 25061 11936 1 17 . 1 1 104 104 VAL CB C 104 32.088 32.088 34.350 -2.262 25061 11937 1 17 . 1 1 104 104 VAL H H 104 7.955 7.955 7.844 0.111 25061 11938 1 17 . 1 1 105 105 ASP N N 105 127.987 127.987 127.293 0.694 25061 11939 1 17 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.738 -0.163 25061 11940 1 17 . 1 1 105 105 ASP C C 105 173.624 173.624 174.223 -0.599 25061 11941 1 17 . 1 1 105 105 ASP CA C 105 54.087 54.087 53.433 0.654 25061 11942 1 17 . 1 1 105 105 ASP CB C 105 40.660 40.660 43.124 -2.464 25061 11943 1 17 . 1 1 105 105 ASP H H 105 8.399 8.399 8.122 0.277 25061 11944 1 17 . 1 1 106 106 VAL N N 106 125.798 125.798 120.439 5.359 25061 11945 1 17 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.862 -0.047 25061 11946 1 17 . 1 1 106 106 VAL C C 106 174.902 174.902 175.501 -0.599 25061 11947 1 17 . 1 1 106 106 VAL CA C 106 60.194 60.194 61.154 -0.960 25061 11948 1 17 . 1 1 106 106 VAL CB C 106 34.179 34.179 35.059 -0.879 25061 11949 1 17 . 1 1 106 106 VAL H H 106 7.550 7.550 8.132 -0.582 25061 11950 1 17 . 1 1 107 107 ARG N N 107 128.099 128.099 126.384 1.715 25061 11951 1 17 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.764 0.112 25061 11952 1 17 . 1 1 107 107 ARG C C 107 173.815 173.815 174.915 -1.100 25061 11953 1 17 . 1 1 107 107 ARG CA C 107 53.386 53.386 54.313 -0.927 25061 11954 1 17 . 1 1 107 107 ARG CB C 107 31.195 31.195 31.175 0.020 25061 11955 1 17 . 1 1 107 107 ARG H H 107 9.132 9.132 8.661 0.471 25061 11956 1 17 . 1 1 108 108 VAL N N 108 123.979 123.979 122.136 1.843 25061 11957 1 17 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.282 -0.340 25061 11958 1 17 . 1 1 108 108 VAL C C 108 175.854 175.854 176.543 -0.689 25061 11959 1 17 . 1 1 108 108 VAL CA C 108 60.017 60.017 61.303 -1.286 25061 11960 1 17 . 1 1 108 108 VAL CB C 108 32.844 32.844 31.576 1.268 25061 11961 1 17 . 1 1 108 108 VAL H H 108 8.561 8.561 8.664 -0.103 25061 11962 1 17 . 1 1 109 109 THR N N 109 120.144 120.144 123.859 -3.715 25061 11963 1 17 . 1 1 109 109 THR HA H 109 4.815 4.815 4.263 0.552 25061 11964 1 17 . 1 1 109 109 THR C C 109 171.867 171.867 174.944 -3.077 25061 11965 1 17 . 1 1 109 109 THR CA C 109 59.613 59.613 63.856 -4.243 25061 11966 1 17 . 1 1 109 109 THR CB C 109 69.720 69.720 69.269 0.451 25061 11967 1 17 . 1 1 109 109 THR H H 109 8.803 8.803 8.394 0.409 25061 11968 1 17 . 1 1 110 110 ASP N N 110 123.212 123.212 119.633 3.579 25061 11969 1 17 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.495 0.474 25061 11970 1 17 . 1 1 110 110 ASP C C 110 175.739 175.739 174.817 0.922 25061 11971 1 17 . 1 1 110 110 ASP CA C 110 53.243 53.243 55.434 -2.191 25061 11972 1 17 . 1 1 110 110 ASP CB C 110 41.351 41.351 40.385 0.966 25061 11973 1 17 . 1 1 110 110 ASP H H 110 8.363 8.363 8.853 -0.490 25061 11974 1 17 . 1 1 111 111 ASN N N 111 116.298 116.298 115.832 0.466 25061 11975 1 17 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.788 0.088 25061 11976 1 17 . 1 1 111 111 ASN C C 111 174.756 174.756 173.681 1.075 25061 11977 1 17 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.438 -0.306 25061 11978 1 17 . 1 1 111 111 ASN CB C 111 40.765 40.765 39.650 1.115 25061 11979 1 17 . 1 1 111 111 ASN H H 111 8.085 8.085 7.712 0.373 25061 11980 1 17 . 1 1 112 112 GLU HA H 112 3.848 3.848 4.312 -0.464 25061 11981 1 17 . 1 1 112 112 GLU C C 112 177.016 177.016 177.454 -0.438 25061 11982 1 17 . 1 1 112 112 GLU CA C 112 59.480 59.480 58.119 1.361 25061 11983 1 17 . 1 1 112 112 GLU CB C 112 29.674 29.674 30.215 -0.541 25061 11984 1 17 . 1 1 113 113 ASP N N 113 121.033 121.033 121.466 -0.433 25061 11985 1 17 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.389 0.024 25061 11986 1 17 . 1 1 113 113 ASP C C 113 178.988 178.988 178.237 0.751 25061 11987 1 17 . 1 1 113 113 ASP CA C 113 57.855 57.855 57.447 0.408 25061 11988 1 17 . 1 1 113 113 ASP CB C 113 40.502 40.502 41.096 -0.594 25061 11989 1 17 . 1 1 113 113 ASP H H 113 8.219 8.219 7.984 0.235 25061 11990 1 17 . 1 1 114 114 GLU N N 114 121.280 121.280 119.664 1.616 25061 11991 1 17 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.081 -0.016 25061 11992 1 17 . 1 1 114 114 GLU C C 114 178.776 178.776 178.341 0.435 25061 11993 1 17 . 1 1 114 114 GLU CA C 114 58.714 58.714 58.988 -0.274 25061 11994 1 17 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.226 -0.013 25061 11995 1 17 . 1 1 114 114 GLU H H 114 8.296 8.296 8.552 -0.256 25061 11996 1 17 . 1 1 115 115 ALA N N 115 120.924 120.924 122.147 -1.223 25061 11997 1 17 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.047 -0.209 25061 11998 1 17 . 1 1 115 115 ALA C C 115 178.502 178.502 179.348 -0.846 25061 11999 1 17 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.324 0.314 25061 12000 1 17 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.450 0.047 25061 12001 1 17 . 1 1 115 115 ALA H H 115 7.853 7.853 8.229 -0.376 25061 12002 1 17 . 1 1 116 116 LYS N N 116 116.616 116.616 117.400 -0.784 25061 12003 1 17 . 1 1 116 116 LYS HA H 116 3.719 3.719 4.072 -0.353 25061 12004 1 17 . 1 1 116 116 LYS C C 116 178.097 178.097 178.935 -0.838 25061 12005 1 17 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.120 1.632 25061 12006 1 17 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.051 0.504 25061 12007 1 17 . 1 1 116 116 LYS H H 116 8.091 8.091 7.823 0.268 25061 12008 1 17 . 1 1 117 117 LYS N N 117 118.990 118.990 119.784 -0.794 25061 12009 1 17 . 1 1 117 117 LYS HA H 117 3.911 3.911 3.991 -0.080 25061 12010 1 17 . 1 1 117 117 LYS C C 117 179.186 179.186 179.185 0.001 25061 12011 1 17 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.711 -0.140 25061 12012 1 17 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.299 0.221 25061 12013 1 17 . 1 1 117 117 LYS H H 117 7.742 7.742 7.899 -0.157 25061 12014 1 17 . 1 1 118 118 ARG N N 118 117.441 117.441 119.674 -2.233 25061 12015 1 17 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.136 0.004 25061 12016 1 17 . 1 1 118 118 ARG C C 118 178.921 178.921 178.677 0.244 25061 12017 1 17 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.867 -1.196 25061 12018 1 17 . 1 1 118 118 ARG CB C 118 29.661 29.661 30.172 -0.511 25061 12019 1 17 . 1 1 118 118 ARG H H 118 8.468 8.468 7.687 0.781 25061 12020 1 17 . 1 1 119 119 LEU N N 119 120.100 120.100 120.305 -0.205 25061 12021 1 17 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.907 0.053 25061 12022 1 17 . 1 1 119 119 LEU C C 119 177.554 177.554 178.537 -0.983 25061 12023 1 17 . 1 1 119 119 LEU CA C 119 57.881 57.881 57.977 -0.096 25061 12024 1 17 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.693 0.196 25061 12025 1 17 . 1 1 119 119 LEU H H 119 8.322 8.322 7.973 0.349 25061 12026 1 17 . 1 1 120 120 LYS N N 120 118.238 118.238 118.968 -0.730 25061 12027 1 17 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.931 -0.109 25061 12028 1 17 . 1 1 120 120 LYS C C 120 178.703 178.703 178.974 -0.271 25061 12029 1 17 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.580 0.766 25061 12030 1 17 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.362 -0.126 25061 12031 1 17 . 1 1 120 120 LYS H H 120 7.990 7.990 7.611 0.379 25061 12032 1 17 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.278 -0.256 25061 12033 1 17 . 1 1 121 121 GLU C C 121 177.769 177.769 179.025 -1.256 25061 12034 1 17 . 1 1 121 121 GLU CA C 121 58.922 58.922 58.653 0.269 25061 12035 1 17 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.111 0.343 25061 12036 1 17 . 1 1 122 122 LEU N N 122 119.454 119.454 119.393 0.061 25061 12037 1 17 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.002 0.131 25061 12038 1 17 . 1 1 122 122 LEU C C 122 178.991 178.991 179.422 -0.431 25061 12039 1 17 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.832 -0.506 25061 12040 1 17 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.635 0.045 25061 12041 1 17 . 1 1 122 122 LEU H H 122 7.930 7.930 7.809 0.121 25061 12042 1 17 . 1 1 123 123 LEU N N 123 117.862 117.862 117.720 0.142 25061 12043 1 17 . 1 1 123 123 LEU HA H 123 4.067 4.067 4.046 0.021 25061 12044 1 17 . 1 1 123 123 LEU C C 123 179.178 179.178 179.205 -0.027 25061 12045 1 17 . 1 1 123 123 LEU CA C 123 56.920 56.920 57.881 -0.961 25061 12046 1 17 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.269 -0.059 25061 12047 1 17 . 1 1 123 123 LEU H H 123 8.095 8.095 7.721 0.374 25061 12048 1 17 . 1 1 124 124 GLU N N 124 118.975 118.975 117.223 1.752 25061 12049 1 17 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.213 -0.084 25061 12050 1 17 . 1 1 124 124 GLU C C 124 177.777 177.777 176.874 0.903 25061 12051 1 17 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.457 -0.370 25061 12052 1 17 . 1 1 124 124 GLU CB C 124 29.540 29.540 30.267 -0.727 25061 12053 1 17 . 1 1 124 124 GLU H H 124 7.930 7.930 7.970 -0.040 25061 12054 1 17 . 1 1 125 125 LYS N N 125 118.933 118.933 115.106 3.827 25061 12055 1 17 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.639 -0.302 25061 12056 1 17 . 1 1 125 125 LYS C C 125 178.188 178.188 175.556 2.632 25061 12057 1 17 . 1 1 125 125 LYS CA C 125 56.980 56.980 55.553 1.427 25061 12058 1 17 . 1 1 125 125 LYS CB C 125 32.608 32.608 32.549 0.059 25061 12059 1 17 . 1 1 125 125 LYS H H 125 7.729 7.729 7.547 0.182 25061 12060 1 17 . 1 1 126 126 VAL N N 126 117.933 117.933 116.974 0.959 25061 12061 1 17 . 1 1 126 126 VAL HA H 126 4.022 4.022 3.571 0.451 25061 12062 1 17 . 1 1 126 126 VAL C C 126 176.947 176.947 176.063 0.884 25061 12063 1 17 . 1 1 126 126 VAL CA C 126 63.641 63.641 64.992 -1.351 25061 12064 1 17 . 1 1 126 126 VAL CB C 126 31.859 31.859 30.877 0.982 25061 12065 1 17 . 1 1 126 126 VAL H H 126 8.044 8.044 8.560 -0.516 25061 12066 1 17 . 1 1 127 127 GLY N N 127 109.813 109.813 105.687 4.126 25061 12067 1 17 . 1 1 127 127 GLY C C 127 174.264 174.264 174.667 -0.403 25061 12068 1 17 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.095 0.184 25061 12069 1 17 . 1 1 127 127 GLY H H 127 8.279 8.279 7.905 0.374 25061 12070 1 17 . 1 1 128 128 SER N N 128 115.185 115.185 118.238 -3.053 25061 12071 1 17 . 1 1 128 128 SER HA H 128 4.462 4.462 4.513 -0.051 25061 12072 1 17 . 1 1 128 128 SER C C 128 174.775 174.775 173.990 0.785 25061 12073 1 17 . 1 1 128 128 SER CA C 128 58.739 58.739 57.404 1.335 25061 12074 1 17 . 1 1 128 128 SER CB C 128 63.850 63.850 62.409 1.441 25061 12075 1 17 . 1 1 128 128 SER H H 128 8.048 8.048 8.163 -0.115 25061 12076 1 17 . 1 1 129 129 LEU N N 129 123.060 123.060 125.902 -2.842 25061 12077 1 17 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.479 -0.181 25061 12078 1 17 . 1 1 129 129 LEU C C 129 177.313 177.313 176.284 1.029 25061 12079 1 17 . 1 1 129 129 LEU CA C 129 55.158 55.158 54.661 0.497 25061 12080 1 17 . 1 1 129 129 LEU CB C 129 41.837 41.837 42.961 -1.124 25061 12081 1 17 . 1 1 129 129 LEU H H 129 8.147 8.147 7.564 0.583 25061 12082 1 17 . 1 1 130 130 GLU N N 130 120.088 120.088 124.055 -3.967 25061 12083 1 17 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.329 -0.148 25061 12084 1 17 . 1 1 130 130 GLU C C 130 176.148 176.148 175.052 1.096 25061 12085 1 17 . 1 1 130 130 GLU CA C 130 56.726 56.726 54.956 1.770 25061 12086 1 17 . 1 1 130 130 GLU CB C 130 30.026 30.026 30.924 -0.898 25061 12087 1 17 . 1 1 130 130 GLU H H 130 8.242 8.242 8.373 -0.131 25061 12088 1 18 . 1 1 2 2 GLY CA C 2 45.319 45.319 45.531 -0.212 25061 12089 1 18 . 1 1 3 3 THR HA H 3 4.820 4.820 4.675 0.145 25061 12090 1 18 . 1 1 3 3 THR C C 3 172.374 172.374 174.000 -1.626 25061 12091 1 18 . 1 1 3 3 THR CA C 3 62.760 62.760 60.194 2.566 25061 12092 1 18 . 1 1 3 3 THR CB C 3 71.441 71.441 69.126 2.314 25061 12093 1 18 . 1 1 4 4 VAL N N 4 126.881 126.881 128.242 -1.361 25061 12094 1 18 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.171 0.397 25061 12095 1 18 . 1 1 4 4 VAL C C 4 173.116 173.116 174.812 -1.696 25061 12096 1 18 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.878 -1.423 25061 12097 1 18 . 1 1 4 4 VAL CB C 4 33.800 33.800 31.563 2.237 25061 12098 1 18 . 1 1 4 4 VAL H H 4 9.097 9.097 8.833 0.264 25061 12099 1 18 . 1 1 5 5 VAL N N 5 127.172 127.172 125.508 1.664 25061 12100 1 18 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.325 -0.438 25061 12101 1 18 . 1 1 5 5 VAL C C 5 174.091 174.091 175.091 -1.000 25061 12102 1 18 . 1 1 5 5 VAL CA C 5 60.118 60.118 58.969 1.149 25061 12103 1 18 . 1 1 5 5 VAL CB C 5 32.935 32.935 31.979 0.956 25061 12104 1 18 . 1 1 5 5 VAL H H 5 8.811 8.811 8.685 0.126 25061 12105 1 18 . 1 1 6 6 ILE N N 6 127.577 127.577 129.387 -1.810 25061 12106 1 18 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.485 0.135 25061 12107 1 18 . 1 1 6 6 ILE C C 6 173.328 173.328 175.471 -2.143 25061 12108 1 18 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.804 0.028 25061 12109 1 18 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.191 1.739 25061 12110 1 18 . 1 1 6 6 ILE H H 6 9.210 9.210 8.939 0.271 25061 12111 1 18 . 1 1 7 7 VAL N N 7 129.024 129.024 130.094 -1.070 25061 12112 1 18 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.428 0.377 25061 12113 1 18 . 1 1 7 7 VAL C C 7 173.561 173.561 175.141 -1.580 25061 12114 1 18 . 1 1 7 7 VAL CA C 7 60.849 60.849 62.291 -1.442 25061 12115 1 18 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.136 1.224 25061 12116 1 18 . 1 1 7 7 VAL H H 7 9.294 9.294 8.275 1.019 25061 12117 1 18 . 1 1 8 8 VAL N N 8 125.318 125.318 129.503 -4.185 25061 12118 1 18 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.528 -0.132 25061 12119 1 18 . 1 1 8 8 VAL C C 8 175.723 175.723 175.435 0.288 25061 12120 1 18 . 1 1 8 8 VAL CA C 8 59.617 59.617 60.100 -0.483 25061 12121 1 18 . 1 1 8 8 VAL CB C 8 34.915 34.915 35.248 -0.333 25061 12122 1 18 . 1 1 8 8 VAL H H 8 8.898 8.898 8.839 0.059 25061 12123 1 18 . 1 1 9 9 SER N N 9 116.544 116.544 118.307 -1.763 25061 12124 1 18 . 1 1 9 9 SER HA H 9 4.724 4.724 4.848 -0.124 25061 12125 1 18 . 1 1 9 9 SER C C 9 174.552 174.552 173.855 0.697 25061 12126 1 18 . 1 1 9 9 SER CA C 9 57.419 57.419 56.790 0.629 25061 12127 1 18 . 1 1 9 9 SER CB C 9 64.998 64.998 66.056 -1.058 25061 12128 1 18 . 1 1 9 9 SER H H 9 7.833 7.833 8.024 -0.191 25061 12129 1 18 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.436 0.476 25061 12130 1 18 . 1 1 10 10 ASN C C 10 176.170 176.170 174.346 1.824 25061 12131 1 18 . 1 1 10 10 ASN CA C 10 54.141 54.141 55.419 -1.278 25061 12132 1 18 . 1 1 10 10 ASN CB C 10 38.626 38.626 38.990 -0.364 25061 12133 1 18 . 1 1 11 11 ASP N N 11 120.164 120.164 116.293 3.871 25061 12134 1 18 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.753 0.090 25061 12135 1 18 . 1 1 11 11 ASP C C 11 176.148 176.148 176.113 0.035 25061 12136 1 18 . 1 1 11 11 ASP CA C 11 52.620 52.620 53.031 -0.411 25061 12137 1 18 . 1 1 11 11 ASP CB C 11 42.631 42.631 43.391 -0.760 25061 12138 1 18 . 1 1 11 11 ASP H H 11 8.142 8.142 7.726 0.416 25061 12139 1 18 . 1 1 12 12 GLU N N 12 127.184 127.184 124.727 2.457 25061 12140 1 18 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.159 -0.306 25061 12141 1 18 . 1 1 12 12 GLU C C 12 177.853 177.853 178.247 -0.394 25061 12142 1 18 . 1 1 12 12 GLU CA C 12 59.547 59.547 58.870 0.677 25061 12143 1 18 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.907 -0.088 25061 12144 1 18 . 1 1 12 12 GLU H H 12 9.152 9.152 8.909 0.243 25061 12145 1 18 . 1 1 13 13 ARG N N 13 119.026 119.026 119.072 -0.046 25061 12146 1 18 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.152 -0.049 25061 12147 1 18 . 1 1 13 13 ARG C C 13 179.151 179.151 178.811 0.340 25061 12148 1 18 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.930 0.013 25061 12149 1 18 . 1 1 13 13 ARG CB C 13 28.757 28.757 30.011 -1.254 25061 12150 1 18 . 1 1 13 13 ARG H H 13 8.389 8.389 7.929 0.460 25061 12151 1 18 . 1 1 14 14 ILE N N 14 119.238 119.238 120.774 -1.536 25061 12152 1 18 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.867 -0.266 25061 12153 1 18 . 1 1 14 14 ILE C C 14 177.905 177.905 178.003 -0.098 25061 12154 1 18 . 1 1 14 14 ILE CA C 14 64.666 64.666 63.425 1.241 25061 12155 1 18 . 1 1 14 14 ILE CB C 14 36.780 36.780 36.947 -0.167 25061 12156 1 18 . 1 1 14 14 ILE H H 14 7.254 7.254 7.658 -0.404 25061 12157 1 18 . 1 1 15 15 LEU N N 15 117.008 117.008 118.875 -1.867 25061 12158 1 18 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.210 -0.289 25061 12159 1 18 . 1 1 15 15 LEU C C 15 178.062 178.062 179.541 -1.479 25061 12160 1 18 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.397 0.014 25061 12161 1 18 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.498 -0.329 25061 12162 1 18 . 1 1 15 15 LEU H H 15 7.412 7.412 7.537 -0.125 25061 12163 1 18 . 1 1 16 16 GLU N N 16 117.637 117.637 119.547 -1.910 25061 12164 1 18 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.950 -0.249 25061 12165 1 18 . 1 1 16 16 GLU C C 16 179.182 179.182 178.541 0.641 25061 12166 1 18 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.076 0.341 25061 12167 1 18 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.235 0.224 25061 12168 1 18 . 1 1 16 16 GLU H H 16 7.981 7.981 7.596 0.385 25061 12169 1 18 . 1 1 17 17 GLU N N 17 119.759 119.759 120.750 -0.991 25061 12170 1 18 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.080 -0.064 25061 12171 1 18 . 1 1 17 17 GLU C C 17 179.949 179.949 179.137 0.812 25061 12172 1 18 . 1 1 17 17 GLU CA C 17 59.195 59.195 58.898 0.297 25061 12173 1 18 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.349 0.191 25061 12174 1 18 . 1 1 17 17 GLU H H 17 8.248 8.248 8.186 0.062 25061 12175 1 18 . 1 1 18 18 LEU N N 18 119.764 119.764 118.974 0.790 25061 12176 1 18 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.231 -0.150 25061 12177 1 18 . 1 1 18 18 LEU C C 18 177.620 177.620 178.961 -1.341 25061 12178 1 18 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.246 0.432 25061 12179 1 18 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.886 -0.776 25061 12180 1 18 . 1 1 18 18 LEU H H 18 8.486 8.486 8.033 0.453 25061 12181 1 18 . 1 1 19 19 LEU N N 19 123.102 123.102 121.170 1.932 25061 12182 1 18 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.332 0.330 25061 12183 1 18 . 1 1 19 19 LEU C C 19 178.343 178.343 178.248 0.095 25061 12184 1 18 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.300 0.936 25061 12185 1 18 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.297 -0.646 25061 12186 1 18 . 1 1 19 19 LEU H H 19 7.870 7.870 7.578 0.292 25061 12187 1 18 . 1 1 20 20 GLU N N 20 117.884 117.884 118.239 -0.355 25061 12188 1 18 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.921 -0.017 25061 12189 1 18 . 1 1 20 20 GLU C C 20 177.707 177.707 179.184 -1.477 25061 12190 1 18 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.489 -0.097 25061 12191 1 18 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.337 -0.360 25061 12192 1 18 . 1 1 20 20 GLU H H 20 7.497 7.497 7.657 -0.160 25061 12193 1 18 . 1 1 21 21 VAL N N 21 117.709 117.709 119.467 -1.758 25061 12194 1 18 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.781 -0.157 25061 12195 1 18 . 1 1 21 21 VAL C C 21 178.523 178.523 177.804 0.719 25061 12196 1 18 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.546 -0.349 25061 12197 1 18 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.510 -0.363 25061 12198 1 18 . 1 1 21 21 VAL H H 21 7.514 7.514 7.536 -0.022 25061 12199 1 18 . 1 1 22 22 VAL N N 22 121.233 121.233 119.042 2.191 25061 12200 1 18 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.622 -0.176 25061 12201 1 18 . 1 1 22 22 VAL C C 22 176.868 176.868 177.937 -1.069 25061 12202 1 18 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.260 0.753 25061 12203 1 18 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.632 -0.318 25061 12204 1 18 . 1 1 22 22 VAL H H 22 7.863 7.863 7.209 0.654 25061 12205 1 18 . 1 1 23 23 LEU N N 23 118.101 118.101 119.154 -1.053 25061 12206 1 18 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.072 -0.007 25061 12207 1 18 . 1 1 23 23 LEU C C 23 179.701 179.701 178.554 1.147 25061 12208 1 18 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.616 -0.320 25061 12209 1 18 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.894 -0.190 25061 12210 1 18 . 1 1 23 23 LEU H H 23 8.151 8.151 8.032 0.119 25061 12211 1 18 . 1 1 24 24 LYS N N 24 114.622 114.622 115.860 -1.238 25061 12212 1 18 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.127 0.010 25061 12213 1 18 . 1 1 24 24 LYS C C 24 178.062 178.062 178.723 -0.661 25061 12214 1 18 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.098 -0.730 25061 12215 1 18 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.039 0.555 25061 12216 1 18 . 1 1 24 24 LYS H H 24 7.823 7.823 7.925 -0.102 25061 12217 1 18 . 1 1 25 25 SER N N 25 115.474 115.474 116.091 -0.617 25061 12218 1 18 . 1 1 25 25 SER HA H 25 4.377 4.377 4.265 0.112 25061 12219 1 18 . 1 1 25 25 SER C C 25 174.520 174.520 174.864 -0.344 25061 12220 1 18 . 1 1 25 25 SER CA C 25 61.049 61.049 60.888 0.161 25061 12221 1 18 . 1 1 25 25 SER CB C 25 63.777 63.777 64.026 -0.249 25061 12222 1 18 . 1 1 25 25 SER H H 25 7.798 7.798 7.905 -0.107 25061 12223 1 18 . 1 1 26 26 ASP N N 26 117.424 117.424 118.335 -0.911 25061 12224 1 18 . 1 1 26 26 ASP HA H 26 4.886 4.886 4.958 -0.072 25061 12225 1 18 . 1 1 26 26 ASP C C 26 173.521 173.521 174.148 -0.627 25061 12226 1 18 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.850 -0.802 25061 12227 1 18 . 1 1 26 26 ASP CB C 26 42.202 42.202 42.940 -0.738 25061 12228 1 18 . 1 1 26 26 ASP H H 26 7.990 7.990 7.876 0.114 25061 12229 1 18 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.676 -0.031 25061 12230 1 18 . 1 1 27 27 PRO C C 27 177.016 177.016 176.226 0.790 25061 12231 1 18 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.033 0.568 25061 12232 1 18 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.306 -0.133 25061 12233 1 18 . 1 1 28 28 ASN N N 28 115.839 115.839 116.536 -0.697 25061 12234 1 18 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.820 -0.128 25061 12235 1 18 . 1 1 28 28 ASN C C 28 175.701 175.701 175.443 0.258 25061 12236 1 18 . 1 1 28 28 ASN CA C 28 53.472 53.472 52.629 0.843 25061 12237 1 18 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.953 -0.739 25061 12238 1 18 . 1 1 28 28 ASN H H 28 8.608 8.608 8.114 0.494 25061 12239 1 18 . 1 1 29 29 VAL N N 29 120.770 120.770 121.993 -1.223 25061 12240 1 18 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.979 -0.164 25061 12241 1 18 . 1 1 29 29 VAL C C 29 175.023 175.023 175.747 -0.724 25061 12242 1 18 . 1 1 29 29 VAL CA C 29 62.552 62.552 62.933 -0.381 25061 12243 1 18 . 1 1 29 29 VAL CB C 29 32.147 32.147 32.723 -0.576 25061 12244 1 18 . 1 1 29 29 VAL H H 29 7.428 7.428 8.176 -0.748 25061 12245 1 18 . 1 1 30 30 LYS N N 30 127.345 127.345 128.283 -0.938 25061 12246 1 18 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.311 0.168 25061 12247 1 18 . 1 1 30 30 LYS C C 30 174.777 174.777 175.994 -1.217 25061 12248 1 18 . 1 1 30 30 LYS CA C 30 55.204 55.204 55.209 -0.005 25061 12249 1 18 . 1 1 30 30 LYS CB C 30 31.949 31.949 30.300 1.649 25061 12250 1 18 . 1 1 30 30 LYS H H 30 8.457 8.457 8.472 -0.015 25061 12251 1 18 . 1 1 31 31 THR N N 31 113.552 113.552 116.741 -3.189 25061 12252 1 18 . 1 1 31 31 THR HA H 31 5.723 5.723 4.811 0.912 25061 12253 1 18 . 1 1 31 31 THR C C 31 174.593 174.593 174.346 0.247 25061 12254 1 18 . 1 1 31 31 THR CA C 31 59.030 59.030 61.299 -2.269 25061 12255 1 18 . 1 1 31 31 THR CB C 31 72.206 72.206 69.114 3.092 25061 12256 1 18 . 1 1 31 31 THR H H 31 8.164 8.164 8.143 0.021 25061 12257 1 18 . 1 1 32 32 VAL N N 32 119.206 119.206 127.547 -8.341 25061 12258 1 18 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.306 0.099 25061 12259 1 18 . 1 1 32 32 VAL C C 32 172.663 172.663 174.186 -1.523 25061 12260 1 18 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.609 -0.537 25061 12261 1 18 . 1 1 32 32 VAL CB C 32 35.051 35.051 34.431 0.620 25061 12262 1 18 . 1 1 32 32 VAL H H 32 8.615 8.615 9.069 -0.454 25061 12263 1 18 . 1 1 33 33 ARG N N 33 130.278 130.278 129.457 0.821 25061 12264 1 18 . 1 1 33 33 ARG HA H 33 5.331 5.331 5.066 0.265 25061 12265 1 18 . 1 1 33 33 ARG C C 33 173.836 173.836 175.431 -1.595 25061 12266 1 18 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.753 -1.603 25061 12267 1 18 . 1 1 33 33 ARG CB C 33 30.028 30.028 30.436 -0.407 25061 12268 1 18 . 1 1 33 33 ARG H H 33 8.996 8.996 8.671 0.325 25061 12269 1 18 . 1 1 34 34 THR N N 34 121.695 121.695 118.878 2.817 25061 12270 1 18 . 1 1 34 34 THR HA H 34 4.483 4.483 4.330 0.153 25061 12271 1 18 . 1 1 34 34 THR C C 34 169.769 169.769 171.983 -2.214 25061 12272 1 18 . 1 1 34 34 THR CA C 34 60.814 60.814 61.939 -1.125 25061 12273 1 18 . 1 1 34 34 THR CB C 34 67.402 67.402 70.961 -3.559 25061 12274 1 18 . 1 1 34 34 THR H H 34 8.126 8.126 7.961 0.165 25061 12275 1 18 . 1 1 35 35 ASP N N 35 122.198 122.198 121.127 1.071 25061 12276 1 18 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.837 -0.013 25061 12277 1 18 . 1 1 35 35 ASP C C 35 174.790 174.790 173.798 0.992 25061 12278 1 18 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.532 -1.147 25061 12279 1 18 . 1 1 35 35 ASP CB C 35 41.848 41.848 42.892 -1.044 25061 12280 1 18 . 1 1 35 35 ASP H H 35 7.983 7.983 7.825 0.158 25061 12281 1 18 . 1 1 36 36 ASP N N 36 121.091 121.091 124.621 -3.530 25061 12282 1 18 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.732 -0.139 25061 12283 1 18 . 1 1 36 36 ASP C C 36 176.189 176.189 175.775 0.414 25061 12284 1 18 . 1 1 36 36 ASP CA C 36 53.055 53.055 53.499 -0.444 25061 12285 1 18 . 1 1 36 36 ASP CB C 36 42.159 42.159 41.092 1.067 25061 12286 1 18 . 1 1 36 36 ASP H H 36 8.157 8.157 8.305 -0.148 25061 12287 1 18 . 1 1 37 37 LYS N N 37 125.839 125.839 116.496 9.343 25061 12288 1 18 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.690 0.032 25061 12289 1 18 . 1 1 37 37 LYS C C 37 176.870 176.870 177.575 -0.705 25061 12290 1 18 . 1 1 37 37 LYS CA C 37 59.404 59.404 60.007 -0.603 25061 12291 1 18 . 1 1 37 37 LYS CB C 37 32.394 32.394 30.453 1.941 25061 12292 1 18 . 1 1 37 37 LYS H H 37 8.843 8.843 8.299 0.544 25061 12293 1 18 . 1 1 38 38 GLU N N 38 118.369 118.369 119.258 -0.889 25061 12294 1 18 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.916 0.091 25061 12295 1 18 . 1 1 38 38 GLU C C 38 179.502 179.502 178.037 1.465 25061 12296 1 18 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.985 -0.315 25061 12297 1 18 . 1 1 38 38 GLU CB C 38 28.474 28.474 29.106 -0.632 25061 12298 1 18 . 1 1 38 38 GLU H H 38 8.182 8.182 8.253 -0.071 25061 12299 1 18 . 1 1 39 39 LYS N N 39 121.722 121.722 120.036 1.686 25061 12300 1 18 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.201 -0.036 25061 12301 1 18 . 1 1 39 39 LYS C C 39 178.500 178.500 178.204 0.296 25061 12302 1 18 . 1 1 39 39 LYS CA C 39 57.736 57.736 59.201 -1.465 25061 12303 1 18 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.405 -1.267 25061 12304 1 18 . 1 1 39 39 LYS H H 39 7.524 7.524 7.473 0.051 25061 12305 1 18 . 1 1 40 40 VAL N N 40 117.199 117.199 118.553 -1.354 25061 12306 1 18 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.659 -0.431 25061 12307 1 18 . 1 1 40 40 VAL C C 40 177.362 177.362 177.864 -0.502 25061 12308 1 18 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.021 1.621 25061 12309 1 18 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.540 -0.637 25061 12310 1 18 . 1 1 40 40 VAL H H 40 7.883 7.883 7.425 0.458 25061 12311 1 18 . 1 1 41 41 LYS N N 41 117.677 117.677 120.141 -2.464 25061 12312 1 18 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.738 -0.296 25061 12313 1 18 . 1 1 41 41 LYS C C 41 177.686 177.686 178.743 -1.057 25061 12314 1 18 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.899 0.910 25061 12315 1 18 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.511 0.104 25061 12316 1 18 . 1 1 41 41 LYS H H 41 7.567 7.567 7.440 0.127 25061 12317 1 18 . 1 1 42 42 GLU N N 42 118.369 118.369 118.733 -0.364 25061 12318 1 18 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.018 -0.011 25061 12319 1 18 . 1 1 42 42 GLU C C 42 179.725 179.725 178.849 0.876 25061 12320 1 18 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.309 -0.241 25061 12321 1 18 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.426 0.113 25061 12322 1 18 . 1 1 42 42 GLU H H 42 7.634 7.634 7.731 -0.097 25061 12323 1 18 . 1 1 43 43 GLU N N 43 117.906 117.906 119.477 -1.571 25061 12324 1 18 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.114 0.069 25061 12325 1 18 . 1 1 43 43 GLU C C 43 179.757 179.757 179.194 0.563 25061 12326 1 18 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.687 -0.321 25061 12327 1 18 . 1 1 43 43 GLU CB C 43 28.841 28.841 28.987 -0.146 25061 12328 1 18 . 1 1 43 43 GLU H H 43 8.162 8.162 7.976 0.186 25061 12329 1 18 . 1 1 44 44 ILE N N 44 122.291 122.291 120.420 1.871 25061 12330 1 18 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.648 -0.036 25061 12331 1 18 . 1 1 44 44 ILE C C 44 177.101 177.101 177.837 -0.736 25061 12332 1 18 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.882 0.473 25061 12333 1 18 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.866 -0.406 25061 12334 1 18 . 1 1 44 44 ILE H H 44 8.742 8.742 8.005 0.737 25061 12335 1 18 . 1 1 45 45 GLU N N 45 119.892 119.892 120.880 -0.988 25061 12336 1 18 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.061 -0.003 25061 12337 1 18 . 1 1 45 45 GLU C C 45 178.991 178.991 178.914 0.077 25061 12338 1 18 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.650 0.015 25061 12339 1 18 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.610 -0.449 25061 12340 1 18 . 1 1 45 45 GLU H H 45 8.171 8.171 7.986 0.185 25061 12341 1 18 . 1 1 46 46 LYS N N 46 118.064 118.064 119.052 -0.988 25061 12342 1 18 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.059 -0.077 25061 12343 1 18 . 1 1 46 46 LYS C C 46 178.837 178.837 179.008 -0.171 25061 12344 1 18 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.152 0.589 25061 12345 1 18 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.316 0.127 25061 12346 1 18 . 1 1 46 46 LYS H H 46 7.785 7.785 8.007 -0.222 25061 12347 1 18 . 1 1 47 47 ALA N N 47 121.817 121.817 122.466 -0.649 25061 12348 1 18 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.046 -0.015 25061 12349 1 18 . 1 1 47 47 ALA C C 47 179.859 179.859 179.212 0.647 25061 12350 1 18 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.387 -0.092 25061 12351 1 18 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.547 -0.891 25061 12352 1 18 . 1 1 47 47 ALA H H 47 8.123 8.123 7.952 0.171 25061 12353 1 18 . 1 1 48 48 ARG N N 48 119.080 119.080 116.923 2.157 25061 12354 1 18 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.097 -0.008 25061 12355 1 18 . 1 1 48 48 ARG C C 48 180.155 180.155 178.642 1.513 25061 12356 1 18 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.538 0.659 25061 12357 1 18 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.886 -0.376 25061 12358 1 18 . 1 1 48 48 ARG H H 48 8.768 8.768 8.115 0.653 25061 12359 1 18 . 1 1 49 49 LYS N N 49 119.951 119.951 119.962 -0.011 25061 12360 1 18 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.139 -0.100 25061 12361 1 18 . 1 1 49 49 LYS C C 49 178.288 178.288 178.459 -0.171 25061 12362 1 18 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.597 0.240 25061 12363 1 18 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.367 -0.224 25061 12364 1 18 . 1 1 49 49 LYS H H 49 8.037 8.037 7.835 0.202 25061 12365 1 18 . 1 1 50 50 GLN N N 50 115.284 115.284 115.352 -0.068 25061 12366 1 18 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.300 0.042 25061 12367 1 18 . 1 1 50 50 GLN C C 50 176.180 176.180 176.887 -0.707 25061 12368 1 18 . 1 1 50 50 GLN CA C 50 55.741 55.741 55.683 0.058 25061 12369 1 18 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.345 0.220 25061 12370 1 18 . 1 1 50 50 GLN H H 50 7.740 7.740 7.736 0.004 25061 12371 1 18 . 1 1 51 51 GLY N N 51 109.725 109.725 106.934 2.791 25061 12372 1 18 . 1 1 51 51 GLY C C 51 174.552 174.552 173.898 0.654 25061 12373 1 18 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.562 0.801 25061 12374 1 18 . 1 1 51 51 GLY H H 51 8.027 8.027 7.794 0.233 25061 12375 1 18 . 1 1 52 52 ARG N N 52 119.064 119.064 119.679 -0.615 25061 12376 1 18 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.780 0.117 25061 12377 1 18 . 1 1 52 52 ARG C C 52 173.123 173.123 173.687 -0.564 25061 12378 1 18 . 1 1 52 52 ARG CA C 52 52.247 52.247 52.294 -0.047 25061 12379 1 18 . 1 1 52 52 ARG CB C 52 32.366 32.366 32.553 -0.187 25061 12380 1 18 . 1 1 52 52 ARG H H 52 7.969 7.969 8.028 -0.059 25061 12381 1 18 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.579 0.276 25061 12382 1 18 . 1 1 53 53 PRO C C 53 174.069 174.069 175.574 -1.505 25061 12383 1 18 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.609 -0.791 25061 12384 1 18 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.598 -0.538 25061 12385 1 18 . 1 1 54 54 ILE N N 54 116.301 116.301 120.682 -4.381 25061 12386 1 18 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.670 0.568 25061 12387 1 18 . 1 1 54 54 ILE C C 54 171.709 171.709 174.024 -2.315 25061 12388 1 18 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.365 -1.591 25061 12389 1 18 . 1 1 54 54 ILE CB C 54 41.558 41.558 41.413 0.145 25061 12390 1 18 . 1 1 54 54 ILE H H 54 7.920 7.920 7.699 0.221 25061 12391 1 18 . 1 1 55 55 VAL N N 55 126.302 126.302 129.837 -3.535 25061 12392 1 18 . 1 1 55 55 VAL HA H 55 4.924 4.924 4.968 -0.044 25061 12393 1 18 . 1 1 55 55 VAL C C 55 173.624 173.624 175.224 -1.600 25061 12394 1 18 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.766 -0.971 25061 12395 1 18 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.166 0.662 25061 12396 1 18 . 1 1 55 55 VAL H H 55 8.652 8.652 8.796 -0.144 25061 12397 1 18 . 1 1 56 56 ILE N N 56 127.503 127.503 128.500 -0.997 25061 12398 1 18 . 1 1 56 56 ILE HA H 56 4.664 4.664 4.952 -0.288 25061 12399 1 18 . 1 1 56 56 ILE C C 56 173.479 173.479 175.526 -2.047 25061 12400 1 18 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.317 0.690 25061 12401 1 18 . 1 1 56 56 ILE CB C 56 40.285 40.285 37.408 2.877 25061 12402 1 18 . 1 1 56 56 ILE H H 56 9.124 9.124 8.430 0.694 25061 12403 1 18 . 1 1 57 57 PHE N N 57 125.302 125.302 128.786 -3.484 25061 12404 1 18 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.212 0.004 25061 12405 1 18 . 1 1 57 57 PHE C C 57 174.536 174.536 175.966 -1.430 25061 12406 1 18 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.541 -0.580 25061 12407 1 18 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.478 0.951 25061 12408 1 18 . 1 1 57 57 PHE H H 57 8.971 8.971 8.588 0.383 25061 12409 1 18 . 1 1 58 58 ILE N N 58 126.472 126.472 117.181 9.291 25061 12410 1 18 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.829 -0.314 25061 12411 1 18 . 1 1 58 58 ILE C C 58 173.391 173.391 173.928 -0.537 25061 12412 1 18 . 1 1 58 58 ILE CA C 58 59.090 59.090 58.793 0.297 25061 12413 1 18 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.304 -0.562 25061 12414 1 18 . 1 1 58 58 ILE H H 58 9.248 9.248 8.595 0.653 25061 12415 1 18 . 1 1 59 59 ARG N N 59 124.681 124.681 122.533 2.148 25061 12416 1 18 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.020 -0.091 25061 12417 1 18 . 1 1 59 59 ARG C C 59 178.521 178.521 178.191 0.330 25061 12418 1 18 . 1 1 59 59 ARG CA C 59 55.742 55.742 55.581 0.161 25061 12419 1 18 . 1 1 59 59 ARG CB C 59 30.918 30.918 32.264 -1.347 25061 12420 1 18 . 1 1 59 59 ARG H H 59 8.587 8.587 8.834 -0.247 25061 12421 1 18 . 1 1 60 60 GLY N N 60 108.848 108.848 108.606 0.242 25061 12422 1 18 . 1 1 60 60 GLY C C 60 174.775 174.775 175.058 -0.283 25061 12423 1 18 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.452 -0.485 25061 12424 1 18 . 1 1 60 60 GLY H H 60 7.732 7.732 8.344 -0.612 25061 12425 1 18 . 1 1 61 61 ALA N N 61 120.877 120.877 124.033 -3.156 25061 12426 1 18 . 1 1 61 61 ALA HA H 61 4.144 4.144 3.986 0.158 25061 12427 1 18 . 1 1 61 61 ALA C C 61 177.769 177.769 179.788 -2.019 25061 12428 1 18 . 1 1 61 61 ALA CA C 61 53.449 53.449 54.210 -0.761 25061 12429 1 18 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.181 0.190 25061 12430 1 18 . 1 1 61 61 ALA H H 61 7.852 7.852 7.881 -0.029 25061 12431 1 18 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.290 0.510 25061 12432 1 18 . 1 1 62 62 TYR CA C 62 63.039 63.039 59.616 3.423 25061 12433 1 18 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.647 -0.207 25061 12434 1 18 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.941 -0.256 25061 12435 1 18 . 1 1 63 63 GLU C C 63 176.251 176.251 178.081 -1.830 25061 12436 1 18 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.270 -0.012 25061 12437 1 18 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.215 0.197 25061 12438 1 18 . 1 1 64 64 GLU N N 64 119.209 119.209 118.407 0.802 25061 12439 1 18 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.812 0.089 25061 12440 1 18 . 1 1 64 64 GLU C C 64 178.251 178.251 179.292 -1.041 25061 12441 1 18 . 1 1 64 64 GLU CA C 64 59.212 59.212 59.011 0.201 25061 12442 1 18 . 1 1 64 64 GLU CB C 64 28.645 28.645 29.407 -0.762 25061 12443 1 18 . 1 1 64 64 GLU H H 64 8.878 8.878 7.497 1.381 25061 12444 1 18 . 1 1 65 65 VAL N N 65 116.728 116.728 119.166 -2.438 25061 12445 1 18 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.835 0.147 25061 12446 1 18 . 1 1 65 65 VAL C C 65 176.915 176.915 177.595 -0.680 25061 12447 1 18 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.781 -1.172 25061 12448 1 18 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.733 0.162 25061 12449 1 18 . 1 1 65 65 VAL H H 65 7.652 7.652 7.747 -0.095 25061 12450 1 18 . 1 1 66 66 VAL N N 66 119.462 119.462 119.707 -0.245 25061 12451 1 18 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.630 -0.316 25061 12452 1 18 . 1 1 66 66 VAL C C 66 177.142 177.142 177.253 -0.111 25061 12453 1 18 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.939 0.396 25061 12454 1 18 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.562 -0.132 25061 12455 1 18 . 1 1 66 66 VAL H H 66 7.896 7.896 7.656 0.240 25061 12456 1 18 . 1 1 67 67 ARG HA H 67 3.628 3.628 3.914 -0.286 25061 12457 1 18 . 1 1 67 67 ARG C C 67 177.841 177.841 178.197 -0.356 25061 12458 1 18 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.729 0.323 25061 12459 1 18 . 1 1 67 67 ARG CB C 67 29.393 29.393 29.964 -0.571 25061 12460 1 18 . 1 1 68 68 ASP N N 68 118.316 118.316 118.808 -0.492 25061 12461 1 18 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.522 -0.161 25061 12462 1 18 . 1 1 68 68 ASP C C 68 178.945 178.945 178.613 0.332 25061 12463 1 18 . 1 1 68 68 ASP CA C 68 57.311 57.311 57.073 0.238 25061 12464 1 18 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.988 0.526 25061 12465 1 18 . 1 1 68 68 ASP H H 68 7.625 7.625 7.813 -0.188 25061 12466 1 18 . 1 1 69 69 ILE N N 69 119.231 119.231 120.104 -0.873 25061 12467 1 18 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.741 -0.111 25061 12468 1 18 . 1 1 69 69 ILE C C 69 177.138 177.138 177.824 -0.686 25061 12469 1 18 . 1 1 69 69 ILE CA C 69 64.540 64.540 64.781 -0.241 25061 12470 1 18 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.883 -0.833 25061 12471 1 18 . 1 1 69 69 ILE H H 69 8.113 8.113 7.636 0.477 25061 12472 1 18 . 1 1 70 70 VAL N N 70 120.164 120.164 119.921 0.243 25061 12473 1 18 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.605 -0.188 25061 12474 1 18 . 1 1 70 70 VAL C C 70 177.079 177.079 177.805 -0.726 25061 12475 1 18 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.157 0.117 25061 12476 1 18 . 1 1 70 70 VAL CB C 70 31.258 31.258 30.857 0.401 25061 12477 1 18 . 1 1 70 70 VAL H H 70 8.478 8.478 8.502 -0.024 25061 12478 1 18 . 1 1 71 71 GLU N N 71 118.293 118.293 119.940 -1.647 25061 12479 1 18 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.905 0.149 25061 12480 1 18 . 1 1 71 71 GLU C C 71 179.009 179.009 178.478 0.531 25061 12481 1 18 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.761 -0.345 25061 12482 1 18 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.410 -0.588 25061 12483 1 18 . 1 1 71 71 GLU H H 71 8.152 8.152 8.056 0.096 25061 12484 1 18 . 1 1 72 72 TYR N N 72 120.091 120.091 120.115 -0.024 25061 12485 1 18 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.117 0.045 25061 12486 1 18 . 1 1 72 72 TYR C C 72 176.404 176.404 177.104 -0.700 25061 12487 1 18 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.682 -0.550 25061 12488 1 18 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.318 -0.181 25061 12489 1 18 . 1 1 72 72 TYR H H 72 7.959 7.959 7.602 0.357 25061 12490 1 18 . 1 1 73 73 ALA N N 73 120.133 120.133 120.152 -0.019 25061 12491 1 18 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.839 -0.209 25061 12492 1 18 . 1 1 73 73 ALA C C 73 179.182 179.182 179.488 -0.306 25061 12493 1 18 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.095 0.017 25061 12494 1 18 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.279 -0.088 25061 12495 1 18 . 1 1 73 73 ALA H H 73 8.604 8.604 7.936 0.668 25061 12496 1 18 . 1 1 74 74 GLN N N 74 115.553 115.553 117.449 -1.896 25061 12497 1 18 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.987 0.151 25061 12498 1 18 . 1 1 74 74 GLN C C 74 180.595 180.595 178.666 1.929 25061 12499 1 18 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.511 0.584 25061 12500 1 18 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.766 -0.191 25061 12501 1 18 . 1 1 74 74 GLN H H 74 8.619 8.619 8.167 0.452 25061 12502 1 18 . 1 1 75 75 LYS N N 75 122.396 122.396 118.840 3.556 25061 12503 1 18 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.054 -0.026 25061 12504 1 18 . 1 1 75 75 LYS C C 75 178.521 178.521 178.673 -0.152 25061 12505 1 18 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.121 0.937 25061 12506 1 18 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.834 -0.235 25061 12507 1 18 . 1 1 75 75 LYS H H 75 8.123 8.123 7.588 0.535 25061 12508 1 18 . 1 1 76 76 GLU N N 76 116.294 116.294 116.149 0.145 25061 12509 1 18 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.130 -0.031 25061 12510 1 18 . 1 1 76 76 GLU C C 76 175.957 175.957 177.224 -1.267 25061 12511 1 18 . 1 1 76 76 GLU CA C 76 55.605 55.605 56.609 -1.004 25061 12512 1 18 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.912 -0.088 25061 12513 1 18 . 1 1 76 76 GLU H H 76 7.450 7.450 7.867 -0.417 25061 12514 1 18 . 1 1 77 77 GLY N N 77 107.446 107.446 107.793 -0.347 25061 12515 1 18 . 1 1 77 77 GLY C C 77 174.520 174.520 174.193 0.327 25061 12516 1 18 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.312 0.495 25061 12517 1 18 . 1 1 77 77 GLY H H 77 7.763 7.763 7.636 0.127 25061 12518 1 18 . 1 1 78 78 LEU N N 78 120.179 120.179 118.876 1.303 25061 12519 1 18 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.584 -0.196 25061 12520 1 18 . 1 1 78 78 LEU C C 78 175.914 175.914 176.199 -0.285 25061 12521 1 18 . 1 1 78 78 LEU CA C 78 53.472 53.472 52.993 0.479 25061 12522 1 18 . 1 1 78 78 LEU CB C 78 41.889 41.889 43.932 -2.043 25061 12523 1 18 . 1 1 78 78 LEU H H 78 7.930 7.930 8.105 -0.175 25061 12524 1 18 . 1 1 79 79 ARG N N 79 122.207 122.207 121.024 1.183 25061 12525 1 18 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.379 0.018 25061 12526 1 18 . 1 1 79 79 ARG C C 79 174.960 174.960 175.308 -0.348 25061 12527 1 18 . 1 1 79 79 ARG CA C 79 55.648 55.648 54.588 1.060 25061 12528 1 18 . 1 1 79 79 ARG CB C 79 30.476 30.476 30.710 -0.234 25061 12529 1 18 . 1 1 79 79 ARG H H 79 8.241 8.241 8.212 0.029 25061 12530 1 18 . 1 1 80 80 VAL N N 80 123.333 123.333 123.855 -0.522 25061 12531 1 18 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.301 0.994 25061 12532 1 18 . 1 1 80 80 VAL C C 80 174.048 174.048 174.025 0.023 25061 12533 1 18 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.689 -1.648 25061 12534 1 18 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.939 1.366 25061 12535 1 18 . 1 1 80 80 VAL H H 80 8.359 8.359 8.644 -0.285 25061 12536 1 18 . 1 1 81 81 LEU N N 81 128.719 128.719 130.303 -1.584 25061 12537 1 18 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.330 -0.226 25061 12538 1 18 . 1 1 81 81 LEU C C 81 174.484 174.484 174.657 -0.173 25061 12539 1 18 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.532 0.588 25061 12540 1 18 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.558 -0.603 25061 12541 1 18 . 1 1 81 81 LEU H H 81 8.650 8.650 8.891 -0.241 25061 12542 1 18 . 1 1 82 82 VAL N N 82 122.487 122.487 122.642 -0.155 25061 12543 1 18 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.784 0.313 25061 12544 1 18 . 1 1 82 82 VAL C C 82 174.525 174.525 174.868 -0.343 25061 12545 1 18 . 1 1 82 82 VAL CA C 82 60.285 60.285 60.291 -0.006 25061 12546 1 18 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.650 2.139 25061 12547 1 18 . 1 1 82 82 VAL H H 82 8.781 8.781 8.621 0.160 25061 12548 1 18 . 1 1 83 83 ILE N N 83 128.082 128.082 128.860 -0.778 25061 12549 1 18 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.736 0.194 25061 12550 1 18 . 1 1 83 83 ILE C C 83 172.925 172.925 175.394 -2.469 25061 12551 1 18 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.574 -0.633 25061 12552 1 18 . 1 1 83 83 ILE CB C 83 40.186 40.186 37.790 2.396 25061 12553 1 18 . 1 1 83 83 ILE H H 83 9.527 9.527 8.621 0.906 25061 12554 1 18 . 1 1 84 84 LYS N N 84 128.493 128.493 128.206 0.287 25061 12555 1 18 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.081 -0.033 25061 12556 1 18 . 1 1 84 84 LYS C C 84 174.027 174.027 175.992 -1.965 25061 12557 1 18 . 1 1 84 84 LYS CA C 84 53.253 53.253 54.643 -1.390 25061 12558 1 18 . 1 1 84 84 LYS CB C 84 34.652 34.652 35.531 -0.879 25061 12559 1 18 . 1 1 84 84 LYS H H 84 8.721 8.721 8.655 0.066 25061 12560 1 18 . 1 1 85 85 VAL N N 85 126.729 126.729 124.906 1.823 25061 12561 1 18 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.135 0.601 25061 12562 1 18 . 1 1 85 85 VAL C C 85 175.935 175.935 175.597 0.338 25061 12563 1 18 . 1 1 85 85 VAL CA C 85 60.200 60.200 61.211 -1.011 25061 12564 1 18 . 1 1 85 85 VAL CB C 85 30.847 30.847 30.467 0.380 25061 12565 1 18 . 1 1 85 85 VAL H H 85 8.643 8.643 8.011 0.632 25061 12566 1 18 . 1 1 86 86 ALA N N 86 132.930 132.930 131.138 1.792 25061 12567 1 18 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.484 -0.054 25061 12568 1 18 . 1 1 86 86 ALA C C 86 175.635 175.635 176.606 -0.971 25061 12569 1 18 . 1 1 86 86 ALA CA C 86 51.504 51.504 51.822 -0.318 25061 12570 1 18 . 1 1 86 86 ALA CB C 86 20.821 20.821 20.394 0.427 25061 12571 1 18 . 1 1 86 86 ALA H H 86 8.835 8.835 7.982 0.853 25061 12572 1 18 . 1 1 87 87 GLN N N 87 118.719 118.719 121.890 -3.171 25061 12573 1 18 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.405 0.064 25061 12574 1 18 . 1 1 87 87 GLN C C 87 175.949 175.949 174.976 0.973 25061 12575 1 18 . 1 1 87 87 GLN CA C 87 55.260 55.260 55.156 0.104 25061 12576 1 18 . 1 1 87 87 GLN CB C 87 30.432 30.432 29.168 1.264 25061 12577 1 18 . 1 1 87 87 GLN H H 87 8.570 8.570 8.515 0.055 25061 12578 1 18 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.141 0.339 25061 12579 1 18 . 1 1 88 88 ASP CA C 88 55.454 55.454 57.144 -1.690 25061 12580 1 18 . 1 1 88 88 ASP CB C 88 41.204 41.204 40.170 1.034 25061 12581 1 18 . 1 1 89 89 GLN HA H 89 4.047 4.047 3.971 0.076 25061 12582 1 18 . 1 1 89 89 GLN CA C 89 56.687 56.687 56.089 0.598 25061 12583 1 18 . 1 1 89 89 GLN CB C 89 27.850 27.850 27.488 0.362 25061 12584 1 18 . 1 1 92 92 LEU N N 92 125.291 125.291 120.508 4.783 25061 12585 1 18 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.052 0.149 25061 12586 1 18 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.821 -2.764 25061 12587 1 18 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.816 0.230 25061 12588 1 18 . 1 1 92 92 LEU H H 92 8.277 8.277 7.457 0.820 25061 12589 1 18 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.360 0.396 25061 12590 1 18 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.166 -0.117 25061 12591 1 18 . 1 1 94 94 ARG C C 94 178.544 178.544 178.302 0.242 25061 12592 1 18 . 1 1 94 94 ARG CA C 94 58.607 58.607 58.465 0.142 25061 12593 1 18 . 1 1 94 94 ARG CB C 94 29.614 29.614 29.884 -0.270 25061 12594 1 18 . 1 1 95 95 PHE N N 95 117.407 117.407 120.387 -2.980 25061 12595 1 18 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.366 0.009 25061 12596 1 18 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.990 -0.759 25061 12597 1 18 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.123 -1.181 25061 12598 1 18 . 1 1 95 95 PHE H H 95 8.419 8.419 7.638 0.781 25061 12599 1 18 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.927 -0.119 25061 12600 1 18 . 1 1 96 96 TYR C C 96 177.728 177.728 177.299 0.429 25061 12601 1 18 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.666 1.490 25061 12602 1 18 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.366 -0.666 25061 12603 1 18 . 1 1 97 97 GLU N N 97 119.054 119.054 117.921 1.133 25061 12604 1 18 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.748 0.315 25061 12605 1 18 . 1 1 97 97 GLU C C 97 179.071 179.071 178.812 0.259 25061 12606 1 18 . 1 1 97 97 GLU CA C 97 58.760 58.760 58.884 -0.124 25061 12607 1 18 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.453 -0.281 25061 12608 1 18 . 1 1 97 97 GLU H H 97 7.858 7.858 7.630 0.228 25061 12609 1 18 . 1 1 98 98 GLN N N 98 119.385 119.385 118.732 0.653 25061 12610 1 18 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.937 -0.036 25061 12611 1 18 . 1 1 98 98 GLN C C 98 177.599 177.599 178.781 -1.182 25061 12612 1 18 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.660 -0.349 25061 12613 1 18 . 1 1 98 98 GLN CB C 98 27.766 27.766 28.221 -0.455 25061 12614 1 18 . 1 1 98 98 GLN H H 98 7.747 7.747 7.514 0.233 25061 12615 1 18 . 1 1 99 99 LEU N N 99 118.348 118.348 117.921 0.427 25061 12616 1 18 . 1 1 99 99 LEU HA H 99 4.019 4.019 4.023 -0.004 25061 12617 1 18 . 1 1 99 99 LEU C C 99 178.669 178.669 178.520 0.149 25061 12618 1 18 . 1 1 99 99 LEU CA C 99 57.430 57.430 57.721 -0.291 25061 12619 1 18 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.043 0.460 25061 12620 1 18 . 1 1 99 99 LEU H H 99 7.891 7.891 7.409 0.482 25061 12621 1 18 . 1 1 100 100 LYS N N 100 118.332 118.332 117.672 0.660 25061 12622 1 18 . 1 1 100 100 LYS HA H 100 4.509 4.509 3.958 0.551 25061 12623 1 18 . 1 1 100 100 LYS C C 100 180.846 180.846 178.956 1.890 25061 12624 1 18 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.236 0.852 25061 12625 1 18 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.932 0.337 25061 12626 1 18 . 1 1 100 100 LYS H H 100 7.560 7.560 7.329 0.231 25061 12627 1 18 . 1 1 101 101 LYS N N 101 121.944 121.944 119.331 2.613 25061 12628 1 18 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.108 -0.036 25061 12629 1 18 . 1 1 101 101 LYS C C 101 177.707 177.707 178.405 -0.698 25061 12630 1 18 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.185 0.686 25061 12631 1 18 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.160 -0.065 25061 12632 1 18 . 1 1 101 101 LYS H H 101 7.959 7.959 7.459 0.500 25061 12633 1 18 . 1 1 102 102 ASP N N 102 118.788 118.788 116.848 1.940 25061 12634 1 18 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.513 0.181 25061 12635 1 18 . 1 1 102 102 ASP C C 102 176.359 176.359 176.961 -0.602 25061 12636 1 18 . 1 1 102 102 ASP CA C 102 54.579 54.579 54.971 -0.392 25061 12637 1 18 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.120 -0.546 25061 12638 1 18 . 1 1 102 102 ASP H H 102 7.893 7.893 7.585 0.308 25061 12639 1 18 . 1 1 103 103 GLY N N 103 107.024 107.024 105.811 1.213 25061 12640 1 18 . 1 1 103 103 GLY C C 103 174.328 174.328 174.652 -0.324 25061 12641 1 18 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.895 0.450 25061 12642 1 18 . 1 1 103 103 GLY H H 103 7.866 7.866 7.468 0.398 25061 12643 1 18 . 1 1 104 104 VAL N N 104 123.060 123.060 120.676 2.384 25061 12644 1 18 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.820 0.153 25061 12645 1 18 . 1 1 104 104 VAL C C 104 175.023 175.023 175.105 -0.082 25061 12646 1 18 . 1 1 104 104 VAL CA C 104 61.878 61.878 63.649 -1.771 25061 12647 1 18 . 1 1 104 104 VAL CB C 104 32.088 32.088 31.715 0.373 25061 12648 1 18 . 1 1 104 104 VAL H H 104 7.955 7.955 7.657 0.298 25061 12649 1 18 . 1 1 105 105 ASP N N 105 127.987 127.987 126.572 1.415 25061 12650 1 18 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.775 -0.200 25061 12651 1 18 . 1 1 105 105 ASP C C 105 173.624 173.624 174.678 -1.054 25061 12652 1 18 . 1 1 105 105 ASP CA C 105 54.087 54.087 53.319 0.768 25061 12653 1 18 . 1 1 105 105 ASP CB C 105 40.660 40.660 43.018 -2.358 25061 12654 1 18 . 1 1 105 105 ASP H H 105 8.399 8.399 8.234 0.165 25061 12655 1 18 . 1 1 106 106 VAL N N 106 125.798 125.798 122.240 3.558 25061 12656 1 18 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.875 -0.060 25061 12657 1 18 . 1 1 106 106 VAL C C 106 174.902 174.902 175.350 -0.448 25061 12658 1 18 . 1 1 106 106 VAL CA C 106 60.194 60.194 60.452 -0.258 25061 12659 1 18 . 1 1 106 106 VAL CB C 106 34.179 34.179 35.005 -0.826 25061 12660 1 18 . 1 1 106 106 VAL H H 106 7.550 7.550 8.531 -0.981 25061 12661 1 18 . 1 1 107 107 ARG N N 107 128.099 128.099 127.611 0.488 25061 12662 1 18 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.792 0.084 25061 12663 1 18 . 1 1 107 107 ARG C C 107 173.815 173.815 174.787 -0.972 25061 12664 1 18 . 1 1 107 107 ARG CA C 107 53.386 53.386 53.165 0.221 25061 12665 1 18 . 1 1 107 107 ARG CB C 107 31.195 31.195 30.105 1.090 25061 12666 1 18 . 1 1 107 107 ARG H H 107 9.132 9.132 8.766 0.366 25061 12667 1 18 . 1 1 108 108 VAL N N 108 123.979 123.979 122.601 1.378 25061 12668 1 18 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.274 -0.332 25061 12669 1 18 . 1 1 108 108 VAL C C 108 175.854 175.854 176.894 -1.040 25061 12670 1 18 . 1 1 108 108 VAL CA C 108 60.017 60.017 60.303 -0.286 25061 12671 1 18 . 1 1 108 108 VAL CB C 108 32.844 32.844 33.272 -0.427 25061 12672 1 18 . 1 1 108 108 VAL H H 108 8.561 8.561 8.595 -0.034 25061 12673 1 18 . 1 1 109 109 THR N N 109 120.144 120.144 116.630 3.514 25061 12674 1 18 . 1 1 109 109 THR HA H 109 4.815 4.815 4.382 0.433 25061 12675 1 18 . 1 1 109 109 THR C C 109 171.867 171.867 175.472 -3.605 25061 12676 1 18 . 1 1 109 109 THR CA C 109 59.613 59.613 61.454 -1.841 25061 12677 1 18 . 1 1 109 109 THR CB C 109 69.720 69.720 69.727 -0.007 25061 12678 1 18 . 1 1 109 109 THR H H 109 8.803 8.803 8.412 0.391 25061 12679 1 18 . 1 1 110 110 ASP N N 110 123.212 123.212 120.431 2.781 25061 12680 1 18 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.286 0.683 25061 12681 1 18 . 1 1 110 110 ASP C C 110 175.739 175.739 174.042 1.697 25061 12682 1 18 . 1 1 110 110 ASP CA C 110 53.243 53.243 55.813 -2.570 25061 12683 1 18 . 1 1 110 110 ASP CB C 110 41.351 41.351 40.086 1.265 25061 12684 1 18 . 1 1 110 110 ASP H H 110 8.363 8.363 8.820 -0.457 25061 12685 1 18 . 1 1 111 111 ASN N N 111 116.298 116.298 115.026 1.272 25061 12686 1 18 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.805 0.071 25061 12687 1 18 . 1 1 111 111 ASN C C 111 174.756 174.756 174.659 0.097 25061 12688 1 18 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.812 -0.680 25061 12689 1 18 . 1 1 111 111 ASN CB C 111 40.765 40.765 40.148 0.617 25061 12690 1 18 . 1 1 111 111 ASN H H 111 8.085 8.085 7.440 0.645 25061 12691 1 18 . 1 1 112 112 GLU HA H 112 3.848 3.848 3.972 -0.124 25061 12692 1 18 . 1 1 112 112 GLU C C 112 177.016 177.016 177.198 -0.182 25061 12693 1 18 . 1 1 112 112 GLU CA C 112 59.480 59.480 59.396 0.084 25061 12694 1 18 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.290 0.384 25061 12695 1 18 . 1 1 113 113 ASP N N 113 121.033 121.033 120.361 0.672 25061 12696 1 18 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.391 0.022 25061 12697 1 18 . 1 1 113 113 ASP C C 113 178.988 178.988 178.073 0.915 25061 12698 1 18 . 1 1 113 113 ASP CA C 113 57.855 57.855 57.858 -0.003 25061 12699 1 18 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.449 0.053 25061 12700 1 18 . 1 1 113 113 ASP H H 113 8.219 8.219 8.483 -0.264 25061 12701 1 18 . 1 1 114 114 GLU N N 114 121.280 121.280 119.769 1.511 25061 12702 1 18 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.136 -0.071 25061 12703 1 18 . 1 1 114 114 GLU C C 114 178.776 178.776 178.317 0.459 25061 12704 1 18 . 1 1 114 114 GLU CA C 114 58.714 58.714 59.172 -0.459 25061 12705 1 18 . 1 1 114 114 GLU CB C 114 29.213 29.213 28.938 0.275 25061 12706 1 18 . 1 1 114 114 GLU H H 114 8.296 8.296 8.419 -0.123 25061 12707 1 18 . 1 1 115 115 ALA N N 115 120.924 120.924 123.019 -2.095 25061 12708 1 18 . 1 1 115 115 ALA HA H 115 3.838 3.838 3.977 -0.139 25061 12709 1 18 . 1 1 115 115 ALA C C 115 178.502 178.502 178.898 -0.396 25061 12710 1 18 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.581 0.057 25061 12711 1 18 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.349 0.148 25061 12712 1 18 . 1 1 115 115 ALA H H 115 7.853 7.853 8.095 -0.242 25061 12713 1 18 . 1 1 116 116 LYS N N 116 116.616 116.616 118.546 -1.930 25061 12714 1 18 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.974 -0.255 25061 12715 1 18 . 1 1 116 116 LYS C C 116 178.097 178.097 179.044 -0.947 25061 12716 1 18 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.578 1.174 25061 12717 1 18 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.277 0.278 25061 12718 1 18 . 1 1 116 116 LYS H H 116 8.091 8.091 8.030 0.061 25061 12719 1 18 . 1 1 117 117 LYS N N 117 118.990 118.990 117.856 1.134 25061 12720 1 18 . 1 1 117 117 LYS HA H 117 3.911 3.911 4.074 -0.163 25061 12721 1 18 . 1 1 117 117 LYS C C 117 179.186 179.186 179.071 0.115 25061 12722 1 18 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.389 0.182 25061 12723 1 18 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.424 0.096 25061 12724 1 18 . 1 1 117 117 LYS H H 117 7.742 7.742 7.751 -0.009 25061 12725 1 18 . 1 1 118 118 ARG N N 118 117.441 117.441 120.563 -3.122 25061 12726 1 18 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.116 0.024 25061 12727 1 18 . 1 1 118 118 ARG C C 118 178.921 178.921 178.656 0.265 25061 12728 1 18 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.865 -1.194 25061 12729 1 18 . 1 1 118 118 ARG CB C 118 29.661 29.661 30.025 -0.364 25061 12730 1 18 . 1 1 118 118 ARG H H 118 8.468 8.468 7.855 0.613 25061 12731 1 18 . 1 1 119 119 LEU N N 119 120.100 120.100 120.309 -0.209 25061 12732 1 18 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.908 0.052 25061 12733 1 18 . 1 1 119 119 LEU C C 119 177.554 177.554 178.701 -1.147 25061 12734 1 18 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.502 -0.621 25061 12735 1 18 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.440 0.449 25061 12736 1 18 . 1 1 119 119 LEU H H 119 8.322 8.322 8.403 -0.081 25061 12737 1 18 . 1 1 120 120 LYS N N 120 118.238 118.238 118.963 -0.725 25061 12738 1 18 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.921 -0.099 25061 12739 1 18 . 1 1 120 120 LYS C C 120 178.703 178.703 178.872 -0.169 25061 12740 1 18 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.637 0.709 25061 12741 1 18 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.043 0.193 25061 12742 1 18 . 1 1 120 120 LYS H H 120 7.990 7.990 7.929 0.061 25061 12743 1 18 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.091 -0.069 25061 12744 1 18 . 1 1 121 121 GLU C C 121 177.769 177.769 179.214 -1.445 25061 12745 1 18 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.097 -0.175 25061 12746 1 18 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.278 0.176 25061 12747 1 18 . 1 1 122 122 LEU N N 122 119.454 119.454 119.261 0.193 25061 12748 1 18 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.096 0.037 25061 12749 1 18 . 1 1 122 122 LEU C C 122 178.991 178.991 179.128 -0.137 25061 12750 1 18 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.046 0.280 25061 12751 1 18 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.929 -0.250 25061 12752 1 18 . 1 1 122 122 LEU H H 122 7.930 7.930 8.037 -0.107 25061 12753 1 18 . 1 1 123 123 LEU N N 123 117.862 117.862 120.155 -2.293 25061 12754 1 18 . 1 1 123 123 LEU HA H 123 4.067 4.067 3.963 0.104 25061 12755 1 18 . 1 1 123 123 LEU C C 123 179.178 179.178 179.775 -0.597 25061 12756 1 18 . 1 1 123 123 LEU CA C 123 56.920 56.920 58.586 -1.666 25061 12757 1 18 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.595 -0.385 25061 12758 1 18 . 1 1 123 123 LEU H H 123 8.095 8.095 7.968 0.127 25061 12759 1 18 . 1 1 124 124 GLU N N 124 118.975 118.975 118.269 0.706 25061 12760 1 18 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.146 -0.017 25061 12761 1 18 . 1 1 124 124 GLU C C 124 177.777 177.777 177.622 0.155 25061 12762 1 18 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.812 -0.725 25061 12763 1 18 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.733 -0.193 25061 12764 1 18 . 1 1 124 124 GLU H H 124 7.930 7.930 8.048 -0.118 25061 12765 1 18 . 1 1 125 125 LYS N N 125 118.933 118.933 117.642 1.291 25061 12766 1 18 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.397 -0.060 25061 12767 1 18 . 1 1 125 125 LYS C C 125 178.188 178.188 175.632 2.556 25061 12768 1 18 . 1 1 125 125 LYS CA C 125 56.980 56.980 55.952 1.028 25061 12769 1 18 . 1 1 125 125 LYS CB C 125 32.608 32.608 32.853 -0.245 25061 12770 1 18 . 1 1 125 125 LYS H H 125 7.729 7.729 7.570 0.159 25061 12771 1 18 . 1 1 126 126 VAL N N 126 117.933 117.933 114.956 2.977 25061 12772 1 18 . 1 1 126 126 VAL HA H 126 4.022 4.022 3.634 0.388 25061 12773 1 18 . 1 1 126 126 VAL C C 126 176.947 176.947 175.478 1.469 25061 12774 1 18 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.895 -0.254 25061 12775 1 18 . 1 1 126 126 VAL CB C 126 31.859 31.859 30.337 1.522 25061 12776 1 18 . 1 1 126 126 VAL H H 126 8.044 8.044 7.614 0.430 25061 12777 1 18 . 1 1 127 127 GLY N N 127 109.813 109.813 104.679 5.134 25061 12778 1 18 . 1 1 127 127 GLY C C 127 174.264 174.264 173.019 1.245 25061 12779 1 18 . 1 1 127 127 GLY CA C 127 45.279 45.279 44.879 0.400 25061 12780 1 18 . 1 1 127 127 GLY H H 127 8.279 8.279 7.831 0.448 25061 12781 1 18 . 1 1 128 128 SER N N 128 115.185 115.185 115.608 -0.423 25061 12782 1 18 . 1 1 128 128 SER HA H 128 4.462 4.462 4.708 -0.246 25061 12783 1 18 . 1 1 128 128 SER C C 128 174.775 174.775 172.760 2.015 25061 12784 1 18 . 1 1 128 128 SER CA C 128 58.739 58.739 57.787 0.952 25061 12785 1 18 . 1 1 128 128 SER CB C 128 63.850 63.850 64.589 -0.739 25061 12786 1 18 . 1 1 128 128 SER H H 128 8.048 8.048 7.986 0.062 25061 12787 1 18 . 1 1 129 129 LEU N N 129 123.060 123.060 123.745 -0.685 25061 12788 1 18 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.598 -0.300 25061 12789 1 18 . 1 1 129 129 LEU C C 129 177.313 177.313 174.693 2.620 25061 12790 1 18 . 1 1 129 129 LEU CA C 129 55.158 55.158 54.199 0.959 25061 12791 1 18 . 1 1 129 129 LEU CB C 129 41.837 41.837 45.971 -4.134 25061 12792 1 18 . 1 1 129 129 LEU H H 129 8.147 8.147 8.154 -0.007 25061 12793 1 18 . 1 1 130 130 GLU N N 130 120.088 120.088 121.620 -1.532 25061 12794 1 18 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.295 -0.114 25061 12795 1 18 . 1 1 130 130 GLU C C 130 176.148 176.148 175.860 0.288 25061 12796 1 18 . 1 1 130 130 GLU CA C 130 56.726 56.726 56.590 0.136 25061 12797 1 18 . 1 1 130 130 GLU CB C 130 30.026 30.026 30.389 -0.363 25061 12798 1 18 . 1 1 130 130 GLU H H 130 8.242 8.242 8.539 -0.297 25061 12799 1 19 . 1 1 2 2 GLY CA C 2 45.319 45.319 45.379 -0.060 25061 12800 1 19 . 1 1 3 3 THR HA H 3 4.820 4.820 4.217 0.603 25061 12801 1 19 . 1 1 3 3 THR C C 3 172.374 172.374 174.972 -2.598 25061 12802 1 19 . 1 1 3 3 THR CA C 3 62.760 62.760 61.471 1.289 25061 12803 1 19 . 1 1 3 3 THR CB C 3 71.441 71.441 69.763 1.678 25061 12804 1 19 . 1 1 4 4 VAL N N 4 126.881 126.881 126.542 0.339 25061 12805 1 19 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.356 0.212 25061 12806 1 19 . 1 1 4 4 VAL C C 4 173.116 173.116 175.023 -1.907 25061 12807 1 19 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.724 -1.270 25061 12808 1 19 . 1 1 4 4 VAL CB C 4 33.800 33.800 30.979 2.821 25061 12809 1 19 . 1 1 4 4 VAL H H 4 9.097 9.097 8.533 0.564 25061 12810 1 19 . 1 1 5 5 VAL N N 5 127.172 127.172 125.517 1.655 25061 12811 1 19 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.299 -0.412 25061 12812 1 19 . 1 1 5 5 VAL C C 5 174.091 174.091 174.896 -0.805 25061 12813 1 19 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.634 0.484 25061 12814 1 19 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.123 -0.188 25061 12815 1 19 . 1 1 5 5 VAL H H 5 8.811 8.811 8.576 0.235 25061 12816 1 19 . 1 1 6 6 ILE N N 6 127.577 127.577 128.448 -0.871 25061 12817 1 19 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.445 0.175 25061 12818 1 19 . 1 1 6 6 ILE C C 6 173.328 173.328 175.369 -2.041 25061 12819 1 19 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.680 0.152 25061 12820 1 19 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.581 1.349 25061 12821 1 19 . 1 1 6 6 ILE H H 6 9.210 9.210 8.136 1.074 25061 12822 1 19 . 1 1 7 7 VAL N N 7 129.024 129.024 128.556 0.468 25061 12823 1 19 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.513 0.292 25061 12824 1 19 . 1 1 7 7 VAL C C 7 173.561 173.561 175.112 -1.551 25061 12825 1 19 . 1 1 7 7 VAL CA C 7 60.849 60.849 62.024 -1.175 25061 12826 1 19 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.689 0.672 25061 12827 1 19 . 1 1 7 7 VAL H H 7 9.294 9.294 8.131 1.163 25061 12828 1 19 . 1 1 8 8 VAL N N 8 125.318 125.318 127.239 -1.921 25061 12829 1 19 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.414 -0.018 25061 12830 1 19 . 1 1 8 8 VAL C C 8 175.723 175.723 175.336 0.387 25061 12831 1 19 . 1 1 8 8 VAL CA C 8 59.617 59.617 59.814 -0.197 25061 12832 1 19 . 1 1 8 8 VAL CB C 8 34.915 34.915 35.448 -0.533 25061 12833 1 19 . 1 1 8 8 VAL H H 8 8.898 8.898 8.813 0.085 25061 12834 1 19 . 1 1 9 9 SER N N 9 116.544 116.544 117.432 -0.888 25061 12835 1 19 . 1 1 9 9 SER HA H 9 4.724 4.724 4.847 -0.123 25061 12836 1 19 . 1 1 9 9 SER C C 9 174.552 174.552 173.703 0.849 25061 12837 1 19 . 1 1 9 9 SER CA C 9 57.419 57.419 57.304 0.115 25061 12838 1 19 . 1 1 9 9 SER CB C 9 64.998 64.998 65.585 -0.587 25061 12839 1 19 . 1 1 9 9 SER H H 9 7.833 7.833 8.252 -0.419 25061 12840 1 19 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.813 0.099 25061 12841 1 19 . 1 1 10 10 ASN C C 10 176.170 176.170 173.846 2.324 25061 12842 1 19 . 1 1 10 10 ASN CA C 10 54.141 54.141 53.437 0.704 25061 12843 1 19 . 1 1 10 10 ASN CB C 10 38.626 38.626 38.781 -0.155 25061 12844 1 19 . 1 1 11 11 ASP N N 11 120.164 120.164 116.875 3.289 25061 12845 1 19 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.815 0.028 25061 12846 1 19 . 1 1 11 11 ASP C C 11 176.148 176.148 175.318 0.830 25061 12847 1 19 . 1 1 11 11 ASP CA C 11 52.620 52.620 53.227 -0.607 25061 12848 1 19 . 1 1 11 11 ASP CB C 11 42.631 42.631 43.604 -0.973 25061 12849 1 19 . 1 1 11 11 ASP H H 11 8.142 8.142 7.301 0.841 25061 12850 1 19 . 1 1 12 12 GLU N N 12 127.184 127.184 122.905 4.279 25061 12851 1 19 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.138 -0.285 25061 12852 1 19 . 1 1 12 12 GLU C C 12 177.853 177.853 178.363 -0.510 25061 12853 1 19 . 1 1 12 12 GLU CA C 12 59.547 59.547 58.980 0.567 25061 12854 1 19 . 1 1 12 12 GLU CB C 12 29.819 29.819 30.132 -0.313 25061 12855 1 19 . 1 1 12 12 GLU H H 12 9.152 9.152 8.859 0.293 25061 12856 1 19 . 1 1 13 13 ARG N N 13 119.026 119.026 119.311 -0.285 25061 12857 1 19 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.354 -0.251 25061 12858 1 19 . 1 1 13 13 ARG C C 13 179.151 179.151 178.955 0.196 25061 12859 1 19 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.708 0.235 25061 12860 1 19 . 1 1 13 13 ARG CB C 13 28.757 28.757 30.245 -1.488 25061 12861 1 19 . 1 1 13 13 ARG H H 13 8.389 8.389 7.962 0.427 25061 12862 1 19 . 1 1 14 14 ILE N N 14 119.238 119.238 120.910 -1.672 25061 12863 1 19 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.755 -0.154 25061 12864 1 19 . 1 1 14 14 ILE C C 14 177.905 177.905 177.658 0.247 25061 12865 1 19 . 1 1 14 14 ILE CA C 14 64.666 64.666 65.263 -0.597 25061 12866 1 19 . 1 1 14 14 ILE CB C 14 36.780 36.780 37.721 -0.941 25061 12867 1 19 . 1 1 14 14 ILE H H 14 7.254 7.254 8.021 -0.767 25061 12868 1 19 . 1 1 15 15 LEU N N 15 117.008 117.008 119.987 -2.979 25061 12869 1 19 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.110 -0.189 25061 12870 1 19 . 1 1 15 15 LEU C C 15 178.062 178.062 179.332 -1.270 25061 12871 1 19 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.454 -0.043 25061 12872 1 19 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.494 -0.325 25061 12873 1 19 . 1 1 15 15 LEU H H 15 7.412 7.412 7.523 -0.111 25061 12874 1 19 . 1 1 16 16 GLU N N 16 117.637 117.637 118.018 -0.381 25061 12875 1 19 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.891 -0.190 25061 12876 1 19 . 1 1 16 16 GLU C C 16 179.182 179.182 179.155 0.027 25061 12877 1 19 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.217 0.200 25061 12878 1 19 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.286 0.173 25061 12879 1 19 . 1 1 16 16 GLU H H 16 7.981 7.981 7.987 -0.006 25061 12880 1 19 . 1 1 17 17 GLU N N 17 119.759 119.759 121.430 -1.671 25061 12881 1 19 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.116 -0.100 25061 12882 1 19 . 1 1 17 17 GLU C C 17 179.949 179.949 178.943 1.006 25061 12883 1 19 . 1 1 17 17 GLU CA C 17 59.195 59.195 58.851 0.344 25061 12884 1 19 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.474 0.066 25061 12885 1 19 . 1 1 17 17 GLU H H 17 8.248 8.248 8.121 0.127 25061 12886 1 19 . 1 1 18 18 LEU N N 18 119.764 119.764 119.862 -0.098 25061 12887 1 19 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.200 -0.119 25061 12888 1 19 . 1 1 18 18 LEU C C 18 177.620 177.620 179.359 -1.739 25061 12889 1 19 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.586 0.092 25061 12890 1 19 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.690 -0.580 25061 12891 1 19 . 1 1 18 18 LEU H H 18 8.486 8.486 8.150 0.336 25061 12892 1 19 . 1 1 19 19 LEU N N 19 123.102 123.102 120.930 2.172 25061 12893 1 19 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.788 -0.126 25061 12894 1 19 . 1 1 19 19 LEU C C 19 178.343 178.343 178.295 0.048 25061 12895 1 19 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.526 0.710 25061 12896 1 19 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.355 -0.704 25061 12897 1 19 . 1 1 19 19 LEU H H 19 7.870 7.870 8.039 -0.169 25061 12898 1 19 . 1 1 20 20 GLU N N 20 117.884 117.884 118.605 -0.721 25061 12899 1 19 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.985 -0.081 25061 12900 1 19 . 1 1 20 20 GLU C C 20 177.707 177.707 179.244 -1.537 25061 12901 1 19 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.336 0.056 25061 12902 1 19 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.380 -0.403 25061 12903 1 19 . 1 1 20 20 GLU H H 20 7.497 7.497 7.663 -0.166 25061 12904 1 19 . 1 1 21 21 VAL N N 21 117.709 117.709 119.536 -1.827 25061 12905 1 19 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.795 -0.171 25061 12906 1 19 . 1 1 21 21 VAL C C 21 178.523 178.523 178.160 0.363 25061 12907 1 19 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.118 0.079 25061 12908 1 19 . 1 1 21 21 VAL CB C 21 31.147 31.147 30.843 0.304 25061 12909 1 19 . 1 1 21 21 VAL H H 21 7.514 7.514 7.354 0.160 25061 12910 1 19 . 1 1 22 22 VAL N N 22 121.233 121.233 119.597 1.636 25061 12911 1 19 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.795 -0.349 25061 12912 1 19 . 1 1 22 22 VAL C C 22 176.868 176.868 178.429 -1.561 25061 12913 1 19 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.216 0.798 25061 12914 1 19 . 1 1 22 22 VAL CB C 22 31.314 31.314 30.994 0.320 25061 12915 1 19 . 1 1 22 22 VAL H H 22 7.863 7.863 7.485 0.378 25061 12916 1 19 . 1 1 23 23 LEU N N 23 118.101 118.101 117.353 0.748 25061 12917 1 19 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.066 -0.001 25061 12918 1 19 . 1 1 23 23 LEU C C 23 179.701 179.701 178.160 1.541 25061 12919 1 19 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.258 0.038 25061 12920 1 19 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.654 0.050 25061 12921 1 19 . 1 1 23 23 LEU H H 23 8.151 8.151 8.135 0.016 25061 12922 1 19 . 1 1 24 24 LYS N N 24 114.622 114.622 115.918 -1.296 25061 12923 1 19 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.183 -0.046 25061 12924 1 19 . 1 1 24 24 LYS C C 24 178.062 178.062 178.150 -0.088 25061 12925 1 19 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.014 -0.646 25061 12926 1 19 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.495 0.099 25061 12927 1 19 . 1 1 24 24 LYS H H 24 7.823 7.823 7.940 -0.117 25061 12928 1 19 . 1 1 25 25 SER N N 25 115.474 115.474 116.620 -1.146 25061 12929 1 19 . 1 1 25 25 SER HA H 25 4.377 4.377 4.302 0.075 25061 12930 1 19 . 1 1 25 25 SER C C 25 174.520 174.520 174.911 -0.391 25061 12931 1 19 . 1 1 25 25 SER CA C 25 61.049 61.049 60.597 0.452 25061 12932 1 19 . 1 1 25 25 SER CB C 25 63.777 63.777 64.302 -0.525 25061 12933 1 19 . 1 1 25 25 SER H H 25 7.798 7.798 7.854 -0.056 25061 12934 1 19 . 1 1 26 26 ASP N N 26 117.424 117.424 118.086 -0.662 25061 12935 1 19 . 1 1 26 26 ASP HA H 26 4.886 4.886 5.025 -0.139 25061 12936 1 19 . 1 1 26 26 ASP C C 26 173.521 173.521 174.546 -1.025 25061 12937 1 19 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.667 -0.619 25061 12938 1 19 . 1 1 26 26 ASP CB C 26 42.202 42.202 42.555 -0.353 25061 12939 1 19 . 1 1 26 26 ASP H H 26 7.990 7.990 8.142 -0.152 25061 12940 1 19 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.418 0.227 25061 12941 1 19 . 1 1 27 27 PRO C C 27 177.016 177.016 176.977 0.039 25061 12942 1 19 . 1 1 27 27 PRO CA C 27 63.601 63.601 64.280 -0.679 25061 12943 1 19 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.350 -0.177 25061 12944 1 19 . 1 1 28 28 ASN N N 28 115.839 115.839 116.216 -0.377 25061 12945 1 19 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.634 0.058 25061 12946 1 19 . 1 1 28 28 ASN C C 28 175.701 175.701 175.917 -0.216 25061 12947 1 19 . 1 1 28 28 ASN CA C 28 53.472 53.472 53.646 -0.174 25061 12948 1 19 . 1 1 28 28 ASN CB C 28 39.213 39.213 38.765 0.448 25061 12949 1 19 . 1 1 28 28 ASN H H 28 8.608 8.608 7.859 0.749 25061 12950 1 19 . 1 1 29 29 VAL N N 29 120.770 120.770 120.836 -0.066 25061 12951 1 19 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.881 -0.066 25061 12952 1 19 . 1 1 29 29 VAL C C 29 175.023 175.023 175.510 -0.487 25061 12953 1 19 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.393 -0.841 25061 12954 1 19 . 1 1 29 29 VAL CB C 29 32.147 32.147 31.910 0.237 25061 12955 1 19 . 1 1 29 29 VAL H H 29 7.428 7.428 7.575 -0.147 25061 12956 1 19 . 1 1 30 30 LYS N N 30 127.345 127.345 129.797 -2.452 25061 12957 1 19 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.367 0.112 25061 12958 1 19 . 1 1 30 30 LYS C C 30 174.777 174.777 175.949 -1.172 25061 12959 1 19 . 1 1 30 30 LYS CA C 30 55.204 55.204 55.479 -0.275 25061 12960 1 19 . 1 1 30 30 LYS CB C 30 31.949 31.949 32.157 -0.208 25061 12961 1 19 . 1 1 30 30 LYS H H 30 8.457 8.457 8.643 -0.186 25061 12962 1 19 . 1 1 31 31 THR N N 31 113.552 113.552 119.152 -5.600 25061 12963 1 19 . 1 1 31 31 THR HA H 31 5.723 5.723 5.174 0.549 25061 12964 1 19 . 1 1 31 31 THR C C 31 174.593 174.593 174.139 0.454 25061 12965 1 19 . 1 1 31 31 THR CA C 31 59.030 59.030 60.500 -1.470 25061 12966 1 19 . 1 1 31 31 THR CB C 31 72.206 72.206 69.630 2.576 25061 12967 1 19 . 1 1 31 31 THR H H 31 8.164 8.164 8.129 0.035 25061 12968 1 19 . 1 1 32 32 VAL N N 32 119.206 119.206 126.776 -7.570 25061 12969 1 19 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.450 -0.045 25061 12970 1 19 . 1 1 32 32 VAL C C 32 172.663 172.663 174.401 -1.738 25061 12971 1 19 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.544 -0.472 25061 12972 1 19 . 1 1 32 32 VAL CB C 32 35.051 35.051 35.030 0.021 25061 12973 1 19 . 1 1 32 32 VAL H H 32 8.615 8.615 9.026 -0.411 25061 12974 1 19 . 1 1 33 33 ARG N N 33 130.278 130.278 127.928 2.350 25061 12975 1 19 . 1 1 33 33 ARG HA H 33 5.331 5.331 5.122 0.209 25061 12976 1 19 . 1 1 33 33 ARG C C 33 173.836 173.836 176.270 -2.434 25061 12977 1 19 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.035 -0.885 25061 12978 1 19 . 1 1 33 33 ARG CB C 33 30.028 30.028 29.587 0.441 25061 12979 1 19 . 1 1 33 33 ARG H H 33 8.996 8.996 8.902 0.094 25061 12980 1 19 . 1 1 34 34 THR N N 34 121.695 121.695 116.365 5.330 25061 12981 1 19 . 1 1 34 34 THR HA H 34 4.483 4.483 4.556 -0.073 25061 12982 1 19 . 1 1 34 34 THR C C 34 169.769 169.769 172.646 -2.877 25061 12983 1 19 . 1 1 34 34 THR CA C 34 60.814 60.814 59.852 0.962 25061 12984 1 19 . 1 1 34 34 THR CB C 34 67.402 67.402 71.381 -3.979 25061 12985 1 19 . 1 1 34 34 THR H H 34 8.126 8.126 8.099 0.027 25061 12986 1 19 . 1 1 35 35 ASP N N 35 122.198 122.198 116.760 5.438 25061 12987 1 19 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.523 0.301 25061 12988 1 19 . 1 1 35 35 ASP C C 35 174.790 174.790 175.230 -0.440 25061 12989 1 19 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.241 -0.855 25061 12990 1 19 . 1 1 35 35 ASP CB C 35 41.848 41.848 42.078 -0.230 25061 12991 1 19 . 1 1 35 35 ASP H H 35 7.983 7.983 8.176 -0.193 25061 12992 1 19 . 1 1 36 36 ASP N N 36 121.091 121.091 123.415 -2.324 25061 12993 1 19 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.544 0.049 25061 12994 1 19 . 1 1 36 36 ASP C C 36 176.189 176.189 177.416 -1.227 25061 12995 1 19 . 1 1 36 36 ASP CA C 36 53.055 53.055 54.475 -1.420 25061 12996 1 19 . 1 1 36 36 ASP CB C 36 42.159 42.159 41.984 0.175 25061 12997 1 19 . 1 1 36 36 ASP H H 36 8.157 8.157 7.633 0.524 25061 12998 1 19 . 1 1 37 37 LYS N N 37 125.839 125.839 127.821 -1.982 25061 12999 1 19 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.870 -0.148 25061 13000 1 19 . 1 1 37 37 LYS C C 37 176.870 176.870 177.820 -0.950 25061 13001 1 19 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.716 -0.312 25061 13002 1 19 . 1 1 37 37 LYS CB C 37 32.394 32.394 31.973 0.421 25061 13003 1 19 . 1 1 37 37 LYS H H 37 8.843 8.843 8.549 0.294 25061 13004 1 19 . 1 1 38 38 GLU N N 38 118.369 118.369 118.482 -0.113 25061 13005 1 19 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.893 0.114 25061 13006 1 19 . 1 1 38 38 GLU C C 38 179.502 179.502 178.686 0.816 25061 13007 1 19 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.812 -0.142 25061 13008 1 19 . 1 1 38 38 GLU CB C 38 28.474 28.474 28.707 -0.233 25061 13009 1 19 . 1 1 38 38 GLU H H 38 8.182 8.182 8.723 -0.541 25061 13010 1 19 . 1 1 39 39 LYS N N 39 121.722 121.722 121.312 0.410 25061 13011 1 19 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.145 0.020 25061 13012 1 19 . 1 1 39 39 LYS C C 39 178.500 178.500 178.712 -0.212 25061 13013 1 19 . 1 1 39 39 LYS CA C 39 57.736 57.736 59.268 -1.532 25061 13014 1 19 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.426 -1.288 25061 13015 1 19 . 1 1 39 39 LYS H H 39 7.524 7.524 7.641 -0.117 25061 13016 1 19 . 1 1 40 40 VAL N N 40 117.199 117.199 119.223 -2.024 25061 13017 1 19 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.890 -0.662 25061 13018 1 19 . 1 1 40 40 VAL C C 40 177.362 177.362 178.541 -1.179 25061 13019 1 19 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.415 1.227 25061 13020 1 19 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.612 -0.709 25061 13021 1 19 . 1 1 40 40 VAL H H 40 7.883 7.883 7.701 0.182 25061 13022 1 19 . 1 1 41 41 LYS N N 41 117.677 117.677 118.672 -0.995 25061 13023 1 19 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.842 -0.400 25061 13024 1 19 . 1 1 41 41 LYS C C 41 177.686 177.686 179.092 -1.406 25061 13025 1 19 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.802 1.007 25061 13026 1 19 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.609 0.006 25061 13027 1 19 . 1 1 41 41 LYS H H 41 7.567 7.567 7.886 -0.319 25061 13028 1 19 . 1 1 42 42 GLU N N 42 118.369 118.369 118.729 -0.360 25061 13029 1 19 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.062 -0.055 25061 13030 1 19 . 1 1 42 42 GLU C C 42 179.725 179.725 178.649 1.076 25061 13031 1 19 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.095 -0.026 25061 13032 1 19 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.970 -0.430 25061 13033 1 19 . 1 1 42 42 GLU H H 42 7.634 7.634 7.659 -0.025 25061 13034 1 19 . 1 1 43 43 GLU N N 43 117.906 117.906 118.972 -1.066 25061 13035 1 19 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.174 0.009 25061 13036 1 19 . 1 1 43 43 GLU C C 43 179.757 179.757 178.920 0.837 25061 13037 1 19 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.539 -0.173 25061 13038 1 19 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.427 -0.587 25061 13039 1 19 . 1 1 43 43 GLU H H 43 8.162 8.162 7.936 0.226 25061 13040 1 19 . 1 1 44 44 ILE N N 44 122.291 122.291 121.587 0.704 25061 13041 1 19 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.641 -0.029 25061 13042 1 19 . 1 1 44 44 ILE C C 44 177.101 177.101 177.527 -0.426 25061 13043 1 19 . 1 1 44 44 ILE CA C 44 66.355 66.355 66.170 0.185 25061 13044 1 19 . 1 1 44 44 ILE CB C 44 37.460 37.460 38.111 -0.651 25061 13045 1 19 . 1 1 44 44 ILE H H 44 8.742 8.742 8.412 0.330 25061 13046 1 19 . 1 1 45 45 GLU N N 45 119.892 119.892 119.164 0.728 25061 13047 1 19 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.094 -0.036 25061 13048 1 19 . 1 1 45 45 GLU C C 45 178.991 178.991 178.703 0.288 25061 13049 1 19 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.009 0.656 25061 13050 1 19 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.241 -0.080 25061 13051 1 19 . 1 1 45 45 GLU H H 45 8.171 8.171 8.163 0.008 25061 13052 1 19 . 1 1 46 46 LYS N N 46 118.064 118.064 119.113 -1.049 25061 13053 1 19 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.179 -0.197 25061 13054 1 19 . 1 1 46 46 LYS C C 46 178.837 178.837 178.818 0.019 25061 13055 1 19 . 1 1 46 46 LYS CA C 46 59.741 59.741 58.013 1.728 25061 13056 1 19 . 1 1 46 46 LYS CB C 46 32.443 32.443 31.822 0.621 25061 13057 1 19 . 1 1 46 46 LYS H H 46 7.785 7.785 7.409 0.376 25061 13058 1 19 . 1 1 47 47 ALA N N 47 121.817 121.817 122.706 -0.889 25061 13059 1 19 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.062 -0.031 25061 13060 1 19 . 1 1 47 47 ALA C C 47 179.859 179.859 179.380 0.479 25061 13061 1 19 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.120 0.175 25061 13062 1 19 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.526 -0.871 25061 13063 1 19 . 1 1 47 47 ALA H H 47 8.123 8.123 8.119 0.004 25061 13064 1 19 . 1 1 48 48 ARG N N 48 119.080 119.080 117.284 1.796 25061 13065 1 19 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.011 0.078 25061 13066 1 19 . 1 1 48 48 ARG C C 48 180.155 180.155 178.501 1.654 25061 13067 1 19 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.809 0.388 25061 13068 1 19 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.732 -0.222 25061 13069 1 19 . 1 1 48 48 ARG H H 48 8.768 8.768 8.281 0.487 25061 13070 1 19 . 1 1 49 49 LYS N N 49 119.951 119.951 119.472 0.479 25061 13071 1 19 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.137 -0.098 25061 13072 1 19 . 1 1 49 49 LYS C C 49 178.288 178.288 178.564 -0.276 25061 13073 1 19 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.544 0.293 25061 13074 1 19 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.296 -0.153 25061 13075 1 19 . 1 1 49 49 LYS H H 49 8.037 8.037 7.515 0.522 25061 13076 1 19 . 1 1 50 50 GLN N N 50 115.284 115.284 116.137 -0.853 25061 13077 1 19 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.229 0.113 25061 13078 1 19 . 1 1 50 50 GLN C C 50 176.180 176.180 177.588 -1.408 25061 13079 1 19 . 1 1 50 50 GLN CA C 50 55.741 55.741 56.454 -0.713 25061 13080 1 19 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.087 0.478 25061 13081 1 19 . 1 1 50 50 GLN H H 50 7.740 7.740 7.899 -0.159 25061 13082 1 19 . 1 1 51 51 GLY N N 51 109.725 109.725 107.554 2.171 25061 13083 1 19 . 1 1 51 51 GLY C C 51 174.552 174.552 174.042 0.510 25061 13084 1 19 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.340 1.023 25061 13085 1 19 . 1 1 51 51 GLY H H 51 8.027 8.027 8.075 -0.048 25061 13086 1 19 . 1 1 52 52 ARG N N 52 119.064 119.064 121.633 -2.569 25061 13087 1 19 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.693 0.204 25061 13088 1 19 . 1 1 52 52 ARG C C 52 173.123 173.123 174.425 -1.302 25061 13089 1 19 . 1 1 52 52 ARG CA C 52 52.247 52.247 53.034 -0.787 25061 13090 1 19 . 1 1 52 52 ARG CB C 52 32.366 32.366 30.462 1.904 25061 13091 1 19 . 1 1 52 52 ARG H H 52 7.969 7.969 7.632 0.337 25061 13092 1 19 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.510 0.345 25061 13093 1 19 . 1 1 53 53 PRO C C 53 174.069 174.069 175.600 -1.531 25061 13094 1 19 . 1 1 53 53 PRO CA C 53 61.818 61.818 63.422 -1.604 25061 13095 1 19 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.209 -0.149 25061 13096 1 19 . 1 1 54 54 ILE N N 54 116.301 116.301 123.524 -7.223 25061 13097 1 19 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.459 0.779 25061 13098 1 19 . 1 1 54 54 ILE C C 54 171.709 171.709 174.417 -2.708 25061 13099 1 19 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.397 -1.623 25061 13100 1 19 . 1 1 54 54 ILE CB C 54 41.558 41.558 40.246 1.312 25061 13101 1 19 . 1 1 54 54 ILE H H 54 7.920 7.920 7.952 -0.032 25061 13102 1 19 . 1 1 55 55 VAL N N 55 126.302 126.302 131.093 -4.791 25061 13103 1 19 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.074 -0.150 25061 13104 1 19 . 1 1 55 55 VAL C C 55 173.624 173.624 174.683 -1.059 25061 13105 1 19 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.256 -0.461 25061 13106 1 19 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.017 0.811 25061 13107 1 19 . 1 1 55 55 VAL H H 55 8.652 8.652 8.793 -0.141 25061 13108 1 19 . 1 1 56 56 ILE N N 56 127.503 127.503 128.486 -0.983 25061 13109 1 19 . 1 1 56 56 ILE HA H 56 4.664 4.664 4.693 -0.029 25061 13110 1 19 . 1 1 56 56 ILE C C 56 173.479 173.479 175.173 -1.694 25061 13111 1 19 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.589 0.418 25061 13112 1 19 . 1 1 56 56 ILE CB C 56 40.285 40.285 37.710 2.575 25061 13113 1 19 . 1 1 56 56 ILE H H 56 9.124 9.124 8.107 1.017 25061 13114 1 19 . 1 1 57 57 PHE N N 57 125.302 125.302 128.568 -3.266 25061 13115 1 19 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.195 0.021 25061 13116 1 19 . 1 1 57 57 PHE C C 57 174.536 174.536 175.532 -0.996 25061 13117 1 19 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.333 -0.372 25061 13118 1 19 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.365 1.064 25061 13119 1 19 . 1 1 57 57 PHE H H 57 8.971 8.971 9.145 -0.174 25061 13120 1 19 . 1 1 58 58 ILE N N 58 126.472 126.472 116.973 9.499 25061 13121 1 19 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.828 -0.313 25061 13122 1 19 . 1 1 58 58 ILE C C 58 173.391 173.391 174.083 -0.692 25061 13123 1 19 . 1 1 58 58 ILE CA C 58 59.090 59.090 58.533 0.557 25061 13124 1 19 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.348 -0.606 25061 13125 1 19 . 1 1 58 58 ILE H H 58 9.248 9.248 8.667 0.581 25061 13126 1 19 . 1 1 59 59 ARG N N 59 124.681 124.681 121.419 3.262 25061 13127 1 19 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.292 -0.363 25061 13128 1 19 . 1 1 59 59 ARG C C 59 178.521 178.521 178.095 0.426 25061 13129 1 19 . 1 1 59 59 ARG CA C 59 55.742 55.742 54.792 0.950 25061 13130 1 19 . 1 1 59 59 ARG CB C 59 30.918 30.918 32.879 -1.961 25061 13131 1 19 . 1 1 59 59 ARG H H 59 8.587 8.587 8.879 -0.292 25061 13132 1 19 . 1 1 60 60 GLY N N 60 108.848 108.848 109.709 -0.861 25061 13133 1 19 . 1 1 60 60 GLY C C 60 174.775 174.775 174.562 0.213 25061 13134 1 19 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.206 -0.239 25061 13135 1 19 . 1 1 60 60 GLY H H 60 7.732 7.732 8.517 -0.785 25061 13136 1 19 . 1 1 61 61 ALA N N 61 120.877 120.877 123.565 -2.688 25061 13137 1 19 . 1 1 61 61 ALA HA H 61 4.144 4.144 3.934 0.210 25061 13138 1 19 . 1 1 61 61 ALA C C 61 177.769 177.769 179.452 -1.683 25061 13139 1 19 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.860 -0.411 25061 13140 1 19 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.365 0.006 25061 13141 1 19 . 1 1 61 61 ALA H H 61 7.852 7.852 7.902 -0.050 25061 13142 1 19 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.176 0.624 25061 13143 1 19 . 1 1 62 62 TYR CA C 62 63.039 63.039 59.997 3.042 25061 13144 1 19 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.343 0.097 25061 13145 1 19 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.838 -0.153 25061 13146 1 19 . 1 1 63 63 GLU C C 63 176.251 176.251 178.329 -2.078 25061 13147 1 19 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.180 0.078 25061 13148 1 19 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.104 0.308 25061 13149 1 19 . 1 1 64 64 GLU N N 64 119.209 119.209 118.306 0.903 25061 13150 1 19 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.306 0.595 25061 13151 1 19 . 1 1 64 64 GLU C C 64 178.251 178.251 178.880 -0.629 25061 13152 1 19 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.471 0.742 25061 13153 1 19 . 1 1 64 64 GLU CB C 64 28.645 28.645 28.849 -0.204 25061 13154 1 19 . 1 1 64 64 GLU H H 64 8.878 8.878 7.470 1.408 25061 13155 1 19 . 1 1 65 65 VAL N N 65 116.728 116.728 119.764 -3.036 25061 13156 1 19 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.785 0.197 25061 13157 1 19 . 1 1 65 65 VAL C C 65 176.915 176.915 177.974 -1.059 25061 13158 1 19 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.328 -0.719 25061 13159 1 19 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.702 0.193 25061 13160 1 19 . 1 1 65 65 VAL H H 65 7.652 7.652 7.682 -0.030 25061 13161 1 19 . 1 1 66 66 VAL N N 66 119.462 119.462 119.507 -0.045 25061 13162 1 19 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.705 -0.391 25061 13163 1 19 . 1 1 66 66 VAL C C 66 177.142 177.142 177.374 -0.232 25061 13164 1 19 . 1 1 66 66 VAL CA C 66 67.335 67.335 65.863 1.472 25061 13165 1 19 . 1 1 66 66 VAL CB C 66 31.430 31.430 30.861 0.569 25061 13166 1 19 . 1 1 66 66 VAL H H 66 7.896 7.896 7.806 0.090 25061 13167 1 19 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.016 -0.388 25061 13168 1 19 . 1 1 67 67 ARG C C 67 177.841 177.841 178.203 -0.362 25061 13169 1 19 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.978 0.074 25061 13170 1 19 . 1 1 67 67 ARG CB C 67 29.393 29.393 30.013 -0.620 25061 13171 1 19 . 1 1 68 68 ASP N N 68 118.316 118.316 118.896 -0.580 25061 13172 1 19 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.533 -0.172 25061 13173 1 19 . 1 1 68 68 ASP C C 68 178.945 178.945 178.544 0.401 25061 13174 1 19 . 1 1 68 68 ASP CA C 68 57.311 57.311 57.446 -0.135 25061 13175 1 19 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.799 0.715 25061 13176 1 19 . 1 1 68 68 ASP H H 68 7.625 7.625 7.947 -0.322 25061 13177 1 19 . 1 1 69 69 ILE N N 69 119.231 119.231 119.847 -0.616 25061 13178 1 19 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.750 -0.120 25061 13179 1 19 . 1 1 69 69 ILE C C 69 177.138 177.138 178.134 -0.996 25061 13180 1 19 . 1 1 69 69 ILE CA C 69 64.540 64.540 65.151 -0.611 25061 13181 1 19 . 1 1 69 69 ILE CB C 69 37.050 37.050 38.085 -1.035 25061 13182 1 19 . 1 1 69 69 ILE H H 69 8.113 8.113 7.298 0.815 25061 13183 1 19 . 1 1 70 70 VAL N N 70 120.164 120.164 120.253 -0.089 25061 13184 1 19 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.567 -0.150 25061 13185 1 19 . 1 1 70 70 VAL C C 70 177.079 177.079 177.583 -0.504 25061 13186 1 19 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.144 0.130 25061 13187 1 19 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.524 -0.266 25061 13188 1 19 . 1 1 70 70 VAL H H 70 8.478 8.478 8.458 0.020 25061 13189 1 19 . 1 1 71 71 GLU N N 71 118.293 118.293 120.631 -2.338 25061 13190 1 19 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.936 0.118 25061 13191 1 19 . 1 1 71 71 GLU C C 71 179.009 179.009 178.766 0.243 25061 13192 1 19 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.729 -0.313 25061 13193 1 19 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.683 -0.861 25061 13194 1 19 . 1 1 71 71 GLU H H 71 8.152 8.152 8.064 0.088 25061 13195 1 19 . 1 1 72 72 TYR N N 72 120.091 120.091 120.028 0.063 25061 13196 1 19 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.163 -0.001 25061 13197 1 19 . 1 1 72 72 TYR C C 72 176.404 176.404 177.059 -0.655 25061 13198 1 19 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.278 -0.146 25061 13199 1 19 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.397 -0.260 25061 13200 1 19 . 1 1 72 72 TYR H H 72 7.959 7.959 7.997 -0.038 25061 13201 1 19 . 1 1 73 73 ALA N N 73 120.133 120.133 120.459 -0.326 25061 13202 1 19 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.818 -0.188 25061 13203 1 19 . 1 1 73 73 ALA C C 73 179.182 179.182 179.611 -0.429 25061 13204 1 19 . 1 1 73 73 ALA CA C 73 55.112 55.112 54.967 0.145 25061 13205 1 19 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.022 0.169 25061 13206 1 19 . 1 1 73 73 ALA H H 73 8.604 8.604 8.102 0.502 25061 13207 1 19 . 1 1 74 74 GLN N N 74 115.553 115.553 116.904 -1.351 25061 13208 1 19 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.970 0.168 25061 13209 1 19 . 1 1 74 74 GLN C C 74 180.595 180.595 178.684 1.911 25061 13210 1 19 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.325 0.770 25061 13211 1 19 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.726 -0.151 25061 13212 1 19 . 1 1 74 74 GLN H H 74 8.619 8.619 8.040 0.579 25061 13213 1 19 . 1 1 75 75 LYS N N 75 122.396 122.396 119.157 3.239 25061 13214 1 19 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.033 -0.005 25061 13215 1 19 . 1 1 75 75 LYS C C 75 178.521 178.521 178.543 -0.022 25061 13216 1 19 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.148 0.909 25061 13217 1 19 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.880 -0.281 25061 13218 1 19 . 1 1 75 75 LYS H H 75 8.123 8.123 7.537 0.586 25061 13219 1 19 . 1 1 76 76 GLU N N 76 116.294 116.294 116.409 -0.115 25061 13220 1 19 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.105 -0.006 25061 13221 1 19 . 1 1 76 76 GLU C C 76 175.957 175.957 177.620 -1.663 25061 13222 1 19 . 1 1 76 76 GLU CA C 76 55.605 55.605 57.013 -1.408 25061 13223 1 19 . 1 1 76 76 GLU CB C 76 29.824 29.824 30.216 -0.392 25061 13224 1 19 . 1 1 76 76 GLU H H 76 7.450 7.450 7.689 -0.239 25061 13225 1 19 . 1 1 77 77 GLY N N 77 107.446 107.446 107.318 0.128 25061 13226 1 19 . 1 1 77 77 GLY C C 77 174.520 174.520 174.262 0.258 25061 13227 1 19 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.214 0.593 25061 13228 1 19 . 1 1 77 77 GLY H H 77 7.763 7.763 7.805 -0.042 25061 13229 1 19 . 1 1 78 78 LEU N N 78 120.179 120.179 119.879 0.300 25061 13230 1 19 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.358 0.030 25061 13231 1 19 . 1 1 78 78 LEU C C 78 175.914 175.914 176.732 -0.818 25061 13232 1 19 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.791 -0.319 25061 13233 1 19 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.652 -0.763 25061 13234 1 19 . 1 1 78 78 LEU H H 78 7.930 7.930 7.862 0.068 25061 13235 1 19 . 1 1 79 79 ARG N N 79 122.207 122.207 123.814 -1.607 25061 13236 1 19 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.230 0.167 25061 13237 1 19 . 1 1 79 79 ARG C C 79 174.960 174.960 174.934 0.026 25061 13238 1 19 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.911 -0.263 25061 13239 1 19 . 1 1 79 79 ARG CB C 79 30.476 30.476 30.190 0.286 25061 13240 1 19 . 1 1 79 79 ARG H H 79 8.241 8.241 8.530 -0.289 25061 13241 1 19 . 1 1 80 80 VAL N N 80 123.333 123.333 125.712 -2.379 25061 13242 1 19 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.672 0.623 25061 13243 1 19 . 1 1 80 80 VAL C C 80 174.048 174.048 174.249 -0.201 25061 13244 1 19 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.313 -1.272 25061 13245 1 19 . 1 1 80 80 VAL CB C 80 34.305 34.305 33.259 1.046 25061 13246 1 19 . 1 1 80 80 VAL H H 80 8.359 8.359 8.351 0.008 25061 13247 1 19 . 1 1 81 81 LEU N N 81 128.719 128.719 129.109 -0.390 25061 13248 1 19 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.195 -0.091 25061 13249 1 19 . 1 1 81 81 LEU C C 81 174.484 174.484 174.729 -0.245 25061 13250 1 19 . 1 1 81 81 LEU CA C 81 54.120 54.120 54.009 0.111 25061 13251 1 19 . 1 1 81 81 LEU CB C 81 44.955 44.955 46.081 -1.126 25061 13252 1 19 . 1 1 81 81 LEU H H 81 8.650 8.650 8.974 -0.324 25061 13253 1 19 . 1 1 82 82 VAL N N 82 122.487 122.487 127.308 -4.821 25061 13254 1 19 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.343 0.754 25061 13255 1 19 . 1 1 82 82 VAL C C 82 174.525 174.525 174.981 -0.456 25061 13256 1 19 . 1 1 82 82 VAL CA C 82 60.285 60.285 62.000 -1.715 25061 13257 1 19 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.298 2.491 25061 13258 1 19 . 1 1 82 82 VAL H H 82 8.781 8.781 8.115 0.666 25061 13259 1 19 . 1 1 83 83 ILE N N 83 128.082 128.082 130.289 -2.207 25061 13260 1 19 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.864 0.066 25061 13261 1 19 . 1 1 83 83 ILE C C 83 172.925 172.925 174.744 -1.819 25061 13262 1 19 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.488 -0.547 25061 13263 1 19 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.209 1.978 25061 13264 1 19 . 1 1 83 83 ILE H H 83 9.527 9.527 8.856 0.671 25061 13265 1 19 . 1 1 84 84 LYS N N 84 128.493 128.493 125.865 2.628 25061 13266 1 19 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.255 -0.207 25061 13267 1 19 . 1 1 84 84 LYS C C 84 174.027 174.027 175.601 -1.574 25061 13268 1 19 . 1 1 84 84 LYS CA C 84 53.253 53.253 53.682 -0.429 25061 13269 1 19 . 1 1 84 84 LYS CB C 84 34.652 34.652 36.228 -1.576 25061 13270 1 19 . 1 1 84 84 LYS H H 84 8.721 8.721 8.873 -0.152 25061 13271 1 19 . 1 1 85 85 VAL N N 85 126.729 126.729 124.428 2.301 25061 13272 1 19 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.168 0.568 25061 13273 1 19 . 1 1 85 85 VAL C C 85 175.935 175.935 175.320 0.615 25061 13274 1 19 . 1 1 85 85 VAL CA C 85 60.200 60.200 62.099 -1.899 25061 13275 1 19 . 1 1 85 85 VAL CB C 85 30.847 30.847 31.697 -0.850 25061 13276 1 19 . 1 1 85 85 VAL H H 85 8.643 8.643 8.108 0.535 25061 13277 1 19 . 1 1 86 86 ALA N N 86 132.930 132.930 130.985 1.945 25061 13278 1 19 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.513 -0.083 25061 13279 1 19 . 1 1 86 86 ALA C C 86 175.635 175.635 176.817 -1.182 25061 13280 1 19 . 1 1 86 86 ALA CA C 86 51.504 51.504 51.409 0.095 25061 13281 1 19 . 1 1 86 86 ALA CB C 86 20.821 20.821 19.964 0.857 25061 13282 1 19 . 1 1 86 86 ALA H H 86 8.835 8.835 8.501 0.334 25061 13283 1 19 . 1 1 87 87 GLN N N 87 118.719 118.719 122.863 -4.144 25061 13284 1 19 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.531 -0.062 25061 13285 1 19 . 1 1 87 87 GLN C C 87 175.949 175.949 175.579 0.370 25061 13286 1 19 . 1 1 87 87 GLN CA C 87 55.260 55.260 56.279 -1.019 25061 13287 1 19 . 1 1 87 87 GLN CB C 87 30.432 30.432 30.699 -0.267 25061 13288 1 19 . 1 1 87 87 GLN H H 87 8.570 8.570 8.813 -0.243 25061 13289 1 19 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.630 -0.150 25061 13290 1 19 . 1 1 88 88 ASP CA C 88 55.454 55.454 55.579 -0.125 25061 13291 1 19 . 1 1 88 88 ASP CB C 88 41.204 41.204 41.567 -0.363 25061 13292 1 19 . 1 1 89 89 GLN HA H 89 4.047 4.047 3.738 0.309 25061 13293 1 19 . 1 1 89 89 GLN CA C 89 56.687 56.687 58.589 -1.902 25061 13294 1 19 . 1 1 89 89 GLN CB C 89 27.850 27.850 26.974 0.876 25061 13295 1 19 . 1 1 92 92 LEU N N 92 125.291 125.291 120.855 4.436 25061 13296 1 19 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.054 0.147 25061 13297 1 19 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.452 -2.395 25061 13298 1 19 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.796 0.250 25061 13299 1 19 . 1 1 92 92 LEU H H 92 8.277 8.277 8.012 0.265 25061 13300 1 19 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.287 0.469 25061 13301 1 19 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.077 -0.028 25061 13302 1 19 . 1 1 94 94 ARG C C 94 178.544 178.544 178.478 0.066 25061 13303 1 19 . 1 1 94 94 ARG CA C 94 58.607 58.607 59.307 -0.700 25061 13304 1 19 . 1 1 94 94 ARG CB C 94 29.614 29.614 30.116 -0.501 25061 13305 1 19 . 1 1 95 95 PHE N N 95 117.407 117.407 118.491 -1.084 25061 13306 1 19 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.338 0.037 25061 13307 1 19 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.093 0.138 25061 13308 1 19 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.459 -1.516 25061 13309 1 19 . 1 1 95 95 PHE H H 95 8.419 8.419 7.708 0.711 25061 13310 1 19 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.905 -0.097 25061 13311 1 19 . 1 1 96 96 TYR C C 96 177.728 177.728 177.321 0.407 25061 13312 1 19 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.661 1.495 25061 13313 1 19 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.623 -0.923 25061 13314 1 19 . 1 1 97 97 GLU N N 97 119.054 119.054 117.666 1.388 25061 13315 1 19 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.947 0.116 25061 13316 1 19 . 1 1 97 97 GLU C C 97 179.071 179.071 178.815 0.256 25061 13317 1 19 . 1 1 97 97 GLU CA C 97 58.760 58.760 59.230 -0.470 25061 13318 1 19 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.420 -0.248 25061 13319 1 19 . 1 1 97 97 GLU H H 97 7.858 7.858 8.157 -0.299 25061 13320 1 19 . 1 1 98 98 GLN N N 98 119.385 119.385 118.742 0.643 25061 13321 1 19 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.961 -0.060 25061 13322 1 19 . 1 1 98 98 GLN C C 98 177.599 177.599 178.387 -0.788 25061 13323 1 19 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.111 0.200 25061 13324 1 19 . 1 1 98 98 GLN CB C 98 27.766 27.766 27.918 -0.152 25061 13325 1 19 . 1 1 98 98 GLN H H 98 7.747 7.747 7.494 0.253 25061 13326 1 19 . 1 1 99 99 LEU N N 99 118.348 118.348 120.046 -1.698 25061 13327 1 19 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.822 0.197 25061 13328 1 19 . 1 1 99 99 LEU C C 99 178.669 178.669 178.706 -0.037 25061 13329 1 19 . 1 1 99 99 LEU CA C 99 57.430 57.430 58.117 -0.687 25061 13330 1 19 . 1 1 99 99 LEU CB C 99 41.503 41.503 40.989 0.514 25061 13331 1 19 . 1 1 99 99 LEU H H 99 7.891 7.891 7.383 0.508 25061 13332 1 19 . 1 1 100 100 LYS N N 100 118.332 118.332 118.078 0.254 25061 13333 1 19 . 1 1 100 100 LYS HA H 100 4.509 4.509 3.986 0.523 25061 13334 1 19 . 1 1 100 100 LYS C C 100 180.846 180.846 179.247 1.599 25061 13335 1 19 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.571 0.517 25061 13336 1 19 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.831 0.438 25061 13337 1 19 . 1 1 100 100 LYS H H 100 7.560 7.560 7.210 0.350 25061 13338 1 19 . 1 1 101 101 LYS N N 101 121.944 121.944 119.617 2.327 25061 13339 1 19 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.103 -0.031 25061 13340 1 19 . 1 1 101 101 LYS C C 101 177.707 177.707 178.196 -0.489 25061 13341 1 19 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.534 0.337 25061 13342 1 19 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.422 -0.327 25061 13343 1 19 . 1 1 101 101 LYS H H 101 7.959 7.959 7.623 0.336 25061 13344 1 19 . 1 1 102 102 ASP N N 102 118.788 118.788 117.398 1.390 25061 13345 1 19 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.443 0.251 25061 13346 1 19 . 1 1 102 102 ASP C C 102 176.359 176.359 177.560 -1.201 25061 13347 1 19 . 1 1 102 102 ASP CA C 102 54.579 54.579 56.165 -1.586 25061 13348 1 19 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.254 -0.680 25061 13349 1 19 . 1 1 102 102 ASP H H 102 7.893 7.893 7.957 -0.064 25061 13350 1 19 . 1 1 103 103 GLY N N 103 107.024 107.024 104.721 2.303 25061 13351 1 19 . 1 1 103 103 GLY C C 103 174.328 174.328 174.555 -0.227 25061 13352 1 19 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.719 0.626 25061 13353 1 19 . 1 1 103 103 GLY H H 103 7.866 7.866 7.832 0.034 25061 13354 1 19 . 1 1 104 104 VAL N N 104 123.060 123.060 121.443 1.617 25061 13355 1 19 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.892 0.081 25061 13356 1 19 . 1 1 104 104 VAL C C 104 175.023 175.023 174.730 0.293 25061 13357 1 19 . 1 1 104 104 VAL CA C 104 61.878 61.878 62.756 -0.878 25061 13358 1 19 . 1 1 104 104 VAL CB C 104 32.088 32.088 32.236 -0.148 25061 13359 1 19 . 1 1 104 104 VAL H H 104 7.955 7.955 7.683 0.272 25061 13360 1 19 . 1 1 105 105 ASP N N 105 127.987 127.987 127.543 0.444 25061 13361 1 19 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.668 -0.093 25061 13362 1 19 . 1 1 105 105 ASP C C 105 173.624 173.624 174.318 -0.694 25061 13363 1 19 . 1 1 105 105 ASP CA C 105 54.087 54.087 53.782 0.305 25061 13364 1 19 . 1 1 105 105 ASP CB C 105 40.660 40.660 42.256 -1.596 25061 13365 1 19 . 1 1 105 105 ASP H H 105 8.399 8.399 8.298 0.101 25061 13366 1 19 . 1 1 106 106 VAL N N 106 125.798 125.798 124.371 1.427 25061 13367 1 19 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.356 0.459 25061 13368 1 19 . 1 1 106 106 VAL C C 106 174.902 174.902 175.210 -0.308 25061 13369 1 19 . 1 1 106 106 VAL CA C 106 60.194 60.194 60.725 -0.531 25061 13370 1 19 . 1 1 106 106 VAL CB C 106 34.179 34.179 33.392 0.787 25061 13371 1 19 . 1 1 106 106 VAL H H 106 7.550 7.550 8.063 -0.513 25061 13372 1 19 . 1 1 107 107 ARG N N 107 128.099 128.099 130.504 -2.405 25061 13373 1 19 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.623 0.253 25061 13374 1 19 . 1 1 107 107 ARG C C 107 173.815 173.815 174.617 -0.802 25061 13375 1 19 . 1 1 107 107 ARG CA C 107 53.386 53.386 53.532 -0.146 25061 13376 1 19 . 1 1 107 107 ARG CB C 107 31.195 31.195 30.267 0.928 25061 13377 1 19 . 1 1 107 107 ARG H H 107 9.132 9.132 8.625 0.507 25061 13378 1 19 . 1 1 108 108 VAL N N 108 123.979 123.979 123.186 0.793 25061 13379 1 19 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.330 -0.388 25061 13380 1 19 . 1 1 108 108 VAL C C 108 175.854 175.854 177.168 -1.314 25061 13381 1 19 . 1 1 108 108 VAL CA C 108 60.017 60.017 60.093 -0.076 25061 13382 1 19 . 1 1 108 108 VAL CB C 108 32.844 32.844 32.187 0.657 25061 13383 1 19 . 1 1 108 108 VAL H H 108 8.561 8.561 8.656 -0.095 25061 13384 1 19 . 1 1 109 109 THR N N 109 120.144 120.144 117.663 2.481 25061 13385 1 19 . 1 1 109 109 THR HA H 109 4.815 4.815 4.345 0.470 25061 13386 1 19 . 1 1 109 109 THR C C 109 171.867 171.867 175.570 -3.703 25061 13387 1 19 . 1 1 109 109 THR CA C 109 59.613 59.613 62.042 -2.429 25061 13388 1 19 . 1 1 109 109 THR CB C 109 69.720 69.720 69.469 0.252 25061 13389 1 19 . 1 1 109 109 THR H H 109 8.803 8.803 8.656 0.147 25061 13390 1 19 . 1 1 110 110 ASP N N 110 123.212 123.212 122.809 0.403 25061 13391 1 19 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.371 0.598 25061 13392 1 19 . 1 1 110 110 ASP C C 110 175.739 175.739 175.257 0.482 25061 13393 1 19 . 1 1 110 110 ASP CA C 110 53.243 53.243 57.452 -4.209 25061 13394 1 19 . 1 1 110 110 ASP CB C 110 41.351 41.351 39.133 2.218 25061 13395 1 19 . 1 1 110 110 ASP H H 110 8.363 8.363 8.519 -0.156 25061 13396 1 19 . 1 1 111 111 ASN N N 111 116.298 116.298 119.833 -3.535 25061 13397 1 19 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.820 0.056 25061 13398 1 19 . 1 1 111 111 ASN C C 111 174.756 174.756 176.390 -1.634 25061 13399 1 19 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.752 -0.620 25061 13400 1 19 . 1 1 111 111 ASN CB C 111 40.765 40.765 39.450 1.315 25061 13401 1 19 . 1 1 111 111 ASN H H 111 8.085 8.085 8.103 -0.018 25061 13402 1 19 . 1 1 112 112 GLU HA H 112 3.848 3.848 4.032 -0.184 25061 13403 1 19 . 1 1 112 112 GLU C C 112 177.016 177.016 178.345 -1.329 25061 13404 1 19 . 1 1 112 112 GLU CA C 112 59.480 59.480 60.357 -0.877 25061 13405 1 19 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.590 0.084 25061 13406 1 19 . 1 1 113 113 ASP N N 113 121.033 121.033 118.319 2.714 25061 13407 1 19 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.354 0.059 25061 13408 1 19 . 1 1 113 113 ASP C C 113 178.988 178.988 177.839 1.149 25061 13409 1 19 . 1 1 113 113 ASP CA C 113 57.855 57.855 57.448 0.407 25061 13410 1 19 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.558 -0.056 25061 13411 1 19 . 1 1 113 113 ASP H H 113 8.219 8.219 8.695 -0.476 25061 13412 1 19 . 1 1 114 114 GLU N N 114 121.280 121.280 118.513 2.767 25061 13413 1 19 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.122 -0.057 25061 13414 1 19 . 1 1 114 114 GLU C C 114 178.776 178.776 178.024 0.752 25061 13415 1 19 . 1 1 114 114 GLU CA C 114 58.714 58.714 59.155 -0.441 25061 13416 1 19 . 1 1 114 114 GLU CB C 114 29.213 29.213 28.746 0.467 25061 13417 1 19 . 1 1 114 114 GLU H H 114 8.296 8.296 8.674 -0.378 25061 13418 1 19 . 1 1 115 115 ALA N N 115 120.924 120.924 122.495 -1.571 25061 13419 1 19 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.161 -0.323 25061 13420 1 19 . 1 1 115 115 ALA C C 115 178.502 178.502 179.328 -0.826 25061 13421 1 19 . 1 1 115 115 ALA CA C 115 55.638 55.638 54.874 0.764 25061 13422 1 19 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.189 0.308 25061 13423 1 19 . 1 1 115 115 ALA H H 115 7.853 7.853 7.601 0.252 25061 13424 1 19 . 1 1 116 116 LYS N N 116 116.616 116.616 119.632 -3.016 25061 13425 1 19 . 1 1 116 116 LYS HA H 116 3.719 3.719 4.026 -0.307 25061 13426 1 19 . 1 1 116 116 LYS C C 116 178.097 178.097 178.634 -0.537 25061 13427 1 19 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.513 1.239 25061 13428 1 19 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.407 0.148 25061 13429 1 19 . 1 1 116 116 LYS H H 116 8.091 8.091 7.922 0.169 25061 13430 1 19 . 1 1 117 117 LYS N N 117 118.990 118.990 116.762 2.228 25061 13431 1 19 . 1 1 117 117 LYS HA H 117 3.911 3.911 4.024 -0.113 25061 13432 1 19 . 1 1 117 117 LYS C C 117 179.186 179.186 179.209 -0.023 25061 13433 1 19 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.034 0.537 25061 13434 1 19 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.003 0.517 25061 13435 1 19 . 1 1 117 117 LYS H H 117 7.742 7.742 8.160 -0.418 25061 13436 1 19 . 1 1 118 118 ARG N N 118 117.441 117.441 120.683 -3.242 25061 13437 1 19 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.129 0.011 25061 13438 1 19 . 1 1 118 118 ARG C C 118 178.921 178.921 178.536 0.385 25061 13439 1 19 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.672 -1.000 25061 13440 1 19 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.772 -0.111 25061 13441 1 19 . 1 1 118 118 ARG H H 118 8.468 8.468 7.416 1.052 25061 13442 1 19 . 1 1 119 119 LEU N N 119 120.100 120.100 119.157 0.943 25061 13443 1 19 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.913 0.047 25061 13444 1 19 . 1 1 119 119 LEU C C 119 177.554 177.554 178.695 -1.141 25061 13445 1 19 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.037 -0.156 25061 13446 1 19 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.445 0.444 25061 13447 1 19 . 1 1 119 119 LEU H H 119 8.322 8.322 7.895 0.427 25061 13448 1 19 . 1 1 120 120 LYS N N 120 118.238 118.238 119.860 -1.622 25061 13449 1 19 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.957 -0.135 25061 13450 1 19 . 1 1 120 120 LYS C C 120 178.703 178.703 179.116 -0.413 25061 13451 1 19 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.844 0.502 25061 13452 1 19 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.194 0.042 25061 13453 1 19 . 1 1 120 120 LYS H H 120 7.990 7.990 7.646 0.344 25061 13454 1 19 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.297 -0.275 25061 13455 1 19 . 1 1 121 121 GLU C C 121 177.769 177.769 178.978 -1.209 25061 13456 1 19 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.085 -0.163 25061 13457 1 19 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.196 0.258 25061 13458 1 19 . 1 1 122 122 LEU N N 122 119.454 119.454 119.921 -0.467 25061 13459 1 19 . 1 1 122 122 LEU HA H 122 4.133 4.133 3.946 0.187 25061 13460 1 19 . 1 1 122 122 LEU C C 122 178.991 178.991 179.283 -0.292 25061 13461 1 19 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.655 -0.329 25061 13462 1 19 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.874 -0.195 25061 13463 1 19 . 1 1 122 122 LEU H H 122 7.930 7.930 7.787 0.143 25061 13464 1 19 . 1 1 123 123 LEU N N 123 117.862 117.862 117.045 0.817 25061 13465 1 19 . 1 1 123 123 LEU HA H 123 4.067 4.067 4.193 -0.126 25061 13466 1 19 . 1 1 123 123 LEU C C 123 179.178 179.178 179.107 0.071 25061 13467 1 19 . 1 1 123 123 LEU CA C 123 56.920 56.920 57.297 -0.377 25061 13468 1 19 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.585 -0.375 25061 13469 1 19 . 1 1 123 123 LEU H H 123 8.095 8.095 7.637 0.458 25061 13470 1 19 . 1 1 124 124 GLU N N 124 118.975 118.975 116.965 2.010 25061 13471 1 19 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.078 0.051 25061 13472 1 19 . 1 1 124 124 GLU C C 124 177.777 177.777 177.405 0.372 25061 13473 1 19 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.542 -0.455 25061 13474 1 19 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.700 -0.160 25061 13475 1 19 . 1 1 124 124 GLU H H 124 7.930 7.930 7.709 0.221 25061 13476 1 19 . 1 1 125 125 LYS N N 125 118.933 118.933 117.206 1.727 25061 13477 1 19 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.452 -0.115 25061 13478 1 19 . 1 1 125 125 LYS C C 125 178.188 178.188 177.478 0.710 25061 13479 1 19 . 1 1 125 125 LYS CA C 125 56.980 56.980 57.492 -0.512 25061 13480 1 19 . 1 1 125 125 LYS CB C 125 32.608 32.608 34.514 -1.907 25061 13481 1 19 . 1 1 125 125 LYS H H 125 7.729 7.729 7.645 0.084 25061 13482 1 19 . 1 1 126 126 VAL N N 126 117.933 117.933 114.646 3.287 25061 13483 1 19 . 1 1 126 126 VAL HA H 126 4.022 4.022 4.314 -0.292 25061 13484 1 19 . 1 1 126 126 VAL C C 126 176.947 176.947 176.186 0.761 25061 13485 1 19 . 1 1 126 126 VAL CA C 126 63.641 63.641 62.946 0.695 25061 13486 1 19 . 1 1 126 126 VAL CB C 126 31.859 31.859 34.146 -2.287 25061 13487 1 19 . 1 1 126 126 VAL H H 126 8.044 8.044 7.956 0.088 25061 13488 1 19 . 1 1 127 127 GLY N N 127 109.813 109.813 105.063 4.750 25061 13489 1 19 . 1 1 127 127 GLY C C 127 174.264 174.264 174.149 0.115 25061 13490 1 19 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.888 -0.609 25061 13491 1 19 . 1 1 127 127 GLY H H 127 8.279 8.279 8.083 0.196 25061 13492 1 19 . 1 1 128 128 SER N N 128 115.185 115.185 118.173 -2.988 25061 13493 1 19 . 1 1 128 128 SER HA H 128 4.462 4.462 4.482 -0.020 25061 13494 1 19 . 1 1 128 128 SER C C 128 174.775 174.775 173.896 0.879 25061 13495 1 19 . 1 1 128 128 SER CA C 128 58.739 58.739 58.470 0.269 25061 13496 1 19 . 1 1 128 128 SER CB C 128 63.850 63.850 62.276 1.574 25061 13497 1 19 . 1 1 128 128 SER H H 128 8.048 8.048 8.100 -0.052 25061 13498 1 19 . 1 1 129 129 LEU N N 129 123.060 123.060 130.966 -7.906 25061 13499 1 19 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.320 -0.022 25061 13500 1 19 . 1 1 129 129 LEU C C 129 177.313 177.313 176.100 1.213 25061 13501 1 19 . 1 1 129 129 LEU CA C 129 55.158 55.158 54.742 0.416 25061 13502 1 19 . 1 1 129 129 LEU CB C 129 41.837 41.837 41.328 0.509 25061 13503 1 19 . 1 1 129 129 LEU H H 129 8.147 8.147 8.417 -0.270 25061 13504 1 19 . 1 1 130 130 GLU N N 130 120.088 120.088 124.070 -3.982 25061 13505 1 19 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.086 0.095 25061 13506 1 19 . 1 1 130 130 GLU C C 130 176.148 176.148 175.127 1.021 25061 13507 1 19 . 1 1 130 130 GLU CA C 130 56.726 56.726 57.850 -1.124 25061 13508 1 19 . 1 1 130 130 GLU CB C 130 30.026 30.026 28.941 1.085 25061 13509 1 19 . 1 1 130 130 GLU H H 130 8.242 8.242 8.299 -0.057 25061 13510 1 20 . 1 1 2 2 GLY CA C 2 45.319 45.319 45.185 0.134 25061 13511 1 20 . 1 1 3 3 THR HA H 3 4.820 4.820 4.279 0.541 25061 13512 1 20 . 1 1 3 3 THR C C 3 172.374 172.374 174.671 -2.297 25061 13513 1 20 . 1 1 3 3 THR CA C 3 62.760 62.760 63.813 -1.053 25061 13514 1 20 . 1 1 3 3 THR CB C 3 71.441 71.441 69.199 2.242 25061 13515 1 20 . 1 1 4 4 VAL N N 4 126.881 126.881 129.125 -2.244 25061 13516 1 20 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.263 0.304 25061 13517 1 20 . 1 1 4 4 VAL C C 4 173.116 173.116 174.547 -1.431 25061 13518 1 20 . 1 1 4 4 VAL CA C 4 60.455 60.455 62.176 -1.721 25061 13519 1 20 . 1 1 4 4 VAL CB C 4 33.800 33.800 31.918 1.882 25061 13520 1 20 . 1 1 4 4 VAL H H 4 9.097 9.097 8.674 0.423 25061 13521 1 20 . 1 1 5 5 VAL N N 5 127.172 127.172 125.150 2.022 25061 13522 1 20 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.341 -0.454 25061 13523 1 20 . 1 1 5 5 VAL C C 5 174.091 174.091 174.911 -0.820 25061 13524 1 20 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.544 0.574 25061 13525 1 20 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.109 -0.174 25061 13526 1 20 . 1 1 5 5 VAL H H 5 8.811 8.811 8.832 -0.021 25061 13527 1 20 . 1 1 6 6 ILE N N 6 127.577 127.577 128.582 -1.005 25061 13528 1 20 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.399 0.221 25061 13529 1 20 . 1 1 6 6 ILE C C 6 173.328 173.328 175.340 -2.012 25061 13530 1 20 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.879 -0.047 25061 13531 1 20 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.144 1.786 25061 13532 1 20 . 1 1 6 6 ILE H H 6 9.210 9.210 8.642 0.568 25061 13533 1 20 . 1 1 7 7 VAL N N 7 129.024 129.024 129.407 -0.383 25061 13534 1 20 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.794 0.011 25061 13535 1 20 . 1 1 7 7 VAL C C 7 173.561 173.561 175.257 -1.696 25061 13536 1 20 . 1 1 7 7 VAL CA C 7 60.849 60.849 61.826 -0.977 25061 13537 1 20 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.763 0.597 25061 13538 1 20 . 1 1 7 7 VAL H H 7 9.294 9.294 8.041 1.253 25061 13539 1 20 . 1 1 8 8 VAL N N 8 125.318 125.318 129.282 -3.964 25061 13540 1 20 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.449 -0.053 25061 13541 1 20 . 1 1 8 8 VAL C C 8 175.723 175.723 175.435 0.288 25061 13542 1 20 . 1 1 8 8 VAL CA C 8 59.617 59.617 60.209 -0.591 25061 13543 1 20 . 1 1 8 8 VAL CB C 8 34.915 34.915 34.878 0.037 25061 13544 1 20 . 1 1 8 8 VAL H H 8 8.898 8.898 8.751 0.147 25061 13545 1 20 . 1 1 9 9 SER N N 9 116.544 116.544 117.622 -1.078 25061 13546 1 20 . 1 1 9 9 SER HA H 9 4.724 4.724 5.226 -0.502 25061 13547 1 20 . 1 1 9 9 SER C C 9 174.552 174.552 174.761 -0.209 25061 13548 1 20 . 1 1 9 9 SER CA C 9 57.419 57.419 56.771 0.648 25061 13549 1 20 . 1 1 9 9 SER CB C 9 64.998 64.998 66.042 -1.044 25061 13550 1 20 . 1 1 9 9 SER H H 9 7.833 7.833 8.306 -0.473 25061 13551 1 20 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.518 0.394 25061 13552 1 20 . 1 1 10 10 ASN C C 10 176.170 176.170 174.155 2.015 25061 13553 1 20 . 1 1 10 10 ASN CA C 10 54.141 54.141 56.282 -2.141 25061 13554 1 20 . 1 1 10 10 ASN CB C 10 38.626 38.626 39.000 -0.374 25061 13555 1 20 . 1 1 11 11 ASP N N 11 120.164 120.164 118.560 1.604 25061 13556 1 20 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.840 0.003 25061 13557 1 20 . 1 1 11 11 ASP C C 11 176.148 176.148 175.785 0.363 25061 13558 1 20 . 1 1 11 11 ASP CA C 11 52.620 52.620 53.073 -0.453 25061 13559 1 20 . 1 1 11 11 ASP CB C 11 42.631 42.631 42.313 0.318 25061 13560 1 20 . 1 1 11 11 ASP H H 11 8.142 8.142 7.850 0.292 25061 13561 1 20 . 1 1 12 12 GLU N N 12 127.184 127.184 125.138 2.046 25061 13562 1 20 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.187 -0.334 25061 13563 1 20 . 1 1 12 12 GLU C C 12 177.853 177.853 177.990 -0.137 25061 13564 1 20 . 1 1 12 12 GLU CA C 12 59.547 59.547 58.562 0.985 25061 13565 1 20 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.920 -0.101 25061 13566 1 20 . 1 1 12 12 GLU H H 12 9.152 9.152 8.906 0.246 25061 13567 1 20 . 1 1 13 13 ARG N N 13 119.026 119.026 119.430 -0.404 25061 13568 1 20 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.366 -0.263 25061 13569 1 20 . 1 1 13 13 ARG C C 13 179.151 179.151 178.595 0.556 25061 13570 1 20 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.760 0.183 25061 13571 1 20 . 1 1 13 13 ARG CB C 13 28.757 28.757 30.282 -1.525 25061 13572 1 20 . 1 1 13 13 ARG H H 13 8.389 8.389 7.814 0.576 25061 13573 1 20 . 1 1 14 14 ILE N N 14 119.238 119.238 121.001 -1.763 25061 13574 1 20 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.729 -0.128 25061 13575 1 20 . 1 1 14 14 ILE C C 14 177.905 177.905 177.600 0.305 25061 13576 1 20 . 1 1 14 14 ILE CA C 14 64.666 64.666 65.313 -0.647 25061 13577 1 20 . 1 1 14 14 ILE CB C 14 36.780 36.780 37.691 -0.911 25061 13578 1 20 . 1 1 14 14 ILE H H 14 7.254 7.254 7.697 -0.443 25061 13579 1 20 . 1 1 15 15 LEU N N 15 117.008 117.008 119.331 -2.323 25061 13580 1 20 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.101 -0.180 25061 13581 1 20 . 1 1 15 15 LEU C C 15 178.062 178.062 179.195 -1.133 25061 13582 1 20 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.198 0.213 25061 13583 1 20 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.420 -0.251 25061 13584 1 20 . 1 1 15 15 LEU H H 15 7.412 7.412 7.576 -0.164 25061 13585 1 20 . 1 1 16 16 GLU N N 16 117.637 117.637 118.466 -0.829 25061 13586 1 20 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.807 -0.106 25061 13587 1 20 . 1 1 16 16 GLU C C 16 179.182 179.182 178.902 0.280 25061 13588 1 20 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.410 0.007 25061 13589 1 20 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.226 0.233 25061 13590 1 20 . 1 1 16 16 GLU H H 16 7.981 7.981 7.690 0.291 25061 13591 1 20 . 1 1 17 17 GLU N N 17 119.759 119.759 121.094 -1.335 25061 13592 1 20 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.192 -0.176 25061 13593 1 20 . 1 1 17 17 GLU C C 17 179.949 179.949 179.139 0.810 25061 13594 1 20 . 1 1 17 17 GLU CA C 17 59.195 59.195 59.138 0.057 25061 13595 1 20 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.798 -0.258 25061 13596 1 20 . 1 1 17 17 GLU H H 17 8.248 8.248 8.029 0.219 25061 13597 1 20 . 1 1 18 18 LEU N N 18 119.764 119.764 119.766 -0.002 25061 13598 1 20 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.147 -0.066 25061 13599 1 20 . 1 1 18 18 LEU C C 18 177.620 177.620 179.426 -1.806 25061 13600 1 20 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.651 0.027 25061 13601 1 20 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.548 -0.438 25061 13602 1 20 . 1 1 18 18 LEU H H 18 8.486 8.486 8.133 0.353 25061 13603 1 20 . 1 1 19 19 LEU N N 19 123.102 123.102 120.502 2.600 25061 13604 1 20 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.608 0.054 25061 13605 1 20 . 1 1 19 19 LEU C C 19 178.343 178.343 178.153 0.190 25061 13606 1 20 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.479 0.757 25061 13607 1 20 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.114 -0.463 25061 13608 1 20 . 1 1 19 19 LEU H H 19 7.870 7.870 7.949 -0.079 25061 13609 1 20 . 1 1 20 20 GLU N N 20 117.884 117.884 118.581 -0.697 25061 13610 1 20 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.977 -0.073 25061 13611 1 20 . 1 1 20 20 GLU C C 20 177.707 177.707 179.299 -1.592 25061 13612 1 20 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.406 -0.014 25061 13613 1 20 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.266 -0.289 25061 13614 1 20 . 1 1 20 20 GLU H H 20 7.497 7.497 7.678 -0.181 25061 13615 1 20 . 1 1 21 21 VAL N N 21 117.709 117.709 119.635 -1.926 25061 13616 1 20 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.654 -0.030 25061 13617 1 20 . 1 1 21 21 VAL C C 21 178.523 178.523 177.814 0.709 25061 13618 1 20 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.427 -0.230 25061 13619 1 20 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.593 -0.446 25061 13620 1 20 . 1 1 21 21 VAL H H 21 7.514 7.514 7.619 -0.105 25061 13621 1 20 . 1 1 22 22 VAL N N 22 121.233 121.233 119.417 1.816 25061 13622 1 20 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.728 -0.282 25061 13623 1 20 . 1 1 22 22 VAL C C 22 176.868 176.868 177.904 -1.036 25061 13624 1 20 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.830 0.183 25061 13625 1 20 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.585 -0.271 25061 13626 1 20 . 1 1 22 22 VAL H H 22 7.863 7.863 7.417 0.446 25061 13627 1 20 . 1 1 23 23 LEU N N 23 118.101 118.101 118.386 -0.285 25061 13628 1 20 . 1 1 23 23 LEU HA H 23 4.065 4.065 3.976 0.089 25061 13629 1 20 . 1 1 23 23 LEU C C 23 179.701 179.701 178.143 1.558 25061 13630 1 20 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.678 -0.382 25061 13631 1 20 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.718 -0.014 25061 13632 1 20 . 1 1 23 23 LEU H H 23 8.151 8.151 8.153 -0.002 25061 13633 1 20 . 1 1 24 24 LYS N N 24 114.622 114.622 115.475 -0.853 25061 13634 1 20 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.092 0.045 25061 13635 1 20 . 1 1 24 24 LYS C C 24 178.062 178.062 178.987 -0.925 25061 13636 1 20 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.317 -0.949 25061 13637 1 20 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.584 0.010 25061 13638 1 20 . 1 1 24 24 LYS H H 24 7.823 7.823 8.025 -0.202 25061 13639 1 20 . 1 1 25 25 SER N N 25 115.474 115.474 115.879 -0.405 25061 13640 1 20 . 1 1 25 25 SER HA H 25 4.377 4.377 4.288 0.089 25061 13641 1 20 . 1 1 25 25 SER C C 25 174.520 174.520 174.888 -0.368 25061 13642 1 20 . 1 1 25 25 SER CA C 25 61.049 61.049 60.734 0.315 25061 13643 1 20 . 1 1 25 25 SER CB C 25 63.777 63.777 64.071 -0.294 25061 13644 1 20 . 1 1 25 25 SER H H 25 7.798 7.798 7.710 0.088 25061 13645 1 20 . 1 1 26 26 ASP N N 26 117.424 117.424 118.150 -0.726 25061 13646 1 20 . 1 1 26 26 ASP HA H 26 4.886 4.886 4.876 0.010 25061 13647 1 20 . 1 1 26 26 ASP C C 26 173.521 173.521 173.981 -0.460 25061 13648 1 20 . 1 1 26 26 ASP CA C 26 52.048 52.048 53.282 -1.234 25061 13649 1 20 . 1 1 26 26 ASP CB C 26 42.202 42.202 42.567 -0.365 25061 13650 1 20 . 1 1 26 26 ASP H H 26 7.990 7.990 8.006 -0.016 25061 13651 1 20 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.618 0.027 25061 13652 1 20 . 1 1 27 27 PRO C C 27 177.016 177.016 176.416 0.600 25061 13653 1 20 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.182 0.419 25061 13654 1 20 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.274 -0.101 25061 13655 1 20 . 1 1 28 28 ASN N N 28 115.839 115.839 116.181 -0.342 25061 13656 1 20 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.636 0.056 25061 13657 1 20 . 1 1 28 28 ASN C C 28 175.701 175.701 175.468 0.233 25061 13658 1 20 . 1 1 28 28 ASN CA C 28 53.472 53.472 54.159 -0.687 25061 13659 1 20 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.436 -0.223 25061 13660 1 20 . 1 1 28 28 ASN H H 28 8.608 8.608 7.949 0.659 25061 13661 1 20 . 1 1 29 29 VAL N N 29 120.770 120.770 121.805 -1.035 25061 13662 1 20 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.824 -0.009 25061 13663 1 20 . 1 1 29 29 VAL C C 29 175.023 175.023 175.842 -0.819 25061 13664 1 20 . 1 1 29 29 VAL CA C 29 62.552 62.552 64.061 -1.509 25061 13665 1 20 . 1 1 29 29 VAL CB C 29 32.147 32.147 31.605 0.542 25061 13666 1 20 . 1 1 29 29 VAL H H 29 7.428 7.428 7.732 -0.304 25061 13667 1 20 . 1 1 30 30 LYS N N 30 127.345 127.345 130.477 -3.132 25061 13668 1 20 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.328 0.151 25061 13669 1 20 . 1 1 30 30 LYS C C 30 174.777 174.777 175.819 -1.042 25061 13670 1 20 . 1 1 30 30 LYS CA C 30 55.204 55.204 55.238 -0.034 25061 13671 1 20 . 1 1 30 30 LYS CB C 30 31.949 31.949 31.182 0.767 25061 13672 1 20 . 1 1 30 30 LYS H H 30 8.457 8.457 8.543 -0.086 25061 13673 1 20 . 1 1 31 31 THR N N 31 113.552 113.552 118.280 -4.728 25061 13674 1 20 . 1 1 31 31 THR HA H 31 5.723 5.723 4.862 0.861 25061 13675 1 20 . 1 1 31 31 THR C C 31 174.593 174.593 174.338 0.255 25061 13676 1 20 . 1 1 31 31 THR CA C 31 59.030 59.030 61.391 -2.361 25061 13677 1 20 . 1 1 31 31 THR CB C 31 72.206 72.206 69.072 3.134 25061 13678 1 20 . 1 1 31 31 THR H H 31 8.164 8.164 8.218 -0.054 25061 13679 1 20 . 1 1 32 32 VAL N N 32 119.206 119.206 128.688 -9.482 25061 13680 1 20 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.327 0.078 25061 13681 1 20 . 1 1 32 32 VAL C C 32 172.663 172.663 174.618 -1.955 25061 13682 1 20 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.619 -0.547 25061 13683 1 20 . 1 1 32 32 VAL CB C 32 35.051 35.051 33.087 1.964 25061 13684 1 20 . 1 1 32 32 VAL H H 32 8.615 8.615 8.693 -0.078 25061 13685 1 20 . 1 1 33 33 ARG N N 33 130.278 130.278 127.858 2.420 25061 13686 1 20 . 1 1 33 33 ARG HA H 33 5.331 5.331 4.916 0.415 25061 13687 1 20 . 1 1 33 33 ARG C C 33 173.836 173.836 175.721 -1.885 25061 13688 1 20 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.275 -1.125 25061 13689 1 20 . 1 1 33 33 ARG CB C 33 30.028 30.028 29.528 0.500 25061 13690 1 20 . 1 1 33 33 ARG H H 33 8.996 8.996 8.761 0.235 25061 13691 1 20 . 1 1 34 34 THR N N 34 121.695 121.695 116.416 5.279 25061 13692 1 20 . 1 1 34 34 THR HA H 34 4.483 4.483 4.180 0.303 25061 13693 1 20 . 1 1 34 34 THR C C 34 169.769 169.769 171.977 -2.208 25061 13694 1 20 . 1 1 34 34 THR CA C 34 60.814 60.814 61.641 -0.827 25061 13695 1 20 . 1 1 34 34 THR CB C 34 67.402 67.402 69.580 -2.178 25061 13696 1 20 . 1 1 34 34 THR H H 34 8.126 8.126 8.106 0.020 25061 13697 1 20 . 1 1 35 35 ASP N N 35 122.198 122.198 121.627 0.571 25061 13698 1 20 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.919 -0.095 25061 13699 1 20 . 1 1 35 35 ASP C C 35 174.790 174.790 174.670 0.120 25061 13700 1 20 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.004 -0.618 25061 13701 1 20 . 1 1 35 35 ASP CB C 35 41.848 41.848 42.241 -0.393 25061 13702 1 20 . 1 1 35 35 ASP H H 35 7.983 7.983 8.256 -0.273 25061 13703 1 20 . 1 1 36 36 ASP N N 36 121.091 121.091 125.710 -4.619 25061 13704 1 20 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.741 -0.148 25061 13705 1 20 . 1 1 36 36 ASP C C 36 176.189 176.189 176.683 -0.494 25061 13706 1 20 . 1 1 36 36 ASP CA C 36 53.055 53.055 53.089 -0.034 25061 13707 1 20 . 1 1 36 36 ASP CB C 36 42.159 42.159 41.190 0.969 25061 13708 1 20 . 1 1 36 36 ASP H H 36 8.157 8.157 8.643 -0.486 25061 13709 1 20 . 1 1 37 37 LYS N N 37 125.839 125.839 116.657 9.182 25061 13710 1 20 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.799 -0.077 25061 13711 1 20 . 1 1 37 37 LYS C C 37 176.870 176.870 177.754 -0.884 25061 13712 1 20 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.790 -0.386 25061 13713 1 20 . 1 1 37 37 LYS CB C 37 32.394 32.394 30.324 2.070 25061 13714 1 20 . 1 1 37 37 LYS H H 37 8.843 8.843 8.045 0.798 25061 13715 1 20 . 1 1 38 38 GLU N N 38 118.369 118.369 118.607 -0.238 25061 13716 1 20 . 1 1 38 38 GLU HA H 38 4.007 4.007 4.001 0.006 25061 13717 1 20 . 1 1 38 38 GLU C C 38 179.502 179.502 178.115 1.387 25061 13718 1 20 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.495 0.175 25061 13719 1 20 . 1 1 38 38 GLU CB C 38 28.474 28.474 29.316 -0.842 25061 13720 1 20 . 1 1 38 38 GLU H H 38 8.182 8.182 8.355 -0.173 25061 13721 1 20 . 1 1 39 39 LYS N N 39 121.722 121.722 119.880 1.842 25061 13722 1 20 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.073 0.092 25061 13723 1 20 . 1 1 39 39 LYS C C 39 178.500 178.500 178.394 0.106 25061 13724 1 20 . 1 1 39 39 LYS CA C 39 57.736 57.736 58.905 -1.169 25061 13725 1 20 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.455 -1.317 25061 13726 1 20 . 1 1 39 39 LYS H H 39 7.524 7.524 7.385 0.139 25061 13727 1 20 . 1 1 40 40 VAL N N 40 117.199 117.199 118.216 -1.017 25061 13728 1 20 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.653 -0.425 25061 13729 1 20 . 1 1 40 40 VAL C C 40 177.362 177.362 177.733 -0.371 25061 13730 1 20 . 1 1 40 40 VAL CA C 40 67.642 67.642 65.765 1.877 25061 13731 1 20 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.535 -0.632 25061 13732 1 20 . 1 1 40 40 VAL H H 40 7.883 7.883 7.563 0.320 25061 13733 1 20 . 1 1 41 41 LYS N N 41 117.677 117.677 118.839 -1.162 25061 13734 1 20 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.807 -0.365 25061 13735 1 20 . 1 1 41 41 LYS C C 41 177.686 177.686 178.490 -0.804 25061 13736 1 20 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.344 1.465 25061 13737 1 20 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.262 0.353 25061 13738 1 20 . 1 1 41 41 LYS H H 41 7.567 7.567 7.639 -0.072 25061 13739 1 20 . 1 1 42 42 GLU N N 42 118.369 118.369 118.798 -0.429 25061 13740 1 20 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.039 -0.032 25061 13741 1 20 . 1 1 42 42 GLU C C 42 179.725 179.725 178.482 1.243 25061 13742 1 20 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.161 -0.092 25061 13743 1 20 . 1 1 42 42 GLU CB C 42 29.539 29.539 28.811 0.728 25061 13744 1 20 . 1 1 42 42 GLU H H 42 7.634 7.634 7.605 0.029 25061 13745 1 20 . 1 1 43 43 GLU N N 43 117.906 117.906 119.641 -1.735 25061 13746 1 20 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.152 0.031 25061 13747 1 20 . 1 1 43 43 GLU C C 43 179.757 179.757 179.238 0.519 25061 13748 1 20 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.434 -0.069 25061 13749 1 20 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.114 -0.273 25061 13750 1 20 . 1 1 43 43 GLU H H 43 8.162 8.162 7.758 0.404 25061 13751 1 20 . 1 1 44 44 ILE N N 44 122.291 122.291 120.444 1.847 25061 13752 1 20 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.682 -0.070 25061 13753 1 20 . 1 1 44 44 ILE C C 44 177.101 177.101 177.799 -0.698 25061 13754 1 20 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.748 0.607 25061 13755 1 20 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.889 -0.429 25061 13756 1 20 . 1 1 44 44 ILE H H 44 8.742 8.742 8.135 0.607 25061 13757 1 20 . 1 1 45 45 GLU N N 45 119.892 119.892 120.989 -1.097 25061 13758 1 20 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.012 0.046 25061 13759 1 20 . 1 1 45 45 GLU C C 45 178.991 178.991 178.874 0.117 25061 13760 1 20 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.820 -0.155 25061 13761 1 20 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.554 -0.393 25061 13762 1 20 . 1 1 45 45 GLU H H 45 8.171 8.171 8.038 0.133 25061 13763 1 20 . 1 1 46 46 LYS N N 46 118.064 118.064 118.990 -0.926 25061 13764 1 20 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.046 -0.065 25061 13765 1 20 . 1 1 46 46 LYS C C 46 178.837 178.837 178.852 -0.015 25061 13766 1 20 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.266 0.476 25061 13767 1 20 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.286 0.157 25061 13768 1 20 . 1 1 46 46 LYS H H 46 7.785 7.785 7.862 -0.077 25061 13769 1 20 . 1 1 47 47 ALA N N 47 121.817 121.817 122.107 -0.290 25061 13770 1 20 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.041 -0.010 25061 13771 1 20 . 1 1 47 47 ALA C C 47 179.859 179.859 179.164 0.695 25061 13772 1 20 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.296 -0.001 25061 13773 1 20 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.540 -0.884 25061 13774 1 20 . 1 1 47 47 ALA H H 47 8.123 8.123 7.839 0.284 25061 13775 1 20 . 1 1 48 48 ARG N N 48 119.080 119.080 116.583 2.497 25061 13776 1 20 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.098 -0.009 25061 13777 1 20 . 1 1 48 48 ARG C C 48 180.155 180.155 178.406 1.749 25061 13778 1 20 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.545 0.652 25061 13779 1 20 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.862 -0.352 25061 13780 1 20 . 1 1 48 48 ARG H H 48 8.768 8.768 7.877 0.891 25061 13781 1 20 . 1 1 49 49 LYS N N 49 119.951 119.951 120.499 -0.548 25061 13782 1 20 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.154 -0.115 25061 13783 1 20 . 1 1 49 49 LYS C C 49 178.288 178.288 178.604 -0.316 25061 13784 1 20 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.604 0.233 25061 13785 1 20 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.725 -0.582 25061 13786 1 20 . 1 1 49 49 LYS H H 49 8.037 8.037 7.531 0.506 25061 13787 1 20 . 1 1 50 50 GLN N N 50 115.284 115.284 115.879 -0.595 25061 13788 1 20 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.241 0.101 25061 13789 1 20 . 1 1 50 50 GLN C C 50 176.180 176.180 177.299 -1.119 25061 13790 1 20 . 1 1 50 50 GLN CA C 50 55.741 55.741 56.336 -0.595 25061 13791 1 20 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.395 0.170 25061 13792 1 20 . 1 1 50 50 GLN H H 50 7.740 7.740 8.016 -0.276 25061 13793 1 20 . 1 1 51 51 GLY N N 51 109.725 109.725 109.530 0.195 25061 13794 1 20 . 1 1 51 51 GLY C C 51 174.552 174.552 174.204 0.348 25061 13795 1 20 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.476 0.887 25061 13796 1 20 . 1 1 51 51 GLY H H 51 8.027 8.027 7.884 0.143 25061 13797 1 20 . 1 1 52 52 ARG N N 52 119.064 119.064 119.717 -0.653 25061 13798 1 20 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.755 0.142 25061 13799 1 20 . 1 1 52 52 ARG C C 52 173.123 173.123 174.523 -1.400 25061 13800 1 20 . 1 1 52 52 ARG CA C 52 52.247 52.247 52.631 -0.384 25061 13801 1 20 . 1 1 52 52 ARG CB C 52 32.366 32.366 31.322 1.044 25061 13802 1 20 . 1 1 52 52 ARG H H 52 7.969 7.969 7.659 0.310 25061 13803 1 20 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.568 0.287 25061 13804 1 20 . 1 1 53 53 PRO C C 53 174.069 174.069 175.586 -1.517 25061 13805 1 20 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.999 -1.181 25061 13806 1 20 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.445 -0.385 25061 13807 1 20 . 1 1 54 54 ILE N N 54 116.301 116.301 122.664 -6.363 25061 13808 1 20 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.683 0.555 25061 13809 1 20 . 1 1 54 54 ILE C C 54 171.709 171.709 173.789 -2.080 25061 13810 1 20 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.124 -1.350 25061 13811 1 20 . 1 1 54 54 ILE CB C 54 41.558 41.558 41.325 0.233 25061 13812 1 20 . 1 1 54 54 ILE H H 54 7.920 7.920 7.867 0.053 25061 13813 1 20 . 1 1 55 55 VAL N N 55 126.302 126.302 129.783 -3.481 25061 13814 1 20 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.052 -0.128 25061 13815 1 20 . 1 1 55 55 VAL C C 55 173.624 173.624 175.184 -1.560 25061 13816 1 20 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.568 -0.773 25061 13817 1 20 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.358 0.470 25061 13818 1 20 . 1 1 55 55 VAL H H 55 8.652 8.652 8.421 0.231 25061 13819 1 20 . 1 1 56 56 ILE N N 56 127.503 127.503 128.425 -0.922 25061 13820 1 20 . 1 1 56 56 ILE HA H 56 4.664 4.664 4.823 -0.159 25061 13821 1 20 . 1 1 56 56 ILE C C 56 173.479 173.479 175.349 -1.870 25061 13822 1 20 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.668 0.339 25061 13823 1 20 . 1 1 56 56 ILE CB C 56 40.285 40.285 37.236 3.049 25061 13824 1 20 . 1 1 56 56 ILE H H 56 9.124 9.124 8.036 1.088 25061 13825 1 20 . 1 1 57 57 PHE N N 57 125.302 125.302 128.538 -3.236 25061 13826 1 20 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.428 -0.212 25061 13827 1 20 . 1 1 57 57 PHE C C 57 174.536 174.536 176.020 -1.484 25061 13828 1 20 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.383 -0.422 25061 13829 1 20 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.495 0.934 25061 13830 1 20 . 1 1 57 57 PHE H H 57 8.971 8.971 8.038 0.933 25061 13831 1 20 . 1 1 58 58 ILE N N 58 126.472 126.472 116.631 9.841 25061 13832 1 20 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.611 -0.096 25061 13833 1 20 . 1 1 58 58 ILE C C 58 173.391 173.391 173.707 -0.316 25061 13834 1 20 . 1 1 58 58 ILE CA C 58 59.090 59.090 58.699 0.391 25061 13835 1 20 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.105 -0.363 25061 13836 1 20 . 1 1 58 58 ILE H H 58 9.248 9.248 8.511 0.737 25061 13837 1 20 . 1 1 59 59 ARG N N 59 124.681 124.681 121.183 3.498 25061 13838 1 20 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.346 -0.417 25061 13839 1 20 . 1 1 59 59 ARG C C 59 178.521 178.521 178.189 0.332 25061 13840 1 20 . 1 1 59 59 ARG CA C 59 55.742 55.742 54.466 1.276 25061 13841 1 20 . 1 1 59 59 ARG CB C 59 30.918 30.918 33.145 -2.227 25061 13842 1 20 . 1 1 59 59 ARG H H 59 8.587 8.587 8.562 0.025 25061 13843 1 20 . 1 1 60 60 GLY N N 60 108.848 108.848 108.775 0.073 25061 13844 1 20 . 1 1 60 60 GLY C C 60 174.775 174.775 174.968 -0.193 25061 13845 1 20 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.348 -0.381 25061 13846 1 20 . 1 1 60 60 GLY H H 60 7.732 7.732 8.816 -1.084 25061 13847 1 20 . 1 1 61 61 ALA N N 61 120.877 120.877 123.911 -3.034 25061 13848 1 20 . 1 1 61 61 ALA HA H 61 4.144 4.144 3.924 0.220 25061 13849 1 20 . 1 1 61 61 ALA C C 61 177.769 177.769 179.341 -1.572 25061 13850 1 20 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.800 -0.351 25061 13851 1 20 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.392 -0.021 25061 13852 1 20 . 1 1 61 61 ALA H H 61 7.852 7.852 7.985 -0.133 25061 13853 1 20 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.273 0.527 25061 13854 1 20 . 1 1 62 62 TYR CA C 62 63.039 63.039 60.571 2.468 25061 13855 1 20 . 1 1 62 62 TYR CB C 62 37.440 37.440 38.052 -0.612 25061 13856 1 20 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.930 -0.245 25061 13857 1 20 . 1 1 63 63 GLU C C 63 176.251 176.251 178.721 -2.470 25061 13858 1 20 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.447 -0.189 25061 13859 1 20 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.194 0.218 25061 13860 1 20 . 1 1 64 64 GLU N N 64 119.209 119.209 119.229 -0.020 25061 13861 1 20 . 1 1 64 64 GLU HA H 64 3.901 3.901 2.952 0.949 25061 13862 1 20 . 1 1 64 64 GLU C C 64 178.251 178.251 178.920 -0.669 25061 13863 1 20 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.621 0.591 25061 13864 1 20 . 1 1 64 64 GLU CB C 64 28.645 28.645 29.257 -0.612 25061 13865 1 20 . 1 1 64 64 GLU H H 64 8.878 8.878 7.434 1.444 25061 13866 1 20 . 1 1 65 65 VAL N N 65 116.728 116.728 118.491 -1.763 25061 13867 1 20 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.946 0.036 25061 13868 1 20 . 1 1 65 65 VAL C C 65 176.915 176.915 178.079 -1.164 25061 13869 1 20 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.205 -0.596 25061 13870 1 20 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.833 0.062 25061 13871 1 20 . 1 1 65 65 VAL H H 65 7.652 7.652 7.665 -0.013 25061 13872 1 20 . 1 1 66 66 VAL N N 66 119.462 119.462 119.401 0.061 25061 13873 1 20 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.703 -0.389 25061 13874 1 20 . 1 1 66 66 VAL C C 66 177.142 177.142 177.590 -0.448 25061 13875 1 20 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.150 1.185 25061 13876 1 20 . 1 1 66 66 VAL CB C 66 31.430 31.430 30.953 0.477 25061 13877 1 20 . 1 1 66 66 VAL H H 66 7.896 7.896 7.511 0.385 25061 13878 1 20 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.010 -0.382 25061 13879 1 20 . 1 1 67 67 ARG C C 67 177.841 177.841 178.374 -0.533 25061 13880 1 20 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.560 0.492 25061 13881 1 20 . 1 1 67 67 ARG CB C 67 29.393 29.393 29.809 -0.416 25061 13882 1 20 . 1 1 68 68 ASP N N 68 118.316 118.316 119.436 -1.120 25061 13883 1 20 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.513 -0.152 25061 13884 1 20 . 1 1 68 68 ASP C C 68 178.945 178.945 179.024 -0.079 25061 13885 1 20 . 1 1 68 68 ASP CA C 68 57.311 57.311 57.497 -0.186 25061 13886 1 20 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.728 0.786 25061 13887 1 20 . 1 1 68 68 ASP H H 68 7.625 7.625 7.851 -0.226 25061 13888 1 20 . 1 1 69 69 ILE N N 69 119.231 119.231 120.778 -1.547 25061 13889 1 20 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.660 -0.030 25061 13890 1 20 . 1 1 69 69 ILE C C 69 177.138 177.138 177.881 -0.743 25061 13891 1 20 . 1 1 69 69 ILE CA C 69 64.540 64.540 64.800 -0.260 25061 13892 1 20 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.740 -0.690 25061 13893 1 20 . 1 1 69 69 ILE H H 69 8.113 8.113 7.372 0.741 25061 13894 1 20 . 1 1 70 70 VAL N N 70 120.164 120.164 119.476 0.688 25061 13895 1 20 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.527 -0.110 25061 13896 1 20 . 1 1 70 70 VAL C C 70 177.079 177.079 177.419 -0.340 25061 13897 1 20 . 1 1 70 70 VAL CA C 70 67.274 67.274 66.963 0.311 25061 13898 1 20 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.326 -0.068 25061 13899 1 20 . 1 1 70 70 VAL H H 70 8.478 8.478 8.239 0.239 25061 13900 1 20 . 1 1 71 71 GLU N N 71 118.293 118.293 119.710 -1.417 25061 13901 1 20 . 1 1 71 71 GLU HA H 71 4.054 4.054 3.963 0.091 25061 13902 1 20 . 1 1 71 71 GLU C C 71 179.009 179.009 178.559 0.450 25061 13903 1 20 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.410 0.006 25061 13904 1 20 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.422 -0.600 25061 13905 1 20 . 1 1 71 71 GLU H H 71 8.152 8.152 7.839 0.313 25061 13906 1 20 . 1 1 72 72 TYR N N 72 120.091 120.091 120.405 -0.314 25061 13907 1 20 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.195 -0.033 25061 13908 1 20 . 1 1 72 72 TYR C C 72 176.404 176.404 176.980 -0.576 25061 13909 1 20 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.360 -0.228 25061 13910 1 20 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.408 -0.271 25061 13911 1 20 . 1 1 72 72 TYR H H 72 7.959 7.959 7.710 0.249 25061 13912 1 20 . 1 1 73 73 ALA N N 73 120.133 120.133 120.704 -0.571 25061 13913 1 20 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.834 -0.204 25061 13914 1 20 . 1 1 73 73 ALA C C 73 179.182 179.182 179.260 -0.078 25061 13915 1 20 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.068 0.044 25061 13916 1 20 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.270 -0.079 25061 13917 1 20 . 1 1 73 73 ALA H H 73 8.604 8.604 7.703 0.901 25061 13918 1 20 . 1 1 74 74 GLN N N 74 115.553 115.553 118.300 -2.747 25061 13919 1 20 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.994 0.144 25061 13920 1 20 . 1 1 74 74 GLN C C 74 180.595 180.595 179.261 1.334 25061 13921 1 20 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.735 0.360 25061 13922 1 20 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.921 -0.346 25061 13923 1 20 . 1 1 74 74 GLN H H 74 8.619 8.619 8.241 0.378 25061 13924 1 20 . 1 1 75 75 LYS N N 75 122.396 122.396 118.682 3.714 25061 13925 1 20 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.022 0.006 25061 13926 1 20 . 1 1 75 75 LYS C C 75 178.521 178.521 178.505 0.016 25061 13927 1 20 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.620 0.438 25061 13928 1 20 . 1 1 75 75 LYS CB C 75 31.599 31.599 32.025 -0.426 25061 13929 1 20 . 1 1 75 75 LYS H H 75 8.123 8.123 7.588 0.535 25061 13930 1 20 . 1 1 76 76 GLU N N 76 116.294 116.294 116.749 -0.455 25061 13931 1 20 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.198 -0.099 25061 13932 1 20 . 1 1 76 76 GLU C C 76 175.957 175.957 177.036 -1.079 25061 13933 1 20 . 1 1 76 76 GLU CA C 76 55.605 55.605 55.702 -0.097 25061 13934 1 20 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.164 0.660 25061 13935 1 20 . 1 1 76 76 GLU H H 76 7.450 7.450 7.521 -0.071 25061 13936 1 20 . 1 1 77 77 GLY N N 77 107.446 107.446 107.062 0.384 25061 13937 1 20 . 1 1 77 77 GLY C C 77 174.520 174.520 174.420 0.100 25061 13938 1 20 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.560 0.247 25061 13939 1 20 . 1 1 77 77 GLY H H 77 7.763 7.763 7.618 0.145 25061 13940 1 20 . 1 1 78 78 LEU N N 78 120.179 120.179 120.841 -0.662 25061 13941 1 20 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.564 -0.176 25061 13942 1 20 . 1 1 78 78 LEU C C 78 175.914 175.914 176.194 -0.280 25061 13943 1 20 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.366 0.106 25061 13944 1 20 . 1 1 78 78 LEU CB C 78 41.889 41.889 43.189 -1.300 25061 13945 1 20 . 1 1 78 78 LEU H H 78 7.930 7.930 7.960 -0.030 25061 13946 1 20 . 1 1 79 79 ARG N N 79 122.207 122.207 124.325 -2.118 25061 13947 1 20 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.266 0.131 25061 13948 1 20 . 1 1 79 79 ARG C C 79 174.960 174.960 174.676 0.284 25061 13949 1 20 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.934 -0.286 25061 13950 1 20 . 1 1 79 79 ARG CB C 79 30.476 30.476 30.724 -0.248 25061 13951 1 20 . 1 1 79 79 ARG H H 79 8.241 8.241 8.752 -0.511 25061 13952 1 20 . 1 1 80 80 VAL N N 80 123.333 123.333 125.716 -2.383 25061 13953 1 20 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.705 0.590 25061 13954 1 20 . 1 1 80 80 VAL C C 80 174.048 174.048 174.392 -0.344 25061 13955 1 20 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.987 -1.946 25061 13956 1 20 . 1 1 80 80 VAL CB C 80 34.305 34.305 33.048 1.257 25061 13957 1 20 . 1 1 80 80 VAL H H 80 8.359 8.359 8.594 -0.235 25061 13958 1 20 . 1 1 81 81 LEU N N 81 128.719 128.719 129.445 -0.726 25061 13959 1 20 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.259 -0.155 25061 13960 1 20 . 1 1 81 81 LEU C C 81 174.484 174.484 174.698 -0.214 25061 13961 1 20 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.877 0.242 25061 13962 1 20 . 1 1 81 81 LEU CB C 81 44.955 44.955 46.069 -1.114 25061 13963 1 20 . 1 1 81 81 LEU H H 81 8.650 8.650 9.009 -0.359 25061 13964 1 20 . 1 1 82 82 VAL N N 82 122.487 122.487 124.152 -1.665 25061 13965 1 20 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.637 0.460 25061 13966 1 20 . 1 1 82 82 VAL C C 82 174.525 174.525 174.360 0.165 25061 13967 1 20 . 1 1 82 82 VAL CA C 82 60.285 60.285 60.193 0.092 25061 13968 1 20 . 1 1 82 82 VAL CB C 82 34.789 34.789 31.501 3.288 25061 13969 1 20 . 1 1 82 82 VAL H H 82 8.781 8.781 8.687 0.094 25061 13970 1 20 . 1 1 83 83 ILE N N 83 128.082 128.082 128.659 -0.577 25061 13971 1 20 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.964 -0.034 25061 13972 1 20 . 1 1 83 83 ILE C C 83 172.925 172.925 175.077 -2.152 25061 13973 1 20 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.465 -0.524 25061 13974 1 20 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.211 1.975 25061 13975 1 20 . 1 1 83 83 ILE H H 83 9.527 9.527 8.594 0.933 25061 13976 1 20 . 1 1 84 84 LYS N N 84 128.493 128.493 126.644 1.849 25061 13977 1 20 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.310 -0.262 25061 13978 1 20 . 1 1 84 84 LYS C C 84 174.027 174.027 175.414 -1.387 25061 13979 1 20 . 1 1 84 84 LYS CA C 84 53.253 53.253 53.952 -0.699 25061 13980 1 20 . 1 1 84 84 LYS CB C 84 34.652 34.652 36.240 -1.588 25061 13981 1 20 . 1 1 84 84 LYS H H 84 8.721 8.721 8.709 0.012 25061 13982 1 20 . 1 1 85 85 VAL N N 85 126.729 126.729 124.769 1.960 25061 13983 1 20 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.229 0.507 25061 13984 1 20 . 1 1 85 85 VAL C C 85 175.935 175.935 175.042 0.893 25061 13985 1 20 . 1 1 85 85 VAL CA C 85 60.200 60.200 62.557 -2.357 25061 13986 1 20 . 1 1 85 85 VAL CB C 85 30.847 30.847 31.685 -0.838 25061 13987 1 20 . 1 1 85 85 VAL H H 85 8.643 8.643 8.423 0.220 25061 13988 1 20 . 1 1 86 86 ALA N N 86 132.930 132.930 130.604 2.326 25061 13989 1 20 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.792 -0.362 25061 13990 1 20 . 1 1 86 86 ALA C C 86 175.635 175.635 175.032 0.603 25061 13991 1 20 . 1 1 86 86 ALA CA C 86 51.504 51.504 50.958 0.546 25061 13992 1 20 . 1 1 86 86 ALA CB C 86 20.821 20.821 21.553 -0.732 25061 13993 1 20 . 1 1 86 86 ALA H H 86 8.835 8.835 8.336 0.499 25061 13994 1 20 . 1 1 87 87 GLN N N 87 118.719 118.719 116.048 2.671 25061 13995 1 20 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.729 -0.260 25061 13996 1 20 . 1 1 87 87 GLN C C 87 175.949 175.949 174.615 1.334 25061 13997 1 20 . 1 1 87 87 GLN CA C 87 55.260 55.260 54.187 1.073 25061 13998 1 20 . 1 1 87 87 GLN CB C 87 30.432 30.432 32.023 -1.591 25061 13999 1 20 . 1 1 87 87 GLN H H 87 8.570 8.570 8.323 0.247 25061 14000 1 20 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.468 0.012 25061 14001 1 20 . 1 1 88 88 ASP CA C 88 55.454 55.454 54.904 0.550 25061 14002 1 20 . 1 1 88 88 ASP CB C 88 41.204 41.204 40.084 1.121 25061 14003 1 20 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.590 -0.543 25061 14004 1 20 . 1 1 89 89 GLN CA C 89 56.687 56.687 54.324 2.363 25061 14005 1 20 . 1 1 89 89 GLN CB C 89 27.850 27.850 31.194 -3.344 25061 14006 1 20 . 1 1 92 92 LEU N N 92 125.291 125.291 119.011 6.280 25061 14007 1 20 . 1 1 92 92 LEU HA H 92 4.201 4.201 3.982 0.219 25061 14008 1 20 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.829 -2.772 25061 14009 1 20 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.525 0.521 25061 14010 1 20 . 1 1 92 92 LEU H H 92 8.277 8.277 7.954 0.323 25061 14011 1 20 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.230 0.526 25061 14012 1 20 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.115 -0.066 25061 14013 1 20 . 1 1 94 94 ARG C C 94 178.544 178.544 178.238 0.306 25061 14014 1 20 . 1 1 94 94 ARG CA C 94 58.607 58.607 59.147 -0.540 25061 14015 1 20 . 1 1 94 94 ARG CB C 94 29.614 29.614 30.228 -0.614 25061 14016 1 20 . 1 1 95 95 PHE N N 95 117.407 117.407 119.377 -1.970 25061 14017 1 20 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.334 0.041 25061 14018 1 20 . 1 1 95 95 PHE CA C 95 60.231 60.231 59.330 0.901 25061 14019 1 20 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.756 -1.814 25061 14020 1 20 . 1 1 95 95 PHE H H 95 8.419 8.419 7.623 0.796 25061 14021 1 20 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.824 -0.016 25061 14022 1 20 . 1 1 96 96 TYR C C 96 177.728 177.728 177.103 0.625 25061 14023 1 20 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.254 1.902 25061 14024 1 20 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.332 -0.632 25061 14025 1 20 . 1 1 97 97 GLU N N 97 119.054 119.054 118.571 0.483 25061 14026 1 20 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.726 0.337 25061 14027 1 20 . 1 1 97 97 GLU C C 97 179.071 179.071 178.733 0.338 25061 14028 1 20 . 1 1 97 97 GLU CA C 97 58.760 58.760 59.310 -0.551 25061 14029 1 20 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.228 -0.056 25061 14030 1 20 . 1 1 97 97 GLU H H 97 7.858 7.858 8.125 -0.267 25061 14031 1 20 . 1 1 98 98 GLN N N 98 119.385 119.385 117.815 1.570 25061 14032 1 20 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.923 -0.022 25061 14033 1 20 . 1 1 98 98 GLN C C 98 177.599 177.599 178.363 -0.764 25061 14034 1 20 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.685 -0.374 25061 14035 1 20 . 1 1 98 98 GLN CB C 98 27.766 27.766 27.924 -0.158 25061 14036 1 20 . 1 1 98 98 GLN H H 98 7.747 7.747 7.687 0.060 25061 14037 1 20 . 1 1 99 99 LEU N N 99 118.348 118.348 119.068 -0.720 25061 14038 1 20 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.844 0.175 25061 14039 1 20 . 1 1 99 99 LEU C C 99 178.669 178.669 178.673 -0.004 25061 14040 1 20 . 1 1 99 99 LEU CA C 99 57.430 57.430 57.996 -0.566 25061 14041 1 20 . 1 1 99 99 LEU CB C 99 41.503 41.503 40.958 0.545 25061 14042 1 20 . 1 1 99 99 LEU H H 99 7.891 7.891 7.054 0.837 25061 14043 1 20 . 1 1 100 100 LYS N N 100 118.332 118.332 117.143 1.189 25061 14044 1 20 . 1 1 100 100 LYS HA H 100 4.509 4.509 3.988 0.521 25061 14045 1 20 . 1 1 100 100 LYS C C 100 180.846 180.846 178.986 1.860 25061 14046 1 20 . 1 1 100 100 LYS CA C 100 59.088 59.088 57.490 1.598 25061 14047 1 20 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.706 0.563 25061 14048 1 20 . 1 1 100 100 LYS H H 100 7.560 7.560 7.122 0.438 25061 14049 1 20 . 1 1 101 101 LYS N N 101 121.944 121.944 120.298 1.646 25061 14050 1 20 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.075 -0.003 25061 14051 1 20 . 1 1 101 101 LYS C C 101 177.707 177.707 177.752 -0.045 25061 14052 1 20 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.706 0.165 25061 14053 1 20 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.521 -0.426 25061 14054 1 20 . 1 1 101 101 LYS H H 101 7.959 7.959 7.695 0.264 25061 14055 1 20 . 1 1 102 102 ASP N N 102 118.788 118.788 116.232 2.556 25061 14056 1 20 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.626 0.068 25061 14057 1 20 . 1 1 102 102 ASP C C 102 176.359 176.359 176.088 0.271 25061 14058 1 20 . 1 1 102 102 ASP CA C 102 54.579 54.579 54.753 -0.174 25061 14059 1 20 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.933 -1.359 25061 14060 1 20 . 1 1 102 102 ASP H H 102 7.893 7.893 7.769 0.124 25061 14061 1 20 . 1 1 103 103 GLY N N 103 107.024 107.024 108.639 -1.615 25061 14062 1 20 . 1 1 103 103 GLY C C 103 174.328 174.328 173.538 0.790 25061 14063 1 20 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.797 0.548 25061 14064 1 20 . 1 1 103 103 GLY H H 103 7.866 7.866 7.662 0.204 25061 14065 1 20 . 1 1 104 104 VAL N N 104 123.060 123.060 120.573 2.487 25061 14066 1 20 . 1 1 104 104 VAL HA H 104 3.973 3.973 4.192 -0.219 25061 14067 1 20 . 1 1 104 104 VAL C C 104 175.023 175.023 174.588 0.435 25061 14068 1 20 . 1 1 104 104 VAL CA C 104 61.878 61.878 60.341 1.537 25061 14069 1 20 . 1 1 104 104 VAL CB C 104 32.088 32.088 34.447 -2.359 25061 14070 1 20 . 1 1 104 104 VAL H H 104 7.955 7.955 8.036 -0.081 25061 14071 1 20 . 1 1 105 105 ASP N N 105 127.987 127.987 128.900 -0.913 25061 14072 1 20 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.589 -0.014 25061 14073 1 20 . 1 1 105 105 ASP C C 105 173.624 173.624 175.316 -1.692 25061 14074 1 20 . 1 1 105 105 ASP CA C 105 54.087 54.087 54.997 -0.910 25061 14075 1 20 . 1 1 105 105 ASP CB C 105 40.660 40.660 40.879 -0.219 25061 14076 1 20 . 1 1 105 105 ASP H H 105 8.399 8.399 8.202 0.197 25061 14077 1 20 . 1 1 106 106 VAL N N 106 125.798 125.798 119.713 6.085 25061 14078 1 20 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.758 0.057 25061 14079 1 20 . 1 1 106 106 VAL C C 106 174.902 174.902 175.924 -1.022 25061 14080 1 20 . 1 1 106 106 VAL CA C 106 60.194 60.194 61.188 -0.994 25061 14081 1 20 . 1 1 106 106 VAL CB C 106 34.179 34.179 33.108 1.071 25061 14082 1 20 . 1 1 106 106 VAL H H 106 7.550 7.550 8.013 -0.463 25061 14083 1 20 . 1 1 107 107 ARG N N 107 128.099 128.099 128.180 -0.081 25061 14084 1 20 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.801 0.075 25061 14085 1 20 . 1 1 107 107 ARG C C 107 173.815 173.815 174.391 -0.576 25061 14086 1 20 . 1 1 107 107 ARG CA C 107 53.386 53.386 54.216 -0.830 25061 14087 1 20 . 1 1 107 107 ARG CB C 107 31.195 31.195 31.416 -0.221 25061 14088 1 20 . 1 1 107 107 ARG H H 107 9.132 9.132 8.902 0.231 25061 14089 1 20 . 1 1 108 108 VAL N N 108 123.979 123.979 121.385 2.594 25061 14090 1 20 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.142 -0.200 25061 14091 1 20 . 1 1 108 108 VAL C C 108 175.854 175.854 176.953 -1.099 25061 14092 1 20 . 1 1 108 108 VAL CA C 108 60.017 60.017 60.110 -0.093 25061 14093 1 20 . 1 1 108 108 VAL CB C 108 32.844 32.844 33.002 -0.158 25061 14094 1 20 . 1 1 108 108 VAL H H 108 8.561 8.561 8.319 0.242 25061 14095 1 20 . 1 1 109 109 THR N N 109 120.144 120.144 118.677 1.467 25061 14096 1 20 . 1 1 109 109 THR HA H 109 4.815 4.815 4.271 0.544 25061 14097 1 20 . 1 1 109 109 THR C C 109 171.867 171.867 175.382 -3.515 25061 14098 1 20 . 1 1 109 109 THR CA C 109 59.613 59.613 61.815 -2.202 25061 14099 1 20 . 1 1 109 109 THR CB C 109 69.720 69.720 69.326 0.394 25061 14100 1 20 . 1 1 109 109 THR H H 109 8.803 8.803 8.798 0.005 25061 14101 1 20 . 1 1 110 110 ASP N N 110 123.212 123.212 119.887 3.325 25061 14102 1 20 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.443 0.526 25061 14103 1 20 . 1 1 110 110 ASP C C 110 175.739 175.739 174.573 1.166 25061 14104 1 20 . 1 1 110 110 ASP CA C 110 53.243 53.243 55.323 -2.080 25061 14105 1 20 . 1 1 110 110 ASP CB C 110 41.351 41.351 39.801 1.550 25061 14106 1 20 . 1 1 110 110 ASP H H 110 8.363 8.363 8.935 -0.572 25061 14107 1 20 . 1 1 111 111 ASN N N 111 116.298 116.298 115.589 0.709 25061 14108 1 20 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.831 0.045 25061 14109 1 20 . 1 1 111 111 ASN C C 111 174.756 174.756 174.722 0.034 25061 14110 1 20 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.706 -0.575 25061 14111 1 20 . 1 1 111 111 ASN CB C 111 40.765 40.765 40.443 0.322 25061 14112 1 20 . 1 1 111 111 ASN H H 111 8.085 8.085 7.517 0.568 25061 14113 1 20 . 1 1 112 112 GLU HA H 112 3.848 3.848 3.981 -0.133 25061 14114 1 20 . 1 1 112 112 GLU C C 112 177.016 177.016 177.379 -0.363 25061 14115 1 20 . 1 1 112 112 GLU CA C 112 59.480 59.480 59.770 -0.290 25061 14116 1 20 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.799 -0.126 25061 14117 1 20 . 1 1 113 113 ASP N N 113 121.033 121.033 117.834 3.199 25061 14118 1 20 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.350 0.063 25061 14119 1 20 . 1 1 113 113 ASP C C 113 178.988 178.988 177.908 1.080 25061 14120 1 20 . 1 1 113 113 ASP CA C 113 57.855 57.855 56.619 1.236 25061 14121 1 20 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.626 -0.124 25061 14122 1 20 . 1 1 113 113 ASP H H 113 8.219 8.219 8.102 0.117 25061 14123 1 20 . 1 1 114 114 GLU N N 114 121.280 121.280 121.757 -0.477 25061 14124 1 20 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.115 -0.050 25061 14125 1 20 . 1 1 114 114 GLU C C 114 178.776 178.776 177.657 1.119 25061 14126 1 20 . 1 1 114 114 GLU CA C 114 58.714 58.714 58.471 0.242 25061 14127 1 20 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.027 0.186 25061 14128 1 20 . 1 1 114 114 GLU H H 114 8.296 8.296 8.242 0.054 25061 14129 1 20 . 1 1 115 115 ALA N N 115 120.924 120.924 121.930 -1.006 25061 14130 1 20 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.130 -0.292 25061 14131 1 20 . 1 1 115 115 ALA C C 115 178.502 178.502 179.344 -0.842 25061 14132 1 20 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.064 0.574 25061 14133 1 20 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.310 0.187 25061 14134 1 20 . 1 1 115 115 ALA H H 115 7.853 7.853 7.710 0.143 25061 14135 1 20 . 1 1 116 116 LYS N N 116 116.616 116.616 118.571 -1.955 25061 14136 1 20 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.955 -0.236 25061 14137 1 20 . 1 1 116 116 LYS C C 116 178.097 178.097 178.792 -0.695 25061 14138 1 20 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.618 1.134 25061 14139 1 20 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.285 0.270 25061 14140 1 20 . 1 1 116 116 LYS H H 116 8.091 8.091 7.585 0.506 25061 14141 1 20 . 1 1 117 117 LYS N N 117 118.990 118.990 118.562 0.428 25061 14142 1 20 . 1 1 117 117 LYS HA H 117 3.911 3.911 3.976 -0.065 25061 14143 1 20 . 1 1 117 117 LYS C C 117 179.186 179.186 179.180 0.006 25061 14144 1 20 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.593 -0.022 25061 14145 1 20 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.316 0.204 25061 14146 1 20 . 1 1 117 117 LYS H H 117 7.742 7.742 7.959 -0.217 25061 14147 1 20 . 1 1 118 118 ARG N N 118 117.441 117.441 119.590 -2.149 25061 14148 1 20 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.104 0.036 25061 14149 1 20 . 1 1 118 118 ARG C C 118 178.921 178.921 178.721 0.200 25061 14150 1 20 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.586 -0.915 25061 14151 1 20 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.598 0.063 25061 14152 1 20 . 1 1 118 118 ARG H H 118 8.468 8.468 7.658 0.810 25061 14153 1 20 . 1 1 119 119 LEU N N 119 120.100 120.100 120.064 0.036 25061 14154 1 20 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.944 0.016 25061 14155 1 20 . 1 1 119 119 LEU C C 119 177.554 177.554 178.697 -1.143 25061 14156 1 20 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.662 -0.781 25061 14157 1 20 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.483 0.405 25061 14158 1 20 . 1 1 119 119 LEU H H 119 8.322 8.322 8.119 0.203 25061 14159 1 20 . 1 1 120 120 LYS N N 120 118.238 118.238 119.084 -0.846 25061 14160 1 20 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.919 -0.097 25061 14161 1 20 . 1 1 120 120 LYS C C 120 178.703 178.703 178.862 -0.159 25061 14162 1 20 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.658 0.688 25061 14163 1 20 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.107 0.129 25061 14164 1 20 . 1 1 120 120 LYS H H 120 7.990 7.990 7.847 0.143 25061 14165 1 20 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.063 -0.041 25061 14166 1 20 . 1 1 121 121 GLU C C 121 177.769 177.769 178.805 -1.036 25061 14167 1 20 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.151 -0.229 25061 14168 1 20 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.336 0.118 25061 14169 1 20 . 1 1 122 122 LEU N N 122 119.454 119.454 118.134 1.320 25061 14170 1 20 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.143 -0.010 25061 14171 1 20 . 1 1 122 122 LEU C C 122 178.991 178.991 179.464 -0.473 25061 14172 1 20 . 1 1 122 122 LEU CA C 122 57.326 57.326 56.911 0.415 25061 14173 1 20 . 1 1 122 122 LEU CB C 122 41.679 41.679 42.169 -0.490 25061 14174 1 20 . 1 1 122 122 LEU H H 122 7.930 7.930 7.954 -0.024 25061 14175 1 20 . 1 1 123 123 LEU N N 123 117.862 117.862 120.109 -2.247 25061 14176 1 20 . 1 1 123 123 LEU HA H 123 4.067 4.067 4.041 0.026 25061 14177 1 20 . 1 1 123 123 LEU C C 123 179.178 179.178 179.710 -0.532 25061 14178 1 20 . 1 1 123 123 LEU CA C 123 56.920 56.920 58.085 -1.165 25061 14179 1 20 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.336 -0.126 25061 14180 1 20 . 1 1 123 123 LEU H H 123 8.095 8.095 8.116 -0.021 25061 14181 1 20 . 1 1 124 124 GLU N N 124 118.975 118.975 118.467 0.508 25061 14182 1 20 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.139 -0.010 25061 14183 1 20 . 1 1 124 124 GLU C C 124 177.777 177.777 177.201 0.576 25061 14184 1 20 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.840 -0.753 25061 14185 1 20 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.374 0.166 25061 14186 1 20 . 1 1 124 124 GLU H H 124 7.930 7.930 8.038 -0.108 25061 14187 1 20 . 1 1 125 125 LYS N N 125 118.933 118.933 117.836 1.097 25061 14188 1 20 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.490 -0.153 25061 14189 1 20 . 1 1 125 125 LYS C C 125 178.188 178.188 175.263 2.925 25061 14190 1 20 . 1 1 125 125 LYS CA C 125 56.980 56.980 55.387 1.593 25061 14191 1 20 . 1 1 125 125 LYS CB C 125 32.608 32.608 33.253 -0.645 25061 14192 1 20 . 1 1 125 125 LYS H H 125 7.729 7.729 7.329 0.400 25061 14193 1 20 . 1 1 126 126 VAL N N 126 117.933 117.933 119.286 -1.353 25061 14194 1 20 . 1 1 126 126 VAL HA H 126 4.022 4.022 3.602 0.420 25061 14195 1 20 . 1 1 126 126 VAL C C 126 176.947 176.947 176.239 0.708 25061 14196 1 20 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.208 0.433 25061 14197 1 20 . 1 1 126 126 VAL CB C 126 31.859 31.859 30.415 1.444 25061 14198 1 20 . 1 1 126 126 VAL H H 126 8.044 8.044 7.606 0.438 25061 14199 1 20 . 1 1 127 127 GLY N N 127 109.813 109.813 113.966 -4.153 25061 14200 1 20 . 1 1 127 127 GLY C C 127 174.264 174.264 173.560 0.704 25061 14201 1 20 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.946 -0.667 25061 14202 1 20 . 1 1 127 127 GLY H H 127 8.279 8.279 8.552 -0.273 25061 14203 1 20 . 1 1 128 128 SER N N 128 115.185 115.185 115.006 0.179 25061 14204 1 20 . 1 1 128 128 SER HA H 128 4.462 4.462 4.708 -0.246 25061 14205 1 20 . 1 1 128 128 SER C C 128 174.775 174.775 174.326 0.449 25061 14206 1 20 . 1 1 128 128 SER CA C 128 58.739 58.739 57.762 0.977 25061 14207 1 20 . 1 1 128 128 SER CB C 128 63.850 63.850 64.626 -0.776 25061 14208 1 20 . 1 1 128 128 SER H H 128 8.048 8.048 7.932 0.116 25061 14209 1 20 . 1 1 129 129 LEU N N 129 123.060 123.060 128.644 -5.584 25061 14210 1 20 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.306 -0.008 25061 14211 1 20 . 1 1 129 129 LEU C C 129 177.313 177.313 176.525 0.788 25061 14212 1 20 . 1 1 129 129 LEU CA C 129 55.158 55.158 57.263 -2.105 25061 14213 1 20 . 1 1 129 129 LEU CB C 129 41.837 41.837 42.243 -0.406 25061 14214 1 20 . 1 1 129 129 LEU H H 129 8.147 8.147 8.671 -0.524 25061 14215 1 20 . 1 1 130 130 GLU N N 130 120.088 120.088 113.444 6.644 25061 14216 1 20 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.354 -0.173 25061 14217 1 20 . 1 1 130 130 GLU C C 130 176.148 176.148 175.440 0.708 25061 14218 1 20 . 1 1 130 130 GLU CA C 130 56.726 56.726 55.575 1.151 25061 14219 1 20 . 1 1 130 130 GLU CB C 130 30.026 30.026 29.857 0.169 25061 14220 1 20 . 1 1 130 130 GLU H H 130 8.242 8.242 7.890 0.352 25061 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 112 2.364 0.074 2.374 25061 2 1 1 "Average Difference" HA 120 0.270 -0.028 0.270 25061 3 1 1 "Average Difference" C 120 1.161 0.318 1.122 25061 4 1 1 "Average Difference" CA 126 1.064 0.196 1.049 25061 5 1 1 "Average Difference" CB 121 1.106 0.066 1.109 25061 6 1 1 "Average Difference" HN 112 0.411 -0.145 0.386 25061 7 1 2 "Average Difference" N 112 2.121 -0.073 2.130 25061 8 1 2 "Average Difference" HA 120 0.306 -0.028 0.306 25061 9 1 2 "Average Difference" C 120 1.190 0.357 1.140 25061 10 1 2 "Average Difference" CA 126 1.210 0.269 1.185 25061 11 1 2 "Average Difference" CB 121 1.019 0.059 1.022 25061 12 1 2 "Average Difference" HN 112 0.405 -0.153 0.377 25061 13 1 3 "Average Difference" N 112 2.287 -0.002 2.297 25061 14 1 3 "Average Difference" HA 120 0.266 -0.008 0.267 25061 15 1 3 "Average Difference" C 120 1.120 0.377 1.059 25061 16 1 3 "Average Difference" CA 126 1.061 0.203 1.045 25061 17 1 3 "Average Difference" CB 121 1.070 0.003 1.074 25061 18 1 3 "Average Difference" HN 112 0.422 -0.157 0.393 25061 19 1 4 "Average Difference" N 112 2.697 -0.027 2.709 25061 20 1 4 "Average Difference" HA 120 0.257 -0.015 0.257 25061 21 1 4 "Average Difference" C 120 1.101 0.260 1.075 25061 22 1 4 "Average Difference" CA 126 1.051 0.148 1.044 25061 23 1 4 "Average Difference" CB 121 1.044 0.029 1.048 25061 24 1 4 "Average Difference" HN 112 0.424 -0.170 0.390 25061 25 1 5 "Average Difference" N 112 2.375 0.019 2.386 25061 26 1 5 "Average Difference" HA 120 0.293 -0.042 0.292 25061 27 1 5 "Average Difference" C 120 1.175 0.342 1.129 25061 28 1 5 "Average Difference" CA 126 1.071 0.163 1.063 25061 29 1 5 "Average Difference" CB 121 1.057 -0.015 1.061 25061 30 1 5 "Average Difference" HN 112 0.408 -0.169 0.373 25061 31 1 6 "Average Difference" N 112 2.715 0.226 2.718 25061 32 1 6 "Average Difference" HA 120 0.287 -0.004 0.288 25061 33 1 6 "Average Difference" C 120 1.082 0.275 1.050 25061 34 1 6 "Average Difference" CA 126 0.974 0.093 0.974 25061 35 1 6 "Average Difference" CB 121 1.115 0.054 1.118 25061 36 1 6 "Average Difference" HN 112 0.411 -0.158 0.381 25061 37 1 7 "Average Difference" N 112 2.487 0.205 2.490 25061 38 1 7 "Average Difference" HA 120 0.259 0.010 0.259 25061 39 1 7 "Average Difference" C 120 1.080 0.273 1.050 25061 40 1 7 "Average Difference" CA 126 1.007 0.037 1.011 25061 41 1 7 "Average Difference" CB 121 1.002 0.108 1.000 25061 42 1 7 "Average Difference" HN 112 0.410 -0.173 0.373 25061 43 1 8 "Average Difference" N 112 2.179 0.037 2.188 25061 44 1 8 "Average Difference" HA 120 0.264 -0.022 0.264 25061 45 1 8 "Average Difference" C 120 1.138 0.340 1.090 25061 46 1 8 "Average Difference" CA 126 0.988 0.159 0.979 25061 47 1 8 "Average Difference" CB 121 0.966 -0.061 0.968 25061 48 1 8 "Average Difference" HN 112 0.408 -0.156 0.379 25061 49 1 9 "Average Difference" N 112 2.557 0.460 2.527 25061 50 1 9 "Average Difference" HA 120 0.248 -0.013 0.249 25061 51 1 9 "Average Difference" C 120 1.114 0.357 1.060 25061 52 1 9 "Average Difference" CA 126 0.993 0.182 0.980 25061 53 1 9 "Average Difference" CB 121 1.106 -0.012 1.110 25061 54 1 9 "Average Difference" HN 112 0.415 -0.130 0.396 25061 55 1 10 "Average Difference" N 112 2.699 0.077 2.710 25061 56 1 10 "Average Difference" HA 120 0.270 -0.005 0.271 25061 57 1 10 "Average Difference" C 120 1.164 0.267 1.137 25061 58 1 10 "Average Difference" CA 126 1.106 0.077 1.108 25061 59 1 10 "Average Difference" CB 121 1.097 0.059 1.100 25061 60 1 10 "Average Difference" HN 112 0.395 -0.152 0.366 25061 61 1 11 "Average Difference" N 112 2.326 -0.010 2.336 25061 62 1 11 "Average Difference" HA 120 0.276 0.000 0.278 25061 63 1 11 "Average Difference" C 120 1.138 0.311 1.099 25061 64 1 11 "Average Difference" CA 126 1.000 0.063 1.002 25061 65 1 11 "Average Difference" CB 121 1.029 0.119 1.026 25061 66 1 11 "Average Difference" HN 112 0.421 -0.161 0.391 25061 67 1 12 "Average Difference" N 112 2.473 -0.035 2.484 25061 68 1 12 "Average Difference" HA 120 0.263 -0.024 0.263 25061 69 1 12 "Average Difference" C 120 1.095 0.320 1.052 25061 70 1 12 "Average Difference" CA 126 1.068 0.151 1.062 25061 71 1 12 "Average Difference" CB 121 1.063 -0.025 1.067 25061 72 1 12 "Average Difference" HN 112 0.425 -0.178 0.388 25061 73 1 13 "Average Difference" N 112 2.611 -0.101 2.621 25061 74 1 13 "Average Difference" HA 120 0.277 -0.023 0.278 25061 75 1 13 "Average Difference" C 120 1.190 0.388 1.130 25061 76 1 13 "Average Difference" CA 126 1.104 0.152 1.098 25061 77 1 13 "Average Difference" CB 121 1.021 -0.035 1.025 25061 78 1 13 "Average Difference" HN 112 0.403 -0.174 0.365 25061 79 1 14 "Average Difference" N 112 2.407 0.169 2.412 25061 80 1 14 "Average Difference" HA 120 0.228 0.004 0.229 25061 81 1 14 "Average Difference" C 120 1.094 0.291 1.060 25061 82 1 14 "Average Difference" CA 126 0.878 0.081 0.878 25061 83 1 14 "Average Difference" CB 121 0.988 0.010 0.992 25061 84 1 14 "Average Difference" HN 112 0.403 -0.134 0.381 25061 85 1 15 "Average Difference" N 112 2.315 0.058 2.324 25061 86 1 15 "Average Difference" HA 120 0.244 0.008 0.245 25061 87 1 15 "Average Difference" C 120 1.097 0.324 1.053 25061 88 1 15 "Average Difference" CA 126 0.975 0.190 0.960 25061 89 1 15 "Average Difference" CB 121 0.917 0.086 0.917 25061 90 1 15 "Average Difference" HN 112 0.390 -0.131 0.369 25061 91 1 16 "Average Difference" N 112 2.187 0.114 2.194 25061 92 1 16 "Average Difference" HA 120 0.238 0.005 0.239 25061 93 1 16 "Average Difference" C 120 1.133 0.377 1.073 25061 94 1 16 "Average Difference" CA 126 0.968 0.073 0.969 25061 95 1 16 "Average Difference" CB 121 1.070 -0.002 1.075 25061 96 1 16 "Average Difference" HN 112 0.408 -0.167 0.374 25061 97 1 17 "Average Difference" N 112 2.798 0.072 2.810 25061 98 1 17 "Average Difference" HA 120 0.289 0.010 0.290 25061 99 1 17 "Average Difference" C 120 1.107 0.260 1.080 25061 100 1 17 "Average Difference" CA 126 1.199 0.088 1.201 25061 101 1 17 "Average Difference" CB 121 0.979 -0.034 0.982 25061 102 1 17 "Average Difference" HN 112 0.420 -0.157 0.391 25061 103 1 18 "Average Difference" N 112 2.421 -0.054 2.431 25061 104 1 18 "Average Difference" HA 120 0.250 -0.022 0.250 25061 105 1 18 "Average Difference" C 120 1.121 0.263 1.095 25061 106 1 18 "Average Difference" CA 126 0.935 0.105 0.933 25061 107 1 18 "Average Difference" CB 121 1.026 0.011 1.031 25061 108 1 18 "Average Difference" HN 112 0.403 -0.164 0.370 25061 109 1 19 "Average Difference" N 112 2.668 0.220 2.670 25061 110 1 19 "Average Difference" HA 120 0.261 -0.020 0.261 25061 111 1 19 "Average Difference" C 120 1.127 0.400 1.058 25061 112 1 19 "Average Difference" CA 126 0.939 0.173 0.926 25061 113 1 19 "Average Difference" CB 121 0.983 -0.022 0.987 25061 114 1 19 "Average Difference" HN 112 0.416 -0.131 0.397 25061 115 1 20 "Average Difference" N 112 2.740 0.068 2.752 25061 116 1 20 "Average Difference" HA 120 0.263 -0.010 0.264 25061 117 1 20 "Average Difference" C 120 1.091 0.267 1.062 25061 118 1 20 "Average Difference" CA 126 0.964 0.106 0.962 25061 119 1 20 "Average Difference" CB 121 1.025 0.013 1.029 25061 120 1 20 "Average Difference" HN 112 0.441 -0.175 0.407 25061 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 25061 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 GLY CA C 2 45.319 45.319 45.066 0.253 25061 2 1 . 1 1 3 3 THR HA H 3 4.820 4.820 4.742 0.078 25061 3 1 . 1 1 3 3 THR C C 3 172.374 172.374 173.858 -1.484 25061 4 1 . 1 1 3 3 THR CA C 3 62.760 62.760 61.496 1.264 25061 5 1 . 1 1 3 3 THR CB C 3 71.441 71.441 70.265 1.176 25061 6 1 . 1 1 4 4 VAL N N 4 126.881 126.881 126.480 0.401 25061 7 1 . 1 1 4 4 VAL HA H 4 4.568 4.568 4.499 0.069 25061 8 1 . 1 1 4 4 VAL C C 4 173.116 173.116 174.579 -1.463 25061 9 1 . 1 1 4 4 VAL CA C 4 60.455 60.455 61.542 -1.087 25061 10 1 . 1 1 4 4 VAL CB C 4 33.800 33.800 32.422 1.378 25061 11 1 . 1 1 4 4 VAL H H 4 9.097 9.097 8.790 0.307 25061 12 1 . 1 1 5 5 VAL N N 5 127.172 127.172 124.518 2.654 25061 13 1 . 1 1 5 5 VAL HA H 5 4.887 4.887 5.381 -0.494 25061 14 1 . 1 1 5 5 VAL C C 5 174.091 174.091 174.965 -0.874 25061 15 1 . 1 1 5 5 VAL CA C 5 60.118 60.118 59.378 0.740 25061 16 1 . 1 1 5 5 VAL CB C 5 32.935 32.935 33.295 -0.360 25061 17 1 . 1 1 5 5 VAL H H 5 8.811 8.811 8.737 0.074 25061 18 1 . 1 1 6 6 ILE N N 6 127.577 127.577 128.332 -0.755 25061 19 1 . 1 1 6 6 ILE HA H 6 4.620 4.620 4.481 0.139 25061 20 1 . 1 1 6 6 ILE C C 6 173.328 173.328 175.355 -2.027 25061 21 1 . 1 1 6 6 ILE CA C 6 59.832 59.832 59.497 0.335 25061 22 1 . 1 1 6 6 ILE CB C 6 39.930 39.930 38.496 1.434 25061 23 1 . 1 1 6 6 ILE H H 6 9.210 9.210 8.542 0.668 25061 24 1 . 1 1 7 7 VAL N N 7 129.024 129.024 129.510 -0.486 25061 25 1 . 1 1 7 7 VAL HA H 7 4.805 4.805 4.514 0.291 25061 26 1 . 1 1 7 7 VAL C C 7 173.561 173.561 175.104 -1.543 25061 27 1 . 1 1 7 7 VAL CA C 7 60.849 60.849 61.903 -1.054 25061 28 1 . 1 1 7 7 VAL CB C 7 32.360 32.360 31.310 1.050 25061 29 1 . 1 1 7 7 VAL H H 7 9.294 9.294 8.229 1.065 25061 30 1 . 1 1 8 8 VAL N N 8 125.318 125.318 128.811 -3.493 25061 31 1 . 1 1 8 8 VAL HA H 8 5.396 5.396 5.364 0.032 25061 32 1 . 1 1 8 8 VAL C C 8 175.723 175.723 175.336 0.387 25061 33 1 . 1 1 8 8 VAL CA C 8 59.617 59.617 60.202 -0.585 25061 34 1 . 1 1 8 8 VAL CB C 8 34.915 34.915 34.665 0.250 25061 35 1 . 1 1 8 8 VAL H H 8 8.898 8.898 8.628 0.270 25061 36 1 . 1 1 9 9 SER N N 9 116.544 116.544 118.574 -2.030 25061 37 1 . 1 1 9 9 SER HA H 9 4.724 4.724 4.913 -0.189 25061 38 1 . 1 1 9 9 SER C C 9 174.552 174.552 173.735 0.817 25061 39 1 . 1 1 9 9 SER CA C 9 57.419 57.419 56.997 0.422 25061 40 1 . 1 1 9 9 SER CB C 9 64.998 64.998 65.795 -0.797 25061 41 1 . 1 1 9 9 SER H H 9 7.833 7.833 8.151 -0.318 25061 42 1 . 1 1 10 10 ASN HA H 10 4.912 4.912 4.617 0.295 25061 43 1 . 1 1 10 10 ASN C C 10 176.170 176.170 174.544 1.626 25061 44 1 . 1 1 10 10 ASN CA C 10 54.141 54.141 54.592 -0.451 25061 45 1 . 1 1 10 10 ASN CB C 10 38.626 38.626 38.905 -0.279 25061 46 1 . 1 1 11 11 ASP N N 11 120.164 120.164 118.516 1.648 25061 47 1 . 1 1 11 11 ASP HA H 11 4.843 4.843 4.799 0.044 25061 48 1 . 1 1 11 11 ASP C C 11 176.148 176.148 176.083 0.065 25061 49 1 . 1 1 11 11 ASP CA C 11 52.620 52.620 53.231 -0.611 25061 50 1 . 1 1 11 11 ASP CB C 11 42.631 42.631 43.048 -0.417 25061 51 1 . 1 1 11 11 ASP H H 11 8.142 8.142 7.638 0.504 25061 52 1 . 1 1 12 12 GLU N N 12 127.184 127.184 123.856 3.328 25061 53 1 . 1 1 12 12 GLU HA H 12 3.853 3.853 4.132 -0.279 25061 54 1 . 1 1 12 12 GLU C C 12 177.853 177.853 178.286 -0.433 25061 55 1 . 1 1 12 12 GLU CA C 12 59.547 59.547 59.220 0.327 25061 56 1 . 1 1 12 12 GLU CB C 12 29.819 29.819 29.944 -0.125 25061 57 1 . 1 1 12 12 GLU H H 12 9.152 9.152 8.854 0.298 25061 58 1 . 1 1 13 13 ARG N N 13 119.026 119.026 119.032 -0.006 25061 59 1 . 1 1 13 13 ARG HA H 13 4.103 4.103 4.236 -0.133 25061 60 1 . 1 1 13 13 ARG C C 13 179.151 179.151 178.781 0.370 25061 61 1 . 1 1 13 13 ARG CA C 13 58.943 58.943 58.815 0.128 25061 62 1 . 1 1 13 13 ARG CB C 13 28.757 28.757 29.913 -1.156 25061 63 1 . 1 1 13 13 ARG H H 13 8.389 8.389 8.050 0.339 25061 64 1 . 1 1 14 14 ILE N N 14 119.238 119.238 120.579 -1.341 25061 65 1 . 1 1 14 14 ILE HA H 14 3.601 3.601 3.849 -0.248 25061 66 1 . 1 1 14 14 ILE C C 14 177.905 177.905 177.808 0.097 25061 67 1 . 1 1 14 14 ILE CA C 14 64.666 64.666 63.794 0.872 25061 68 1 . 1 1 14 14 ILE CB C 14 36.780 36.780 37.222 -0.442 25061 69 1 . 1 1 14 14 ILE H H 14 7.254 7.254 7.896 -0.642 25061 70 1 . 1 1 15 15 LEU N N 15 117.008 117.008 119.756 -2.748 25061 71 1 . 1 1 15 15 LEU HA H 15 3.921 3.921 4.152 -0.231 25061 72 1 . 1 1 15 15 LEU C C 15 178.062 178.062 179.396 -1.334 25061 73 1 . 1 1 15 15 LEU CA C 15 58.411 58.411 58.260 0.151 25061 74 1 . 1 1 15 15 LEU CB C 15 41.169 41.169 41.504 -0.335 25061 75 1 . 1 1 15 15 LEU H H 15 7.412 7.412 7.609 -0.197 25061 76 1 . 1 1 16 16 GLU N N 16 117.637 117.637 118.882 -1.245 25061 77 1 . 1 1 16 16 GLU HA H 16 3.701 3.701 3.883 -0.182 25061 78 1 . 1 1 16 16 GLU C C 16 179.182 179.182 178.825 0.357 25061 79 1 . 1 1 16 16 GLU CA C 16 59.417 59.417 59.418 -0.001 25061 80 1 . 1 1 16 16 GLU CB C 16 29.459 29.459 29.292 0.167 25061 81 1 . 1 1 16 16 GLU H H 16 7.981 7.981 7.932 0.049 25061 82 1 . 1 1 17 17 GLU N N 17 119.759 119.759 120.874 -1.115 25061 83 1 . 1 1 17 17 GLU HA H 17 4.016 4.016 4.176 -0.160 25061 84 1 . 1 1 17 17 GLU C C 17 179.949 179.949 179.156 0.793 25061 85 1 . 1 1 17 17 GLU CA C 17 59.195 59.195 58.991 0.204 25061 86 1 . 1 1 17 17 GLU CB C 17 29.540 29.540 29.554 -0.014 25061 87 1 . 1 1 17 17 GLU H H 17 8.248 8.248 8.071 0.177 25061 88 1 . 1 1 18 18 LEU N N 18 119.764 119.764 119.484 0.281 25061 89 1 . 1 1 18 18 LEU HA H 18 4.081 4.081 4.194 -0.113 25061 90 1 . 1 1 18 18 LEU C C 18 177.620 177.620 179.165 -1.545 25061 91 1 . 1 1 18 18 LEU CA C 18 57.678 57.678 57.530 0.148 25061 92 1 . 1 1 18 18 LEU CB C 18 41.110 41.110 41.679 -0.569 25061 93 1 . 1 1 18 18 LEU H H 18 8.486 8.486 8.121 0.365 25061 94 1 . 1 1 19 19 LEU N N 19 123.102 123.102 120.945 2.157 25061 95 1 . 1 1 19 19 LEU HA H 19 3.662 3.662 3.530 0.132 25061 96 1 . 1 1 19 19 LEU C C 19 178.343 178.343 178.237 0.106 25061 97 1 . 1 1 19 19 LEU CA C 19 59.236 59.236 58.337 0.899 25061 98 1 . 1 1 19 19 LEU CB C 19 40.651 40.651 41.267 -0.616 25061 99 1 . 1 1 19 19 LEU H H 19 7.870 7.870 7.780 0.090 25061 100 1 . 1 1 20 20 GLU N N 20 117.884 117.884 118.457 -0.573 25061 101 1 . 1 1 20 20 GLU HA H 20 3.904 3.904 3.943 -0.039 25061 102 1 . 1 1 20 20 GLU C C 20 177.707 177.707 179.217 -1.510 25061 103 1 . 1 1 20 20 GLU CA C 20 59.392 59.392 59.450 -0.058 25061 104 1 . 1 1 20 20 GLU CB C 20 28.977 28.977 29.355 -0.378 25061 105 1 . 1 1 20 20 GLU H H 20 7.497 7.497 7.702 -0.205 25061 106 1 . 1 1 21 21 VAL N N 21 117.709 117.709 119.742 -2.033 25061 107 1 . 1 1 21 21 VAL HA H 21 3.624 3.624 3.717 -0.093 25061 108 1 . 1 1 21 21 VAL C C 21 178.523 178.523 177.992 0.531 25061 109 1 . 1 1 21 21 VAL CA C 21 66.197 66.197 66.365 -0.168 25061 110 1 . 1 1 21 21 VAL CB C 21 31.147 31.147 31.505 -0.358 25061 111 1 . 1 1 21 21 VAL H H 21 7.514 7.514 7.517 -0.003 25061 112 1 . 1 1 22 22 VAL N N 22 121.233 121.233 119.404 1.829 25061 113 1 . 1 1 22 22 VAL HA H 22 3.446 3.446 3.689 -0.243 25061 114 1 . 1 1 22 22 VAL C C 22 176.868 176.868 178.009 -1.141 25061 115 1 . 1 1 22 22 VAL CA C 22 67.013 67.013 66.440 0.573 25061 116 1 . 1 1 22 22 VAL CB C 22 31.314 31.314 31.577 -0.263 25061 117 1 . 1 1 22 22 VAL H H 22 7.863 7.863 7.443 0.420 25061 118 1 . 1 1 23 23 LEU N N 23 118.101 118.101 118.823 -0.722 25061 119 1 . 1 1 23 23 LEU HA H 23 4.065 4.065 4.059 0.006 25061 120 1 . 1 1 23 23 LEU C C 23 179.701 179.701 178.449 1.252 25061 121 1 . 1 1 23 23 LEU CA C 23 57.296 57.296 57.774 -0.478 25061 122 1 . 1 1 23 23 LEU CB C 23 41.704 41.704 41.724 -0.020 25061 123 1 . 1 1 23 23 LEU H H 23 8.151 8.151 8.165 -0.014 25061 124 1 . 1 1 24 24 LYS N N 24 114.622 114.622 116.232 -1.610 25061 125 1 . 1 1 24 24 LYS HA H 24 4.137 4.137 4.127 0.010 25061 126 1 . 1 1 24 24 LYS C C 24 178.062 178.062 178.568 -0.506 25061 127 1 . 1 1 24 24 LYS CA C 24 57.368 57.368 58.285 -0.918 25061 128 1 . 1 1 24 24 LYS CB C 24 32.594 32.594 32.268 0.326 25061 129 1 . 1 1 24 24 LYS H H 24 7.823 7.823 7.898 -0.075 25061 130 1 . 1 1 25 25 SER N N 25 115.474 115.474 115.805 -0.331 25061 131 1 . 1 1 25 25 SER HA H 25 4.377 4.377 4.319 0.058 25061 132 1 . 1 1 25 25 SER C C 25 174.520 174.520 174.536 -0.016 25061 133 1 . 1 1 25 25 SER CA C 25 61.049 61.049 60.651 0.398 25061 134 1 . 1 1 25 25 SER CB C 25 63.777 63.777 64.235 -0.458 25061 135 1 . 1 1 25 25 SER H H 25 7.798 7.798 7.785 0.014 25061 136 1 . 1 1 26 26 ASP N N 26 117.424 117.424 118.278 -0.854 25061 137 1 . 1 1 26 26 ASP HA H 26 4.886 4.886 4.990 -0.104 25061 138 1 . 1 1 26 26 ASP C C 26 173.521 173.521 174.211 -0.690 25061 139 1 . 1 1 26 26 ASP CA C 26 52.048 52.048 52.715 -0.667 25061 140 1 . 1 1 26 26 ASP CB C 26 42.202 42.202 42.943 -0.741 25061 141 1 . 1 1 26 26 ASP H H 26 7.990 7.990 7.980 0.010 25061 142 1 . 1 1 27 27 PRO HA H 27 4.645 4.645 4.558 0.087 25061 143 1 . 1 1 27 27 PRO C C 27 177.016 177.016 176.796 0.220 25061 144 1 . 1 1 27 27 PRO CA C 27 63.601 63.601 63.810 -0.209 25061 145 1 . 1 1 27 27 PRO CB C 27 32.173 32.173 32.421 -0.248 25061 146 1 . 1 1 28 28 ASN N N 28 115.839 115.839 116.429 -0.590 25061 147 1 . 1 1 28 28 ASN HA H 28 4.692 4.692 4.670 0.022 25061 148 1 . 1 1 28 28 ASN C C 28 175.701 175.701 175.630 0.071 25061 149 1 . 1 1 28 28 ASN CA C 28 53.472 53.472 53.688 -0.216 25061 150 1 . 1 1 28 28 ASN CB C 28 39.213 39.213 39.088 0.125 25061 151 1 . 1 1 28 28 ASN H H 28 8.608 8.608 8.187 0.421 25061 152 1 . 1 1 29 29 VAL N N 29 120.770 120.770 121.272 -0.502 25061 153 1 . 1 1 29 29 VAL HA H 29 3.815 3.815 3.923 -0.108 25061 154 1 . 1 1 29 29 VAL C C 29 175.023 175.023 175.855 -0.832 25061 155 1 . 1 1 29 29 VAL CA C 29 62.552 62.552 63.352 -0.800 25061 156 1 . 1 1 29 29 VAL CB C 29 32.147 32.147 31.805 0.342 25061 157 1 . 1 1 29 29 VAL H H 29 7.428 7.428 7.708 -0.280 25061 158 1 . 1 1 30 30 LYS N N 30 127.345 127.345 128.591 -1.246 25061 159 1 . 1 1 30 30 LYS HA H 30 4.479 4.479 4.318 0.161 25061 160 1 . 1 1 30 30 LYS C C 30 174.777 174.777 176.074 -1.297 25061 161 1 . 1 1 30 30 LYS CA C 30 55.204 55.204 55.551 -0.347 25061 162 1 . 1 1 30 30 LYS CB C 30 31.949 31.949 31.581 0.368 25061 163 1 . 1 1 30 30 LYS H H 30 8.457 8.457 8.376 0.081 25061 164 1 . 1 1 31 31 THR N N 31 113.552 113.552 116.615 -3.063 25061 165 1 . 1 1 31 31 THR HA H 31 5.723 5.723 4.953 0.770 25061 166 1 . 1 1 31 31 THR C C 31 174.593 174.593 174.413 0.180 25061 167 1 . 1 1 31 31 THR CA C 31 59.030 59.030 61.168 -2.138 25061 168 1 . 1 1 31 31 THR CB C 31 72.206 72.206 69.224 2.982 25061 169 1 . 1 1 31 31 THR H H 31 8.164 8.164 8.191 -0.027 25061 170 1 . 1 1 32 32 VAL N N 32 119.206 119.206 126.786 -7.580 25061 171 1 . 1 1 32 32 VAL HA H 32 4.405 4.405 4.371 0.034 25061 172 1 . 1 1 32 32 VAL C C 32 172.663 172.663 174.567 -1.904 25061 173 1 . 1 1 32 32 VAL CA C 32 61.072 61.072 61.416 -0.344 25061 174 1 . 1 1 32 32 VAL CB C 32 35.051 35.051 34.345 0.706 25061 175 1 . 1 1 32 32 VAL H H 32 8.615 8.615 8.870 -0.255 25061 176 1 . 1 1 33 33 ARG N N 33 130.278 130.278 128.534 1.744 25061 177 1 . 1 1 33 33 ARG HA H 33 5.331 5.331 4.998 0.333 25061 178 1 . 1 1 33 33 ARG C C 33 173.836 173.836 175.640 -1.804 25061 179 1 . 1 1 33 33 ARG CA C 33 54.150 54.150 55.500 -1.350 25061 180 1 . 1 1 33 33 ARG CB C 33 30.028 30.028 30.318 -0.290 25061 181 1 . 1 1 33 33 ARG H H 33 8.996 8.996 8.782 0.214 25061 182 1 . 1 1 34 34 THR N N 34 121.695 121.695 119.095 2.600 25061 183 1 . 1 1 34 34 THR HA H 34 4.483 4.483 4.425 0.058 25061 184 1 . 1 1 34 34 THR C C 34 169.769 169.769 173.215 -3.446 25061 185 1 . 1 1 34 34 THR CA C 34 60.814 60.814 61.455 -0.641 25061 186 1 . 1 1 34 34 THR CB C 34 67.402 67.402 70.686 -3.284 25061 187 1 . 1 1 34 34 THR H H 34 8.126 8.126 8.201 -0.075 25061 188 1 . 1 1 35 35 ASP N N 35 122.198 122.198 121.817 0.381 25061 189 1 . 1 1 35 35 ASP HA H 35 4.824 4.824 4.524 0.300 25061 190 1 . 1 1 35 35 ASP C C 35 174.790 174.790 175.278 -0.488 25061 191 1 . 1 1 35 35 ASP CA C 35 53.386 53.386 54.342 -0.956 25061 192 1 . 1 1 35 35 ASP CB C 35 41.848 41.848 41.058 0.790 25061 193 1 . 1 1 35 35 ASP H H 35 7.983 7.983 8.336 -0.353 25061 194 1 . 1 1 36 36 ASP N N 36 121.091 121.091 122.472 -1.381 25061 195 1 . 1 1 36 36 ASP HA H 36 4.593 4.593 4.519 0.074 25061 196 1 . 1 1 36 36 ASP C C 36 176.189 176.189 176.817 -0.628 25061 197 1 . 1 1 36 36 ASP CA C 36 53.055 53.055 54.546 -1.491 25061 198 1 . 1 1 36 36 ASP CB C 36 42.159 42.159 41.145 1.014 25061 199 1 . 1 1 36 36 ASP H H 36 8.157 8.157 8.014 0.143 25061 200 1 . 1 1 37 37 LYS N N 37 125.839 125.839 122.691 3.148 25061 201 1 . 1 1 37 37 LYS HA H 37 3.722 3.722 3.835 -0.113 25061 202 1 . 1 1 37 37 LYS C C 37 176.870 176.870 177.762 -0.892 25061 203 1 . 1 1 37 37 LYS CA C 37 59.404 59.404 59.516 -0.112 25061 204 1 . 1 1 37 37 LYS CB C 37 32.394 32.394 31.652 0.742 25061 205 1 . 1 1 37 37 LYS H H 37 8.843 8.843 8.379 0.464 25061 206 1 . 1 1 38 38 GLU N N 38 118.369 118.369 118.705 -0.336 25061 207 1 . 1 1 38 38 GLU HA H 38 4.007 4.007 3.940 0.067 25061 208 1 . 1 1 38 38 GLU C C 38 179.502 179.502 178.370 1.132 25061 209 1 . 1 1 38 38 GLU CA C 38 58.670 58.670 58.889 -0.219 25061 210 1 . 1 1 38 38 GLU CB C 38 28.474 28.474 28.913 -0.439 25061 211 1 . 1 1 38 38 GLU H H 38 8.182 8.182 8.454 -0.272 25061 212 1 . 1 1 39 39 LYS N N 39 121.722 121.722 120.622 1.100 25061 213 1 . 1 1 39 39 LYS HA H 39 4.165 4.165 4.173 -0.008 25061 214 1 . 1 1 39 39 LYS C C 39 178.500 178.500 178.600 -0.100 25061 215 1 . 1 1 39 39 LYS CA C 39 57.736 57.736 59.026 -1.290 25061 216 1 . 1 1 39 39 LYS CB C 39 31.138 31.138 32.395 -1.257 25061 217 1 . 1 1 39 39 LYS H H 39 7.524 7.524 7.612 -0.088 25061 218 1 . 1 1 40 40 VAL N N 40 117.199 117.199 119.040 -1.841 25061 219 1 . 1 1 40 40 VAL HA H 40 3.228 3.228 3.615 -0.387 25061 220 1 . 1 1 40 40 VAL C C 40 177.362 177.362 177.993 -0.631 25061 221 1 . 1 1 40 40 VAL CA C 40 67.642 67.642 66.349 1.293 25061 222 1 . 1 1 40 40 VAL CB C 40 30.903 30.903 31.410 -0.507 25061 223 1 . 1 1 40 40 VAL H H 40 7.883 7.883 7.831 0.052 25061 224 1 . 1 1 41 41 LYS N N 41 117.677 117.677 118.872 -1.195 25061 225 1 . 1 1 41 41 LYS HA H 41 3.442 3.442 3.676 -0.234 25061 226 1 . 1 1 41 41 LYS C C 41 177.686 177.686 178.718 -1.032 25061 227 1 . 1 1 41 41 LYS CA C 41 60.809 60.809 59.713 1.096 25061 228 1 . 1 1 41 41 LYS CB C 41 31.615 31.615 31.466 0.149 25061 229 1 . 1 1 41 41 LYS H H 41 7.567 7.567 7.537 0.030 25061 230 1 . 1 1 42 42 GLU N N 42 118.369 118.369 118.942 -0.573 25061 231 1 . 1 1 42 42 GLU HA H 42 4.007 4.007 4.042 -0.035 25061 232 1 . 1 1 42 42 GLU C C 42 179.725 179.725 178.930 0.795 25061 233 1 . 1 1 42 42 GLU CA C 42 59.069 59.069 59.216 -0.147 25061 234 1 . 1 1 42 42 GLU CB C 42 29.539 29.539 29.330 0.209 25061 235 1 . 1 1 42 42 GLU H H 42 7.634 7.634 7.623 0.011 25061 236 1 . 1 1 43 43 GLU N N 43 117.906 117.906 119.126 -1.220 25061 237 1 . 1 1 43 43 GLU HA H 43 4.183 4.183 4.150 0.033 25061 238 1 . 1 1 43 43 GLU C C 43 179.757 179.757 179.197 0.559 25061 239 1 . 1 1 43 43 GLU CA C 43 58.366 58.366 58.477 -0.111 25061 240 1 . 1 1 43 43 GLU CB C 43 28.841 28.841 29.211 -0.370 25061 241 1 . 1 1 43 43 GLU H H 43 8.162 8.162 7.925 0.237 25061 242 1 . 1 1 44 44 ILE N N 44 122.291 122.291 120.852 1.439 25061 243 1 . 1 1 44 44 ILE HA H 44 3.612 3.612 3.637 -0.025 25061 244 1 . 1 1 44 44 ILE C C 44 177.101 177.101 177.707 -0.606 25061 245 1 . 1 1 44 44 ILE CA C 44 66.355 66.355 65.925 0.430 25061 246 1 . 1 1 44 44 ILE CB C 44 37.460 37.460 37.900 -0.440 25061 247 1 . 1 1 44 44 ILE H H 44 8.742 8.742 8.182 0.560 25061 248 1 . 1 1 45 45 GLU N N 45 119.892 119.892 120.287 -0.395 25061 249 1 . 1 1 45 45 GLU HA H 45 4.058 4.058 4.075 -0.017 25061 250 1 . 1 1 45 45 GLU C C 45 178.991 178.991 178.906 0.085 25061 251 1 . 1 1 45 45 GLU CA C 45 59.665 59.665 59.594 0.071 25061 252 1 . 1 1 45 45 GLU CB C 45 29.161 29.161 29.424 -0.263 25061 253 1 . 1 1 45 45 GLU H H 45 8.171 8.171 7.977 0.194 25061 254 1 . 1 1 46 46 LYS N N 46 118.064 118.064 118.834 -0.770 25061 255 1 . 1 1 46 46 LYS HA H 46 3.982 3.982 4.074 -0.092 25061 256 1 . 1 1 46 46 LYS C C 46 178.837 178.837 178.961 -0.124 25061 257 1 . 1 1 46 46 LYS CA C 46 59.741 59.741 59.090 0.651 25061 258 1 . 1 1 46 46 LYS CB C 46 32.443 32.443 32.220 0.223 25061 259 1 . 1 1 46 46 LYS H H 46 7.785 7.785 7.671 0.114 25061 260 1 . 1 1 47 47 ALA N N 47 121.817 121.817 122.303 -0.486 25061 261 1 . 1 1 47 47 ALA HA H 47 4.031 4.031 4.073 -0.042 25061 262 1 . 1 1 47 47 ALA C C 47 179.859 179.859 179.363 0.496 25061 263 1 . 1 1 47 47 ALA CA C 47 55.295 55.295 55.198 0.097 25061 264 1 . 1 1 47 47 ALA CB C 47 17.656 17.656 18.572 -0.916 25061 265 1 . 1 1 47 47 ALA H H 47 8.123 8.123 7.906 0.217 25061 266 1 . 1 1 48 48 ARG N N 48 119.080 119.080 117.488 1.592 25061 267 1 . 1 1 48 48 ARG HA H 48 4.089 4.089 4.101 -0.012 25061 268 1 . 1 1 48 48 ARG C C 48 180.155 180.155 178.551 1.604 25061 269 1 . 1 1 48 48 ARG CA C 48 59.197 59.197 58.400 0.797 25061 270 1 . 1 1 48 48 ARG CB C 48 29.510 29.510 29.716 -0.206 25061 271 1 . 1 1 48 48 ARG H H 48 8.768 8.768 8.038 0.730 25061 272 1 . 1 1 49 49 LYS N N 49 119.951 119.951 119.555 0.396 25061 273 1 . 1 1 49 49 LYS HA H 49 4.039 4.039 4.129 -0.090 25061 274 1 . 1 1 49 49 LYS C C 49 178.288 178.288 178.404 -0.116 25061 275 1 . 1 1 49 49 LYS CA C 49 58.837 58.837 58.564 0.274 25061 276 1 . 1 1 49 49 LYS CB C 49 32.143 32.143 32.324 -0.181 25061 277 1 . 1 1 49 49 LYS H H 49 8.037 8.037 7.755 0.282 25061 278 1 . 1 1 50 50 GLN N N 50 115.284 115.284 116.275 -0.991 25061 279 1 . 1 1 50 50 GLN HA H 50 4.342 4.342 4.293 0.049 25061 280 1 . 1 1 50 50 GLN C C 50 176.180 176.180 176.853 -0.673 25061 281 1 . 1 1 50 50 GLN CA C 50 55.741 55.741 55.851 -0.110 25061 282 1 . 1 1 50 50 GLN CB C 50 29.565 29.565 29.408 0.157 25061 283 1 . 1 1 50 50 GLN H H 50 7.740 7.740 7.787 -0.047 25061 284 1 . 1 1 51 51 GLY N N 51 109.725 109.725 107.956 1.769 25061 285 1 . 1 1 51 51 GLY C C 51 174.552 174.552 173.864 0.688 25061 286 1 . 1 1 51 51 GLY CA C 51 46.363 46.363 45.301 1.062 25061 287 1 . 1 1 51 51 GLY H H 51 8.027 8.027 7.836 0.191 25061 288 1 . 1 1 52 52 ARG N N 52 119.064 119.064 119.711 -0.647 25061 289 1 . 1 1 52 52 ARG HA H 52 4.897 4.897 4.726 0.171 25061 290 1 . 1 1 52 52 ARG C C 52 173.123 173.123 173.872 -0.749 25061 291 1 . 1 1 52 52 ARG CA C 52 52.247 52.247 53.010 -0.763 25061 292 1 . 1 1 52 52 ARG CB C 52 32.366 32.366 31.146 1.220 25061 293 1 . 1 1 52 52 ARG H H 52 7.969 7.969 7.894 0.075 25061 294 1 . 1 1 53 53 PRO HA H 53 4.855 4.855 4.675 0.180 25061 295 1 . 1 1 53 53 PRO C C 53 174.069 174.069 175.708 -1.639 25061 296 1 . 1 1 53 53 PRO CA C 53 61.818 61.818 62.708 -0.890 25061 297 1 . 1 1 53 53 PRO CB C 53 32.060 32.060 32.545 -0.485 25061 298 1 . 1 1 54 54 ILE N N 54 116.301 116.301 121.183 -4.882 25061 299 1 . 1 1 54 54 ILE HA H 54 5.238 5.238 4.647 0.591 25061 300 1 . 1 1 54 54 ILE C C 54 171.709 171.709 173.785 -2.076 25061 301 1 . 1 1 54 54 ILE CA C 54 57.774 57.774 59.626 -1.852 25061 302 1 . 1 1 54 54 ILE CB C 54 41.558 41.558 41.352 0.206 25061 303 1 . 1 1 54 54 ILE H H 54 7.920 7.920 7.976 -0.056 25061 304 1 . 1 1 55 55 VAL N N 55 126.302 126.302 129.330 -3.028 25061 305 1 . 1 1 55 55 VAL HA H 55 4.924 4.924 5.118 -0.194 25061 306 1 . 1 1 55 55 VAL C C 55 173.624 173.624 174.984 -1.360 25061 307 1 . 1 1 55 55 VAL CA C 55 59.795 59.795 60.463 -0.668 25061 308 1 . 1 1 55 55 VAL CB C 55 32.828 32.828 32.813 0.015 25061 309 1 . 1 1 55 55 VAL H H 55 8.652 8.652 8.652 0.000 25061 310 1 . 1 1 56 56 ILE N N 56 127.503 127.503 127.911 -0.408 25061 311 1 . 1 1 56 56 ILE HA H 56 4.664 4.664 4.912 -0.248 25061 312 1 . 1 1 56 56 ILE C C 56 173.479 173.479 175.231 -1.752 25061 313 1 . 1 1 56 56 ILE CA C 56 59.007 59.007 58.509 0.498 25061 314 1 . 1 1 56 56 ILE CB C 56 40.285 40.285 38.093 2.192 25061 315 1 . 1 1 56 56 ILE H H 56 9.124 9.124 8.173 0.951 25061 316 1 . 1 1 57 57 PHE N N 57 125.302 125.302 128.095 -2.793 25061 317 1 . 1 1 57 57 PHE HA H 57 5.216 5.216 5.297 -0.081 25061 318 1 . 1 1 57 57 PHE C C 57 174.536 174.536 175.803 -1.267 25061 319 1 . 1 1 57 57 PHE CA C 57 56.961 56.961 57.247 -0.286 25061 320 1 . 1 1 57 57 PHE CB C 57 40.429 40.429 39.841 0.588 25061 321 1 . 1 1 57 57 PHE H H 57 8.971 8.971 8.567 0.405 25061 322 1 . 1 1 58 58 ILE N N 58 126.472 126.472 119.230 7.242 25061 323 1 . 1 1 58 58 ILE HA H 58 4.515 4.515 4.723 -0.208 25061 324 1 . 1 1 58 58 ILE C C 58 173.391 173.391 174.253 -0.862 25061 325 1 . 1 1 58 58 ILE CA C 58 59.090 59.090 59.224 -0.134 25061 326 1 . 1 1 58 58 ILE CB C 58 41.742 41.742 42.160 -0.418 25061 327 1 . 1 1 58 58 ILE H H 58 9.248 9.248 8.789 0.459 25061 328 1 . 1 1 59 59 ARG N N 59 124.681 124.681 122.331 2.350 25061 329 1 . 1 1 59 59 ARG HA H 59 4.929 4.929 5.200 -0.271 25061 330 1 . 1 1 59 59 ARG C C 59 178.521 178.521 177.843 0.678 25061 331 1 . 1 1 59 59 ARG CA C 59 55.742 55.742 55.248 0.494 25061 332 1 . 1 1 59 59 ARG CB C 59 30.918 30.918 32.857 -1.939 25061 333 1 . 1 1 59 59 ARG H H 59 8.587 8.587 8.785 -0.198 25061 334 1 . 1 1 60 60 GLY N N 60 108.848 108.848 110.266 -1.418 25061 335 1 . 1 1 60 60 GLY C C 60 174.775 174.775 174.774 0.001 25061 336 1 . 1 1 60 60 GLY CA C 60 46.967 46.967 47.153 -0.186 25061 337 1 . 1 1 60 60 GLY H H 60 7.732 7.732 8.468 -0.736 25061 338 1 . 1 1 61 61 ALA N N 61 120.877 120.877 123.843 -2.966 25061 339 1 . 1 1 61 61 ALA HA H 61 4.144 4.144 4.036 0.108 25061 340 1 . 1 1 61 61 ALA C C 61 177.769 177.769 179.440 -1.671 25061 341 1 . 1 1 61 61 ALA CA C 61 53.449 53.449 53.894 -0.445 25061 342 1 . 1 1 61 61 ALA CB C 61 18.371 18.371 18.379 -0.008 25061 343 1 . 1 1 61 61 ALA H H 61 7.852 7.852 7.976 -0.124 25061 344 1 . 1 1 62 62 TYR HA H 62 4.800 4.800 4.260 0.540 25061 345 1 . 1 1 62 62 TYR CA C 62 63.039 63.039 59.277 3.762 25061 346 1 . 1 1 62 62 TYR CB C 62 37.440 37.440 37.547 -0.107 25061 347 1 . 1 1 63 63 GLU HA H 63 3.685 3.685 3.861 -0.176 25061 348 1 . 1 1 63 63 GLU C C 63 176.251 176.251 178.350 -2.099 25061 349 1 . 1 1 63 63 GLU CA C 63 59.258 59.258 59.289 -0.031 25061 350 1 . 1 1 63 63 GLU CB C 63 29.412 29.412 29.024 0.388 25061 351 1 . 1 1 64 64 GLU N N 64 119.209 119.209 119.136 0.073 25061 352 1 . 1 1 64 64 GLU HA H 64 3.901 3.901 3.575 0.326 25061 353 1 . 1 1 64 64 GLU C C 64 178.251 178.251 178.893 -0.642 25061 354 1 . 1 1 64 64 GLU CA C 64 59.212 59.212 58.676 0.536 25061 355 1 . 1 1 64 64 GLU CB C 64 28.645 28.645 28.990 -0.345 25061 356 1 . 1 1 64 64 GLU H H 64 8.878 8.878 7.650 1.228 25061 357 1 . 1 1 65 65 VAL N N 65 116.728 116.728 119.274 -2.546 25061 358 1 . 1 1 65 65 VAL HA H 65 3.982 3.982 3.833 0.149 25061 359 1 . 1 1 65 65 VAL C C 65 176.915 176.915 177.891 -0.976 25061 360 1 . 1 1 65 65 VAL CA C 65 64.609 64.609 65.604 -0.995 25061 361 1 . 1 1 65 65 VAL CB C 65 31.895 31.895 31.608 0.287 25061 362 1 . 1 1 65 65 VAL H H 65 7.652 7.652 7.744 -0.092 25061 363 1 . 1 1 66 66 VAL N N 66 119.462 119.462 119.551 -0.089 25061 364 1 . 1 1 66 66 VAL HA H 66 3.314 3.314 3.656 -0.342 25061 365 1 . 1 1 66 66 VAL C C 66 177.142 177.142 177.472 -0.330 25061 366 1 . 1 1 66 66 VAL CA C 66 67.335 67.335 66.332 1.003 25061 367 1 . 1 1 66 66 VAL CB C 66 31.430 31.430 31.291 0.139 25061 368 1 . 1 1 66 66 VAL H H 66 7.896 7.896 7.686 0.210 25061 369 1 . 1 1 67 67 ARG HA H 67 3.628 3.628 4.008 -0.380 25061 370 1 . 1 1 67 67 ARG C C 67 177.841 177.841 178.152 -0.311 25061 371 1 . 1 1 67 67 ARG CA C 67 60.052 60.052 59.673 0.379 25061 372 1 . 1 1 67 67 ARG CB C 67 29.393 29.393 29.947 -0.554 25061 373 1 . 1 1 68 68 ASP N N 68 118.316 118.316 118.989 -0.673 25061 374 1 . 1 1 68 68 ASP HA H 68 4.361 4.361 4.572 -0.211 25061 375 1 . 1 1 68 68 ASP C C 68 178.945 178.945 178.630 0.315 25061 376 1 . 1 1 68 68 ASP CA C 68 57.311 57.311 57.176 0.135 25061 377 1 . 1 1 68 68 ASP CB C 68 41.514 41.514 40.893 0.621 25061 378 1 . 1 1 68 68 ASP H H 68 7.625 7.625 7.835 -0.210 25061 379 1 . 1 1 69 69 ILE N N 69 119.231 119.231 120.361 -1.130 25061 380 1 . 1 1 69 69 ILE HA H 69 3.630 3.630 3.753 -0.123 25061 381 1 . 1 1 69 69 ILE C C 69 177.138 177.138 178.007 -0.869 25061 382 1 . 1 1 69 69 ILE CA C 69 64.540 64.540 64.708 -0.168 25061 383 1 . 1 1 69 69 ILE CB C 69 37.050 37.050 37.829 -0.779 25061 384 1 . 1 1 69 69 ILE H H 69 8.113 8.113 7.483 0.630 25061 385 1 . 1 1 70 70 VAL N N 70 120.164 120.164 120.008 0.156 25061 386 1 . 1 1 70 70 VAL HA H 70 3.417 3.417 3.573 -0.156 25061 387 1 . 1 1 70 70 VAL C C 70 177.079 177.079 177.596 -0.517 25061 388 1 . 1 1 70 70 VAL CA C 70 67.274 67.274 67.231 0.043 25061 389 1 . 1 1 70 70 VAL CB C 70 31.258 31.258 31.265 -0.007 25061 390 1 . 1 1 70 70 VAL H H 70 8.478 8.478 8.333 0.145 25061 391 1 . 1 1 71 71 GLU N N 71 118.293 118.293 119.718 -1.425 25061 392 1 . 1 1 71 71 GLU HA H 71 4.054 4.054 4.009 0.045 25061 393 1 . 1 1 71 71 GLU C C 71 179.009 179.009 178.705 0.304 25061 394 1 . 1 1 71 71 GLU CA C 71 59.416 59.416 59.575 -0.159 25061 395 1 . 1 1 71 71 GLU CB C 71 28.822 28.822 29.444 -0.622 25061 396 1 . 1 1 71 71 GLU H H 71 8.152 8.152 7.935 0.217 25061 397 1 . 1 1 72 72 TYR N N 72 120.091 120.091 120.247 -0.156 25061 398 1 . 1 1 72 72 TYR HA H 72 4.162 4.162 4.147 0.015 25061 399 1 . 1 1 72 72 TYR C C 72 176.404 176.404 177.155 -0.751 25061 400 1 . 1 1 72 72 TYR CA C 72 61.132 61.132 61.459 -0.327 25061 401 1 . 1 1 72 72 TYR CB C 72 38.137 38.137 38.407 -0.270 25061 402 1 . 1 1 72 72 TYR H H 72 7.959 7.959 7.655 0.304 25061 403 1 . 1 1 73 73 ALA N N 73 120.133 120.133 120.331 -0.198 25061 404 1 . 1 1 73 73 ALA HA H 73 3.630 3.630 3.876 -0.246 25061 405 1 . 1 1 73 73 ALA C C 73 179.182 179.182 179.456 -0.274 25061 406 1 . 1 1 73 73 ALA CA C 73 55.112 55.112 55.093 0.019 25061 407 1 . 1 1 73 73 ALA CB C 73 18.191 18.191 18.226 -0.035 25061 408 1 . 1 1 73 73 ALA H H 73 8.604 8.604 8.039 0.565 25061 409 1 . 1 1 74 74 GLN N N 74 115.553 115.553 117.004 -1.451 25061 410 1 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.034 0.104 25061 411 1 . 1 1 74 74 GLN C C 74 180.595 180.595 178.599 1.996 25061 412 1 . 1 1 74 74 GLN CA C 74 59.095 59.095 58.303 0.792 25061 413 1 . 1 1 74 74 GLN CB C 74 28.575 28.575 28.754 -0.179 25061 414 1 . 1 1 74 74 GLN H H 74 8.619 8.619 8.093 0.526 25061 415 1 . 1 1 75 75 LYS N N 75 122.396 122.396 118.728 3.668 25061 416 1 . 1 1 75 75 LYS HA H 75 4.028 4.028 4.055 -0.027 25061 417 1 . 1 1 75 75 LYS C C 75 178.521 178.521 178.518 0.003 25061 418 1 . 1 1 75 75 LYS CA C 75 59.058 59.058 58.092 0.966 25061 419 1 . 1 1 75 75 LYS CB C 75 31.599 31.599 31.841 -0.242 25061 420 1 . 1 1 75 75 LYS H H 75 8.123 8.123 7.550 0.573 25061 421 1 . 1 1 76 76 GLU N N 76 116.294 116.294 116.496 -0.202 25061 422 1 . 1 1 76 76 GLU HA H 76 4.099 4.099 4.191 -0.092 25061 423 1 . 1 1 76 76 GLU C C 76 175.957 175.957 177.145 -1.188 25061 424 1 . 1 1 76 76 GLU CA C 76 55.605 55.605 56.187 -0.582 25061 425 1 . 1 1 76 76 GLU CB C 76 29.824 29.824 29.570 0.254 25061 426 1 . 1 1 76 76 GLU H H 76 7.450 7.450 7.618 -0.168 25061 427 1 . 1 1 77 77 GLY N N 77 107.446 107.446 107.326 0.120 25061 428 1 . 1 1 77 77 GLY C C 77 174.520 174.520 174.542 -0.022 25061 429 1 . 1 1 77 77 GLY CA C 77 45.807 45.807 45.555 0.252 25061 430 1 . 1 1 77 77 GLY H H 77 7.763 7.763 7.527 0.236 25061 431 1 . 1 1 78 78 LEU N N 78 120.179 120.179 119.418 0.761 25061 432 1 . 1 1 78 78 LEU HA H 78 4.388 4.388 4.447 -0.059 25061 433 1 . 1 1 78 78 LEU C C 78 175.914 175.914 176.476 -0.562 25061 434 1 . 1 1 78 78 LEU CA C 78 53.472 53.472 53.868 -0.396 25061 435 1 . 1 1 78 78 LEU CB C 78 41.889 41.889 42.911 -1.022 25061 436 1 . 1 1 78 78 LEU H H 78 7.930 7.930 7.852 0.078 25061 437 1 . 1 1 79 79 ARG N N 79 122.207 122.207 123.287 -1.080 25061 438 1 . 1 1 79 79 ARG HA H 79 4.397 4.397 4.321 0.076 25061 439 1 . 1 1 79 79 ARG C C 79 174.960 174.960 174.684 0.276 25061 440 1 . 1 1 79 79 ARG CA C 79 55.648 55.648 55.404 0.244 25061 441 1 . 1 1 79 79 ARG CB C 79 30.476 30.476 30.381 0.095 25061 442 1 . 1 1 79 79 ARG H H 79 8.241 8.241 8.291 -0.050 25061 443 1 . 1 1 80 80 VAL N N 80 123.333 123.333 125.142 -1.809 25061 444 1 . 1 1 80 80 VAL HA H 80 5.295 5.295 4.556 0.739 25061 445 1 . 1 1 80 80 VAL C C 80 174.048 174.048 174.139 -0.091 25061 446 1 . 1 1 80 80 VAL CA C 80 60.041 60.041 61.348 -1.307 25061 447 1 . 1 1 80 80 VAL CB C 80 34.305 34.305 32.910 1.395 25061 448 1 . 1 1 80 80 VAL H H 80 8.359 8.359 8.502 -0.143 25061 449 1 . 1 1 81 81 LEU N N 81 128.719 128.719 129.728 -1.009 25061 450 1 . 1 1 81 81 LEU HA H 81 5.104 5.104 5.266 -0.162 25061 451 1 . 1 1 81 81 LEU C C 81 174.484 174.484 174.588 -0.104 25061 452 1 . 1 1 81 81 LEU CA C 81 54.120 54.120 53.752 0.368 25061 453 1 . 1 1 81 81 LEU CB C 81 44.955 44.955 45.738 -0.783 25061 454 1 . 1 1 81 81 LEU H H 81 8.650 8.650 8.884 -0.234 25061 455 1 . 1 1 82 82 VAL N N 82 122.487 122.487 126.528 -4.041 25061 456 1 . 1 1 82 82 VAL HA H 82 5.097 5.097 4.511 0.586 25061 457 1 . 1 1 82 82 VAL C C 82 174.525 174.525 174.668 -0.143 25061 458 1 . 1 1 82 82 VAL CA C 82 60.285 60.285 61.126 -0.841 25061 459 1 . 1 1 82 82 VAL CB C 82 34.789 34.789 32.376 2.413 25061 460 1 . 1 1 82 82 VAL H H 82 8.781 8.781 8.486 0.295 25061 461 1 . 1 1 83 83 ILE N N 83 128.082 128.082 129.494 -1.412 25061 462 1 . 1 1 83 83 ILE HA H 83 4.930 4.930 4.765 0.165 25061 463 1 . 1 1 83 83 ILE C C 83 172.925 172.925 174.799 -1.874 25061 464 1 . 1 1 83 83 ILE CA C 83 59.941 59.941 60.489 -0.548 25061 465 1 . 1 1 83 83 ILE CB C 83 40.186 40.186 38.154 2.032 25061 466 1 . 1 1 83 83 ILE H H 83 9.527 9.527 8.660 0.867 25061 467 1 . 1 1 84 84 LYS N N 84 128.493 128.493 127.265 1.228 25061 468 1 . 1 1 84 84 LYS HA H 84 5.048 5.048 5.252 -0.204 25061 469 1 . 1 1 84 84 LYS C C 84 174.027 174.027 175.328 -1.301 25061 470 1 . 1 1 84 84 LYS CA C 84 53.253 53.253 53.982 -0.729 25061 471 1 . 1 1 84 84 LYS CB C 84 34.652 34.652 36.167 -1.515 25061 472 1 . 1 1 84 84 LYS H H 84 8.721 8.721 8.794 -0.073 25061 473 1 . 1 1 85 85 VAL N N 85 126.729 126.729 124.820 1.909 25061 474 1 . 1 1 85 85 VAL HA H 85 4.736 4.736 4.266 0.470 25061 475 1 . 1 1 85 85 VAL C C 85 175.935 175.935 175.513 0.422 25061 476 1 . 1 1 85 85 VAL CA C 85 60.200 60.200 61.786 -1.586 25061 477 1 . 1 1 85 85 VAL CB C 85 30.847 30.847 31.667 -0.820 25061 478 1 . 1 1 85 85 VAL H H 85 8.643 8.643 8.151 0.492 25061 479 1 . 1 1 86 86 ALA N N 86 132.930 132.930 130.938 1.992 25061 480 1 . 1 1 86 86 ALA HA H 86 4.430 4.430 4.423 0.007 25061 481 1 . 1 1 86 86 ALA C C 86 175.635 175.635 176.901 -1.266 25061 482 1 . 1 1 86 86 ALA CA C 86 51.504 51.504 52.209 -0.705 25061 483 1 . 1 1 86 86 ALA CB C 86 20.821 20.821 19.935 0.886 25061 484 1 . 1 1 86 86 ALA H H 86 8.835 8.835 8.368 0.467 25061 485 1 . 1 1 87 87 GLN N N 87 118.719 118.719 120.346 -1.627 25061 486 1 . 1 1 87 87 GLN HA H 87 4.469 4.469 4.312 0.157 25061 487 1 . 1 1 87 87 GLN C C 87 175.949 175.949 175.508 0.441 25061 488 1 . 1 1 87 87 GLN CA C 87 55.260 55.260 56.089 -0.829 25061 489 1 . 1 1 87 87 GLN CB C 87 30.432 30.432 29.078 1.354 25061 490 1 . 1 1 87 87 GLN H H 87 8.570 8.570 8.434 0.136 25061 491 1 . 1 1 88 88 ASP HA H 88 4.480 4.480 4.398 0.082 25061 492 1 . 1 1 88 88 ASP CA C 88 55.454 55.454 55.478 -0.024 25061 493 1 . 1 1 88 88 ASP CB C 88 41.204 41.204 40.806 0.398 25061 494 1 . 1 1 89 89 GLN HA H 89 4.047 4.047 4.244 -0.197 25061 495 1 . 1 1 89 89 GLN CA C 89 56.687 56.687 56.156 0.531 25061 496 1 . 1 1 89 89 GLN CB C 89 27.850 27.850 29.341 -1.491 25061 497 1 . 1 1 92 92 LEU N N 92 125.291 125.291 119.809 5.482 25061 498 1 . 1 1 92 92 LEU HA H 92 4.201 4.201 4.092 0.108 25061 499 1 . 1 1 92 92 LEU CA C 92 55.057 55.057 57.753 -2.696 25061 500 1 . 1 1 92 92 LEU CB C 92 42.046 42.046 41.793 0.253 25061 501 1 . 1 1 92 92 LEU H H 92 8.277 8.277 8.026 0.251 25061 502 1 . 1 1 93 93 GLU CB C 93 29.756 29.756 29.260 0.496 25061 503 1 . 1 1 94 94 ARG HA H 94 4.049 4.049 4.132 -0.083 25061 504 1 . 1 1 94 94 ARG C C 94 178.544 178.544 178.435 0.109 25061 505 1 . 1 1 94 94 ARG CA C 94 58.607 58.607 59.037 -0.430 25061 506 1 . 1 1 94 94 ARG CB C 94 29.614 29.614 30.008 -0.394 25061 507 1 . 1 1 95 95 PHE N N 95 117.407 117.407 119.640 -2.233 25061 508 1 . 1 1 95 95 PHE HA H 95 4.375 4.375 4.318 0.057 25061 509 1 . 1 1 95 95 PHE CA C 95 60.231 60.231 60.659 -0.428 25061 510 1 . 1 1 95 95 PHE CB C 95 37.942 37.942 39.266 -1.324 25061 511 1 . 1 1 95 95 PHE H H 95 8.419 8.419 7.722 0.697 25061 512 1 . 1 1 96 96 TYR HA H 96 3.808 3.808 3.941 -0.133 25061 513 1 . 1 1 96 96 TYR C C 96 177.728 177.728 177.259 0.469 25061 514 1 . 1 1 96 96 TYR CA C 96 63.156 63.156 61.482 1.674 25061 515 1 . 1 1 96 96 TYR CB C 96 37.700 37.700 38.402 -0.702 25061 516 1 . 1 1 97 97 GLU N N 97 119.054 119.054 117.883 1.171 25061 517 1 . 1 1 97 97 GLU HA H 97 4.063 4.063 3.697 0.366 25061 518 1 . 1 1 97 97 GLU C C 97 179.071 179.071 178.670 0.401 25061 519 1 . 1 1 97 97 GLU CA C 97 58.760 58.760 59.072 -0.312 25061 520 1 . 1 1 97 97 GLU CB C 97 29.172 29.172 29.334 -0.162 25061 521 1 . 1 1 97 97 GLU H H 97 7.858 7.858 7.958 -0.100 25061 522 1 . 1 1 98 98 GLN N N 98 119.385 119.385 118.906 0.479 25061 523 1 . 1 1 98 98 GLN HA H 98 3.901 3.901 3.970 -0.069 25061 524 1 . 1 1 98 98 GLN C C 98 177.599 177.599 178.517 -0.918 25061 525 1 . 1 1 98 98 GLN CA C 98 58.311 58.311 58.436 -0.125 25061 526 1 . 1 1 98 98 GLN CB C 98 27.766 27.766 27.993 -0.227 25061 527 1 . 1 1 98 98 GLN H H 98 7.747 7.747 7.524 0.223 25061 528 1 . 1 1 99 99 LEU N N 99 118.348 118.348 119.256 -0.908 25061 529 1 . 1 1 99 99 LEU HA H 99 4.019 4.019 3.888 0.131 25061 530 1 . 1 1 99 99 LEU C C 99 178.669 178.669 178.809 -0.140 25061 531 1 . 1 1 99 99 LEU CA C 99 57.430 57.430 57.938 -0.508 25061 532 1 . 1 1 99 99 LEU CB C 99 41.503 41.503 41.237 0.266 25061 533 1 . 1 1 99 99 LEU H H 99 7.891 7.891 7.390 0.501 25061 534 1 . 1 1 100 100 LYS N N 100 118.332 118.332 118.313 0.019 25061 535 1 . 1 1 100 100 LYS HA H 100 4.509 4.509 4.051 0.458 25061 536 1 . 1 1 100 100 LYS C C 100 180.846 180.846 178.976 1.870 25061 537 1 . 1 1 100 100 LYS CA C 100 59.088 59.088 58.439 0.649 25061 538 1 . 1 1 100 100 LYS CB C 100 32.269 32.269 31.932 0.337 25061 539 1 . 1 1 100 100 LYS H H 100 7.560 7.560 7.306 0.254 25061 540 1 . 1 1 101 101 LYS N N 101 121.944 121.944 118.910 3.034 25061 541 1 . 1 1 101 101 LYS HA H 101 4.072 4.072 4.071 0.001 25061 542 1 . 1 1 101 101 LYS C C 101 177.707 177.707 177.967 -0.260 25061 543 1 . 1 1 101 101 LYS CA C 101 58.871 58.871 58.462 0.409 25061 544 1 . 1 1 101 101 LYS CB C 101 32.095 32.095 32.331 -0.236 25061 545 1 . 1 1 101 101 LYS H H 101 7.959 7.959 7.617 0.342 25061 546 1 . 1 1 102 102 ASP N N 102 118.788 118.788 117.205 1.583 25061 547 1 . 1 1 102 102 ASP HA H 102 4.694 4.694 4.484 0.210 25061 548 1 . 1 1 102 102 ASP C C 102 176.359 176.359 177.173 -0.814 25061 549 1 . 1 1 102 102 ASP CA C 102 54.579 54.579 55.374 -0.795 25061 550 1 . 1 1 102 102 ASP CB C 102 40.574 40.574 41.778 -1.204 25061 551 1 . 1 1 102 102 ASP H H 102 7.893 7.893 7.722 0.171 25061 552 1 . 1 1 103 103 GLY N N 103 107.024 107.024 106.390 0.634 25061 553 1 . 1 1 103 103 GLY C C 103 174.328 174.328 174.094 0.234 25061 554 1 . 1 1 103 103 GLY CA C 103 45.345 45.345 44.849 0.496 25061 555 1 . 1 1 103 103 GLY H H 103 7.866 7.866 7.858 0.008 25061 556 1 . 1 1 104 104 VAL N N 104 123.060 123.060 121.276 1.784 25061 557 1 . 1 1 104 104 VAL HA H 104 3.973 3.973 3.964 0.009 25061 558 1 . 1 1 104 104 VAL C C 104 175.023 175.023 174.886 0.137 25061 559 1 . 1 1 104 104 VAL CA C 104 61.878 61.878 62.430 -0.552 25061 560 1 . 1 1 104 104 VAL CB C 104 32.088 32.088 32.470 -0.382 25061 561 1 . 1 1 104 104 VAL H H 104 7.955 7.955 7.726 0.229 25061 562 1 . 1 1 105 105 ASP N N 105 127.987 127.987 127.777 0.210 25061 563 1 . 1 1 105 105 ASP HA H 105 4.575 4.575 4.671 -0.096 25061 564 1 . 1 1 105 105 ASP C C 105 173.624 173.624 174.706 -1.082 25061 565 1 . 1 1 105 105 ASP CA C 105 54.087 54.087 54.155 -0.068 25061 566 1 . 1 1 105 105 ASP CB C 105 40.660 40.660 42.049 -1.389 25061 567 1 . 1 1 105 105 ASP H H 105 8.399 8.399 8.207 0.192 25061 568 1 . 1 1 106 106 VAL N N 106 125.798 125.798 121.181 4.617 25061 569 1 . 1 1 106 106 VAL HA H 106 4.815 4.815 4.694 0.121 25061 570 1 . 1 1 106 106 VAL C C 106 174.902 174.902 175.077 -0.175 25061 571 1 . 1 1 106 106 VAL CA C 106 60.194 60.194 60.503 -0.309 25061 572 1 . 1 1 106 106 VAL CB C 106 34.179 34.179 34.014 0.166 25061 573 1 . 1 1 106 106 VAL H H 106 7.550 7.550 8.048 -0.498 25061 574 1 . 1 1 107 107 ARG N N 107 128.099 128.099 128.073 0.026 25061 575 1 . 1 1 107 107 ARG HA H 107 4.876 4.876 4.729 0.147 25061 576 1 . 1 1 107 107 ARG C C 107 173.815 173.815 174.910 -1.095 25061 577 1 . 1 1 107 107 ARG CA C 107 53.386 53.386 53.801 -0.415 25061 578 1 . 1 1 107 107 ARG CB C 107 31.195 31.195 31.028 0.167 25061 579 1 . 1 1 107 107 ARG H H 107 9.132 9.132 8.725 0.407 25061 580 1 . 1 1 108 108 VAL N N 108 123.979 123.979 122.502 1.477 25061 581 1 . 1 1 108 108 VAL HA H 108 4.942 4.942 5.081 -0.139 25061 582 1 . 1 1 108 108 VAL C C 108 175.854 175.854 176.537 -0.683 25061 583 1 . 1 1 108 108 VAL CA C 108 60.017 60.017 60.662 -0.645 25061 584 1 . 1 1 108 108 VAL CB C 108 32.844 32.844 32.210 0.634 25061 585 1 . 1 1 108 108 VAL H H 108 8.561 8.561 8.594 -0.033 25061 586 1 . 1 1 109 109 THR N N 109 120.144 120.144 118.583 1.561 25061 587 1 . 1 1 109 109 THR HA H 109 4.815 4.815 4.409 0.406 25061 588 1 . 1 1 109 109 THR C C 109 171.867 171.867 175.242 -3.375 25061 589 1 . 1 1 109 109 THR CA C 109 59.613 59.613 62.229 -2.616 25061 590 1 . 1 1 109 109 THR CB C 109 69.720 69.720 69.751 -0.031 25061 591 1 . 1 1 109 109 THR H H 109 8.803 8.803 8.481 0.322 25061 592 1 . 1 1 110 110 ASP N N 110 123.212 123.212 121.216 1.996 25061 593 1 . 1 1 110 110 ASP HA H 110 4.969 4.969 4.391 0.578 25061 594 1 . 1 1 110 110 ASP C C 110 175.739 175.739 175.152 0.587 25061 595 1 . 1 1 110 110 ASP CA C 110 53.243 53.243 56.306 -3.063 25061 596 1 . 1 1 110 110 ASP CB C 110 41.351 41.351 39.697 1.654 25061 597 1 . 1 1 110 110 ASP H H 110 8.363 8.363 8.542 -0.179 25061 598 1 . 1 1 111 111 ASN N N 111 116.298 116.298 118.238 -1.940 25061 599 1 . 1 1 111 111 ASN HA H 111 4.876 4.876 4.807 0.069 25061 600 1 . 1 1 111 111 ASN C C 111 174.756 174.756 175.544 -0.788 25061 601 1 . 1 1 111 111 ASN CA C 111 52.132 52.132 52.799 -0.667 25061 602 1 . 1 1 111 111 ASN CB C 111 40.765 40.765 40.094 0.671 25061 603 1 . 1 1 111 111 ASN H H 111 8.085 8.085 7.846 0.239 25061 604 1 . 1 1 112 112 GLU HA H 112 3.848 3.848 4.028 -0.180 25061 605 1 . 1 1 112 112 GLU C C 112 177.016 177.016 177.845 -0.829 25061 606 1 . 1 1 112 112 GLU CA C 112 59.480 59.480 59.638 -0.158 25061 607 1 . 1 1 112 112 GLU CB C 112 29.674 29.674 29.611 0.063 25061 608 1 . 1 1 113 113 ASP N N 113 121.033 121.033 119.496 1.537 25061 609 1 . 1 1 113 113 ASP HA H 113 4.413 4.413 4.411 0.002 25061 610 1 . 1 1 113 113 ASP C C 113 178.988 178.988 178.266 0.722 25061 611 1 . 1 1 113 113 ASP CA C 113 57.855 57.855 57.286 0.569 25061 612 1 . 1 1 113 113 ASP CB C 113 40.502 40.502 40.639 -0.137 25061 613 1 . 1 1 113 113 ASP H H 113 8.219 8.219 8.352 -0.133 25061 614 1 . 1 1 114 114 GLU N N 114 121.280 121.280 119.616 1.664 25061 615 1 . 1 1 114 114 GLU HA H 114 4.065 4.065 4.100 -0.035 25061 616 1 . 1 1 114 114 GLU C C 114 178.776 178.776 178.233 0.543 25061 617 1 . 1 1 114 114 GLU CA C 114 58.714 58.714 58.934 -0.220 25061 618 1 . 1 1 114 114 GLU CB C 114 29.213 29.213 29.199 0.014 25061 619 1 . 1 1 114 114 GLU H H 114 8.296 8.296 8.415 -0.119 25061 620 1 . 1 1 115 115 ALA N N 115 120.924 120.924 122.076 -1.152 25061 621 1 . 1 1 115 115 ALA HA H 115 3.838 3.838 4.062 -0.224 25061 622 1 . 1 1 115 115 ALA C C 115 178.502 178.502 179.299 -0.797 25061 623 1 . 1 1 115 115 ALA CA C 115 55.638 55.638 55.200 0.438 25061 624 1 . 1 1 115 115 ALA CB C 115 18.497 18.497 18.277 0.220 25061 625 1 . 1 1 115 115 ALA H H 115 7.853 7.853 7.761 0.092 25061 626 1 . 1 1 116 116 LYS N N 116 116.616 116.616 118.239 -1.623 25061 627 1 . 1 1 116 116 LYS HA H 116 3.719 3.719 3.985 -0.266 25061 628 1 . 1 1 116 116 LYS C C 116 178.097 178.097 178.703 -0.606 25061 629 1 . 1 1 116 116 LYS CA C 116 60.752 60.752 59.491 1.261 25061 630 1 . 1 1 116 116 LYS CB C 116 32.555 32.555 32.187 0.368 25061 631 1 . 1 1 116 116 LYS H H 116 8.091 8.091 7.803 0.288 25061 632 1 . 1 1 117 117 LYS N N 117 118.990 118.990 118.571 0.419 25061 633 1 . 1 1 117 117 LYS HA H 117 3.911 3.911 4.025 -0.114 25061 634 1 . 1 1 117 117 LYS C C 117 179.186 179.186 179.197 -0.011 25061 635 1 . 1 1 117 117 LYS CA C 117 59.571 59.571 59.403 0.168 25061 636 1 . 1 1 117 117 LYS CB C 117 32.520 32.520 32.254 0.266 25061 637 1 . 1 1 117 117 LYS H H 117 7.742 7.742 7.728 0.014 25061 638 1 . 1 1 118 118 ARG N N 118 117.441 117.441 119.596 -2.155 25061 639 1 . 1 1 118 118 ARG HA H 118 4.140 4.140 4.155 -0.015 25061 640 1 . 1 1 118 118 ARG C C 118 178.921 178.921 178.755 0.166 25061 641 1 . 1 1 118 118 ARG CA C 118 57.671 57.671 58.623 -0.952 25061 642 1 . 1 1 118 118 ARG CB C 118 29.661 29.661 29.762 -0.101 25061 643 1 . 1 1 118 118 ARG H H 118 8.468 8.468 7.764 0.704 25061 644 1 . 1 1 119 119 LEU N N 119 120.100 120.100 120.265 -0.165 25061 645 1 . 1 1 119 119 LEU HA H 119 3.960 3.960 3.913 0.047 25061 646 1 . 1 1 119 119 LEU C C 119 177.554 177.554 178.658 -1.104 25061 647 1 . 1 1 119 119 LEU CA C 119 57.881 57.881 58.245 -0.364 25061 648 1 . 1 1 119 119 LEU CB C 119 41.889 41.889 41.481 0.408 25061 649 1 . 1 1 119 119 LEU H H 119 8.322 8.322 8.044 0.278 25061 650 1 . 1 1 120 120 LYS N N 120 118.238 118.238 119.254 -1.016 25061 651 1 . 1 1 120 120 LYS HA H 120 3.822 3.822 3.931 -0.109 25061 652 1 . 1 1 120 120 LYS C C 120 178.703 178.703 178.893 -0.190 25061 653 1 . 1 1 120 120 LYS CA C 120 60.346 60.346 59.554 0.793 25061 654 1 . 1 1 120 120 LYS CB C 120 32.236 32.236 32.233 0.003 25061 655 1 . 1 1 120 120 LYS H H 120 7.990 7.990 7.658 0.332 25061 656 1 . 1 1 121 121 GLU HA H 121 4.022 4.022 4.158 -0.136 25061 657 1 . 1 1 121 121 GLU C C 121 177.769 177.769 179.165 -1.396 25061 658 1 . 1 1 121 121 GLU CA C 121 58.922 58.922 59.116 -0.194 25061 659 1 . 1 1 121 121 GLU CB C 121 29.454 29.454 29.398 0.056 25061 660 1 . 1 1 122 122 LEU N N 122 119.454 119.454 119.246 0.208 25061 661 1 . 1 1 122 122 LEU HA H 122 4.133 4.133 4.127 0.006 25061 662 1 . 1 1 122 122 LEU C C 122 178.991 178.991 179.259 -0.268 25061 663 1 . 1 1 122 122 LEU CA C 122 57.326 57.326 57.358 -0.032 25061 664 1 . 1 1 122 122 LEU CB C 122 41.679 41.679 41.912 -0.233 25061 665 1 . 1 1 122 122 LEU H H 122 7.930 7.930 7.904 0.026 25061 666 1 . 1 1 123 123 LEU N N 123 117.862 117.862 118.993 -1.131 25061 667 1 . 1 1 123 123 LEU HA H 123 4.067 4.067 4.054 0.013 25061 668 1 . 1 1 123 123 LEU C C 123 179.178 179.178 179.276 -0.098 25061 669 1 . 1 1 123 123 LEU CA C 123 56.920 56.920 57.790 -0.870 25061 670 1 . 1 1 123 123 LEU CB C 123 41.210 41.210 41.453 -0.243 25061 671 1 . 1 1 123 123 LEU H H 123 8.095 8.095 7.873 0.222 25061 672 1 . 1 1 124 124 GLU N N 124 118.975 118.975 117.978 0.997 25061 673 1 . 1 1 124 124 GLU HA H 124 4.129 4.129 4.117 0.012 25061 674 1 . 1 1 124 124 GLU C C 124 177.777 177.777 177.530 0.247 25061 675 1 . 1 1 124 124 GLU CA C 124 58.087 58.087 58.682 -0.595 25061 676 1 . 1 1 124 124 GLU CB C 124 29.540 29.540 29.604 -0.064 25061 677 1 . 1 1 124 124 GLU H H 124 7.930 7.930 7.976 -0.046 25061 678 1 . 1 1 125 125 LYS N N 125 118.933 118.933 116.940 1.993 25061 679 1 . 1 1 125 125 LYS HA H 125 4.337 4.337 4.423 -0.086 25061 680 1 . 1 1 125 125 LYS C C 125 178.188 178.188 176.312 1.876 25061 681 1 . 1 1 125 125 LYS CA C 125 56.980 56.980 56.313 0.667 25061 682 1 . 1 1 125 125 LYS CB C 125 32.608 32.608 33.533 -0.925 25061 683 1 . 1 1 125 125 LYS H H 125 7.729 7.729 7.550 0.179 25061 684 1 . 1 1 126 126 VAL N N 126 117.933 117.933 115.919 2.014 25061 685 1 . 1 1 126 126 VAL HA H 126 4.022 4.022 3.877 0.145 25061 686 1 . 1 1 126 126 VAL C C 126 176.947 176.947 175.198 1.749 25061 687 1 . 1 1 126 126 VAL CA C 126 63.641 63.641 63.238 0.403 25061 688 1 . 1 1 126 126 VAL CB C 126 31.859 31.859 31.554 0.305 25061 689 1 . 1 1 126 126 VAL H H 126 8.044 8.044 7.906 0.138 25061 690 1 . 1 1 127 127 GLY N N 127 109.813 109.813 107.951 1.862 25061 691 1 . 1 1 127 127 GLY C C 127 174.264 174.264 173.325 0.939 25061 692 1 . 1 1 127 127 GLY CA C 127 45.279 45.279 45.409 -0.130 25061 693 1 . 1 1 127 127 GLY H H 127 8.279 8.279 8.047 0.232 25061 694 1 . 1 1 128 128 SER N N 128 115.185 115.185 115.468 -0.283 25061 695 1 . 1 1 128 128 SER HA H 128 4.462 4.462 4.616 -0.154 25061 696 1 . 1 1 128 128 SER C C 128 174.775 174.775 173.343 1.432 25061 697 1 . 1 1 128 128 SER CA C 128 58.739 58.739 57.953 0.786 25061 698 1 . 1 1 128 128 SER CB C 128 63.850 63.850 64.433 -0.583 25061 699 1 . 1 1 128 128 SER H H 128 8.048 8.048 7.948 0.100 25061 700 1 . 1 1 129 129 LEU N N 129 123.060 123.060 122.029 1.031 25061 701 1 . 1 1 129 129 LEU HA H 129 4.298 4.298 4.481 -0.183 25061 702 1 . 1 1 129 129 LEU C C 129 177.313 177.313 175.682 1.631 25061 703 1 . 1 1 129 129 LEU CA C 129 55.158 55.158 55.097 0.061 25061 704 1 . 1 1 129 129 LEU CB C 129 41.837 41.837 43.137 -1.300 25061 705 1 . 1 1 129 129 LEU H H 129 8.147 8.147 8.208 -0.061 25061 706 1 . 1 1 130 130 GLU N N 130 120.088 120.088 121.141 -1.053 25061 707 1 . 1 1 130 130 GLU HA H 130 4.181 4.181 4.279 -0.098 25061 708 1 . 1 1 130 130 GLU C C 130 176.148 176.148 175.663 0.485 25061 709 1 . 1 1 130 130 GLU CA C 130 56.726 56.726 56.519 0.207 25061 710 1 . 1 1 130 130 GLU CB C 130 30.026 30.026 29.938 0.088 25061 711 1 . 1 1 130 130 GLU H H 130 8.242 8.242 8.469 -0.227 25061 stop_ save_